----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 23:42:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.533394339999999 0.000000000000000 0.000000000000000 b 0.000000000000000 7.510434100000000 0.000000000000000 c 0.000000000000000 0.000000000000000 5.210799460000000 Atomic positions (fractional): *1 Ho 0.07134534141558 0.75000000000000 0.52063379385185 164.930 2 Ho 0.57134534141558 0.75000000000000 0.97936620614815 164.930 3 Ho 0.42865465858442 0.25000000000000 0.02063379385185 164.930 4 Ho 0.92865465858442 0.25000000000000 0.47936620614815 164.930 *5 Ga 0.50000000000000 0.50000000000000 0.50000000000000 69.723 6 Ga 0.00000000000000 0.50000000000000 0.00000000000000 69.723 7 Ga 0.00000000000000 0.00000000000000 0.00000000000000 69.723 8 Ga 0.50000000000000 0.00000000000000 0.50000000000000 69.723 *9 O 0.53815855356764 0.25000000000000 0.61274709485478 15.999 *10 O 0.80528975360267 0.55725411544531 0.69246530936360 15.999 11 O 0.80528975360267 0.94274588455469 0.69246530936360 15.999 12 O 0.30528975360267 0.94274588455469 0.80753469063640 15.999 13 O 0.30528975360267 0.55725411544531 0.80753469063640 15.999 14 O 0.03815855356764 0.25000000000000 0.88725290514522 15.999 15 O 0.96184144643236 0.75000000000000 0.11274709485478 15.999 16 O 0.69471024639733 0.05725411544531 0.19246530936360 15.999 17 O 0.69471024639733 0.44274588455469 0.19246530936360 15.999 18 O 0.19471024639733 0.44274588455469 0.30753469063640 15.999 19 O 0.19471024639733 0.05725411544531 0.30753469063640 15.999 20 O 0.46184144643236 0.75000000000000 0.38725290514522 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.533394339999999 0.000000000000000 0.000000000000000 b 0.000000000000000 7.510434100000000 0.000000000000000 c 0.000000000000000 0.000000000000000 5.210799460000000 Atomic positions (fractional): *1 Ho 0.07134534141558 0.75000000000000 0.52063379385185 164.930 > 1 2 Ho 0.57134534141558 0.75000000000000 0.97936620614815 164.930 > 2 3 Ho 0.42865465858442 0.25000000000000 0.02063379385185 164.930 > 3 4 Ho 0.92865465858442 0.25000000000000 0.47936620614815 164.930 > 4 *5 Ga 0.50000000000000 0.50000000000000 0.50000000000000 69.723 > 5 6 Ga 0.00000000000000 0.50000000000000 0.00000000000000 69.723 > 6 7 Ga 0.00000000000000 0.00000000000000 0.00000000000000 69.723 > 7 8 Ga 0.50000000000000 0.00000000000000 0.50000000000000 69.723 > 8 *9 O 0.53815855356764 0.25000000000000 0.61274709485478 15.999 > 9 *10 O 0.80528975360267 0.55725411544531 0.69246530936360 15.999 > 10 11 O 0.80528975360267 0.94274588455469 0.69246530936360 15.999 > 11 12 O 0.30528975360267 0.94274588455469 0.80753469063640 15.999 > 12 13 O 0.30528975360267 0.55725411544531 0.80753469063640 15.999 > 13 14 O 0.03815855356764 0.25000000000000 0.88725290514522 15.999 > 14 15 O 0.96184144643236 0.75000000000000 0.11274709485478 15.999 > 15 16 O 0.69471024639733 0.05725411544531 0.19246530936360 15.999 > 16 17 O 0.69471024639733 0.44274588455469 0.19246530936360 15.999 > 17 18 O 0.19471024639733 0.44274588455469 0.30753469063640 15.999 > 18 19 O 0.19471024639733 0.05725411544531 0.30753469063640 15.999 > 19 20 O 0.46184144643236 0.75000000000000 0.38725290514522 15.999 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.066788679999998 0.000000000000000 0.000000000000000 b 0.000000000000000 7.510434100000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.421598919999999 Atomic positions (fractional): *1 Ho 0.03567267070779 0.75000000000000 0.26031689692592 164.930 > 1 2 Ho 0.53567267070779 0.75000000000000 0.26031689692592 164.930 > 1 3 Ho 0.03567267070779 0.75000000000000 0.76031689692592 164.930 > 1 4 Ho 0.53567267070779 0.75000000000000 0.76031689692592 164.930 > 1 5 Ho 0.28567267070779 0.75000000000000 0.48968310307408 164.930 > 2 6 Ho 0.78567267070779 0.75000000000000 0.48968310307408 164.930 > 2 7 Ho 0.28567267070779 0.75000000000000 0.98968310307408 164.930 > 2 8 Ho 0.78567267070779 0.75000000000000 0.98968310307408 164.930 > 2 9 Ho 0.21432732929221 0.25000000000000 0.01031689692592 164.930 > 3 10 Ho 0.71432732929221 0.25000000000000 0.01031689692592 164.930 > 3 11 Ho 0.21432732929221 0.25000000000000 0.51031689692592 164.930 > 3 12 Ho 0.71432732929221 0.25000000000000 0.51031689692592 164.930 > 3 13 Ho 0.46432732929221 0.25000000000000 0.23968310307408 164.930 > 4 14 Ho 0.96432732929221 0.25000000000000 0.23968310307408 164.930 > 4 15 Ho 0.46432732929221 0.25000000000000 0.73968310307408 164.930 > 4 16 Ho 0.96432732929221 0.25000000000000 0.73968310307408 164.930 > 4 *17 Ga 0.25000000000000 0.50000000000000 0.25000000000000 69.723 > 5 18 Ga 0.75000000000000 0.50000000000000 0.25000000000000 69.723 > 5 19 Ga 0.25000000000000 0.50000000000000 0.75000000000000 69.723 > 5 20 Ga 0.75000000000000 0.50000000000000 0.75000000000000 69.723 > 5 21 Ga 0.00000000000000 0.50000000000000 0.00000000000000 69.723 > 6 22 Ga 0.50000000000000 0.50000000000000 0.00000000000000 69.723 > 6 23 Ga 0.00000000000000 0.50000000000000 0.50000000000000 69.723 > 6 24 Ga 0.50000000000000 0.50000000000000 0.50000000000000 69.723 > 6 25 Ga 0.00000000000000 0.00000000000000 0.00000000000000 69.723 > 7 26 Ga 0.50000000000000 0.00000000000000 0.00000000000000 69.723 > 7 27 Ga 0.00000000000000 0.00000000000000 0.50000000000000 69.723 > 7 28 Ga 0.50000000000000 0.00000000000000 0.50000000000000 69.723 > 7 29 Ga 0.25000000000000 0.00000000000000 0.25000000000000 69.723 > 8 30 Ga 0.75000000000000 0.00000000000000 0.25000000000000 69.723 > 8 31 Ga 0.25000000000000 0.00000000000000 0.75000000000000 69.723 > 8 32 Ga 0.75000000000000 0.00000000000000 0.75000000000000 69.723 > 8 *33 O 0.26907927678382 0.25000000000000 0.30637354742739 15.999 > 9 34 O 0.76907927678382 0.25000000000000 0.30637354742739 15.999 > 9 35 O 0.26907927678382 0.25000000000000 0.80637354742739 15.999 > 9 36 O 0.76907927678382 0.25000000000000 0.80637354742739 15.999 > 9 *37 O 0.40264487680134 0.55725411544531 0.34623265468180 15.999 > 10 38 O 0.90264487680134 0.55725411544531 0.34623265468180 15.999 > 10 39 O 0.40264487680134 0.55725411544531 0.84623265468180 15.999 > 10 40 O 0.90264487680134 0.55725411544531 0.84623265468180 15.999 > 10 41 O 0.40264487680134 0.94274588455469 0.34623265468180 15.999 > 11 42 O 0.90264487680134 0.94274588455469 0.34623265468180 15.999 > 11 43 O 0.40264487680134 0.94274588455469 0.84623265468180 15.999 > 11 44 O 0.90264487680134 0.94274588455469 0.84623265468180 15.999 > 11 45 O 0.15264487680134 0.94274588455469 0.40376734531820 15.999 > 12 46 O 0.65264487680134 0.94274588455469 0.40376734531820 15.999 > 12 47 O 0.15264487680134 0.94274588455469 0.90376734531820 15.999 > 12 48 O 0.65264487680134 0.94274588455469 0.90376734531820 15.999 > 12 49 O 0.15264487680134 0.55725411544531 0.40376734531820 15.999 > 13 50 O 0.65264487680134 0.55725411544531 0.40376734531820 15.999 > 13 51 O 0.15264487680134 0.55725411544531 0.90376734531820 15.999 > 13 52 O 0.65264487680134 0.55725411544531 0.90376734531820 15.999 > 13 53 O 0.01907927678382 0.25000000000000 0.44362645257261 15.999 > 14 54 O 0.51907927678382 0.25000000000000 0.44362645257261 15.999 > 14 55 O 0.01907927678382 0.25000000000000 0.94362645257261 15.999 > 14 56 O 0.51907927678382 0.25000000000000 0.94362645257261 15.999 > 14 57 O 0.48092072321618 0.75000000000000 0.05637354742739 15.999 > 15 58 O 0.98092072321618 0.75000000000000 0.05637354742739 15.999 > 15 59 O 0.48092072321618 0.75000000000000 0.55637354742739 15.999 > 15 60 O 0.98092072321618 0.75000000000000 0.55637354742739 15.999 > 15 61 O 0.34735512319866 0.05725411544531 0.09623265468180 15.999 > 16 62 O 0.84735512319866 0.05725411544531 0.09623265468180 15.999 > 16 63 O 0.34735512319866 0.05725411544531 0.59623265468180 15.999 > 16 64 O 0.84735512319866 0.05725411544531 0.59623265468180 15.999 > 16 65 O 0.34735512319866 0.44274588455469 0.09623265468180 15.999 > 17 66 O 0.84735512319866 0.44274588455469 0.09623265468180 15.999 > 17 67 O 0.34735512319866 0.44274588455469 0.59623265468180 15.999 > 17 68 O 0.84735512319866 0.44274588455469 0.59623265468180 15.999 > 17 69 O 0.09735512319866 0.44274588455469 0.15376734531820 15.999 > 18 70 O 0.59735512319866 0.44274588455469 0.15376734531820 15.999 > 18 71 O 0.09735512319866 0.44274588455469 0.65376734531820 15.999 > 18 72 O 0.59735512319866 0.44274588455469 0.65376734531820 15.999 > 18 73 O 0.09735512319866 0.05725411544531 0.15376734531820 15.999 > 19 74 O 0.59735512319866 0.05725411544531 0.15376734531820 15.999 > 19 75 O 0.09735512319866 0.05725411544531 0.65376734531820 15.999 > 19 76 O 0.59735512319866 0.05725411544531 0.65376734531820 15.999 > 19 77 O 0.23092072321618 0.75000000000000 0.19362645257261 15.999 > 20 78 O 0.73092072321618 0.75000000000000 0.19362645257261 15.999 > 20 79 O 0.23092072321618 0.75000000000000 0.69362645257261 15.999 > 20 80 O 0.73092072321618 0.75000000000000 0.69362645257261 15.999 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.5871271 0.0000000 0.0000000 0.0000000 4.4338171 0.0000000 0.0000000 0.0000000 4.5860746 -------------------------- Born effective charges -------------------------- 1 Ho 3.9283046 0.0000000 -0.0796509 0.0000000 3.5661962 0.0000000 -0.1956360 0.0000000 3.9654738 2 Ho 3.9283046 0.0000000 0.0796509 0.0000000 3.5661962 0.0000000 0.1956360 0.0000000 3.9654738 3 Ho 3.9283046 0.0000000 0.0796509 0.0000000 3.5661962 0.0000000 0.1956360 0.0000000 3.9654738 4 Ho 3.9283046 0.0000000 -0.0796509 0.0000000 3.5661962 0.0000000 -0.1956360 0.0000000 3.9654738 5 Ga 3.3710288 -0.0764278 0.0880726 -0.0447934 3.2809525 -0.0151912 0.1581340 0.1264893 3.2448872 6 Ga 3.3710288 -0.0764278 -0.0880726 -0.0447934 3.2809525 0.0151912 -0.1581340 -0.1264893 3.2448872 7 Ga 3.3710288 0.0764278 -0.0880726 0.0447934 3.2809525 -0.0151912 -0.1581340 0.1264893 3.2448872 8 Ga 3.3710288 0.0764278 0.0880726 0.0447934 3.2809525 0.0151912 0.1581340 -0.1264893 3.2448872 9 O -2.1291899 0.0000000 0.4072127 0.0000000 -2.4901666 0.0000000 0.3881317 0.0000000 -2.5220988 10 O -2.5850717 -0.1320251 -0.1265311 -0.1586416 -2.1784911 -0.1055012 -0.1093669 -0.1361119 -2.3441311 11 O -2.5850717 0.1320251 -0.1265311 0.1586416 -2.1784911 0.1055012 -0.1093669 0.1361119 -2.3441311 12 O -2.5850717 0.1320251 0.1265311 0.1586416 -2.1784911 -0.1055012 0.1093669 -0.1361119 -2.3441311 13 O -2.5850717 -0.1320251 0.1265311 -0.1586416 -2.1784911 0.1055012 0.1093669 0.1361119 -2.3441311 14 O -2.1291899 0.0000000 -0.4072127 0.0000000 -2.4901666 0.0000000 -0.3881317 0.0000000 -2.5220988 15 O -2.1291899 0.0000000 -0.4072127 0.0000000 -2.4901666 0.0000000 -0.3881317 0.0000000 -2.5220988 16 O -2.5850717 0.1320251 0.1265311 0.1586416 -2.1784911 -0.1055012 0.1093669 -0.1361119 -2.3441311 17 O -2.5850717 -0.1320251 0.1265311 -0.1586416 -2.1784911 0.1055012 0.1093669 0.1361119 -2.3441311 18 O -2.5850717 -0.1320251 -0.1265311 -0.1586416 -2.1784911 -0.1055012 -0.1093669 -0.1361119 -2.3441311 19 O -2.5850717 0.1320251 -0.1265311 0.1586416 -2.1784911 0.1055012 -0.1093669 0.1361119 -2.3441311 20 O -2.1291899 0.0000000 0.4072127 0.0000000 -2.4901666 0.0000000 0.3881317 0.0000000 -2.5220988 ---------------------------------------------------------------------------- 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: 994 Number of blocks in projector: 994 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 236 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 172 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 172 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 138 Use standard eigh solver. Tree of FC basis block matrices: - (994, 966), data: False |-- (138, 134), data: True |-- (138, 134), data: True |-- (138, 134), data: True |-- (172, 168), data: True |-- (172, 168), data: True |-- (236, 228), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 320 - Time: 0.727 Solver_block: 200 / 320 - Time: 0.726 Solver_block: 300 / 320 - Time: 0.726 Solver_block: 320 / 320 - Time: 0.183 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.379 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) 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: 994 Number of blocks in projector: 994 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 236 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 172 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 172 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 138 Use standard eigh solver. Tree of FC basis block matrices: - (994, 966), data: False |-- (138, 134), data: True |-- (138, 134), data: True |-- (138, 134), data: True |-- (172, 168), data: True |-- (172, 168), data: True |-- (236, 228), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) 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 23:42:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:42:32]------------------------- 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 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.533394339999999 0.000000000000000 0.000000000000000 b 0.000000000000000 7.510434100000000 0.000000000000000 c 0.000000000000000 0.000000000000000 5.210799460000000 Atomic positions (fractional): 1 Ho 0.07134534141558 0.75000000000000 0.52063379385185 164.930 2 Ho 0.57134534141558 0.75000000000000 0.97936620614815 164.930 3 Ho 0.42865465858442 0.25000000000000 0.02063379385185 164.930 4 Ho 0.92865465858442 0.25000000000000 0.47936620614815 164.930 5 Ga 0.50000000000000 0.50000000000000 0.50000000000000 69.723 6 Ga 0.00000000000000 0.50000000000000 0.00000000000000 69.723 7 Ga 0.00000000000000 0.00000000000000 0.00000000000000 69.723 8 Ga 0.50000000000000 0.00000000000000 0.50000000000000 69.723 9 O 0.53815855356764 0.25000000000000 0.61274709485478 15.999 10 O 0.80528975360267 0.55725411544531 0.69246530936360 15.999 11 O 0.80528975360267 0.94274588455469 0.69246530936360 15.999 12 O 0.30528975360267 0.94274588455469 0.80753469063640 15.999 13 O 0.30528975360267 0.55725411544531 0.80753469063640 15.999 14 O 0.03815855356764 0.25000000000000 0.88725290514522 15.999 15 O 0.96184144643236 0.75000000000000 0.11274709485478 15.999 16 O 0.69471024639733 0.05725411544531 0.19246530936360 15.999 17 O 0.69471024639733 0.44274588455469 0.19246530936360 15.999 18 O 0.19471024639733 0.44274588455469 0.30753469063640 15.999 19 O 0.19471024639733 0.05725411544531 0.30753469063640 15.999 20 O 0.46184144643236 0.75000000000000 0.38725290514522 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.066788679999998 0.000000000000000 0.000000000000000 b 0.000000000000000 7.510434100000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.421598919999999 Atomic positions (fractional): 1 Ho 0.03567267070779 0.75000000000000 0.26031689692592 164.930 > 1 2 Ho 0.53567267070779 0.75000000000000 0.26031689692592 164.930 > 1 3 Ho 0.03567267070779 0.75000000000000 0.76031689692592 164.930 > 1 4 Ho 0.53567267070779 0.75000000000000 0.76031689692592 164.930 > 1 5 Ho 0.28567267070779 0.75000000000000 0.48968310307408 164.930 > 5 6 Ho 0.78567267070779 0.75000000000000 0.48968310307408 164.930 > 5 7 Ho 0.28567267070779 0.75000000000000 0.98968310307408 164.930 > 5 8 Ho 0.78567267070779 0.75000000000000 0.98968310307408 164.930 > 5 9 Ho 0.21432732929221 0.25000000000000 0.01031689692592 164.930 > 9 10 Ho 0.71432732929221 0.25000000000000 0.01031689692592 164.930 > 9 11 Ho 0.21432732929221 0.25000000000000 0.51031689692592 164.930 > 9 12 Ho 0.71432732929221 0.25000000000000 0.51031689692592 164.930 > 9 13 Ho 0.46432732929221 0.25000000000000 0.23968310307408 164.930 > 13 14 Ho 0.96432732929221 0.25000000000000 0.23968310307408 164.930 > 13 15 Ho 0.46432732929221 0.25000000000000 0.73968310307408 164.930 > 13 16 Ho 0.96432732929221 0.25000000000000 0.73968310307408 164.930 > 13 17 Ga 0.25000000000000 0.50000000000000 0.25000000000000 69.723 > 17 18 Ga 0.75000000000000 0.50000000000000 0.25000000000000 69.723 > 17 19 Ga 0.25000000000000 0.50000000000000 0.75000000000000 69.723 > 17 20 Ga 0.75000000000000 0.50000000000000 0.75000000000000 69.723 > 17 21 Ga 0.00000000000000 0.50000000000000 0.00000000000000 69.723 > 21 22 Ga 0.50000000000000 0.50000000000000 0.00000000000000 69.723 > 21 23 Ga 0.00000000000000 0.50000000000000 0.50000000000000 69.723 > 21 24 Ga 0.50000000000000 0.50000000000000 0.50000000000000 69.723 > 21 25 Ga 0.00000000000000 0.00000000000000 0.00000000000000 69.723 > 25 26 Ga 0.50000000000000 0.00000000000000 0.00000000000000 69.723 > 25 27 Ga 0.00000000000000 0.00000000000000 0.50000000000000 69.723 > 25 28 Ga 0.50000000000000 0.00000000000000 0.50000000000000 69.723 > 25 29 Ga 0.25000000000000 0.00000000000000 0.25000000000000 69.723 > 29 30 Ga 0.75000000000000 0.00000000000000 0.25000000000000 69.723 > 29 31 Ga 0.25000000000000 0.00000000000000 0.75000000000000 69.723 > 29 32 Ga 0.75000000000000 0.00000000000000 0.75000000000000 69.723 > 29 33 O 0.26907927678382 0.25000000000000 0.30637354742739 15.999 > 33 34 O 0.76907927678382 0.25000000000000 0.30637354742739 15.999 > 33 35 O 0.26907927678382 0.25000000000000 0.80637354742739 15.999 > 33 36 O 0.76907927678382 0.25000000000000 0.80637354742739 15.999 > 33 37 O 0.40264487680134 0.55725411544531 0.34623265468180 15.999 > 37 38 O 0.90264487680134 0.55725411544531 0.34623265468180 15.999 > 37 39 O 0.40264487680134 0.55725411544531 0.84623265468180 15.999 > 37 40 O 0.90264487680134 0.55725411544531 0.84623265468180 15.999 > 37 41 O 0.40264487680134 0.94274588455469 0.34623265468180 15.999 > 41 42 O 0.90264487680134 0.94274588455469 0.34623265468180 15.999 > 41 43 O 0.40264487680134 0.94274588455469 0.84623265468180 15.999 > 41 44 O 0.90264487680134 0.94274588455469 0.84623265468180 15.999 > 41 45 O 0.15264487680134 0.94274588455469 0.40376734531820 15.999 > 45 46 O 0.65264487680134 0.94274588455469 0.40376734531820 15.999 > 45 47 O 0.15264487680134 0.94274588455469 0.90376734531820 15.999 > 45 48 O 0.65264487680134 0.94274588455469 0.90376734531820 15.999 > 45 49 O 0.15264487680134 0.55725411544531 0.40376734531820 15.999 > 49 50 O 0.65264487680134 0.55725411544531 0.40376734531820 15.999 > 49 51 O 0.15264487680134 0.55725411544531 0.90376734531820 15.999 > 49 52 O 0.65264487680134 0.55725411544531 0.90376734531820 15.999 > 49 53 O 0.01907927678382 0.25000000000000 0.44362645257261 15.999 > 53 54 O 0.51907927678382 0.25000000000000 0.44362645257261 15.999 > 53 55 O 0.01907927678382 0.25000000000000 0.94362645257261 15.999 > 53 56 O 0.51907927678382 0.25000000000000 0.94362645257261 15.999 > 53 57 O 0.48092072321618 0.75000000000000 0.05637354742739 15.999 > 57 58 O 0.98092072321618 0.75000000000000 0.05637354742739 15.999 > 57 59 O 0.48092072321618 0.75000000000000 0.55637354742739 15.999 > 57 60 O 0.98092072321618 0.75000000000000 0.55637354742739 15.999 > 57 61 O 0.34735512319866 0.05725411544531 0.09623265468180 15.999 > 61 62 O 0.84735512319866 0.05725411544531 0.09623265468180 15.999 > 61 63 O 0.34735512319866 0.05725411544531 0.59623265468180 15.999 > 61 64 O 0.84735512319866 0.05725411544531 0.59623265468180 15.999 > 61 65 O 0.34735512319866 0.44274588455469 0.09623265468180 15.999 > 65 66 O 0.84735512319866 0.44274588455469 0.09623265468180 15.999 > 65 67 O 0.34735512319866 0.44274588455469 0.59623265468180 15.999 > 65 68 O 0.84735512319866 0.44274588455469 0.59623265468180 15.999 > 65 69 O 0.09735512319866 0.44274588455469 0.15376734531820 15.999 > 69 70 O 0.59735512319866 0.44274588455469 0.15376734531820 15.999 > 69 71 O 0.09735512319866 0.44274588455469 0.65376734531820 15.999 > 69 72 O 0.59735512319866 0.44274588455469 0.65376734531820 15.999 > 69 73 O 0.09735512319866 0.05725411544531 0.15376734531820 15.999 > 73 74 O 0.59735512319866 0.05725411544531 0.15376734531820 15.999 > 73 75 O 0.09735512319866 0.05725411544531 0.65376734531820 15.999 > 73 76 O 0.59735512319866 0.05725411544531 0.65376734531820 15.999 > 73 77 O 0.23092072321618 0.75000000000000 0.19362645257261 15.999 > 77 78 O 0.73092072321618 0.75000000000000 0.19362645257261 15.999 > 77 79 O 0.23092072321618 0.75000000000000 0.69362645257261 15.999 > 77 80 O 0.73092072321618 0.75000000000000 0.69362645257261 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.5871271 0.0000000 0.0000000 0.0000000 4.4338171 0.0000000 0.0000000 0.0000000 4.5860746 -------------------------- Born effective charges -------------------------- 1 Ho 3.9283046 0.0000000 -0.0796509 0.0000000 3.5661962 0.0000000 -0.1956360 0.0000000 3.9654738 2 Ho 3.9283046 0.0000000 0.0796509 0.0000000 3.5661962 0.0000000 0.1956360 0.0000000 3.9654738 3 Ho 3.9283046 0.0000000 0.0796509 0.0000000 3.5661962 0.0000000 0.1956360 0.0000000 3.9654738 4 Ho 3.9283046 0.0000000 -0.0796509 0.0000000 3.5661962 0.0000000 -0.1956360 0.0000000 3.9654738 5 Ga 3.3710288 -0.0764278 0.0880726 -0.0447934 3.2809525 -0.0151912 0.1581340 0.1264893 3.2448872 6 Ga 3.3710288 -0.0764278 -0.0880726 -0.0447934 3.2809525 0.0151912 -0.1581340 -0.1264893 3.2448872 7 Ga 3.3710288 0.0764278 -0.0880726 0.0447934 3.2809525 -0.0151912 -0.1581340 0.1264893 3.2448872 8 Ga 3.3710288 0.0764278 0.0880726 0.0447934 3.2809525 0.0151912 0.1581340 -0.1264893 3.2448872 9 O -2.1291899 0.0000000 0.4072127 0.0000000 -2.4901666 0.0000000 0.3881317 0.0000000 -2.5220988 10 O -2.5850717 -0.1320251 -0.1265311 -0.1586416 -2.1784911 -0.1055012 -0.1093669 -0.1361119 -2.3441311 11 O -2.5850717 0.1320251 -0.1265311 0.1586416 -2.1784911 0.1055012 -0.1093669 0.1361119 -2.3441311 12 O -2.5850717 0.1320251 0.1265311 0.1586416 -2.1784911 -0.1055012 0.1093669 -0.1361119 -2.3441311 13 O -2.5850717 -0.1320251 0.1265311 -0.1586416 -2.1784911 0.1055012 0.1093669 0.1361119 -2.3441311 14 O -2.1291899 0.0000000 -0.4072127 0.0000000 -2.4901666 0.0000000 -0.3881317 0.0000000 -2.5220988 15 O -2.1291899 0.0000000 -0.4072127 0.0000000 -2.4901666 0.0000000 -0.3881317 0.0000000 -2.5220988 16 O -2.5850717 0.1320251 0.1265311 0.1586416 -2.1784911 -0.1055012 0.1093669 -0.1361119 -2.3441311 17 O -2.5850717 -0.1320251 0.1265311 -0.1586416 -2.1784911 0.1055012 0.1093669 0.1361119 -2.3441311 18 O -2.5850717 -0.1320251 -0.1265311 -0.1586416 -2.1784911 -0.1055012 -0.1093669 -0.1361119 -2.3441311 19 O -2.5850717 0.1320251 -0.1265311 0.1586416 -2.1784911 0.1055012 -0.1093669 0.1361119 -2.3441311 20 O -2.1291899 0.0000000 0.4072127 0.0000000 -2.4901666 0.0000000 0.3881317 0.0000000 -2.5220988 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 37, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000004 (xxx) -0.00000004 (xxx) -0.00000004 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000004 (zx) 0.00000004 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 23:42:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:42:42]------------------------- 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 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.533394339999999 0.000000000000000 0.000000000000000 b 0.000000000000000 7.510434100000000 0.000000000000000 c 0.000000000000000 0.000000000000000 5.210799460000000 Atomic positions (fractional): 1 Ho 0.07134534141558 0.75000000000000 0.52063379385185 164.930 2 Ho 0.57134534141558 0.75000000000000 0.97936620614815 164.930 3 Ho 0.42865465858442 0.25000000000000 0.02063379385185 164.930 4 Ho 0.92865465858442 0.25000000000000 0.47936620614815 164.930 5 Ga 0.50000000000000 0.50000000000000 0.50000000000000 69.723 6 Ga 0.00000000000000 0.50000000000000 0.00000000000000 69.723 7 Ga 0.00000000000000 0.00000000000000 0.00000000000000 69.723 8 Ga 0.50000000000000 0.00000000000000 0.50000000000000 69.723 9 O 0.53815855356764 0.25000000000000 0.61274709485478 15.999 10 O 0.80528975360267 0.55725411544531 0.69246530936360 15.999 11 O 0.80528975360267 0.94274588455469 0.69246530936360 15.999 12 O 0.30528975360267 0.94274588455469 0.80753469063640 15.999 13 O 0.30528975360267 0.55725411544531 0.80753469063640 15.999 14 O 0.03815855356764 0.25000000000000 0.88725290514522 15.999 15 O 0.96184144643236 0.75000000000000 0.11274709485478 15.999 16 O 0.69471024639733 0.05725411544531 0.19246530936360 15.999 17 O 0.69471024639733 0.44274588455469 0.19246530936360 15.999 18 O 0.19471024639733 0.44274588455469 0.30753469063640 15.999 19 O 0.19471024639733 0.05725411544531 0.30753469063640 15.999 20 O 0.46184144643236 0.75000000000000 0.38725290514522 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.066788679999998 0.000000000000000 0.000000000000000 b 0.000000000000000 7.510434100000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.421598919999999 Atomic positions (fractional): 1 Ho 0.03567267070779 0.75000000000000 0.26031689692592 164.930 > 1 2 Ho 0.53567267070779 0.75000000000000 0.26031689692592 164.930 > 1 3 Ho 0.03567267070779 0.75000000000000 0.76031689692592 164.930 > 1 4 Ho 0.53567267070779 0.75000000000000 0.76031689692592 164.930 > 1 5 Ho 0.28567267070779 0.75000000000000 0.48968310307408 164.930 > 5 6 Ho 0.78567267070779 0.75000000000000 0.48968310307408 164.930 > 5 7 Ho 0.28567267070779 0.75000000000000 0.98968310307408 164.930 > 5 8 Ho 0.78567267070779 0.75000000000000 0.98968310307408 164.930 > 5 9 Ho 0.21432732929221 0.25000000000000 0.01031689692592 164.930 > 9 10 Ho 0.71432732929221 0.25000000000000 0.01031689692592 164.930 > 9 11 Ho 0.21432732929221 0.25000000000000 0.51031689692592 164.930 > 9 12 Ho 0.71432732929221 0.25000000000000 0.51031689692592 164.930 > 9 13 Ho 0.46432732929221 0.25000000000000 0.23968310307408 164.930 > 13 14 Ho 0.96432732929221 0.25000000000000 0.23968310307408 164.930 > 13 15 Ho 0.46432732929221 0.25000000000000 0.73968310307408 164.930 > 13 16 Ho 0.96432732929221 0.25000000000000 0.73968310307408 164.930 > 13 17 Ga 0.25000000000000 0.50000000000000 0.25000000000000 69.723 > 17 18 Ga 0.75000000000000 0.50000000000000 0.25000000000000 69.723 > 17 19 Ga 0.25000000000000 0.50000000000000 0.75000000000000 69.723 > 17 20 Ga 0.75000000000000 0.50000000000000 0.75000000000000 69.723 > 17 21 Ga 0.00000000000000 0.50000000000000 0.00000000000000 69.723 > 21 22 Ga 0.50000000000000 0.50000000000000 0.00000000000000 69.723 > 21 23 Ga 0.00000000000000 0.50000000000000 0.50000000000000 69.723 > 21 24 Ga 0.50000000000000 0.50000000000000 0.50000000000000 69.723 > 21 25 Ga 0.00000000000000 0.00000000000000 0.00000000000000 69.723 > 25 26 Ga 0.50000000000000 0.00000000000000 0.00000000000000 69.723 > 25 27 Ga 0.00000000000000 0.00000000000000 0.50000000000000 69.723 > 25 28 Ga 0.50000000000000 0.00000000000000 0.50000000000000 69.723 > 25 29 Ga 0.25000000000000 0.00000000000000 0.25000000000000 69.723 > 29 30 Ga 0.75000000000000 0.00000000000000 0.25000000000000 69.723 > 29 31 Ga 0.25000000000000 0.00000000000000 0.75000000000000 69.723 > 29 32 Ga 0.75000000000000 0.00000000000000 0.75000000000000 69.723 > 29 33 O 0.26907927678382 0.25000000000000 0.30637354742739 15.999 > 33 34 O 0.76907927678382 0.25000000000000 0.30637354742739 15.999 > 33 35 O 0.26907927678382 0.25000000000000 0.80637354742739 15.999 > 33 36 O 0.76907927678382 0.25000000000000 0.80637354742739 15.999 > 33 37 O 0.40264487680134 0.55725411544531 0.34623265468180 15.999 > 37 38 O 0.90264487680134 0.55725411544531 0.34623265468180 15.999 > 37 39 O 0.40264487680134 0.55725411544531 0.84623265468180 15.999 > 37 40 O 0.90264487680134 0.55725411544531 0.84623265468180 15.999 > 37 41 O 0.40264487680134 0.94274588455469 0.34623265468180 15.999 > 41 42 O 0.90264487680134 0.94274588455469 0.34623265468180 15.999 > 41 43 O 0.40264487680134 0.94274588455469 0.84623265468180 15.999 > 41 44 O 0.90264487680134 0.94274588455469 0.84623265468180 15.999 > 41 45 O 0.15264487680134 0.94274588455469 0.40376734531820 15.999 > 45 46 O 0.65264487680134 0.94274588455469 0.40376734531820 15.999 > 45 47 O 0.15264487680134 0.94274588455469 0.90376734531820 15.999 > 45 48 O 0.65264487680134 0.94274588455469 0.90376734531820 15.999 > 45 49 O 0.15264487680134 0.55725411544531 0.40376734531820 15.999 > 49 50 O 0.65264487680134 0.55725411544531 0.40376734531820 15.999 > 49 51 O 0.15264487680134 0.55725411544531 0.90376734531820 15.999 > 49 52 O 0.65264487680134 0.55725411544531 0.90376734531820 15.999 > 49 53 O 0.01907927678382 0.25000000000000 0.44362645257261 15.999 > 53 54 O 0.51907927678382 0.25000000000000 0.44362645257261 15.999 > 53 55 O 0.01907927678382 0.25000000000000 0.94362645257261 15.999 > 53 56 O 0.51907927678382 0.25000000000000 0.94362645257261 15.999 > 53 57 O 0.48092072321618 0.75000000000000 0.05637354742739 15.999 > 57 58 O 0.98092072321618 0.75000000000000 0.05637354742739 15.999 > 57 59 O 0.48092072321618 0.75000000000000 0.55637354742739 15.999 > 57 60 O 0.98092072321618 0.75000000000000 0.55637354742739 15.999 > 57 61 O 0.34735512319866 0.05725411544531 0.09623265468180 15.999 > 61 62 O 0.84735512319866 0.05725411544531 0.09623265468180 15.999 > 61 63 O 0.34735512319866 0.05725411544531 0.59623265468180 15.999 > 61 64 O 0.84735512319866 0.05725411544531 0.59623265468180 15.999 > 61 65 O 0.34735512319866 0.44274588455469 0.09623265468180 15.999 > 65 66 O 0.84735512319866 0.44274588455469 0.09623265468180 15.999 > 65 67 O 0.34735512319866 0.44274588455469 0.59623265468180 15.999 > 65 68 O 0.84735512319866 0.44274588455469 0.59623265468180 15.999 > 65 69 O 0.09735512319866 0.44274588455469 0.15376734531820 15.999 > 69 70 O 0.59735512319866 0.44274588455469 0.15376734531820 15.999 > 69 71 O 0.09735512319866 0.44274588455469 0.65376734531820 15.999 > 69 72 O 0.59735512319866 0.44274588455469 0.65376734531820 15.999 > 69 73 O 0.09735512319866 0.05725411544531 0.15376734531820 15.999 > 73 74 O 0.59735512319866 0.05725411544531 0.15376734531820 15.999 > 73 75 O 0.09735512319866 0.05725411544531 0.65376734531820 15.999 > 73 76 O 0.59735512319866 0.05725411544531 0.65376734531820 15.999 > 73 77 O 0.23092072321618 0.75000000000000 0.19362645257261 15.999 > 77 78 O 0.73092072321618 0.75000000000000 0.19362645257261 15.999 > 77 79 O 0.23092072321618 0.75000000000000 0.69362645257261 15.999 > 77 80 O 0.73092072321618 0.75000000000000 0.69362645257261 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.5871271 0.0000000 0.0000000 0.0000000 4.4338171 0.0000000 0.0000000 0.0000000 4.5860746 -------------------------- Born effective charges -------------------------- 1 Ho 3.9283046 0.0000000 -0.0796509 0.0000000 3.5661962 0.0000000 -0.1956360 0.0000000 3.9654738 2 Ho 3.9283046 0.0000000 0.0796509 0.0000000 3.5661962 0.0000000 0.1956360 0.0000000 3.9654738 3 Ho 3.9283046 0.0000000 0.0796509 0.0000000 3.5661962 0.0000000 0.1956360 0.0000000 3.9654738 4 Ho 3.9283046 0.0000000 -0.0796509 0.0000000 3.5661962 0.0000000 -0.1956360 0.0000000 3.9654738 5 Ga 3.3710288 -0.0764278 0.0880726 -0.0447934 3.2809525 -0.0151912 0.1581340 0.1264893 3.2448872 6 Ga 3.3710288 -0.0764278 -0.0880726 -0.0447934 3.2809525 0.0151912 -0.1581340 -0.1264893 3.2448872 7 Ga 3.3710288 0.0764278 -0.0880726 0.0447934 3.2809525 -0.0151912 -0.1581340 0.1264893 3.2448872 8 Ga 3.3710288 0.0764278 0.0880726 0.0447934 3.2809525 0.0151912 0.1581340 -0.1264893 3.2448872 9 O -2.1291899 0.0000000 0.4072127 0.0000000 -2.4901666 0.0000000 0.3881317 0.0000000 -2.5220988 10 O -2.5850717 -0.1320251 -0.1265311 -0.1586416 -2.1784911 -0.1055012 -0.1093669 -0.1361119 -2.3441311 11 O -2.5850717 0.1320251 -0.1265311 0.1586416 -2.1784911 0.1055012 -0.1093669 0.1361119 -2.3441311 12 O -2.5850717 0.1320251 0.1265311 0.1586416 -2.1784911 -0.1055012 0.1093669 -0.1361119 -2.3441311 13 O -2.5850717 -0.1320251 0.1265311 -0.1586416 -2.1784911 0.1055012 0.1093669 0.1361119 -2.3441311 14 O -2.1291899 0.0000000 -0.4072127 0.0000000 -2.4901666 0.0000000 -0.3881317 0.0000000 -2.5220988 15 O -2.1291899 0.0000000 -0.4072127 0.0000000 -2.4901666 0.0000000 -0.3881317 0.0000000 -2.5220988 16 O -2.5850717 0.1320251 0.1265311 0.1586416 -2.1784911 -0.1055012 0.1093669 -0.1361119 -2.3441311 17 O -2.5850717 -0.1320251 0.1265311 -0.1586416 -2.1784911 0.1055012 0.1093669 0.1361119 -2.3441311 18 O -2.5850717 -0.1320251 -0.1265311 -0.1586416 -2.1784911 -0.1055012 -0.1093669 -0.1361119 -2.3441311 19 O -2.5850717 0.1320251 -0.1265311 0.1586416 -2.1784911 0.1055012 -0.1093669 0.1361119 -2.3441311 20 O -2.1291899 0.0000000 0.4072127 0.0000000 -2.4901666 0.0000000 0.3881317 0.0000000 -2.5220988 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000004 (xxx) -0.00000004 (xxx) -0.00000004 (xxx) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 7 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.69, Number of G-points: 303, Lambda: 0.15 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/120) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.457 ( 0.000 0.000 0.000) 0.000 3.175 ( 0.000 0.000 0.000) 0.000 3.296 ( 0.000 0.000 0.000) 0.000 3.351 ( 0.000 0.000 0.000) 0.000 3.533 ( 0.000 0.000 0.000) 0.000 3.778 ( 0.000 0.000 0.000) 0.000 4.212 ( 0.000 0.000 0.000) 0.000 4.218 ( 0.000 0.000 0.000) 0.000 4.681 ( 0.000 0.000 0.000) 0.000 4.735 ( 0.000 0.000 0.000) 0.000 4.869 ( 0.000 0.000 0.000) 0.000 4.922 ( 0.000 0.000 0.000) 0.000 5.181 ( 0.000 0.000 0.000) 0.000 5.544 ( 0.000 0.000 0.000) 0.000 5.556 ( 0.000 0.000 0.000) 0.000 7.036 ( 0.000 0.000 0.000) 0.000 7.089 ( 0.000 0.000 0.000) 0.000 7.205 ( 0.000 0.000 0.000) 0.000 7.504 ( 0.000 0.000 0.000) 0.000 7.721 ( 0.000 0.000 0.000) 0.000 8.222 ( 0.000 0.000 0.000) 0.000 8.259 ( 0.000 0.000 0.000) 0.000 8.515 ( 0.000 0.000 0.000) 0.000 8.546 ( 0.000 0.000 0.000) 0.000 8.555 ( 0.000 0.000 0.000) 0.000 9.403 ( 0.000 0.000 0.000) 0.000 9.560 ( 0.000 0.000 0.000) 0.000 9.572 ( 0.000 0.000 0.000) 0.000 9.649 ( 0.000 0.000 0.000) 0.000 9.990 ( 0.000 0.000 0.000) 0.000 10.405 ( 0.000 0.000 0.000) 0.000 10.438 ( 0.000 0.000 0.000) 0.000 10.841 ( 0.000 0.000 0.000) 0.000 10.924 ( 0.000 0.000 0.000) 0.000 11.242 ( 0.000 0.000 0.000) 0.000 11.680 ( 0.000 0.000 0.000) 0.000 11.711 ( 0.000 0.000 0.000) 0.000 11.784 ( 0.000 0.000 0.000) 0.000 12.000 ( 0.000 0.000 0.000) 0.000 12.608 ( 0.000 0.000 0.000) 0.000 12.839 ( 0.000 0.000 0.000) 0.000 13.698 ( 0.000 0.000 0.000) 0.000 14.455 ( 0.000 0.000 0.000) 0.000 15.059 ( 0.000 0.000 0.000) 0.000 15.173 ( 0.000 0.000 0.000) 0.000 15.653 ( 0.000 0.000 0.000) 0.000 15.737 ( 0.000 0.000 0.000) 0.000 15.927 ( 0.000 0.000 0.000) 0.000 16.298 ( 0.000 0.000 0.000) 0.000 16.375 ( 0.000 0.000 0.000) 0.000 16.732 ( 0.000 0.000 0.000) 0.000 16.778 ( 0.000 0.000 0.000) 0.000 16.967 ( 0.000 0.000 0.000) 0.000 17.599 ( 0.000 0.000 0.000) 0.000 18.349 ( 0.000 0.000 0.000) 0.000 18.960 ( 0.000 0.000 0.000) 0.000 19.619 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/120) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.605 ( 29.618 0.000 0.000) 29.618 0.753 ( 36.844 0.000 0.000) 36.844 1.202 ( 57.882 0.000 0.000) 57.882 2.490 ( 3.111 0.000 0.000) 3.111 3.131 ( -5.444 0.000 0.000) 5.444 3.314 ( 1.773 0.000 0.000) 1.773 3.358 ( 0.632 0.000 0.000) 0.632 3.557 ( 2.285 0.000 0.000) 2.285 3.706 ( -6.704 0.000 0.000) 6.704 3.920 ( -21.443 0.000 0.000) 21.443 4.189 ( -2.349 0.000 0.000) 2.349 4.748 ( 0.820 0.000 0.000) 0.820 4.802 ( 1.708 0.000 0.000) 1.708 4.807 ( -10.898 0.000 0.000) 10.898 5.047 ( 19.957 0.000 0.000) 19.957 5.285 ( 10.120 0.000 0.000) 10.120 5.532 ( -3.616 0.000 0.000) 3.616 5.599 ( 5.728 0.000 0.000) 5.728 7.031 ( -0.471 0.000 0.000) 0.471 7.190 ( -1.838 0.000 0.000) 1.838 7.459 ( -3.150 0.000 0.000) 3.150 7.495 ( 2.986 0.000 0.000) 2.986 7.755 ( 0.693 0.000 0.000) 0.693 8.170 ( -4.791 0.000 0.000) 4.791 8.258 ( -0.245 0.000 0.000) 0.245 8.397 ( -14.182 0.000 0.000) 14.182 8.474 ( -6.460 0.000 0.000) 6.460 8.576 ( 3.754 0.000 0.000) 3.754 9.344 ( -14.177 0.000 0.000) 14.177 9.625 ( 3.774 0.000 0.000) 3.774 9.782 ( 6.000 0.000 0.000) 6.000 9.968 ( -1.605 0.000 0.000) 1.605 10.371 ( -2.032 0.000 0.000) 2.032 10.467 ( 2.763 0.000 0.000) 2.763 10.756 ( -6.727 0.000 0.000) 6.727 10.933 ( 0.014 0.000 0.000) 0.014 11.314 ( 7.370 0.000 0.000) 7.370 11.494 ( -10.318 0.000 0.000) 10.318 11.895 ( 14.787 0.000 0.000) 14.787 12.025 ( 15.552 0.000 0.000) 15.552 12.203 ( 19.513 0.000 0.000) 19.513 12.548 ( -11.568 0.000 0.000) 11.568 12.675 ( 6.317 0.000 0.000) 6.317 13.125 ( 12.558 0.000 0.000) 12.558 14.372 ( -7.762 0.000 0.000) 7.762 14.968 ( -8.877 0.000 0.000) 8.877 15.143 ( -2.196 0.000 0.000) 2.196 15.624 ( -10.819 0.000 0.000) 10.819 15.662 ( 0.180 0.000 0.000) 0.180 15.759 ( 5.186 0.000 0.000) 5.186 15.904 ( -0.766 0.000 0.000) 0.766 16.481 ( 8.726 0.000 0.000) 8.726 16.757 ( 2.906 0.000 0.000) 2.906 16.759 ( -1.769 0.000 0.000) 1.769 16.950 ( -1.531 0.000 0.000) 1.531 17.517 ( -8.189 0.000 0.000) 8.189 18.438 ( 8.303 0.000 0.000) 8.303 18.965 ( 0.522 0.000 0.000) 0.522 19.269 ( -1.707 0.000 0.000) 1.707 19.602 ( -1.717 0.000 0.000) 1.717 ======================= Grid point 2 (3/120) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.180 ( 27.495 0.000 0.000) 27.495 1.465 ( 33.655 0.000 0.000) 33.655 2.267 ( 46.033 0.000 0.000) 46.033 2.566 ( 3.810 0.000 0.000) 3.810 2.985 ( -8.902 0.000 0.000) 8.902 3.364 ( 2.982 0.000 0.000) 2.982 3.395 ( 4.225 0.000 0.000) 4.225 3.484 ( -20.691 0.000 0.000) 20.691 3.533 ( -9.781 0.000 0.000) 9.781 3.617 ( 3.574 0.000 0.000) 3.574 4.118 ( -4.639 0.000 0.000) 4.639 4.514 ( -17.408 0.000 0.000) 17.408 4.742 ( -1.788 0.000 0.000) 1.788 4.789 ( -2.255 0.000 0.000) 2.255 5.451 ( -3.349 0.000 0.000) 3.349 5.514 ( 25.060 0.000 0.000) 25.060 5.576 ( 18.518 0.000 0.000) 18.518 5.785 ( 12.829 0.000 0.000) 12.829 7.024 ( -0.064 0.000 0.000) 0.064 7.105 ( -7.432 0.000 0.000) 7.432 7.396 ( -3.416 0.000 0.000) 3.416 7.566 ( 3.063 0.000 0.000) 3.063 7.674 ( -9.004 0.000 0.000) 9.004 8.031 ( -9.334 0.000 0.000) 9.334 8.046 ( -19.718 0.000 0.000) 19.718 8.242 ( -1.553 0.000 0.000) 1.553 8.347 ( -3.976 0.000 0.000) 3.976 8.720 ( 10.326 0.000 0.000) 10.326 9.043 ( -15.012 0.000 0.000) 15.012 9.669 ( -0.152 0.000 0.000) 0.152 9.855 ( 1.348 0.000 0.000) 1.348 9.938 ( -1.569 0.000 0.000) 1.569 10.302 ( -4.188 0.000 0.000) 4.188 10.544 ( 4.745 0.000 0.000) 4.745 10.608 ( -7.621 0.000 0.000) 7.621 10.931 ( 0.398 0.000 0.000) 0.398 11.298 ( -9.339 0.000 0.000) 9.339 11.543 ( 15.230 0.000 0.000) 15.230 11.945 ( -12.311 0.000 0.000) 12.311 12.354 ( 16.312 0.000 0.000) 16.312 12.659 ( 22.440 0.000 0.000) 22.440 12.744 ( 33.130 0.000 0.000) 33.130 12.841 ( 9.665 0.000 0.000) 9.665 13.350 ( 10.121 0.000 0.000) 10.121 14.181 ( -10.047 0.000 0.000) 10.047 14.722 ( -14.829 0.000 0.000) 14.829 15.132 ( 2.559 0.000 0.000) 2.559 15.327 ( -18.064 0.000 0.000) 18.064 15.618 ( -5.764 0.000 0.000) 5.764 15.886 ( 6.806 0.000 0.000) 6.806 15.928 ( 3.000 0.000 0.000) 3.000 16.665 ( 8.729 0.000 0.000) 8.729 16.721 ( -1.510 0.000 0.000) 1.510 16.827 ( 3.678 0.000 0.000) 3.678 16.913 ( -2.149 0.000 0.000) 2.149 17.273 ( -16.053 0.000 0.000) 16.053 18.651 ( 12.164 0.000 0.000) 12.164 18.980 ( 0.924 0.000 0.000) 0.924 19.222 ( -2.900 0.000 0.000) 2.900 19.549 ( -3.585 0.000 0.000) 3.585 ======================= Grid point 3 (4/120) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( 24.184 0.000 0.000) 24.184 2.082 ( 26.930 0.000 0.000) 26.930 2.619 ( 1.105 0.000 0.000) 1.105 2.772 ( -11.097 0.000 0.000) 11.097 2.941 ( 18.852 0.000 0.000) 18.852 3.131 ( -13.435 0.000 0.000) 13.435 3.337 ( -9.471 0.000 0.000) 9.471 3.420 ( 1.905 0.000 0.000) 1.905 3.591 ( 14.642 0.000 0.000) 14.642 3.693 ( 3.785 0.000 0.000) 3.785 4.010 ( -5.708 0.000 0.000) 5.708 4.157 ( -16.473 0.000 0.000) 16.473 4.682 ( -3.641 0.000 0.000) 3.641 4.723 ( -4.048 0.000 0.000) 4.048 5.470 ( 7.616 0.000 0.000) 7.616 6.006 ( 23.373 0.000 0.000) 23.373 6.028 ( 25.653 0.000 0.000) 25.653 6.104 ( 18.555 0.000 0.000) 18.555 6.862 ( -16.951 0.000 0.000) 16.951 7.028 ( 0.138 0.000 0.000) 0.138 7.286 ( -9.798 0.000 0.000) 9.798 7.442 ( -11.121 0.000 0.000) 11.121 7.498 ( -13.618 0.000 0.000) 13.618 7.636 ( -20.408 0.000 0.000) 20.408 7.887 ( -0.720 0.000 0.000) 0.720 8.185 ( -4.255 0.000 0.000) 4.255 8.352 ( 3.756 0.000 0.000) 3.756 8.775 ( -11.043 0.000 0.000) 11.043 8.961 ( 12.966 0.000 0.000) 12.966 9.608 ( -5.747 0.000 0.000) 5.747 9.851 ( -1.203 0.000 0.000) 1.203 9.897 ( -2.525 0.000 0.000) 2.525 10.236 ( -1.745 0.000 0.000) 1.745 10.458 ( -7.206 0.000 0.000) 7.206 10.654 ( 6.208 0.000 0.000) 6.208 10.975 ( 4.374 0.000 0.000) 4.374 11.117 ( -8.727 0.000 0.000) 8.727 11.634 ( -16.103 0.000 0.000) 16.103 11.903 ( 19.814 0.000 0.000) 19.814 12.618 ( 7.775 0.000 0.000) 7.775 13.041 ( 9.766 0.000 0.000) 9.766 13.106 ( 17.171 0.000 0.000) 17.171 13.480 ( 38.799 0.000 0.000) 38.799 13.550 ( 10.625 0.000 0.000) 10.625 14.033 ( -2.555 0.000 0.000) 2.555 14.404 ( -16.284 0.000 0.000) 16.284 14.926 ( -21.214 0.000 0.000) 21.214 15.304 ( 15.572 0.000 0.000) 15.572 15.392 ( -17.199 0.000 0.000) 17.199 16.004 ( 3.942 0.000 0.000) 3.942 16.011 ( 5.210 0.000 0.000) 5.210 16.714 ( 0.906 0.000 0.000) 0.906 16.788 ( -2.791 0.000 0.000) 2.791 16.865 ( -2.575 0.000 0.000) 2.575 16.892 ( 2.610 0.000 0.000) 2.610 16.900 ( -14.789 0.000 0.000) 14.789 18.901 ( 12.276 0.000 0.000) 12.276 19.003 ( 1.452 0.000 0.000) 1.452 19.158 ( -3.320 0.000 0.000) 3.320 19.457 ( -5.705 0.000 0.000) 5.705 ======================= Grid point 4 (5/120) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 20.000 0.000 0.000) 20.000 2.492 ( 12.336 0.000 0.000) 12.336 2.502 ( -15.525 0.000 0.000) 15.525 2.609 ( -2.059 0.000 0.000) 2.059 2.999 ( 1.667 0.000 0.000) 1.667 3.147 ( -9.732 0.000 0.000) 9.732 3.204 ( 10.593 0.000 0.000) 10.593 3.389 ( -6.209 0.000 0.000) 6.209 3.755 ( 2.346 0.000 0.000) 2.346 3.787 ( 1.726 0.000 0.000) 1.726 3.924 ( -1.595 0.000 0.000) 1.595 3.937 ( -4.088 0.000 0.000) 4.088 4.627 ( -1.146 0.000 0.000) 1.146 4.647 ( -2.896 0.000 0.000) 2.896 5.806 ( 24.472 0.000 0.000) 24.472 6.300 ( -14.856 0.000 0.000) 14.856 6.503 ( 19.971 0.000 0.000) 19.971 6.521 ( 22.075 0.000 0.000) 22.075 6.623 ( 14.227 0.000 0.000) 14.227 6.957 ( -10.799 0.000 0.000) 10.799 6.968 ( -18.475 0.000 0.000) 18.475 7.088 ( -24.269 0.000 0.000) 24.269 7.305 ( -3.929 0.000 0.000) 3.929 7.310 ( -7.868 0.000 0.000) 7.868 7.960 ( 5.638 0.000 0.000) 5.638 8.079 ( -5.935 0.000 0.000) 5.935 8.462 ( 6.445 0.000 0.000) 6.445 8.598 ( -7.259 0.000 0.000) 7.259 9.220 ( 12.416 0.000 0.000) 12.416 9.448 ( -9.978 0.000 0.000) 9.978 9.831 ( -0.309 0.000 0.000) 0.309 9.848 ( -1.952 0.000 0.000) 1.952 10.243 ( 2.407 0.000 0.000) 2.407 10.326 ( -5.639 0.000 0.000) 5.639 10.791 ( 7.344 0.000 0.000) 7.344 10.947 ( -8.150 0.000 0.000) 8.150 11.111 ( 9.097 0.000 0.000) 9.097 11.336 ( -13.243 0.000 0.000) 13.243 12.301 ( 18.733 0.000 0.000) 18.733 12.600 ( -9.399 0.000 0.000) 9.399 13.213 ( 6.742 0.000 0.000) 6.742 13.280 ( 1.144 0.000 0.000) 1.144 13.796 ( 13.573 0.000 0.000) 13.573 14.085 ( -15.200 0.000 0.000) 15.200 14.138 ( 12.696 0.000 0.000) 12.696 14.241 ( 33.802 0.000 0.000) 33.802 14.510 ( -17.509 0.000 0.000) 17.509 14.928 ( -28.615 0.000 0.000) 28.615 15.747 ( 26.894 0.000 0.000) 26.894 16.064 ( 1.339 0.000 0.000) 1.339 16.083 ( 1.957 0.000 0.000) 1.957 16.335 ( -27.724 0.000 0.000) 27.724 16.752 ( 2.637 0.000 0.000) 2.637 16.810 ( -2.925 0.000 0.000) 2.925 16.910 ( 2.188 0.000 0.000) 2.188 16.925 ( 0.576 0.000 0.000) 0.576 19.040 ( 2.246 0.000 0.000) 2.246 19.093 ( -3.012 0.000 0.000) 3.012 19.132 ( 10.498 0.000 0.000) 10.498 19.319 ( -8.086 0.000 0.000) 8.086 ======================= Grid point 9 (6/120) ======================= q-point: ( 0.00 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.608 ( 0.000 31.516 0.000) 31.516 0.701 ( 0.000 36.356 0.000) 36.356 1.076 ( 0.000 54.802 0.000) 54.802 2.476 ( 0.000 1.010 0.000) 1.010 3.153 ( 0.000 -2.057 0.000) 2.057 3.250 ( 0.000 -10.307 0.000) 10.307 3.250 ( 0.000 -3.827 0.000) 3.827 3.596 ( 0.000 6.440 0.000) 6.440 3.744 ( 0.000 -3.424 0.000) 3.424 4.101 ( 0.000 -10.266 0.000) 10.266 4.208 ( 0.000 -1.491 0.000) 1.491 4.744 ( 0.000 6.022 0.000) 6.022 4.779 ( 0.000 0.990 0.000) 0.990 4.844 ( 0.000 -4.410 0.000) 4.410 5.172 ( 0.000 -1.005 0.000) 1.005 5.532 ( 0.000 -2.557 0.000) 2.557 5.633 ( 0.000 8.898 0.000) 8.898 5.718 ( 0.000 8.935 0.000) 8.935 6.973 ( 0.000 -11.443 0.000) 11.443 7.105 ( 0.000 7.077 0.000) 7.077 7.125 ( 0.000 -8.289 0.000) 8.289 7.749 ( 0.000 2.614 0.000) 2.614 8.128 ( 0.000 -3.692 0.000) 3.692 8.204 ( 0.000 -5.674 0.000) 5.674 8.264 ( 0.000 2.779 0.000) 2.779 8.500 ( 0.000 -1.470 0.000) 1.470 8.568 ( 0.000 1.599 0.000) 1.599 9.372 ( 0.000 -2.640 0.000) 2.640 9.380 ( 0.000 -0.850 0.000) 0.850 9.465 ( 0.000 -8.596 0.000) 8.596 9.597 ( 0.000 1.457 0.000) 1.457 9.655 ( 0.000 0.538 0.000) 0.538 9.991 ( 0.000 0.070 0.000) 0.070 10.232 ( 0.000 -7.304 0.000) 7.304 10.722 ( 0.000 17.991 0.000) 17.991 10.768 ( 0.000 -5.853 0.000) 5.853 10.880 ( 0.000 -4.232 0.000) 4.232 11.702 ( 0.000 -1.030 0.000) 1.030 11.773 ( 0.000 9.132 0.000) 9.132 12.023 ( 0.000 2.375 0.000) 2.375 12.027 ( 0.000 23.153 0.000) 23.153 12.606 ( 0.000 -0.052 0.000) 0.052 12.780 ( 0.000 -6.056 0.000) 6.056 13.727 ( 0.000 3.115 0.000) 3.115 14.508 ( 0.000 5.279 0.000) 5.279 14.894 ( 0.000 -17.278 0.000) 17.278 15.039 ( 0.000 -2.076 0.000) 2.076 15.517 ( 0.000 14.090 0.000) 14.090 15.525 ( 0.000 -15.207 0.000) 15.207 15.928 ( 0.000 0.244 0.000) 0.244 16.166 ( 0.000 3.525 0.000) 3.525 16.279 ( 0.000 -2.005 0.000) 2.005 16.330 ( 0.000 -3.558 0.000) 3.558 16.702 ( 0.000 -5.670 0.000) 5.670 16.703 ( 0.000 -2.997 0.000) 2.997 17.524 ( 0.000 -7.676 0.000) 7.676 18.384 ( 0.000 3.589 0.000) 3.589 18.925 ( 0.000 -2.717 0.000) 2.717 19.084 ( 0.000 11.530 0.000) 11.530 19.637 ( 0.000 1.584 0.000) 1.584 ======================= Grid point 10 (7/120) ======================= q-point: ( 0.11 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.835 ( 22.590 17.882 0.000) 28.811 0.840 ( 19.601 21.060 0.000) 28.771 1.698 ( 43.768 38.257 0.000) 58.131 2.494 ( 1.700 -0.341 0.000) 1.734 3.103 ( -4.962 -2.138 0.000) 5.403 3.227 ( -2.354 -12.381 0.000) 12.603 3.263 ( 1.319 -4.457 0.000) 4.648 3.610 ( 0.279 4.490 0.000) 4.499 3.679 ( -5.216 -1.916 0.000) 5.557 3.969 ( -15.767 2.353 0.000) 15.942 4.086 ( -3.372 -7.913 0.000) 8.602 4.706 ( -9.479 -7.238 0.000) 11.926 4.841 ( 1.823 6.164 0.000) 6.428 4.923 ( 8.889 3.884 0.000) 9.701 5.275 ( 10.091 -1.030 0.000) 10.144 5.356 ( -9.449 21.039 0.000) 23.063 5.522 ( -1.072 2.193 0.000) 2.441 5.681 ( 5.020 8.290 0.000) 9.691 7.040 ( -3.613 -2.679 0.000) 4.498 7.132 ( 8.057 -16.668 0.000) 18.513 7.176 ( 2.006 2.173 0.000) 2.957 7.754 ( -2.027 3.008 0.000) 3.627 7.870 ( -14.297 13.603 0.000) 19.735 8.083 ( -4.841 -6.164 0.000) 7.838 8.199 ( -0.916 -5.687 0.000) 5.760 8.426 ( -12.588 2.674 0.000) 12.869 8.453 ( -6.206 -1.585 0.000) 6.406 8.780 ( -2.505 15.673 0.000) 15.872 9.273 ( -14.512 -7.389 0.000) 16.285 9.621 ( 2.876 0.040 0.000) 2.877 9.783 ( 6.666 -0.052 0.000) 6.666 9.930 ( -0.693 -4.573 0.000) 4.625 10.218 ( 1.109 -7.363 0.000) 7.446 10.700 ( -5.836 -4.772 0.000) 7.539 10.720 ( 34.656 -28.316 0.000) 44.754 10.739 ( 3.429 13.876 0.000) 14.293 10.880 ( -0.356 -4.765 0.000) 4.779 11.632 ( -9.673 12.626 0.000) 15.905 11.911 ( 17.596 -1.035 0.000) 17.627 12.212 ( 13.856 18.633 0.000) 23.220 12.219 ( 19.358 1.991 0.000) 19.460 12.664 ( 5.429 -0.925 0.000) 5.507 12.724 ( -7.532 2.371 0.000) 7.896 13.313 ( -11.880 15.793 0.000) 19.763 14.411 ( -8.860 3.658 0.000) 9.586 14.952 ( -8.552 -1.631 0.000) 8.706 14.975 ( 0.128 -17.803 0.000) 17.804 15.557 ( -1.713 3.804 0.000) 4.172 15.566 ( 3.259 -11.915 0.000) 12.352 15.914 ( -0.126 1.189 0.000) 1.196 15.976 ( -4.295 12.604 0.000) 13.315 16.420 ( 7.184 -5.070 0.000) 8.793 16.622 ( 9.853 -21.381 0.000) 23.542 16.668 ( -2.979 -6.957 0.000) 7.568 16.731 ( 3.054 -2.701 0.000) 4.077 17.444 ( -7.944 -7.475 0.000) 10.908 18.471 ( 8.168 3.467 0.000) 8.873 19.089 ( 0.442 11.436 0.000) 11.445 19.116 ( 8.868 -9.185 0.000) 12.767 19.621 ( -1.591 1.718 0.000) 2.342 ======================= Grid point 11 (8/120) ======================= q-point: ( 0.22 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.284 ( 23.107 10.435 0.000) 25.354 1.411 ( 30.812 -0.331 0.000) 30.814 2.541 ( 2.758 -2.826 0.000) 3.949 2.563 ( 38.324 24.784 0.000) 45.640 2.958 ( -9.352 -2.311 0.000) 9.634 3.160 ( -4.128 -15.456 0.000) 15.998 3.303 ( 2.503 -5.745 0.000) 6.266 3.485 ( -9.629 -4.098 0.000) 10.465 3.666 ( 1.181 4.320 0.000) 4.478 3.681 ( -9.961 11.149 0.000) 14.951 4.005 ( -5.042 -9.975 0.000) 11.176 4.432 ( -16.675 -6.593 0.000) 17.931 4.883 ( 1.651 12.033 0.000) 12.146 4.893 ( -5.905 7.409 0.000) 9.475 5.503 ( 0.990 4.925 0.000) 5.024 5.565 ( 18.324 -1.235 0.000) 18.365 5.573 ( 20.829 7.080 0.000) 21.999 5.848 ( 11.801 6.507 0.000) 13.476 6.962 ( -4.740 -5.707 0.000) 7.418 7.185 ( -1.234 7.572 0.000) 7.672 7.237 ( 2.349 -12.785 0.000) 12.999 7.665 ( -4.425 3.758 0.000) 5.806 7.712 ( -7.279 5.577 0.000) 9.170 7.956 ( -8.410 -6.312 0.000) 10.515 8.048 ( -17.188 -0.302 0.000) 17.191 8.226 ( -3.488 -1.214 0.000) 3.694 8.312 ( -5.493 -2.854 0.000) 6.190 8.856 ( 8.013 12.121 0.000) 14.530 8.957 ( -15.959 -8.739 0.000) 18.195 9.657 ( -0.096 -0.613 0.000) 0.621 9.873 ( 2.219 1.148 0.000) 2.498 9.912 ( -0.969 -2.955 0.000) 3.110 10.215 ( -0.915 -4.602 0.000) 4.693 10.565 ( -7.060 -3.558 0.000) 7.906 10.780 ( 2.602 19.467 0.000) 19.640 10.873 ( 0.245 -5.021 0.000) 5.027 11.194 ( 14.978 -24.077 0.000) 28.356 11.439 ( -9.344 13.369 0.000) 16.311 12.154 ( 0.304 9.568 0.000) 9.573 12.509 ( 14.710 15.228 0.000) 21.173 12.695 ( 19.250 2.173 0.000) 19.372 12.785 ( 28.756 5.531 0.000) 29.283 12.806 ( 8.156 -3.287 0.000) 8.794 13.312 ( 6.484 -2.622 0.000) 6.994 14.198 ( -11.069 1.359 0.000) 11.152 14.718 ( -13.875 -0.314 0.000) 13.878 14.962 ( 0.144 -15.553 0.000) 15.554 15.394 ( -12.170 5.660 0.000) 13.422 15.600 ( -1.572 -3.712 0.000) 4.031 15.950 ( 3.497 2.356 0.000) 4.216 15.986 ( 3.609 8.949 0.000) 9.650 16.513 ( -0.905 -13.918 0.000) 13.948 16.651 ( 4.235 -5.354 0.000) 6.826 16.684 ( -0.371 -17.862 0.000) 17.866 16.819 ( 4.248 -3.255 0.000) 5.352 17.205 ( -15.766 -7.079 0.000) 17.282 18.682 ( 12.093 3.284 0.000) 12.531 19.101 ( 0.767 11.164 0.000) 11.190 19.203 ( 1.171 -2.136 0.000) 2.436 19.572 ( -3.389 2.067 0.000) 3.970 ======================= Grid point 12 (9/120) ======================= q-point: ( 0.33 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.735 ( 21.344 3.694 0.000) 21.662 1.997 ( 26.475 -6.025 0.000) 27.152 2.590 ( 1.733 -3.401 0.000) 3.817 2.732 ( -12.799 -3.754 0.000) 13.339 3.036 ( 1.699 -2.409 0.000) 2.947 3.100 ( 4.883 6.171 0.000) 7.869 3.282 ( -8.821 -5.263 0.000) 10.272 3.368 ( 2.140 -5.445 0.000) 5.851 3.670 ( -0.817 -1.070 0.000) 1.346 3.674 ( 7.689 6.239 0.000) 9.901 3.888 ( -6.339 -9.221 0.000) 11.190 4.083 ( -16.602 -5.169 0.000) 17.388 4.833 ( 1.190 10.387 0.000) 10.455 4.903 ( 0.546 18.950 0.000) 18.957 5.562 ( 7.324 9.228 0.000) 11.781 5.989 ( 23.282 -1.690 0.000) 23.343 6.051 ( 24.878 2.324 0.000) 24.987 6.150 ( 17.765 4.503 0.000) 18.327 6.798 ( -12.980 -4.686 0.000) 13.800 7.138 ( -3.244 9.436 0.000) 9.978 7.202 ( -7.118 -7.377 0.000) 10.251 7.435 ( -15.368 0.527 0.000) 15.377 7.608 ( -10.058 7.930 0.000) 12.808 7.664 ( -19.011 2.778 0.000) 19.213 7.806 ( -0.769 -7.869 0.000) 7.907 8.152 ( -5.115 -3.434 0.000) 6.161 8.290 ( 2.779 -5.566 0.000) 6.221 8.674 ( -11.317 -10.182 0.000) 15.223 9.055 ( 11.007 8.771 0.000) 14.074 9.607 ( -4.792 0.264 0.000) 4.800 9.881 ( -0.999 2.181 0.000) 2.399 9.887 ( -1.509 -1.380 0.000) 2.045 10.200 ( -0.011 -1.948 0.000) 1.948 10.427 ( -6.545 -2.404 0.000) 6.973 10.846 ( 4.076 18.064 0.000) 18.518 10.909 ( 3.573 -5.433 0.000) 6.503 11.260 ( -8.301 13.496 0.000) 15.845 11.343 ( -0.963 -19.732 0.000) 19.756 12.166 ( 6.917 16.731 0.000) 18.105 12.739 ( 5.961 12.204 0.000) 13.582 12.974 ( 8.445 -6.944 0.000) 10.933 13.078 ( 14.093 -3.793 0.000) 14.594 13.402 ( 20.348 -6.768 0.000) 21.444 13.589 ( 29.470 4.060 0.000) 29.749 14.019 ( -5.705 -1.735 0.000) 5.963 14.437 ( -12.827 3.463 0.000) 13.286 14.899 ( -11.609 -3.992 0.000) 12.276 15.288 ( 9.075 -0.649 0.000) 9.098 15.445 ( -14.753 4.884 0.000) 15.541 16.030 ( 3.880 2.609 0.000) 4.676 16.064 ( 3.403 4.712 0.000) 5.812 16.479 ( -0.251 -21.368 0.000) 21.370 16.654 ( -2.326 -17.752 0.000) 17.904 16.739 ( -4.686 -5.202 0.000) 7.002 16.842 ( -12.889 -6.408 0.000) 14.395 16.883 ( 2.099 -2.629 0.000) 3.364 18.931 ( 12.192 3.168 0.000) 12.597 19.119 ( 1.027 10.556 0.000) 10.606 19.200 ( -0.970 3.266 0.000) 3.407 19.483 ( -5.510 2.502 0.000) 6.052 ======================= Grid point 13 (10/120) ======================= q-point: ( 0.44 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( 17.585 -1.501 0.000) 17.649 2.401 ( 3.313 -8.189 0.000) 8.834 2.488 ( -2.560 -1.351 0.000) 2.894 2.595 ( -1.849 -2.090 0.000) 2.791 2.987 ( 0.278 -1.042 0.000) 1.079 3.099 ( -8.953 -3.792 0.000) 9.723 3.242 ( 7.553 2.439 0.000) 7.937 3.374 ( -3.525 -2.974 0.000) 4.612 3.658 ( 1.031 -9.487 0.000) 9.543 3.729 ( -4.323 -15.179 0.000) 15.782 3.803 ( -0.469 1.111 0.000) 1.206 3.840 ( -6.141 -3.996 0.000) 7.327 4.896 ( 2.585 21.692 0.000) 21.846 4.912 ( 0.301 23.838 0.000) 23.839 5.867 ( 22.725 6.099 0.000) 23.529 6.341 ( -15.639 4.024 0.000) 16.148 6.482 ( 21.157 -3.492 0.000) 21.443 6.539 ( 22.754 1.890 0.000) 22.833 6.610 ( 15.039 0.823 0.000) 15.061 6.921 ( -19.222 -4.192 0.000) 19.674 6.983 ( -14.445 2.602 0.000) 14.677 7.068 ( -21.211 -0.501 0.000) 21.217 7.395 ( -4.905 7.972 0.000) 9.360 7.419 ( -5.653 8.951 0.000) 10.586 7.886 ( 6.222 -7.460 0.000) 9.715 8.023 ( -7.094 -5.940 0.000) 9.252 8.382 ( 5.643 -7.500 0.000) 9.386 8.503 ( -6.565 -9.314 0.000) 11.396 9.277 ( 10.647 5.366 0.000) 11.923 9.471 ( -8.496 2.381 0.000) 8.824 9.857 ( -0.815 1.992 0.000) 2.153 9.859 ( -0.974 0.615 0.000) 1.152 10.227 ( 2.733 -0.774 0.000) 2.841 10.308 ( -5.177 -1.161 0.000) 5.305 10.943 ( 5.348 14.776 0.000) 15.714 11.001 ( 3.415 -2.262 0.000) 4.096 11.124 ( -3.233 9.440 0.000) 9.978 11.221 ( -8.406 -10.128 0.000) 13.162 12.420 ( 15.490 11.042 0.000) 19.022 12.694 ( -9.773 9.288 0.000) 13.482 13.132 ( 6.535 -8.607 0.000) 10.807 13.205 ( 0.100 -8.584 0.000) 8.585 13.701 ( 13.041 -7.653 0.000) 15.121 13.923 ( -7.587 -8.890 0.000) 11.687 14.282 ( 29.409 3.941 0.000) 29.672 14.309 ( 3.292 10.042 0.000) 10.568 14.614 ( -9.295 9.743 0.000) 13.465 15.010 ( -27.534 8.414 0.000) 28.791 15.689 ( 26.823 -6.164 0.000) 27.522 16.088 ( 1.286 1.658 0.000) 2.098 16.108 ( 0.849 1.739 0.000) 1.935 16.268 ( -27.448 -6.859 0.000) 28.292 16.523 ( 3.052 -21.148 0.000) 21.367 16.595 ( -3.493 -18.917 0.000) 19.237 16.869 ( 2.859 -4.284 0.000) 5.150 16.901 ( -0.325 -3.239 0.000) 3.256 19.142 ( 1.241 9.181 0.000) 9.264 19.148 ( 6.118 4.178 0.000) 7.409 19.186 ( 2.875 5.771 0.000) 6.448 19.349 ( -7.895 2.923 0.000) 8.419 ======================= Grid point 18 (11/120) ======================= q-point: ( 0.00 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( 0.000 29.464 0.000) 29.464 1.373 ( 0.000 34.084 0.000) 34.084 2.042 ( 0.000 45.066 0.000) 45.066 2.426 ( 0.000 -8.091 0.000) 8.091 2.977 ( 0.000 -17.732 0.000) 17.732 3.110 ( 0.000 -2.229 0.000) 2.229 3.215 ( 0.000 1.759 0.000) 1.759 3.639 ( 0.000 -6.403 0.000) 6.403 3.779 ( 0.000 11.424 0.000) 11.424 3.890 ( 0.000 -10.122 0.000) 10.122 4.137 ( 0.000 -6.592 0.000) 6.592 4.600 ( 0.000 -13.436 0.000) 13.436 4.893 ( 0.000 9.258 0.000) 9.258 4.924 ( 0.000 6.190 0.000) 6.190 5.144 ( 0.000 -1.946 0.000) 1.946 5.451 ( 0.000 -6.255 0.000) 6.255 5.867 ( 0.000 15.339 0.000) 15.339 5.920 ( 0.000 11.490 0.000) 11.490 6.695 ( 0.000 -16.459 0.000) 16.459 6.898 ( 0.000 -15.134 0.000) 15.134 7.295 ( 0.000 12.465 0.000) 12.465 7.810 ( 0.000 3.640 0.000) 3.640 8.052 ( 0.000 -4.296 0.000) 4.296 8.052 ( 0.000 -10.022 0.000) 10.022 8.316 ( 0.000 2.759 0.000) 2.759 8.463 ( 0.000 -2.225 0.000) 2.225 8.627 ( 0.000 4.978 0.000) 4.978 9.249 ( 0.000 -13.347 0.000) 13.347 9.328 ( 0.000 -1.575 0.000) 1.575 9.358 ( 0.000 -1.351 0.000) 1.351 9.629 ( 0.000 1.771 0.000) 1.771 9.666 ( 0.000 0.523 0.000) 0.523 9.995 ( 0.000 0.531 0.000) 0.531 10.124 ( 0.000 -4.443 0.000) 4.443 10.671 ( 0.000 -3.681 0.000) 3.681 10.782 ( 0.000 -5.615 0.000) 5.615 11.076 ( 0.000 18.350 0.000) 18.350 11.667 ( 0.000 -2.876 0.000) 2.876 11.995 ( 0.000 13.214 0.000) 13.214 12.091 ( 0.000 4.873 0.000) 4.873 12.473 ( 0.000 8.658 0.000) 8.658 12.620 ( 0.000 -10.375 0.000) 10.375 12.714 ( 0.000 24.869 0.000) 24.869 13.822 ( 0.000 7.033 0.000) 7.033 14.564 ( 0.000 -17.185 0.000) 17.185 14.638 ( 0.000 7.833 0.000) 7.833 14.949 ( 0.000 -15.190 0.000) 15.190 15.072 ( 0.000 -23.452 0.000) 23.452 15.764 ( 0.000 11.867 0.000) 11.867 15.947 ( 0.000 2.114 0.000) 2.114 16.221 ( 0.000 -4.184 0.000) 4.184 16.258 ( 0.000 5.855 0.000) 5.855 16.261 ( 0.000 -4.621 0.000) 4.621 16.623 ( 0.000 -5.291 0.000) 5.291 16.658 ( 0.000 2.757 0.000) 2.757 17.324 ( 0.000 -12.742 0.000) 12.742 18.478 ( 0.000 6.083 0.000) 6.083 18.850 ( 0.000 -5.042 0.000) 5.042 19.329 ( 0.000 12.743 0.000) 12.743 19.663 ( 0.000 0.635 0.000) 0.635 ======================= Grid point 19 (12/120) ======================= q-point: ( 0.11 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.295 ( 9.851 25.255 0.000) 27.108 1.335 ( 2.738 30.577 0.000) 30.699 2.419 ( 29.202 33.412 0.000) 44.375 2.428 ( 0.237 -8.014 0.000) 8.018 2.925 ( -4.631 -18.120 0.000) 18.702 3.070 ( -3.961 -1.003 0.000) 4.086 3.203 ( -0.891 -0.309 0.000) 0.943 3.563 ( -7.108 -6.567 0.000) 9.677 3.790 ( 0.612 10.553 0.000) 10.570 3.853 ( -2.784 -8.199 0.000) 8.659 4.068 ( -6.763 0.673 0.000) 6.797 4.517 ( -8.058 -11.840 0.000) 14.322 4.985 ( 5.700 7.729 0.000) 9.603 4.985 ( 6.763 3.454 0.000) 7.594 5.246 ( 9.951 -2.069 0.000) 10.164 5.391 ( -3.863 -5.961 0.000) 7.103 5.833 ( -3.436 19.059 0.000) 19.367 5.902 ( 3.666 14.600 0.000) 15.053 6.802 ( 7.855 -17.978 0.000) 19.619 6.870 ( -2.471 -13.375 0.000) 13.601 7.329 ( 2.862 11.945 0.000) 12.283 7.793 ( -2.396 1.711 0.000) 2.944 7.947 ( -9.830 -4.471 0.000) 10.799 8.055 ( -0.062 -9.309 0.000) 9.309 8.101 ( -11.164 7.840 0.000) 13.642 8.411 ( -6.666 -2.951 0.000) 7.291 8.497 ( -11.927 4.979 0.000) 12.925 9.061 ( -2.037 13.285 0.000) 13.441 9.077 ( -14.665 -12.454 0.000) 19.240 9.638 ( 1.879 1.732 0.000) 2.556 9.769 ( 6.276 -11.994 0.000) 13.537 9.773 ( 6.447 -1.173 0.000) 6.553 10.125 ( 4.486 -2.292 0.000) 5.037 10.313 ( 25.220 -11.825 0.000) 27.855 10.621 ( -4.490 -2.802 0.000) 5.293 10.775 ( -0.685 -5.860 0.000) 5.900 11.118 ( 4.057 20.249 0.000) 20.652 11.860 ( 16.898 -4.427 0.000) 17.468 11.914 ( -6.836 16.020 0.000) 17.418 12.274 ( 17.826 3.685 0.000) 18.203 12.535 ( 5.168 1.576 0.000) 5.403 12.655 ( 4.133 -7.276 0.000) 8.368 12.791 ( 7.141 26.699 0.000) 27.637 13.589 ( -16.616 13.510 0.000) 21.415 14.470 ( -12.869 0.243 0.000) 12.871 14.584 ( 0.152 -21.303 0.000) 21.303 14.908 ( -6.893 -3.084 0.000) 7.551 15.173 ( 9.546 -26.609 0.000) 28.270 15.708 ( -5.811 9.824 0.000) 11.415 15.957 ( 1.591 3.528 0.000) 3.870 16.171 ( -2.664 5.486 0.000) 6.098 16.332 ( 3.805 -7.511 0.000) 8.420 16.336 ( 6.160 -4.885 0.000) 7.862 16.592 ( -6.400 1.261 0.000) 6.523 16.657 ( 3.505 -4.963 0.000) 6.076 17.247 ( -7.694 -12.659 0.000) 14.814 18.564 ( 8.065 6.130 0.000) 10.131 18.969 ( 9.290 -6.967 0.000) 11.612 19.331 ( 0.167 12.551 0.000) 12.552 19.651 ( -1.249 0.863 0.000) 1.518 ======================= Grid point 20 (13/120) ======================= q-point: ( 0.22 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( 14.478 16.645 0.000) 22.060 1.552 ( 17.243 14.837 0.000) 22.747 2.441 ( 1.155 -8.309 0.000) 8.388 2.796 ( -5.717 -19.337 0.000) 20.165 2.938 ( 2.080 2.455 0.000) 3.217 3.016 ( 12.697 12.492 0.000) 17.812 3.194 ( 0.174 -4.227 0.000) 4.230 3.385 ( -9.660 -6.341 0.000) 11.555 3.778 ( -2.360 7.481 0.000) 7.845 3.827 ( 1.421 0.562 0.000) 1.528 3.892 ( -9.882 5.143 0.000) 11.141 4.290 ( -14.015 -8.267 0.000) 16.271 4.999 ( -2.818 4.662 0.000) 5.448 5.129 ( 8.104 12.601 0.000) 14.981 5.509 ( 14.420 -4.116 0.000) 14.996 5.529 ( 17.752 -2.636 0.000) 17.947 5.859 ( 6.114 19.823 0.000) 20.744 6.026 ( 9.013 12.015 0.000) 15.019 6.810 ( -3.547 -10.280 0.000) 10.875 6.948 ( 6.201 -17.101 0.000) 18.190 7.383 ( 1.821 12.901 0.000) 13.029 7.689 ( -7.808 0.152 0.000) 7.809 7.775 ( -7.351 -2.989 0.000) 7.936 7.914 ( -8.666 5.162 0.000) 10.087 8.007 ( -7.517 -4.398 0.000) 8.709 8.224 ( -11.815 1.511 0.000) 11.912 8.248 ( -7.631 -3.927 0.000) 8.583 8.733 ( -18.306 -13.933 0.000) 23.005 9.116 ( 5.768 14.318 0.000) 15.436 9.665 ( 0.143 1.706 0.000) 1.712 9.812 ( 0.667 -7.738 0.000) 7.767 9.871 ( 2.926 -1.810 0.000) 3.440 10.182 ( 1.999 1.355 0.000) 2.415 10.514 ( -5.568 -0.932 0.000) 5.645 10.760 ( 16.061 -19.329 0.000) 25.131 10.762 ( -0.154 -6.366 0.000) 6.368 11.215 ( 4.825 23.778 0.000) 24.262 11.759 ( -8.125 19.229 0.000) 20.875 12.202 ( 13.570 -3.915 0.000) 14.123 12.653 ( 6.261 -7.125 0.000) 9.485 12.717 ( 20.580 0.779 0.000) 20.595 12.869 ( 20.297 -0.531 0.000) 20.304 12.959 ( 8.152 25.312 0.000) 26.592 13.363 ( -1.642 10.918 0.000) 11.041 14.197 ( -13.503 -2.890 0.000) 13.808 14.589 ( 2.234 -22.725 0.000) 22.835 14.718 ( -10.573 0.610 0.000) 10.590 15.370 ( 8.978 -20.998 0.000) 22.837 15.530 ( -11.091 8.582 0.000) 14.024 16.022 ( 4.659 5.398 0.000) 7.130 16.125 ( -2.388 -0.079 0.000) 2.389 16.351 ( -11.248 0.293 0.000) 11.252 16.380 ( 1.437 -6.892 0.000) 7.041 16.517 ( 5.167 -8.477 0.000) 9.928 16.742 ( 4.157 -5.086 0.000) 6.569 17.014 ( -15.565 -12.527 0.000) 19.979 18.773 ( 11.915 6.021 0.000) 13.350 19.138 ( 6.770 -4.627 0.000) 8.200 19.335 ( 0.148 11.923 0.000) 11.924 19.611 ( -2.803 1.501 0.000) 3.180 ======================= Grid point 21 (14/120) ======================= q-point: ( 0.33 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.845 ( 14.368 7.907 0.000) 16.400 1.944 ( 19.919 1.751 0.000) 19.995 2.476 ( 2.142 -8.793 0.000) 9.050 2.627 ( -10.206 -8.973 0.000) 13.589 2.898 ( 0.288 -5.733 0.000) 5.741 3.171 ( -5.578 -5.324 0.000) 7.711 3.202 ( 1.840 -2.356 0.000) 2.989 3.243 ( -1.285 -6.680 0.000) 6.803 3.688 ( -6.279 3.069 0.000) 6.989 3.692 ( -9.449 1.251 0.000) 9.531 3.875 ( -0.152 4.359 0.000) 4.362 3.991 ( -14.434 -4.864 0.000) 15.231 5.092 ( 13.303 16.648 0.000) 21.311 5.287 ( 7.112 19.714 0.000) 20.957 5.755 ( 9.137 7.238 0.000) 11.657 5.937 ( 22.216 -4.100 0.000) 22.591 6.132 ( 20.734 8.047 0.000) 22.241 6.268 ( 14.892 7.781 0.000) 16.802 6.706 ( -7.512 -5.119 0.000) 9.090 7.020 ( -0.693 -12.132 0.000) 12.152 7.359 ( -6.439 13.667 0.000) 15.108 7.446 ( -16.255 0.335 0.000) 16.259 7.622 ( -8.437 -8.741 0.000) 12.148 7.731 ( -14.380 4.124 0.000) 14.960 7.769 ( -4.237 7.405 0.000) 8.531 8.061 ( -8.642 -5.755 0.000) 10.383 8.170 ( 0.017 -6.682 0.000) 6.682 8.412 ( -11.437 -16.621 0.000) 20.175 9.254 ( 7.411 11.374 0.000) 13.575 9.632 ( -3.403 2.532 0.000) 4.242 9.821 ( 0.395 -5.945 0.000) 5.958 9.889 ( -0.764 -1.997 0.000) 2.138 10.218 ( 1.859 4.516 0.000) 4.884 10.410 ( -4.658 1.547 0.000) 4.908 10.784 ( 2.503 -7.515 0.000) 7.921 10.955 ( 3.852 -17.992 0.000) 18.400 11.298 ( 3.595 25.543 0.000) 25.794 11.601 ( -7.369 21.564 0.000) 22.788 12.411 ( 9.842 5.962 0.000) 11.507 12.776 ( 5.677 -13.440 0.000) 14.590 12.954 ( 3.551 -6.784 0.000) 7.657 13.055 ( -0.066 19.606 0.000) 19.606 13.270 ( 16.613 -6.753 0.000) 17.933 13.724 ( 33.705 10.645 0.000) 35.346 13.953 ( -10.506 -5.672 0.000) 11.940 14.539 ( -5.781 7.622 0.000) 9.567 14.723 ( 9.929 -14.862 0.000) 17.874 15.330 ( -5.501 5.711 0.000) 7.930 15.489 ( 0.400 -6.312 0.000) 6.324 16.013 ( -12.810 -8.429 0.000) 15.335 16.062 ( -3.899 -11.134 0.000) 11.797 16.172 ( 3.753 1.206 0.000) 3.942 16.396 ( -0.116 -1.495 0.000) 1.500 16.588 ( -14.357 -10.757 0.000) 17.940 16.677 ( -3.043 -9.934 0.000) 10.390 16.803 ( 1.625 -5.679 0.000) 5.907 19.017 ( 11.892 5.539 0.000) 13.118 19.241 ( 3.774 0.514 0.000) 3.809 19.335 ( -0.207 10.684 0.000) 10.686 19.535 ( -4.826 2.434 0.000) 5.405 ======================= Grid point 22 (15/120) ======================= q-point: ( 0.44 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( 11.755 0.291 0.000) 11.759 2.251 ( 4.715 -5.818 0.000) 7.489 2.453 ( -2.484 -3.020 0.000) 3.910 2.502 ( -0.682 -7.840 0.000) 7.870 2.942 ( 3.374 -3.387 0.000) 4.781 3.041 ( -6.290 -1.947 0.000) 6.585 3.212 ( 1.166 -7.711 0.000) 7.798 3.239 ( -0.730 -9.273 0.000) 9.302 3.543 ( -4.134 -0.604 0.000) 4.178 3.562 ( -5.151 0.157 0.000) 5.154 3.782 ( -4.456 -3.162 0.000) 5.464 3.805 ( -4.643 -1.359 0.000) 4.838 5.361 ( 8.154 25.441 0.000) 26.716 5.395 ( 2.981 25.119 0.000) 25.295 6.004 ( 17.932 6.773 0.000) 19.169 6.332 ( 2.046 -8.164 0.000) 8.417 6.478 ( 6.098 6.532 0.000) 8.936 6.590 ( 22.683 3.567 0.000) 22.962 6.664 ( 16.620 3.463 0.000) 16.977 6.847 ( -15.645 -3.132 0.000) 15.955 7.060 ( -20.785 6.024 0.000) 21.640 7.069 ( -20.524 0.468 0.000) 20.530 7.525 ( 0.069 -3.582 0.000) 3.583 7.569 ( -3.565 9.103 0.000) 9.776 7.746 ( 1.711 -1.314 0.000) 2.158 7.855 ( -9.288 -11.123 0.000) 14.491 8.212 ( 3.191 -9.733 0.000) 10.242 8.280 ( -3.776 -13.115 0.000) 13.648 9.402 ( 7.167 7.486 0.000) 10.364 9.536 ( -5.953 4.383 0.000) 7.393 9.832 ( 0.881 -4.130 0.000) 4.223 9.859 ( -1.730 -2.674 0.000) 3.185 10.264 ( 2.732 5.527 0.000) 6.166 10.328 ( -3.634 4.177 0.000) 5.536 10.859 ( 4.630 -9.896 0.000) 10.925 10.948 ( -3.428 -13.830 0.000) 14.249 11.372 ( 4.030 25.330 0.000) 25.649 11.469 ( -5.726 23.657 0.000) 24.340 12.644 ( 12.903 8.281 0.000) 15.332 12.845 ( -2.121 -10.793 0.000) 10.999 12.967 ( -4.616 8.173 0.000) 9.386 12.968 ( -0.981 -12.377 0.000) 12.416 13.548 ( 11.460 -9.015 0.000) 14.581 13.757 ( -9.747 -9.277 0.000) 13.456 14.404 ( 26.428 9.507 0.000) 28.086 14.520 ( 3.023 13.079 0.000) 13.423 14.826 ( 3.972 11.076 0.000) 11.766 15.229 ( -24.960 13.860 0.000) 28.550 15.516 ( 23.574 -11.494 0.000) 26.227 15.889 ( 1.198 -27.968 0.000) 27.994 15.974 ( -4.624 -19.956 0.000) 20.485 16.081 ( -28.031 -12.128 0.000) 30.543 16.283 ( 5.245 3.082 0.000) 6.084 16.367 ( -2.858 1.619 0.000) 3.285 16.754 ( 3.800 -7.577 0.000) 8.477 16.806 ( -1.275 -6.567 0.000) 6.689 19.236 ( 9.559 4.878 0.000) 10.732 19.300 ( 2.386 4.911 0.000) 5.460 19.323 ( -1.048 8.550 0.000) 8.614 19.415 ( -7.182 3.508 0.000) 7.993 ======================= Grid point 27 (16/120) ======================= q-point: ( 0.00 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 0.000 25.818 0.000) 25.818 1.988 ( 0.000 30.160 0.000) 30.160 2.156 ( 0.000 -19.485 0.000) 19.485 2.486 ( 0.000 -17.454 0.000) 17.454 2.819 ( 0.000 18.102 0.000) 18.102 3.054 ( 0.000 -5.204 0.000) 5.204 3.321 ( 0.000 8.240 0.000) 8.240 3.490 ( 0.000 -8.825 0.000) 8.825 3.790 ( 0.000 1.647 0.000) 1.647 3.951 ( 0.000 -11.997 0.000) 11.997 4.033 ( 0.000 14.692 0.000) 14.692 4.322 ( 0.000 -15.283 0.000) 15.283 5.027 ( 0.000 4.517 0.000) 4.517 5.086 ( 0.000 10.888 0.000) 10.888 5.097 ( 0.000 -2.985 0.000) 2.985 5.292 ( 0.000 -10.148 0.000) 10.148 6.143 ( 0.000 12.027 0.000) 12.027 6.200 ( 0.000 19.081 0.000) 19.081 6.392 ( 0.000 -14.622 0.000) 14.622 6.568 ( 0.000 -19.003 0.000) 19.003 7.559 ( 0.000 14.653 0.000) 14.653 7.829 ( 0.000 -13.285 0.000) 13.285 7.885 ( 0.000 4.191 0.000) 4.191 7.968 ( 0.000 -4.459 0.000) 4.459 8.368 ( 0.000 2.691 0.000) 2.691 8.418 ( 0.000 -2.521 0.000) 2.521 8.766 ( 0.000 9.624 0.000) 9.624 8.988 ( 0.000 -13.354 0.000) 13.354 9.316 ( 0.000 0.254 0.000) 0.254 9.332 ( 0.000 -1.234 0.000) 1.234 9.658 ( 0.000 1.186 0.000) 1.186 9.671 ( 0.000 -0.137 0.000) 0.137 10.014 ( 0.000 1.521 0.000) 1.521 10.055 ( 0.000 -2.849 0.000) 2.849 10.639 ( 0.000 0.439 0.000) 0.439 10.685 ( 0.000 -4.109 0.000) 4.109 11.386 ( 0.000 13.516 0.000) 13.516 11.579 ( 0.000 -6.926 0.000) 6.926 12.216 ( 0.000 8.373 0.000) 8.373 12.242 ( 0.000 11.978 0.000) 11.978 12.407 ( 0.000 -11.306 0.000) 11.306 12.428 ( 0.000 -7.198 0.000) 7.198 13.428 ( 0.000 42.727 0.000) 42.727 13.998 ( 0.000 11.448 0.000) 11.448 14.253 ( 0.000 -15.154 0.000) 15.154 14.258 ( 0.000 -43.146 0.000) 43.146 14.787 ( 0.000 7.393 0.000) 7.393 14.912 ( 0.000 -5.843 0.000) 5.843 15.966 ( 0.000 9.318 0.000) 9.318 16.018 ( 0.000 5.366 0.000) 5.366 16.118 ( 0.000 -6.660 0.000) 6.660 16.142 ( 0.000 -7.159 0.000) 7.159 16.380 ( 0.000 6.772 0.000) 6.772 16.508 ( 0.000 -6.559 0.000) 6.559 16.807 ( 0.000 11.679 0.000) 11.679 17.061 ( 0.000 -14.295 0.000) 14.295 18.606 ( 0.000 7.051 0.000) 7.051 18.738 ( 0.000 -6.603 0.000) 6.603 19.534 ( 0.000 8.398 0.000) 8.398 19.643 ( 0.000 -3.123 0.000) 3.123 ======================= Grid point 28 (17/120) ======================= q-point: ( 0.11 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( 4.558 23.670 0.000) 24.105 1.919 ( -3.606 29.903 0.000) 30.120 2.172 ( 1.563 -18.238 0.000) 18.305 2.447 ( -3.942 -24.585 0.000) 24.899 2.949 ( 9.456 12.945 0.000) 16.031 3.059 ( -0.314 -1.189 0.000) 1.229 3.269 ( -4.516 6.536 0.000) 7.945 3.417 ( -6.639 -8.283 0.000) 10.615 3.823 ( 4.057 6.457 0.000) 7.626 4.001 ( 2.907 -8.127 0.000) 8.632 4.019 ( -1.829 13.052 0.000) 13.180 4.274 ( -4.949 -13.398 0.000) 14.282 5.079 ( 0.409 6.876 0.000) 6.888 5.112 ( 8.141 5.469 0.000) 9.807 5.195 ( 9.446 -3.395 0.000) 10.038 5.240 ( -2.683 -9.218 0.000) 9.601 6.162 ( 2.444 16.089 0.000) 16.274 6.219 ( 2.074 18.184 0.000) 18.302 6.469 ( 6.313 -16.676 0.000) 17.831 6.567 ( 0.059 -17.750 0.000) 17.750 7.587 ( 2.603 14.325 0.000) 14.559 7.825 ( -5.278 1.893 0.000) 5.607 7.847 ( 1.600 -12.514 0.000) 12.616 7.872 ( -7.945 -3.124 0.000) 8.537 8.236 ( -9.529 6.239 0.000) 11.390 8.339 ( -7.685 -4.595 0.000) 8.954 8.626 ( -12.976 8.794 0.000) 15.675 8.832 ( -14.223 -12.527 0.000) 18.952 9.296 ( 3.381 11.869 0.000) 12.342 9.526 ( 8.087 -12.604 0.000) 14.975 9.683 ( 2.457 2.860 0.000) 3.771 9.737 ( 4.493 -2.526 0.000) 5.154 10.119 ( 7.338 1.330 0.000) 7.457 10.173 ( 12.778 -4.458 0.000) 13.533 10.607 ( -2.853 1.473 0.000) 3.211 10.670 ( -1.375 -4.799 0.000) 4.992 11.476 ( 8.149 16.596 0.000) 18.488 11.729 ( 13.287 -9.861 0.000) 16.547 12.208 ( -3.089 14.161 0.000) 14.494 12.362 ( 14.512 5.789 0.000) 15.624 12.433 ( 0.504 -9.174 0.000) 9.188 12.498 ( 9.612 -8.296 0.000) 12.697 13.463 ( 3.030 39.398 0.000) 39.515 13.862 ( -11.163 15.753 0.000) 19.307 14.190 ( -6.556 -32.697 0.000) 33.348 14.195 ( -4.981 -19.216 0.000) 19.851 14.826 ( 2.982 -2.228 0.000) 3.723 14.862 ( -3.422 -4.302 0.000) 5.497 15.896 ( -6.718 9.753 0.000) 11.843 16.055 ( 3.664 6.753 0.000) 7.683 16.076 ( -4.601 -9.093 0.000) 10.191 16.203 ( 5.431 -8.241 0.000) 9.869 16.404 ( 2.476 7.880 0.000) 8.260 16.545 ( 3.488 -6.740 0.000) 7.589 16.730 ( -7.696 11.634 0.000) 13.949 16.985 ( -7.654 -14.311 0.000) 16.230 18.694 ( 8.212 7.321 0.000) 11.001 18.835 ( 8.599 -7.285 0.000) 11.271 19.532 ( -0.272 8.145 0.000) 8.149 19.636 ( -0.777 -2.858 0.000) 2.962 ======================= Grid point 29 (18/120) ======================= q-point: ( 0.22 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 7.065 18.232 0.000) 19.553 1.925 ( 4.553 22.827 0.000) 23.277 2.214 ( 2.451 -15.234 0.000) 15.429 2.376 ( -2.121 -23.732 0.000) 23.826 2.988 ( -4.182 4.491 0.000) 6.136 3.086 ( 1.016 -4.050 0.000) 4.176 3.174 ( -4.114 2.199 0.000) 4.665 3.260 ( -7.946 -6.156 0.000) 10.052 3.926 ( 2.446 7.374 0.000) 7.769 3.941 ( -6.209 9.311 0.000) 11.191 3.984 ( -4.472 1.743 0.000) 4.800 4.121 ( -10.108 -9.346 0.000) 13.766 5.130 ( 7.294 10.037 0.000) 12.407 5.333 ( 13.282 8.570 0.000) 15.807 5.354 ( 14.862 -11.569 0.000) 18.835 5.459 ( 16.324 -4.893 0.000) 17.041 6.243 ( 5.515 19.787 0.000) 20.541 6.290 ( 5.153 15.142 0.000) 15.995 6.575 ( 0.695 -14.160 0.000) 14.177 6.606 ( 6.914 -18.535 0.000) 19.783 7.650 ( 3.219 14.133 0.000) 14.495 7.688 ( -8.517 0.179 0.000) 8.519 7.711 ( -8.366 -2.404 0.000) 8.705 7.879 ( 0.855 -9.326 0.000) 9.365 8.042 ( -9.092 6.818 0.000) 11.365 8.159 ( -8.813 -5.461 0.000) 10.367 8.292 ( -18.956 5.990 0.000) 19.880 8.469 ( -20.883 -12.548 0.000) 24.363 9.384 ( 4.578 13.558 0.000) 14.310 9.625 ( 2.855 -11.556 0.000) 11.903 9.722 ( 0.762 4.074 0.000) 4.145 9.807 ( 1.974 -4.441 0.000) 4.860 10.263 ( 6.551 7.110 0.000) 9.668 10.453 ( 12.302 -12.937 0.000) 17.852 10.542 ( -3.203 3.683 0.000) 4.881 10.640 ( -1.229 -6.185 0.000) 6.306 11.661 ( 9.069 22.094 0.000) 23.882 12.021 ( 14.036 -14.846 0.000) 20.431 12.130 ( -4.413 18.802 0.000) 19.313 12.446 ( 0.703 -14.005 0.000) 14.023 12.741 ( 19.503 2.013 0.000) 19.606 12.801 ( 18.896 -4.260 0.000) 19.370 13.512 ( 0.561 30.410 0.000) 30.415 13.691 ( -1.049 21.366 0.000) 21.392 14.010 ( -10.807 -18.794 0.000) 21.680 14.133 ( 1.699 -24.388 0.000) 24.447 14.760 ( -3.546 4.717 0.000) 5.901 14.956 ( 7.679 -17.476 0.000) 19.088 15.716 ( -10.608 10.836 0.000) 15.164 15.940 ( -8.320 -12.641 0.000) 15.134 16.156 ( 5.953 8.490 0.000) 10.369 16.333 ( 6.961 -9.571 0.000) 11.835 16.466 ( 3.126 8.733 0.000) 9.276 16.494 ( -15.761 11.597 0.000) 19.568 16.623 ( 3.614 -7.391 0.000) 8.227 16.752 ( -15.583 -14.400 0.000) 21.217 18.900 ( 11.402 7.071 0.000) 13.416 19.031 ( 9.964 -6.462 0.000) 11.876 19.522 ( -0.834 7.334 0.000) 7.381 19.610 ( -1.896 -2.055 0.000) 2.796 ======================= Grid point 30 (19/120) ======================= q-point: ( 0.33 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.033 ( 7.027 11.576 0.000) 13.542 2.078 ( 9.426 11.962 0.000) 15.229 2.267 ( 2.821 -12.411 0.000) 12.727 2.364 ( 0.039 -16.570 0.000) 16.570 2.903 ( -2.805 5.257 0.000) 5.958 3.054 ( -2.758 -9.677 0.000) 10.062 3.109 ( -3.338 -0.835 0.000) 3.441 3.139 ( -3.030 -3.800 0.000) 4.860 3.776 ( -9.508 5.716 0.000) 11.094 3.799 ( -9.797 7.101 0.000) 12.100 3.889 ( -11.950 -5.824 0.000) 13.294 3.898 ( -6.975 -2.416 0.000) 7.381 5.440 ( 21.121 18.441 0.000) 28.038 5.613 ( 13.520 14.078 0.000) 19.519 5.725 ( 18.944 -9.823 0.000) 21.339 5.822 ( 18.865 -8.204 0.000) 20.572 6.395 ( 10.535 17.678 0.000) 20.579 6.433 ( 9.263 9.037 0.000) 12.941 6.591 ( 0.921 -7.234 0.000) 7.292 6.737 ( 5.790 -17.190 0.000) 18.139 7.452 ( -15.504 0.702 0.000) 15.520 7.494 ( -12.997 -4.238 0.000) 13.670 7.649 ( -10.200 15.943 0.000) 18.927 7.809 ( -5.378 2.603 0.000) 5.975 7.908 ( -4.034 7.106 0.000) 8.171 7.951 ( -17.441 -4.433 0.000) 17.996 8.040 ( -2.584 -6.884 0.000) 7.353 8.079 ( -10.124 -16.625 0.000) 19.465 9.471 ( 4.160 11.152 0.000) 11.903 9.670 ( 1.966 -9.528 0.000) 9.729 9.705 ( -2.351 5.004 0.000) 5.529 9.810 ( -1.463 -5.568 0.000) 5.757 10.370 ( 4.070 11.117 0.000) 11.839 10.491 ( -1.853 6.392 0.000) 6.655 10.628 ( 5.189 -15.697 0.000) 16.533 10.633 ( 0.589 -8.097 0.000) 8.118 11.812 ( 5.819 26.892 0.000) 27.515 12.041 ( -4.224 23.549 0.000) 23.925 12.269 ( 10.465 -19.146 0.000) 21.819 12.459 ( 0.542 -19.706 0.000) 19.713 12.968 ( 3.644 7.395 0.000) 8.243 13.130 ( 12.464 -8.300 0.000) 14.975 13.448 ( -7.134 20.373 0.000) 21.586 13.778 ( -11.914 -13.370 0.000) 17.908 13.996 ( 29.675 17.683 0.000) 34.545 14.371 ( 22.497 -20.570 0.000) 30.483 14.749 ( 2.697 15.245 0.000) 15.482 15.130 ( 9.360 -23.822 0.000) 25.595 15.497 ( -10.409 11.496 0.000) 15.508 15.760 ( -9.316 -16.011 0.000) 18.524 16.076 ( -23.701 11.723 0.000) 26.442 16.286 ( 0.058 4.275 0.000) 4.276 16.352 ( -16.054 -9.691 0.000) 18.752 16.485 ( 4.465 -10.054 0.000) 11.001 16.509 ( 0.765 8.738 0.000) 8.771 16.672 ( 0.961 -7.960 0.000) 8.018 19.126 ( 10.687 5.565 0.000) 12.049 19.214 ( 8.015 -3.293 0.000) 8.665 19.495 ( -1.903 5.851 0.000) 6.152 19.556 ( -3.569 -0.716 0.000) 3.640 ======================= Grid point 31 (20/120) ======================= q-point: ( 0.44 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( 5.797 5.690 0.000) 8.123 2.223 ( 2.359 3.197 0.000) 3.973 2.320 ( 2.054 -10.084 0.000) 10.291 2.344 ( -1.370 -7.857 0.000) 7.975 2.922 ( 4.648 2.640 0.000) 5.346 3.033 ( -4.726 1.344 0.000) 4.913 3.035 ( 1.799 -8.543 0.000) 8.730 3.096 ( -2.752 -5.359 0.000) 6.024 3.615 ( -4.761 4.500 0.000) 6.551 3.629 ( -5.800 6.614 0.000) 8.797 3.707 ( -4.153 -4.689 0.000) 6.264 3.744 ( -6.479 -4.963 0.000) 8.161 5.802 ( 10.287 19.305 0.000) 21.875 5.824 ( 6.163 19.375 0.000) 20.332 6.041 ( 12.576 -4.905 0.000) 13.498 6.129 ( 7.476 -13.015 0.000) 15.009 6.613 ( 6.285 6.453 0.000) 9.008 6.686 ( 14.640 6.380 0.000) 15.970 6.692 ( 12.989 -1.331 0.000) 13.057 6.791 ( -1.339 -3.755 0.000) 3.986 7.110 ( -15.700 5.275 0.000) 16.562 7.240 ( -22.877 13.151 0.000) 26.388 7.301 ( -0.678 -13.877 0.000) 13.893 7.527 ( -19.586 -14.942 0.000) 24.634 7.818 ( 1.997 9.555 0.000) 9.761 7.856 ( -1.853 8.500 0.000) 8.700 8.027 ( 0.350 -9.457 0.000) 9.463 8.033 ( -0.118 -12.419 0.000) 12.420 9.554 ( 4.191 8.367 0.000) 9.358 9.638 ( -4.002 6.269 0.000) 7.438 9.712 ( 2.332 -7.852 0.000) 8.191 9.764 ( -2.743 -6.521 0.000) 7.075 10.431 ( 2.112 11.404 0.000) 11.598 10.462 ( -1.230 9.270 0.000) 9.351 10.658 ( 1.548 -10.842 0.000) 10.952 10.677 ( 0.184 -14.025 0.000) 14.027 11.901 ( 3.368 28.800 0.000) 28.996 11.965 ( -3.355 27.235 0.000) 27.441 12.421 ( 4.392 -24.562 0.000) 24.952 12.462 ( -0.464 -24.201 0.000) 24.205 13.056 ( 7.240 14.647 0.000) 16.339 13.252 ( -11.088 16.362 0.000) 19.765 13.335 ( 9.546 -13.462 0.000) 16.504 13.543 ( -11.224 -13.529 0.000) 17.579 14.649 ( 28.469 15.703 0.000) 32.513 14.837 ( 3.841 20.732 0.000) 21.085 14.916 ( 27.331 -6.874 0.000) 28.182 15.310 ( 6.409 -27.993 0.000) 28.717 15.365 ( 0.947 1.982 0.000) 2.196 15.523 ( -28.637 14.940 0.000) 32.300 15.584 ( -6.752 -17.614 0.000) 18.864 15.818 ( -26.783 -15.122 0.000) 30.757 16.416 ( 4.983 8.824 0.000) 10.134 16.492 ( -2.413 8.684 0.000) 9.013 16.591 ( 4.613 -9.224 0.000) 10.313 16.660 ( -2.090 -8.545 0.000) 8.797 19.319 ( 8.361 3.413 0.000) 9.030 19.351 ( 5.681 0.354 0.000) 5.692 19.441 ( -3.606 3.613 0.000) 5.105 19.463 ( -5.748 1.079 0.000) 5.849 ======================= Grid point 63 (21/120) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.557 ( 0.000 0.000 28.692) 28.692 0.611 ( 0.000 0.000 31.325) 31.325 1.125 ( 0.000 0.000 57.384) 57.384 2.519 ( 0.000 0.000 5.987) 5.987 3.138 ( 0.000 0.000 -7.939) 7.939 3.219 ( 0.000 0.000 -3.167) 3.167 3.353 ( 0.000 0.000 -0.375) 0.375 3.534 ( 0.000 0.000 -0.573) 0.573 3.711 ( 0.000 0.000 -6.400) 6.400 3.992 ( 0.000 0.000 -19.683) 19.683 4.116 ( 0.000 0.000 -9.501) 9.501 4.721 ( 0.000 0.000 2.563) 2.563 4.841 ( 0.000 0.000 8.298) 8.298 4.883 ( 0.000 0.000 -3.644) 3.644 4.919 ( 0.000 0.000 6.310) 6.310 5.538 ( 0.000 0.000 -1.395) 1.395 5.646 ( 0.000 0.000 9.567) 9.567 5.655 ( 0.000 0.000 9.691) 9.691 6.998 ( 0.000 0.000 -3.778) 3.778 7.126 ( 0.000 0.000 3.508) 3.508 7.501 ( 0.000 0.000 -0.338) 0.338 7.541 ( 0.000 0.000 0.690) 0.690 7.813 ( 0.000 0.000 9.078) 9.078 8.094 ( 0.000 0.000 -12.701) 12.701 8.440 ( 0.000 0.000 -7.914) 7.914 8.502 ( 0.000 0.000 -4.507) 4.507 8.515 ( 0.000 0.000 -3.852) 3.852 9.336 ( 0.000 0.000 -5.354) 5.354 9.363 ( 0.000 0.000 -5.191) 5.191 9.551 ( 0.000 0.000 -2.237) 2.237 9.709 ( 0.000 0.000 3.805) 3.805 9.785 ( 0.000 0.000 -10.471) 10.471 10.260 ( 0.000 0.000 -11.103) 11.103 10.463 ( 0.000 0.000 21.380) 21.380 10.510 ( 0.000 0.000 7.287) 7.287 11.044 ( 0.000 0.000 9.734) 9.734 11.249 ( 0.000 0.000 0.729) 0.729 11.342 ( 0.000 0.000 -6.280) 6.280 11.707 ( 0.000 0.000 1.545) 1.545 11.837 ( 0.000 0.000 5.496) 5.496 11.843 ( 0.000 0.000 10.525) 10.525 12.109 ( 0.000 0.000 12.270) 12.270 12.817 ( 0.000 0.000 -1.567) 1.567 13.581 ( 0.000 0.000 -11.668) 11.668 14.345 ( 0.000 0.000 -10.981) 10.981 14.837 ( 0.000 0.000 -19.803) 19.803 15.017 ( 0.000 0.000 -11.756) 11.756 15.555 ( 0.000 0.000 -10.784) 10.784 15.726 ( 0.000 0.000 -1.659) 1.659 15.827 ( 0.000 0.000 15.303) 15.303 16.287 ( 0.000 0.000 3.196) 3.196 16.616 ( 0.000 0.000 12.874) 12.874 16.676 ( 0.000 0.000 -1.513) 1.513 16.679 ( 0.000 0.000 -7.960) 7.960 16.939 ( 0.000 0.000 -2.827) 2.827 17.240 ( 0.000 0.000 1.266) 1.266 18.498 ( 0.000 0.000 13.720) 13.720 18.960 ( 0.000 0.000 0.016) 0.016 19.144 ( 0.000 0.000 -0.669) 0.669 19.618 ( 0.000 0.000 -0.148) 0.148 ======================= Grid point 64 (22/120) ======================= q-point: ( 0.11 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( 21.696 0.000 19.766) 29.350 0.960 ( 27.882 0.000 18.951) 33.712 1.607 ( 40.525 0.000 37.071) 54.923 2.548 ( 2.640 0.000 5.526) 6.124 3.096 ( -4.496 0.000 -4.055) 6.054 3.220 ( 0.618 0.000 -7.740) 7.765 3.346 ( -0.367 0.000 -0.166) 0.403 3.543 ( 2.309 0.000 -1.377) 2.689 3.632 ( -7.467 0.000 -7.083) 10.292 3.823 ( -14.858 0.000 -10.579) 18.239 4.089 ( -2.487 0.000 -9.278) 9.606 4.734 ( 1.934 0.000 -0.953) 2.156 4.779 ( -9.987 0.000 -2.854) 10.387 4.825 ( -0.976 0.000 3.047) 3.199 5.067 ( 11.306 0.000 3.058) 11.712 5.350 ( -5.377 0.000 2.490) 5.925 5.719 ( 2.249 0.000 13.852) 14.033 5.744 ( 9.788 0.000 12.773) 16.092 7.001 ( 0.318 0.000 -3.011) 3.028 7.249 ( 6.221 0.000 3.567) 7.171 7.462 ( -3.234 0.000 0.018) 3.235 7.485 ( -3.190 0.000 -0.103) 3.191 7.800 ( -3.145 0.000 4.333) 5.354 8.021 ( -6.119 0.000 -11.173) 12.739 8.343 ( -7.628 0.000 -4.482) 8.847 8.369 ( -12.186 0.000 -2.321) 12.405 8.559 ( 5.362 0.000 -1.824) 5.663 8.649 ( -16.457 0.000 16.032) 22.975 9.296 ( -13.425 0.000 -4.174) 14.059 9.601 ( 3.726 0.000 -2.407) 4.436 9.761 ( 2.627 0.000 -2.703) 3.769 9.996 ( 2.227 0.000 -2.924) 3.675 10.275 ( 2.822 0.000 -5.407) 6.099 10.538 ( 2.681 0.000 7.179) 7.664 10.726 ( 4.238 0.000 -2.070) 4.717 10.951 ( -7.074 0.000 7.193) 10.089 11.319 ( 7.079 0.000 0.753) 7.119 11.587 ( -9.372 0.000 9.021) 13.008 11.702 ( 17.718 0.000 -24.953) 30.604 11.948 ( 12.130 0.000 -5.116) 13.165 12.104 ( 23.242 0.000 7.246) 24.345 12.371 ( 21.580 0.000 14.691) 26.106 12.814 ( 0.811 0.000 -2.013) 2.170 13.453 ( -4.662 0.000 6.842) 8.280 14.271 ( -6.987 0.000 -10.219) 12.379 14.804 ( -4.450 0.000 -14.226) 14.906 14.955 ( -4.486 0.000 -15.088) 15.741 15.395 ( -13.057 0.000 -15.698) 20.418 15.735 ( -1.866 0.000 8.489) 8.692 15.779 ( 2.415 0.000 3.477) 4.233 16.350 ( -2.081 0.000 21.886) 21.985 16.532 ( 4.205 0.000 8.710) 9.672 16.683 ( 0.210 0.000 -6.352) 6.355 16.712 ( 3.909 0.000 -4.792) 6.185 16.926 ( -1.197 0.000 -2.465) 2.740 17.395 ( 1.895 0.000 -7.285) 7.527 18.558 ( 5.709 0.000 11.272) 12.636 18.961 ( 0.109 0.000 -0.418) 0.432 19.157 ( -0.084 0.000 -6.143) 6.143 19.600 ( -1.866 0.000 -0.305) 1.891 ======================= Grid point 65 (23/120) ======================= q-point: ( 0.22 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( 23.632 0.000 12.433) 26.703 1.562 ( 30.180 0.000 9.646) 31.684 2.461 ( 39.342 0.000 18.871) 43.633 2.609 ( 2.913 0.000 4.174) 5.090 2.971 ( -7.785 0.000 -1.740) 7.977 3.217 ( -0.512 0.000 -9.133) 9.147 3.399 ( 6.299 0.000 -3.256) 7.091 3.412 ( -15.008 0.000 -6.266) 16.264 3.510 ( -13.126 0.000 -3.724) 13.644 3.616 ( 4.531 0.000 -0.042) 4.531 4.022 ( -4.073 0.000 -8.879) 9.769 4.507 ( -16.173 0.000 -0.940) 16.200 4.766 ( 0.180 0.000 -0.703) 0.726 4.789 ( -2.798 0.000 2.594) 3.815 5.325 ( 0.850 0.000 -5.523) 5.588 5.340 ( 16.228 0.000 -9.476) 18.792 5.823 ( 9.811 0.000 16.129) 18.878 6.026 ( 17.545 0.000 17.068) 24.477 7.008 ( 0.330 0.000 -1.942) 1.970 7.209 ( -9.806 0.000 8.334) 12.870 7.390 ( -3.817 0.000 -1.342) 4.046 7.521 ( 5.064 0.000 -4.584) 6.830 7.625 ( -14.561 0.000 -3.470) 14.969 7.871 ( -8.772 0.000 -10.611) 13.767 8.089 ( -14.548 0.000 3.686) 15.007 8.246 ( -1.199 0.000 -4.512) 4.669 8.448 ( -7.392 0.000 9.406) 11.963 8.732 ( 11.291 0.000 1.286) 11.364 9.002 ( -14.803 0.000 -3.632) 15.242 9.650 ( 0.349 0.000 -1.907) 1.938 9.770 ( -1.013 0.000 -7.334) 7.404 10.009 ( -0.082 0.000 3.388) 3.389 10.320 ( 0.725 0.000 2.551) 2.652 10.613 ( 4.702 0.000 7.035) 8.462 10.658 ( -8.491 0.000 3.942) 9.362 10.866 ( 0.011 0.000 -2.737) 2.737 11.381 ( -8.739 0.000 8.376) 12.105 11.554 ( 14.074 0.000 1.273) 14.132 11.787 ( -6.612 0.000 -13.896) 15.389 12.260 ( 17.169 0.000 -7.466) 18.723 12.632 ( 26.565 0.000 6.255) 27.291 12.907 ( 31.030 0.000 14.703) 34.337 12.924 ( 10.883 0.000 -1.952) 11.057 13.469 ( 4.393 0.000 8.725) 9.769 14.098 ( -8.988 0.000 -8.597) 12.437 14.610 ( -13.825 0.000 -8.009) 15.978 14.932 ( 2.902 0.000 -18.401) 18.628 15.076 ( -18.263 0.000 -19.199) 26.497 15.765 ( -4.844 0.000 8.118) 9.453 15.776 ( 4.632 0.000 0.320) 4.643 16.294 ( -1.758 0.000 21.770) 21.841 16.672 ( 6.885 0.000 0.514) 6.904 16.684 ( 0.129 0.000 -3.257) 3.260 16.808 ( 5.091 0.000 -0.646) 5.132 16.897 ( -1.546 0.000 -1.499) 2.153 17.286 ( -11.016 0.000 0.758) 11.043 18.714 ( 9.416 0.000 6.153) 11.248 18.965 ( 0.331 0.000 -1.512) 1.548 19.132 ( -2.118 0.000 -7.636) 7.925 19.543 ( -3.825 0.000 -0.717) 3.892 ======================= Grid point 66 (24/120) ======================= q-point: ( 0.33 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.779 ( 22.150 0.000 7.491) 23.382 2.124 ( 24.720 0.000 4.329) 25.096 2.641 ( -0.075 0.000 2.006) 2.007 2.782 ( -10.661 0.000 0.757) 10.688 3.011 ( 13.417 0.000 6.391) 14.861 3.112 ( -12.257 0.000 -1.910) 12.405 3.255 ( 4.864 0.000 -13.672) 14.511 3.298 ( -9.010 0.000 -3.938) 9.833 3.539 ( 3.685 0.000 -4.170) 5.565 3.775 ( 12.954 0.000 5.991) 14.273 3.927 ( -5.856 0.000 -7.859) 9.801 4.190 ( -12.961 0.000 2.961) 13.295 4.717 ( -3.774 0.000 1.935) 4.241 4.736 ( -2.885 0.000 2.392) 3.748 5.401 ( 9.124 0.000 -5.813) 10.819 5.722 ( 21.562 0.000 -16.253) 27.002 6.118 ( 18.294 0.000 9.821) 20.764 6.409 ( 19.547 0.000 16.674) 25.693 6.907 ( -19.584 0.000 2.864) 19.792 6.998 ( -3.133 0.000 -5.147) 6.026 7.245 ( -17.439 0.000 -10.062) 20.133 7.331 ( -4.697 0.000 3.283) 5.730 7.474 ( -13.645 0.000 -2.568) 13.885 7.793 ( 4.531 0.000 -6.014) 7.530 7.796 ( -14.744 0.000 9.572) 17.579 8.286 ( 0.981 0.000 3.141) 3.291 8.304 ( -3.977 0.000 -0.511) 4.009 8.738 ( -10.912 0.000 -3.310) 11.403 8.982 ( 13.067 0.000 2.247) 13.258 9.603 ( -5.006 0.000 -0.567) 5.038 9.756 ( 0.310 0.000 -6.543) 6.550 9.985 ( -2.726 0.000 5.143) 5.821 10.300 ( -1.850 0.000 5.622) 5.918 10.480 ( -8.096 0.000 2.030) 8.347 10.724 ( 6.291 0.000 7.077) 9.470 10.932 ( 5.995 0.000 -2.487) 6.490 11.199 ( -8.968 0.000 8.416) 12.299 11.568 ( -13.011 0.000 -5.443) 14.103 11.901 ( 19.327 0.000 -0.116) 19.327 12.556 ( 9.846 0.000 -5.840) 11.447 13.048 ( 14.785 0.000 4.990) 15.605 13.233 ( 16.559 0.000 1.877) 16.665 13.542 ( 27.632 0.000 4.864) 28.057 13.571 ( 5.311 0.000 5.152) 7.399 14.011 ( 5.794 0.000 -1.479) 5.979 14.301 ( -16.130 0.000 -8.484) 18.225 14.680 ( -20.649 0.000 -19.562) 28.444 15.100 ( 14.496 0.000 -17.178) 22.477 15.553 ( -16.625 0.000 10.603) 19.718 15.870 ( 3.233 0.000 -5.593) 6.460 16.281 ( 0.484 0.000 16.232) 16.239 16.702 ( 1.823 0.000 -0.935) 2.049 16.760 ( -0.338 0.000 -0.774) 0.844 16.862 ( -2.060 0.000 -0.298) 2.082 16.897 ( 3.387 0.000 2.499) 4.209 17.020 ( -12.384 0.000 7.640) 14.551 18.918 ( 10.571 0.000 1.766) 10.717 18.975 ( 0.723 0.000 -2.893) 2.982 19.082 ( -2.607 0.000 -7.180) 7.639 19.445 ( -5.906 0.000 -1.195) 6.026 ======================= Grid point 67 (25/120) ======================= q-point: ( 0.44 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 18.834 0.000 4.594) 19.386 2.498 ( 11.148 0.000 0.482) 11.159 2.529 ( -14.598 0.000 2.607) 14.829 2.611 ( -2.669 0.000 0.106) 2.672 2.992 ( 1.629 0.000 -0.603) 1.737 3.125 ( -8.643 0.000 -1.963) 8.863 3.179 ( 7.085 0.000 -3.122) 7.742 3.303 ( -3.059 0.000 -8.944) 9.453 3.584 ( 4.638 0.000 -8.613) 9.782 3.744 ( -10.142 0.000 -8.043) 12.944 3.996 ( 5.939 0.000 8.815) 10.629 4.059 ( -2.062 0.000 7.702) 7.973 4.661 ( -1.207 0.000 2.880) 3.123 4.676 ( -2.419 0.000 2.954) 3.818 5.757 ( 25.355 0.000 -4.923) 25.828 6.189 ( 24.477 0.000 -17.788) 30.258 6.280 ( -19.046 0.000 -2.456) 19.204 6.666 ( -17.357 0.000 -10.413) 20.241 6.678 ( 13.792 0.000 5.112) 14.709 6.805 ( 9.651 0.000 3.542) 10.280 7.025 ( -7.664 0.000 2.893) 8.192 7.096 ( -21.830 0.000 0.974) 21.852 7.323 ( 4.350 0.000 6.068) 7.465 7.508 ( -13.025 0.000 11.239) 17.203 7.941 ( 8.664 0.000 -1.192) 8.746 8.122 ( -9.141 0.000 2.938) 9.601 8.419 ( 6.970 0.000 -3.631) 7.859 8.561 ( -7.378 0.000 -3.168) 8.030 9.238 ( 12.076 0.000 1.931) 12.229 9.456 ( -9.348 0.000 0.890) 9.390 9.797 ( 3.776 0.000 -1.991) 4.269 9.896 ( -5.532 0.000 3.203) 6.392 10.288 ( 1.196 0.000 3.867) 4.048 10.350 ( -4.813 0.000 1.892) 5.172 10.863 ( 7.554 0.000 7.380) 10.561 11.024 ( -8.423 0.000 7.879) 11.534 11.091 ( 9.573 0.000 -0.811) 9.608 11.310 ( -12.140 0.000 -1.618) 12.247 12.289 ( 18.217 0.000 -1.145) 18.253 12.574 ( -8.221 0.000 -2.699) 8.653 13.294 ( 9.871 0.000 7.875) 12.627 13.411 ( -0.188 0.000 9.419) 9.421 13.722 ( 10.971 0.000 -5.888) 12.452 13.897 ( 14.998 0.000 -15.054) 21.250 13.987 ( -14.773 0.000 -9.151) 17.378 14.255 ( -18.933 0.000 -16.774) 25.295 14.487 ( 31.176 0.000 11.770) 33.324 15.103 ( -27.595 0.000 12.264) 30.198 15.483 ( 21.178 0.000 -17.780) 27.652 15.822 ( -9.945 0.000 -15.053) 18.042 16.343 ( 6.647 0.000 16.613) 17.893 16.560 ( -14.291 0.000 14.131) 20.098 16.753 ( 2.995 0.000 0.229) 3.004 16.813 ( -2.809 0.000 0.390) 2.836 16.934 ( 1.048 0.000 3.026) 3.202 16.943 ( 0.471 0.000 1.718) 1.781 18.996 ( 1.433 0.000 -4.448) 4.674 19.033 ( -2.212 0.000 -5.986) 6.382 19.125 ( 9.799 0.000 -0.626) 9.819 19.305 ( -8.013 0.000 -1.366) 8.129 ======================= Grid point 72 (26/120) ======================= q-point: ( 0.00 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.775 ( 0.000 19.244 19.665) 27.514 0.889 ( 0.000 28.021 17.333) 32.948 1.575 ( 0.000 37.100 40.551) 54.962 2.535 ( 0.000 0.467 5.441) 5.461 3.126 ( 0.000 -0.636 -7.771) 7.797 3.151 ( 0.000 -6.062 -4.392) 7.485 3.245 ( 0.000 -10.574 -0.336) 10.580 3.563 ( 0.000 4.801 -3.714) 6.070 3.719 ( 0.000 -1.299 -3.628) 3.853 4.009 ( 0.000 -9.716 -7.549) 12.304 4.014 ( 0.000 1.580 -17.391) 17.462 4.770 ( 0.000 -8.148 -3.249) 8.772 4.795 ( 0.000 5.265 4.662) 7.033 4.929 ( 0.000 5.223 9.493) 10.835 5.146 ( 0.000 13.313 -1.526) 13.400 5.479 ( 0.000 1.049 -8.859) 8.921 5.629 ( 0.000 -2.564 9.505) 9.845 5.712 ( 0.000 6.612 7.384) 9.912 7.005 ( 0.000 -8.433 1.581) 8.580 7.062 ( 0.000 2.974 -2.552) 3.919 7.330 ( 0.000 -11.078 11.195) 15.750 7.722 ( 0.000 5.553 -16.462) 17.374 7.849 ( 0.000 3.558 9.668) 10.302 8.040 ( 0.000 -1.053 -8.940) 9.001 8.426 ( 0.000 -1.345 -7.793) 7.908 8.532 ( 0.000 1.870 -3.620) 4.075 8.587 ( 0.000 2.254 1.440) 2.675 9.241 ( 0.000 -7.051 -7.253) 10.115 9.312 ( 0.000 -2.172 -5.044) 5.492 9.477 ( 0.000 -7.654 -1.391) 7.780 9.708 ( 0.000 0.166 3.431) 3.435 9.811 ( 0.000 1.647 -5.869) 6.095 10.135 ( 0.000 -17.274 27.672) 32.621 10.177 ( 0.000 -5.776 -5.988) 8.319 10.651 ( 0.000 9.879 0.907) 9.921 10.854 ( 0.000 -8.935 7.392) 11.597 11.053 ( 0.000 2.300 11.136) 11.371 11.782 ( 0.000 7.380 0.045) 7.380 11.808 ( 0.000 -1.722 8.663) 8.833 12.015 ( 0.000 23.826 -6.241) 24.629 12.139 ( 0.000 3.273 12.838) 13.249 12.221 ( 0.000 28.911 -13.885) 32.073 12.764 ( 0.000 -5.156 -1.128) 5.278 13.606 ( 0.000 2.708 -12.030) 12.331 14.303 ( 0.000 -3.120 -12.357) 12.745 14.818 ( 0.000 -2.038 -19.741) 19.846 14.914 ( 0.000 -10.589 -8.007) 13.275 15.479 ( 0.000 -10.151 -5.733) 11.658 15.575 ( 0.000 -3.555 10.920) 11.484 15.941 ( 0.000 6.128 -1.032) 6.215 16.224 ( 0.000 -5.994 -0.226) 5.999 16.498 ( 0.000 -8.309 -0.470) 8.322 16.626 ( 0.000 -11.651 24.378) 27.019 16.654 ( 0.000 -1.889 -6.538) 6.805 16.678 ( 0.000 -1.299 10.455) 10.535 17.344 ( 0.000 -1.775 -11.812) 11.944 18.524 ( 0.000 2.747 12.872) 13.162 19.044 ( 0.000 -6.290 5.901) 8.625 19.085 ( 0.000 11.508 0.061) 11.509 19.635 ( 0.000 1.531 -0.204) 1.545 ======================= Grid point 73 (27/120) ======================= q-point: ( 0.11 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.991 ( 21.165 9.179 16.672) 28.464 1.063 ( 15.056 19.572 17.427) 30.224 1.977 ( 33.768 30.976 26.967) 53.170 2.547 ( 1.199 -0.826 4.986) 5.194 3.083 ( -4.499 -1.330 -2.380) 5.260 3.141 ( -1.484 -7.744 -8.143) 11.335 3.235 ( 0.172 -9.227 -2.112) 9.467 3.575 ( -0.560 2.452 -3.871) 4.616 3.650 ( -4.529 1.341 -2.937) 5.562 3.857 ( -11.569 1.094 -11.360) 16.251 4.009 ( -2.612 -5.686 -7.025) 9.408 4.672 ( -9.527 -8.157 -3.396) 12.994 4.800 ( 2.336 4.955 -1.267) 5.623 4.988 ( 0.645 10.213 4.208) 11.065 5.172 ( 4.343 7.381 -0.754) 8.597 5.380 ( -2.615 6.485 -2.342) 7.374 5.667 ( 3.631 -2.673 12.458) 13.249 5.804 ( 8.806 5.055 11.024) 14.988 7.030 ( 0.276 0.363 -2.382) 2.425 7.150 ( 7.888 -7.382 1.215) 10.872 7.282 ( -4.421 -9.806 8.914) 13.970 7.672 ( -4.073 7.129 -11.228) 13.910 7.837 ( -2.730 3.274 5.778) 7.180 7.960 ( -6.649 -2.753 -9.350) 11.798 8.313 ( -9.389 -3.022 -2.627) 10.207 8.396 ( -11.687 1.816 -1.988) 11.994 8.562 ( -6.332 -3.986 9.569) 12.147 8.755 ( -4.401 13.159 -1.462) 13.952 9.239 ( -13.613 -6.046 -3.184) 15.232 9.577 ( 3.379 -1.660 -3.787) 5.340 9.783 ( 4.413 1.423 -0.949) 4.733 9.980 ( 1.233 -1.507 -1.802) 2.653 10.179 ( 4.459 -7.439 -1.781) 8.855 10.569 ( 17.198 -14.677 0.581) 22.617 10.666 ( 3.289 5.366 -0.351) 6.303 10.903 ( 8.543 -15.802 5.457) 18.774 10.973 ( -6.125 4.558 9.154) 11.920 11.709 ( -7.910 12.035 7.442) 16.210 12.004 ( 14.726 1.378 4.639) 15.500 12.097 ( 10.372 13.628 -5.056) 17.857 12.217 ( 9.607 16.060 -15.570) 24.344 12.446 ( 18.163 9.232 11.827) 23.558 12.779 ( 2.549 -3.186 -1.286) 4.278 13.468 ( -6.928 2.079 3.332) 7.964 14.267 ( -5.342 -0.412 -12.521) 13.619 14.781 ( -3.678 -3.251 -15.685) 16.435 14.855 ( -5.606 -10.210 -11.302) 16.230 15.379 ( -8.637 -1.613 -10.930) 14.024 15.629 ( 4.465 -5.114 6.103) 9.129 15.901 ( -2.022 6.148 1.949) 6.759 16.332 ( 4.741 -4.945 7.413) 10.094 16.416 ( -2.159 -6.380 10.911) 12.822 16.600 ( 0.327 -9.341 -0.457) 9.358 16.659 ( 0.334 -4.634 -5.080) 6.884 16.785 ( 4.584 -6.387 8.691) 11.719 17.352 ( -1.986 -5.860 -7.343) 9.603 18.582 ( 5.605 2.690 10.441) 12.151 19.083 ( 0.563 9.100 -0.397) 9.126 19.102 ( 2.918 -2.313 -1.120) 3.889 19.618 ( -1.741 1.668 -0.361) 2.438 ======================= Grid point 74 (28/120) ======================= q-point: ( 0.22 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.424 ( 19.738 10.956 12.629) 25.867 1.511 ( 27.904 -1.626 10.139) 29.734 2.578 ( 1.772 -3.142 3.548) 5.060 2.691 ( 31.968 18.737 11.892) 38.916 2.954 ( -8.545 -2.257 -0.442) 8.849 3.071 ( -4.158 -11.230 -7.043) 13.893 3.285 ( 3.615 -6.349 -2.585) 7.750 3.443 ( -9.112 -2.428 -3.715) 10.135 3.615 ( -8.134 7.471 -6.697) 12.916 3.658 ( 1.156 5.495 -1.159) 5.734 3.932 ( -4.660 -7.828 -6.259) 11.053 4.413 ( -15.382 -7.269 -1.923) 17.122 4.844 ( -0.347 6.355 -2.785) 6.947 4.951 ( -0.856 13.554 4.590) 14.336 5.308 ( 6.842 -0.525 -8.701) 11.082 5.451 ( 9.889 10.316 -7.101) 15.957 5.812 ( 11.516 0.260 14.547) 18.555 6.062 ( 16.395 2.993 15.936) 23.059 7.017 ( -2.239 -0.836 2.066) 3.159 7.164 ( -6.843 -4.489 0.921) 8.236 7.287 ( 4.375 -6.759 3.243) 8.680 7.593 ( -5.703 5.692 -9.499) 12.456 7.676 ( -10.822 3.429 -1.530) 11.455 7.825 ( -7.374 -3.601 -7.780) 11.308 8.094 ( -12.633 -0.536 3.201) 13.044 8.211 ( -4.297 -2.091 -3.461) 5.900 8.410 ( -7.306 -3.366 7.869) 11.253 8.836 ( 3.617 5.880 -1.764) 7.125 8.954 ( -9.828 -1.618 -0.072) 9.960 9.614 ( 0.296 -1.527 -3.802) 4.108 9.837 ( 0.898 4.430 -3.631) 5.798 9.981 ( -0.329 -2.721 3.808) 4.691 10.254 ( 2.281 -4.731 3.764) 6.461 10.570 ( -5.924 -4.022 2.755) 7.672 10.778 ( 4.191 1.212 -3.797) 5.783 10.878 ( -2.099 10.474 5.641) 12.081 11.184 ( 13.008 -22.023 -0.743) 25.588 11.527 ( -9.335 13.228 8.839) 18.446 12.102 ( -2.888 17.342 -7.262) 19.022 12.367 ( 17.354 9.142 -9.054) 21.603 12.619 ( 23.291 -0.475 2.575) 23.438 12.876 ( 17.920 -2.393 1.525) 18.143 12.969 ( 22.922 4.235 11.324) 25.915 13.430 ( 2.342 -2.882 8.863) 9.609 14.106 ( -9.162 0.543 -9.286) 13.056 14.605 ( -12.768 -0.525 -8.570) 15.387 14.794 ( -0.433 -12.653 -16.148) 20.520 15.159 ( -11.808 6.361 -17.026) 21.674 15.709 ( 1.413 -1.686 5.007) 5.469 15.886 ( 0.684 5.799 2.806) 6.478 16.309 ( -1.853 1.074 19.466) 19.584 16.462 ( 0.542 -16.467 -4.705) 17.135 16.635 ( 2.429 -13.907 -1.282) 14.176 16.664 ( 1.304 -5.800 -2.016) 6.277 16.860 ( 3.101 -2.810 4.782) 6.355 17.220 ( -10.798 -6.880 0.754) 12.825 18.737 ( 9.384 2.659 5.304) 11.102 19.089 ( 0.286 11.218 -1.231) 11.289 19.139 ( 0.576 0.156 -5.570) 5.602 19.564 ( -3.626 2.020 -0.769) 4.221 ======================= Grid point 75 (29/120) ======================= q-point: ( 0.33 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( 19.222 4.488 8.149) 21.355 2.046 ( 24.347 -5.977 5.089) 25.581 2.600 ( -0.155 -4.159 0.901) 4.258 2.744 ( -11.624 -4.254 0.891) 12.410 3.005 ( -1.708 -6.067 -3.861) 7.392 3.086 ( 5.360 1.329 -2.642) 6.122 3.274 ( -5.200 2.038 -0.087) 5.586 3.290 ( -2.197 -1.899 -5.947) 6.618 3.590 ( -0.209 3.834 -5.505) 6.712 3.737 ( 7.156 -2.271 3.967) 8.491 3.837 ( -3.996 -6.882 -4.305) 9.048 4.100 ( -14.078 -6.063 1.371) 15.389 4.835 ( 2.229 10.135 0.265) 10.380 4.955 ( 0.070 19.918 4.855) 20.501 5.455 ( 10.220 4.890 -8.819) 14.357 5.761 ( 19.793 4.562 -15.094) 25.307 6.127 ( 18.963 1.096 10.131) 21.528 6.424 ( 18.264 1.225 15.597) 24.049 6.839 ( -15.733 -5.367 2.323) 16.785 7.069 ( -4.244 5.289 -6.189) 9.181 7.241 ( -17.811 -2.418 -2.508) 18.149 7.304 ( -7.331 1.454 -4.476) 8.711 7.570 ( -9.173 7.360 0.821) 11.789 7.710 ( -0.585 -6.360 -4.931) 8.069 7.847 ( -9.680 2.677 8.566) 13.200 8.208 ( 1.363 -6.892 -0.059) 7.026 8.266 ( -5.956 -3.695 1.563) 7.182 8.639 ( -11.169 -9.576 -3.011) 15.017 9.087 ( 11.149 9.369 3.040) 14.877 9.590 ( -2.772 0.062 -1.412) 3.111 9.830 ( -0.938 5.806 -3.832) 7.020 9.962 ( -1.944 -2.513 4.976) 5.904 10.265 ( -0.626 -2.570 5.768) 6.346 10.433 ( -6.604 -3.436 0.872) 7.495 10.869 ( 5.164 -5.700 -2.558) 8.106 10.903 ( 4.070 16.412 5.759) 17.863 11.300 ( -3.149 -9.294 0.047) 9.813 11.357 ( -6.675 5.173 6.064) 10.396 12.134 ( 8.505 16.157 -2.841) 18.478 12.662 ( 9.341 10.063 -7.005) 15.414 12.966 ( 12.466 -8.023 3.802) 15.305 13.228 ( 16.205 -0.907 1.412) 16.292 13.419 ( 8.535 -10.696 6.208) 15.026 13.630 ( 22.040 5.006 4.267) 23.001 13.985 ( 0.928 -2.451 -3.163) 4.108 14.347 ( -10.443 4.443 -7.139) 13.407 14.697 ( -12.517 -0.122 -17.255) 21.317 15.097 ( 10.430 0.787 -15.072) 18.346 15.584 ( -14.392 3.473 9.100) 17.378 15.931 ( 1.962 5.407 -4.777) 7.477 16.286 ( -0.576 0.250 14.741) 14.754 16.466 ( 1.503 -21.864 -1.355) 21.958 16.605 ( -3.997 -18.280 -2.915) 18.937 16.739 ( 1.921 -5.194 0.896) 5.610 16.902 ( 0.137 -2.905 4.716) 5.541 16.968 ( -10.720 -5.239 6.867) 13.766 18.940 ( 10.387 2.760 0.794) 10.777 19.096 ( 0.456 10.777 -2.303) 11.030 19.137 ( -0.479 4.346 -5.938) 7.374 19.471 ( -5.709 2.455 -1.240) 6.337 ======================= Grid point 76 (30/120) ======================= q-point: ( 0.44 0.14 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( 16.060 -1.152 4.798) 16.801 2.439 ( 8.839 -7.144 3.337) 11.845 2.475 ( -7.452 -3.279 -0.569) 8.162 2.602 ( -3.168 -1.857 0.440) 3.698 2.977 ( 0.087 -1.347 -1.642) 2.126 3.048 ( -5.363 -5.288 -5.118) 9.106 3.231 ( 2.310 2.981 -1.468) 4.047 3.298 ( -1.517 -1.474 -6.927) 7.243 3.571 ( 1.561 -2.323 -6.022) 6.641 3.680 ( -7.661 -7.867 -4.257) 11.777 3.861 ( 1.801 -7.951 5.012) 9.570 3.917 ( -4.546 -8.147 6.018) 11.102 4.913 ( 3.345 20.544 1.750) 20.888 4.949 ( -0.716 23.622 3.363) 23.871 5.803 ( 24.268 4.503 -6.283) 25.470 6.210 ( 24.183 2.050 -17.290) 29.799 6.316 ( -20.580 3.380 -3.383) 21.129 6.595 ( 15.809 -5.319 4.609) 17.305 6.717 ( -23.914 3.039 -14.886) 28.332 6.808 ( 12.319 -0.215 8.466) 14.950 6.998 ( -10.506 -1.012 3.494) 11.118 7.120 ( -11.685 2.830 3.636) 12.561 7.441 ( -0.032 9.662 5.732) 11.235 7.555 ( -9.905 4.048 8.805) 13.857 7.888 ( 7.956 -5.576 0.715) 9.742 8.066 ( -9.417 -5.972 3.546) 11.701 8.332 ( 6.233 -8.031 -4.542) 11.135 8.463 ( -7.024 -9.398 -3.391) 12.213 9.308 ( 10.446 6.425 3.058) 12.639 9.490 ( -7.303 3.327 1.902) 8.247 9.834 ( 1.847 3.351 -1.657) 4.170 9.898 ( -3.945 -0.088 2.745) 4.807 10.267 ( 1.399 -1.597 3.413) 4.020 10.324 ( -4.208 -1.948 1.307) 4.818 10.986 ( 6.023 -0.104 2.065) 6.368 11.010 ( 5.469 6.014 3.773) 8.962 11.173 ( -5.725 7.704 4.590) 10.639 11.216 ( -7.656 -2.601 1.585) 8.239 12.400 ( 15.445 10.299 -1.904) 18.661 12.664 ( -8.586 8.856 -3.190) 12.741 13.199 ( 10.512 -10.279 6.980) 16.276 13.348 ( -3.296 -8.135 11.314) 14.320 13.598 ( 11.251 -8.957 -9.945) 17.485 13.788 ( -5.136 -6.510 -10.956) 13.740 14.120 ( 6.498 9.389 -11.103) 15.927 14.337 ( -9.593 6.616 -10.318) 15.565 14.584 ( 23.411 9.574 6.770) 26.184 15.156 ( -26.632 5.558 10.714) 29.239 15.470 ( 22.180 -1.656 -15.445) 27.078 15.850 ( -12.297 2.416 -14.425) 19.109 16.315 ( 4.356 -4.817 14.237) 15.648 16.462 ( -9.398 -13.783 8.752) 18.839 16.532 ( 4.563 -19.073 1.410) 19.662 16.642 ( -6.797 -11.062 5.597) 14.139 16.891 ( 1.956 -4.503 2.708) 5.607 16.921 ( -0.755 -3.116 1.962) 3.759 19.097 ( 1.771 8.110 -4.424) 9.407 19.110 ( 0.227 7.460 -4.666) 8.802 19.167 ( 7.519 4.332 -1.133) 8.751 19.335 ( -7.817 2.872 -1.407) 8.446 ======================= Grid point 81 (31/120) ======================= q-point: ( 0.00 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.234 ( 0.000 26.399 6.341) 27.150 1.467 ( 0.000 31.044 9.315) 32.411 2.301 ( 0.000 35.335 23.296) 42.324 2.463 ( 0.000 -9.513 2.941) 9.957 2.977 ( 0.000 -17.130 -0.059) 17.130 3.041 ( 0.000 -4.523 -6.681) 8.068 3.159 ( 0.000 5.163 -4.751) 7.016 3.614 ( 0.000 -3.267 -4.520) 5.578 3.746 ( 0.000 5.344 -2.330) 5.830 3.815 ( 0.000 -6.045 -5.641) 8.268 4.016 ( 0.000 -2.266 -12.120) 12.330 4.560 ( 0.000 -13.297 -3.864) 13.847 4.912 ( 0.000 6.757 2.262) 7.125 5.031 ( 0.000 4.362 11.011) 11.844 5.229 ( 0.000 0.298 7.316) 7.322 5.548 ( 0.000 -6.090 9.519) 11.301 5.694 ( 0.000 16.189 -15.459) 22.384 5.897 ( 0.000 12.483 2.913) 12.819 6.750 ( 0.000 -15.210 4.985) 16.006 7.066 ( 0.000 -16.397 11.611) 20.092 7.196 ( 0.000 8.959 -8.300) 12.213 7.697 ( 0.000 -5.812 -17.438) 18.381 7.940 ( 0.000 5.839 11.347) 12.761 8.098 ( 0.000 4.848 -5.500) 7.332 8.394 ( 0.000 -1.948 -7.321) 7.576 8.508 ( 0.000 -8.296 9.363) 12.510 8.597 ( 0.000 5.345 -3.087) 6.173 9.189 ( 0.000 -1.723 -8.655) 8.825 9.273 ( 0.000 -1.608 -4.969) 5.223 9.282 ( 0.000 -10.432 -2.341) 10.691 9.722 ( 0.000 1.269 3.675) 3.888 9.822 ( 0.000 -0.734 3.396) 3.475 9.945 ( 0.000 -4.229 8.093) 9.131 10.074 ( 0.000 -5.030 -4.535) 6.772 10.742 ( 0.000 -3.727 7.812) 8.655 10.751 ( 0.000 0.244 1.833) 1.850 11.201 ( 0.000 12.889 9.001) 15.720 11.756 ( 0.000 -3.823 7.580) 8.490 11.954 ( 0.000 9.813 -3.159) 10.309 12.235 ( 0.000 6.788 13.600) 15.200 12.409 ( 0.000 11.836 -7.232) 13.871 12.545 ( 0.000 -3.422 -4.187) 5.408 12.791 ( 0.000 24.689 5.660) 25.329 13.690 ( 0.000 6.229 -13.028) 14.441 14.227 ( 0.000 -6.231 -19.477) 20.449 14.728 ( 0.000 -6.116 -2.333) 6.546 14.744 ( 0.000 -7.500 -18.776) 20.219 15.098 ( 0.000 -27.653 2.927) 27.807 15.622 ( 0.000 6.350 0.425) 6.364 16.062 ( 0.000 6.897 -3.975) 7.960 16.108 ( 0.000 -6.226 -4.499) 7.681 16.388 ( 0.000 -3.130 -7.143) 7.798 16.530 ( 0.000 -0.857 24.668) 24.683 16.622 ( 0.000 -0.185 -3.781) 3.785 16.641 ( 0.000 -2.184 13.567) 13.741 17.202 ( 0.000 -11.467 -10.758) 15.723 18.600 ( 0.000 5.061 11.241) 12.327 18.936 ( 0.000 -5.528 6.891) 8.834 19.328 ( 0.000 12.654 -0.071) 12.654 19.660 ( 0.000 0.594 -0.297) 0.664 ======================= Grid point 82 (32/120) ======================= q-point: ( 0.11 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.311 ( 8.489 22.019 6.493) 24.476 1.517 ( 6.212 26.433 12.949) 30.083 2.458 ( 0.744 -8.285 2.776) 8.769 2.575 ( 21.220 25.661 14.562) 36.342 2.918 ( -5.263 -15.376 -1.102) 16.289 3.021 ( -2.139 -4.959 -4.472) 7.012 3.150 ( -0.471 2.447 -4.765) 5.377 3.550 ( -6.049 -3.396 -1.910) 7.195 3.752 ( -0.838 -3.765 -5.609) 6.807 3.768 ( -2.008 5.824 -5.126) 8.014 3.996 ( -3.409 1.246 -7.788) 8.592 4.480 ( -7.758 -11.679 -3.558) 14.465 4.901 ( 1.723 5.662 -1.533) 6.113 5.135 ( 7.569 4.188 7.126) 11.208 5.225 ( -2.272 1.607 3.112) 4.175 5.524 ( 1.799 -1.128 5.654) 6.040 5.738 ( 4.792 14.697 -1.293) 15.512 5.949 ( 5.455 10.416 4.167) 12.475 6.837 ( 6.994 -15.211 3.770) 17.161 7.016 ( -4.252 -13.855 10.417) 17.849 7.233 ( 3.078 7.360 -7.667) 11.065 7.680 ( -1.691 -4.709 -15.205) 16.007 7.900 ( -3.757 3.709 8.009) 9.592 8.014 ( -8.417 6.526 -6.007) 12.228 8.230 ( -11.438 -5.257 1.207) 12.646 8.400 ( -9.899 -3.014 -0.159) 10.349 8.516 ( -6.998 1.859 2.405) 7.630 8.990 ( -6.585 4.822 -4.944) 9.542 9.096 ( -7.446 -2.996 -0.228) 8.029 9.553 ( 5.865 -1.506 -5.447) 8.145 9.784 ( 4.062 -1.663 1.042) 4.512 9.938 ( 0.456 -3.683 9.583) 10.277 10.039 ( 10.786 -4.915 -7.766) 14.171 10.283 ( 21.005 -11.209 0.747) 23.820 10.671 ( -4.481 -2.449 5.217) 7.300 10.756 ( -1.008 -4.443 1.676) 4.855 11.206 ( 1.341 17.225 6.962) 18.627 11.948 ( 12.498 -1.378 5.779) 13.838 11.977 ( 1.767 10.324 6.395) 12.272 12.291 ( 10.924 7.188 2.807) 13.374 12.456 ( 2.255 7.153 -7.416) 10.548 12.582 ( 5.905 -4.056 -4.649) 8.540 12.893 ( 9.316 24.317 8.372) 27.353 13.553 ( -9.609 7.286 -4.459) 12.858 14.227 ( -2.248 -5.593 -17.640) 18.642 14.564 ( -8.698 -14.596 -8.152) 18.845 14.751 ( -4.470 -2.980 -11.896) 13.053 15.169 ( 5.290 -22.731 -1.124) 23.365 15.622 ( 0.149 5.935 0.600) 5.967 16.000 ( -3.999 5.116 -4.831) 8.093 16.192 ( 5.847 -7.514 -2.158) 9.763 16.349 ( -3.846 -3.310 -4.571) 6.829 16.488 ( -2.335 0.136 16.672) 16.835 16.592 ( -2.719 -1.243 1.932) 3.559 16.708 ( 4.747 -3.170 9.031) 10.684 17.175 ( -3.560 -12.096 -6.742) 14.299 18.659 ( 5.673 5.193 8.904) 11.766 19.002 ( 5.526 -5.447 2.842) 8.263 19.328 ( -0.082 12.496 -0.332) 12.501 19.647 ( -1.396 0.821 -0.453) 1.682 ======================= Grid point 83 (33/120) ======================= q-point: ( 0.22 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( 17.456 9.754 6.501) 21.026 1.710 ( 12.056 17.862 11.810) 24.574 2.465 ( 0.576 -9.442 2.033) 9.675 2.775 ( -7.231 -14.164 -2.031) 16.033 2.947 ( 0.615 0.293 1.424) 1.578 2.982 ( 6.983 3.704 -3.893) 8.811 3.164 ( 1.681 -5.235 -3.740) 6.650 3.413 ( -6.302 -1.396 3.496) 7.341 3.712 ( -0.694 5.385 -8.097) 9.749 3.778 ( 1.323 3.901 -2.310) 4.722 3.866 ( -8.514 4.921 -2.998) 10.281 4.266 ( -12.848 -8.089 -2.331) 15.360 4.958 ( 1.710 5.716 -2.810) 6.595 5.204 ( 5.778 9.430 3.175) 11.506 5.306 ( 8.711 2.369 -4.967) 10.304 5.677 ( 11.186 8.979 -2.238) 14.518 5.881 ( 9.685 8.786 10.876) 17.008 6.134 ( 13.099 5.259 8.575) 16.515 6.906 ( -6.500 -10.329 7.495) 14.322 6.978 ( 5.944 -13.602 2.330) 15.025 7.300 ( 3.063 6.497 -6.000) 9.359 7.631 ( -3.226 -3.511 -10.624) 11.645 7.756 ( -16.661 6.985 -4.110) 18.528 7.814 ( -5.147 2.623 0.311) 5.785 8.043 ( -7.598 -4.145 0.621) 8.678 8.186 ( -9.673 -1.829 -2.701) 10.209 8.352 ( -8.624 -1.841 6.663) 11.052 8.715 ( -17.103 -11.771 -1.614) 20.825 9.135 ( 6.750 13.575 1.859) 15.274 9.619 ( 1.584 1.584 -3.493) 4.149 9.845 ( 2.039 -4.552 1.064) 5.100 9.953 ( 0.229 0.198 7.221) 7.228 10.187 ( 5.058 -1.300 -0.225) 5.227 10.498 ( -4.236 -3.226 0.648) 5.364 10.690 ( 3.649 -6.881 -4.043) 8.775 10.786 ( 9.144 -15.953 1.672) 18.464 11.259 ( 3.467 22.357 4.084) 22.990 11.845 ( -7.801 18.877 8.333) 22.060 12.281 ( 10.139 -2.168 6.590) 12.285 12.468 ( 7.331 2.591 -10.982) 13.456 12.689 ( 19.329 5.139 -5.806) 20.826 12.821 ( 17.126 -3.549 -4.301) 18.011 13.128 ( 12.424 15.077 13.121) 23.533 13.439 ( 1.563 6.010 6.085) 8.694 14.098 ( -9.728 -2.273 -9.769) 13.972 14.466 ( -0.178 -20.347 -11.893) 23.568 14.608 ( -8.025 0.442 -9.013) 12.076 15.227 ( -0.950 -4.711 -10.476) 11.525 15.628 ( 1.023 -5.439 7.184) 9.069 15.967 ( 0.689 4.728 -5.035) 6.941 16.217 ( -4.416 -12.644 1.305) 13.456 16.280 ( -3.794 -1.180 -5.088) 6.455 16.442 ( -2.829 -0.241 7.597) 8.110 16.559 ( 1.330 -5.146 4.643) 7.057 16.791 ( 3.065 -4.346 6.350) 8.282 17.037 ( -9.939 -11.721 0.966) 15.398 18.815 ( 9.455 5.335 4.113) 11.609 19.114 ( 5.078 -2.715 -2.103) 6.130 19.324 ( -0.285 11.958 -1.041) 12.007 19.603 ( -3.045 1.452 -0.864) 3.483 ======================= Grid point 84 (34/120) ======================= q-point: ( 0.33 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( 14.138 4.385 7.800) 16.732 1.993 ( 17.053 3.935 5.011) 18.204 2.487 ( 1.237 -8.296 1.132) 8.464 2.604 ( -9.263 -9.499 -2.106) 13.434 2.914 ( 0.091 -2.856 0.991) 3.024 3.031 ( -2.822 -4.903 -8.822) 10.480 3.180 ( 0.811 -7.987 -4.726) 9.316 3.310 ( -4.492 -2.946 3.996) 6.695 3.655 ( -5.718 4.678 -3.691) 8.258 3.678 ( -8.037 -0.935 -1.353) 8.204 3.824 ( -1.530 2.886 -2.279) 3.983 4.009 ( -11.140 -3.782 0.503) 11.775 5.077 ( 12.341 14.389 -0.935) 18.980 5.369 ( 6.150 22.085 6.904) 23.943 5.529 ( 15.110 1.546 -14.443) 20.960 5.921 ( 13.483 12.156 -12.470) 22.024 6.151 ( 17.101 0.262 13.365) 21.706 6.449 ( 16.522 1.751 10.430) 19.617 6.725 ( -11.459 -6.391 0.325) 13.125 7.063 ( 1.248 -7.070 3.070) 7.808 7.303 ( -9.971 9.578 -4.807) 14.637 7.352 ( -16.857 3.063 -7.629) 18.754 7.561 ( -2.206 -7.836 -5.095) 9.604 7.715 ( -4.866 7.213 3.850) 9.515 7.887 ( -7.879 1.305 5.419) 9.652 8.066 ( -3.688 -7.805 -2.093) 8.883 8.179 ( -7.849 -4.922 2.435) 9.579 8.404 ( -11.857 -14.074 -0.398) 18.408 9.290 ( 8.117 11.151 3.562) 14.245 9.626 ( -0.882 3.486 -0.410) 3.619 9.870 ( 0.473 -5.050 2.761) 5.775 9.929 ( -2.479 1.238 4.482) 5.269 10.249 ( 1.412 2.101 2.901) 3.850 10.393 ( -4.571 0.088 -1.094) 4.701 10.737 ( 3.292 -7.785 -3.378) 9.102 10.942 ( 3.246 -16.982 -0.984) 17.317 11.334 ( 4.060 24.188 3.858) 24.828 11.688 ( -7.552 21.622 8.470) 24.419 12.406 ( 7.421 10.497 -1.566) 12.950 12.697 ( 12.146 -13.296 -2.508) 18.183 12.928 ( 3.610 6.545 -5.697) 9.399 13.184 ( 16.141 -4.893 -6.295) 18.003 13.217 ( -2.824 -3.707 11.470) 12.380 13.766 ( 20.104 8.843 3.375) 22.221 13.918 ( -1.151 -4.613 -3.977) 6.198 14.466 ( -1.143 8.094 -5.774) 10.008 14.596 ( 8.438 -10.575 -11.544) 17.785 15.172 ( -0.495 6.462 -10.884) 12.668 15.642 ( -3.414 -3.365 10.370) 11.425 15.918 ( -6.378 -12.239 -5.653) 14.913 16.135 ( -6.997 -1.080 -1.069) 7.160 16.164 ( -2.518 -16.505 -3.235) 17.006 16.357 ( -4.673 -0.623 6.050) 7.670 16.626 ( 2.464 -6.286 2.835) 7.322 16.783 ( -6.581 -8.683 8.803) 14.006 16.858 ( -2.494 -5.859 4.013) 7.527 19.019 ( 10.443 5.181 0.213) 11.660 19.201 ( 3.570 1.688 -3.862) 5.524 19.314 ( -0.729 10.839 -2.022) 11.050 19.522 ( -5.048 2.355 -1.362) 5.734 ======================= Grid point 85 (35/120) ======================= q-point: ( 0.44 0.29 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( 10.128 -0.004 5.023) 11.305 2.292 ( 6.308 -6.144 3.950) 9.651 2.419 ( -2.708 -2.983 -2.582) 4.785 2.508 ( -2.465 -7.987 0.480) 8.372 2.942 ( 1.423 -1.890 -1.539) 2.823 2.965 ( -2.154 -3.001 -6.627) 7.587 3.200 ( 1.043 -7.803 -2.345) 8.214 3.234 ( -2.813 -5.656 0.743) 6.361 3.534 ( -3.743 1.730 -1.192) 4.292 3.551 ( -4.879 -1.907 -0.632) 5.276 3.758 ( -0.688 -3.626 -0.556) 3.732 3.835 ( -6.964 -2.922 1.293) 7.662 5.336 ( 9.542 22.057 -1.311) 24.068 5.426 ( -0.301 24.689 1.456) 24.734 5.902 ( 21.496 4.830 -8.862) 23.747 6.234 ( 9.873 -1.526 -11.983) 15.601 6.386 ( -6.340 3.984 -8.302) 11.180 6.552 ( 17.298 2.769 5.836) 18.465 6.702 ( -8.576 -3.256 -6.587) 11.293 6.883 ( -14.417 6.907 -4.015) 16.483 7.004 ( -0.075 1.325 10.964) 11.044 7.189 ( -9.498 4.323 5.513) 11.803 7.574 ( 2.406 -6.218 3.299) 7.439 7.630 ( -3.100 9.170 5.893) 11.333 7.787 ( -0.554 -0.756 4.183) 4.287 7.891 ( -9.948 -12.209 3.403) 16.113 8.161 ( 3.438 -9.098 -4.848) 10.868 8.248 ( -5.193 -12.057 -2.622) 13.387 9.449 ( 7.461 7.859 4.612) 11.777 9.574 ( -4.562 5.360 3.664) 7.935 9.868 ( -0.300 -3.654 2.772) 4.596 9.879 ( -1.707 -0.100 1.790) 2.475 10.273 ( 1.649 3.575 0.884) 4.035 10.321 ( -2.926 2.772 -0.631) 4.080 10.827 ( 5.254 -10.347 -2.155) 11.803 10.926 ( -3.857 -13.550 -1.550) 14.173 11.426 ( 5.239 24.461 5.652) 25.647 11.546 ( -6.591 23.550 7.551) 25.594 12.619 ( 12.845 10.328 -2.604) 16.686 12.853 ( -7.213 0.624 -0.904) 7.296 12.933 ( 7.989 -8.738 0.428) 11.847 13.098 ( -7.489 -13.642 8.902) 17.928 13.450 ( 11.173 -7.986 -9.439) 16.665 13.666 ( -10.506 -7.423 -7.988) 15.142 14.324 ( 16.291 12.473 -8.626) 22.257 14.507 ( -1.428 12.179 -4.491) 13.059 14.792 ( 18.854 10.518 0.727) 21.602 15.305 ( -21.742 9.023 5.087) 24.084 15.409 ( 18.165 -4.120 -7.230) 19.981 15.872 ( -16.499 -2.195 -10.725) 19.801 15.922 ( -0.253 -30.176 1.645) 30.222 16.029 ( -6.927 -25.899 2.005) 26.884 16.391 ( 6.387 1.173 9.783) 11.742 16.537 ( -7.714 -1.394 11.105) 13.593 16.773 ( 3.312 -7.564 2.286) 8.568 16.829 ( -2.006 -6.204 2.134) 6.860 19.215 ( 8.168 5.269 -2.361) 10.002 19.264 ( 3.129 5.378 -3.386) 7.083 19.294 ( -1.135 8.561 -2.839) 9.091 19.399 ( -7.144 3.352 -1.599) 8.052 ======================= Grid point 90 (36/120) ======================= q-point: ( 0.00 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 0.000 24.548 1.265) 24.580 2.013 ( 0.000 19.472 2.350) 19.613 2.202 ( 0.000 -10.506 4.531) 11.442 2.553 ( 0.000 -21.241 6.040) 22.083 2.840 ( 0.000 13.296 1.538) 13.384 2.976 ( 0.000 -3.229 -6.861) 7.583 3.315 ( 0.000 10.224 -0.985) 10.271 3.509 ( 0.000 -8.905 1.596) 9.047 3.714 ( 0.000 5.434 -6.135) 8.196 3.902 ( 0.000 -9.831 -5.639) 11.333 4.003 ( 0.000 14.143 -3.462) 14.561 4.285 ( 0.000 -15.097 -3.719) 15.548 5.029 ( 0.000 4.734 0.141) 4.736 5.073 ( 0.000 -0.001 6.190) 6.190 5.267 ( 0.000 4.635 10.960) 11.900 5.403 ( 0.000 -8.551 10.249) 13.348 5.985 ( 0.000 13.511 -9.753) 16.663 6.113 ( 0.000 4.933 -4.051) 6.384 6.532 ( 0.000 -2.398 9.266) 9.571 6.733 ( 0.000 -17.458 11.098) 20.687 7.379 ( 0.000 9.811 -12.886) 16.196 7.556 ( 0.000 -8.581 -15.981) 18.139 8.065 ( 0.000 6.861 12.210) 14.005 8.154 ( 0.000 -0.578 3.542) 3.589 8.355 ( 0.000 -1.844 -6.253) 6.519 8.365 ( 0.000 -4.594 2.380) 5.174 8.746 ( 0.000 10.432 -1.873) 10.599 8.984 ( 0.000 -13.931 -0.412) 13.937 9.243 ( 0.000 0.762 -7.907) 7.943 9.254 ( 0.000 -0.529 -5.787) 5.811 9.753 ( 0.000 1.946 5.517) 5.850 9.792 ( 0.000 -2.002 8.080) 8.324 9.929 ( 0.000 1.626 -3.980) 4.299 9.986 ( 0.000 -4.054 -4.940) 6.390 10.704 ( 0.000 -0.329 7.693) 7.700 10.722 ( 0.000 -1.925 5.843) 6.152 11.460 ( 0.000 12.647 6.236) 14.101 11.652 ( 0.000 -7.462 6.318) 9.777 12.143 ( 0.000 10.341 -4.502) 11.278 12.354 ( 0.000 -11.454 -4.628) 12.353 12.380 ( 0.000 7.536 10.937) 13.282 12.483 ( 0.000 -2.309 4.399) 4.968 13.478 ( 0.000 41.192 4.670) 41.456 13.843 ( 0.000 9.565 -14.693) 17.532 14.053 ( 0.000 -10.905 -18.211) 21.226 14.276 ( 0.000 -39.331 -0.401) 39.333 14.701 ( 0.000 2.130 -7.284) 7.589 14.776 ( 0.000 -6.092 -9.710) 11.463 15.775 ( 0.000 9.269 -3.365) 9.861 15.958 ( 0.000 -9.386 -3.722) 10.097 16.199 ( 0.000 7.203 -4.866) 8.693 16.321 ( 0.000 -5.133 -6.703) 8.442 16.546 ( 0.000 1.959 21.474) 21.563 16.591 ( 0.000 -2.570 18.090) 18.271 16.716 ( 0.000 9.831 -8.299) 12.866 16.953 ( 0.000 -13.763 -10.007) 17.016 18.708 ( 0.000 6.119 9.458) 11.265 18.826 ( 0.000 -6.058 7.881) 9.940 19.532 ( 0.000 8.335 -0.239) 8.339 19.640 ( 0.000 -3.113 -0.321) 3.130 ======================= Grid point 91 (37/120) ======================= q-point: ( 0.11 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( 2.717 23.038 0.607) 23.206 2.008 ( 0.543 19.776 5.755) 20.604 2.202 ( 0.431 -12.253 4.072) 12.919 2.522 ( -2.673 -22.395 6.934) 23.596 2.920 ( 5.228 6.461 -2.864) 8.791 2.970 ( -0.937 -1.077 -7.824) 7.953 3.261 ( -4.701 8.549 -1.449) 9.863 3.441 ( -6.058 -9.064 1.797) 11.049 3.764 ( 5.173 9.502 -4.870) 11.864 3.934 ( 0.858 -2.219 -6.474) 6.897 4.004 ( 0.131 8.348 -2.687) 8.771 4.240 ( -4.517 -13.204 -3.268) 14.332 5.019 ( 0.092 6.593 -0.565) 6.618 5.125 ( 2.732 -3.804 0.158) 4.686 5.299 ( 3.621 5.266 12.136) 13.716 5.421 ( 6.152 -7.201 12.404) 15.606 6.044 ( 4.984 14.303 -6.373) 16.432 6.151 ( 3.537 6.600 -3.479) 8.257 6.592 ( 5.330 -6.304 8.642) 11.951 6.722 ( -0.930 -15.193 10.708) 18.610 7.400 ( 1.921 9.074 -12.693) 15.720 7.559 ( 0.145 -7.465 -14.958) 16.718 7.983 ( -6.324 4.974 8.255) 11.527 8.077 ( -7.191 -3.550 4.889) 9.392 8.192 ( -10.451 4.733 -3.360) 11.955 8.307 ( -7.745 -5.926 -1.969) 9.949 8.621 ( -10.901 8.407 -0.490) 13.775 8.820 ( -13.608 -11.908 -1.181) 18.121 9.267 ( 5.727 11.191 -2.796) 12.879 9.463 ( 9.409 -8.530 -4.650) 13.525 9.769 ( 1.460 1.755 4.774) 5.292 9.841 ( 3.840 -5.072 9.331) 11.293 10.041 ( 9.887 3.267 -7.185) 12.651 10.130 ( 13.060 -5.979 -2.619) 14.601 10.647 ( -4.680 0.308 5.431) 7.176 10.682 ( -3.561 -3.132 3.536) 5.916 11.539 ( 6.910 16.490 5.409) 18.680 11.802 ( 12.803 -10.855 6.301) 17.929 12.222 ( 3.778 11.629 -0.811) 12.254 12.411 ( 6.514 5.206 6.664) 10.674 12.419 ( 5.398 -8.481 -3.039) 10.503 12.503 ( 4.381 -2.854 1.861) 5.550 13.516 ( 3.157 37.096 4.838) 37.543 13.747 ( -7.624 12.855 -10.844) 18.465 14.017 ( -2.828 -14.654 -15.220) 21.316 14.200 ( -7.450 -29.284 -1.919) 30.278 14.709 ( -1.436 -0.506 -10.234) 10.347 14.783 ( 3.352 -10.750 -4.762) 12.226 15.789 ( 0.056 10.442 -2.780) 10.806 15.992 ( 1.767 -10.011 -4.018) 10.931 16.138 ( -4.280 6.320 -3.805) 8.529 16.267 ( -3.379 -6.174 -6.534) 9.604 16.545 ( -0.527 4.243 17.482) 17.997 16.612 ( 0.328 -1.433 11.793) 11.884 16.700 ( -0.987 7.056 -2.172) 7.448 16.922 ( -3.560 -13.682 -6.259) 15.461 18.770 ( 5.902 6.316 7.149) 11.217 18.891 ( 5.990 -6.209 5.202) 10.074 19.528 ( -0.466 8.107 -0.442) 8.132 19.631 ( -0.936 -2.860 -0.488) 3.049 ======================= Grid point 92 (38/120) ======================= q-point: ( 0.22 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( 6.990 16.799 0.568) 18.204 2.055 ( 3.786 13.005 6.293) 14.935 2.229 ( 2.501 -9.766 4.501) 11.040 2.472 ( -2.086 -17.835 8.019) 19.665 2.919 ( -2.714 0.464 -6.328) 6.901 2.975 ( -1.000 -4.235 -8.683) 9.713 3.162 ( -4.429 5.455 -1.839) 7.263 3.305 ( -6.722 -8.362 2.310) 10.974 3.858 ( -0.555 6.798 -6.686) 9.551 3.881 ( -4.744 4.700 -5.108) 8.408 3.979 ( -3.192 5.574 -1.221) 6.538 4.109 ( -8.111 -8.096 -1.172) 11.520 5.080 ( 6.893 7.161 -3.254) 10.459 5.202 ( 9.235 -4.774 -7.047) 12.559 5.481 ( 13.329 11.214 11.474) 20.859 5.673 ( 17.059 -7.430 14.277) 23.453 6.141 ( 3.951 14.513 -3.850) 15.526 6.260 ( 7.424 4.654 -2.721) 9.175 6.687 ( 0.030 -8.824 8.402) 12.184 6.733 ( 5.766 -10.902 8.571) 15.019 7.438 ( 1.047 6.771 -11.085) 13.032 7.545 ( -2.245 -4.866 -11.202) 12.418 7.873 ( -3.964 3.515 5.318) 7.507 7.902 ( -13.096 4.823 -3.453) 14.377 7.980 ( -7.575 0.436 -2.135) 7.882 8.104 ( -11.129 -6.921 -3.818) 13.650 8.365 ( -13.545 3.466 5.305) 14.954 8.494 ( -17.922 -10.049 2.167) 20.660 9.387 ( 5.613 12.462 0.270) 13.670 9.589 ( 4.048 -7.422 -2.463) 8.806 9.802 ( 1.321 3.185 6.207) 7.101 9.904 ( 1.621 -5.342 9.548) 11.060 10.240 ( 8.722 6.481 -4.037) 11.592 10.400 ( 9.617 -8.825 -4.139) 13.693 10.564 ( -1.438 -1.433 2.435) 3.170 10.611 ( -2.766 -5.013 -0.256) 5.732 11.692 ( 7.582 22.176 2.985) 23.625 12.069 ( 12.196 -16.200 4.312) 20.731 12.202 ( -3.214 16.647 6.309) 18.090 12.451 ( 0.764 -7.406 0.498) 7.462 12.720 ( 17.341 0.602 -3.132) 17.632 12.755 ( 17.390 -2.752 -3.703) 17.991 13.547 ( -2.380 25.907 2.429) 26.129 13.668 ( 4.690 16.501 -1.435) 17.214 13.970 ( -7.165 -12.619 -5.254) 15.433 14.039 ( 0.016 -23.448 -8.010) 24.778 14.666 ( -0.837 6.694 -7.464) 10.061 14.915 ( 8.656 -19.576 -2.603) 21.562 15.703 ( -8.570 10.445 -1.773) 13.627 15.941 ( -7.639 -13.917 -1.307) 15.929 16.108 ( 1.949 8.957 -7.969) 12.147 16.269 ( 1.923 -6.042 -8.698) 10.764 16.480 ( -7.108 6.030 7.882) 12.207 16.554 ( -4.244 1.859 9.234) 10.331 16.710 ( 0.666 -2.413 6.787) 7.234 16.809 ( -6.563 -10.953 2.204) 12.958 18.927 ( 9.208 6.160 2.691) 11.400 19.038 ( 7.963 -5.156 0.706) 9.513 19.512 ( -1.173 7.364 -0.998) 7.523 19.600 ( -2.169 -2.094 -0.943) 3.159 ======================= Grid point 93 (39/120) ======================= q-point: ( 0.33 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( 9.548 7.773 1.038) 12.356 2.143 ( 4.854 4.465 2.511) 7.057 2.299 ( 3.793 -5.652 5.801) 8.944 2.426 ( -3.031 -9.874 4.547) 11.286 2.882 ( -0.152 -0.065 -2.413) 2.419 2.933 ( -1.739 -5.063 -7.410) 9.142 3.098 ( -2.023 1.085 -2.548) 3.429 3.187 ( -4.959 -7.146 2.301) 8.998 3.714 ( -8.602 3.813 -4.752) 10.541 3.758 ( -8.157 1.862 -5.411) 9.964 3.857 ( -9.449 2.600 0.202) 9.802 3.939 ( -8.776 -4.171 0.972) 9.765 5.337 ( 17.739 11.752 -7.067) 22.422 5.497 ( 17.803 -4.948 -13.623) 22.957 5.765 ( 13.216 18.841 11.364) 25.667 6.047 ( 18.096 -9.123 12.540) 23.832 6.204 ( 3.413 13.363 -8.467) 16.184 6.433 ( 8.737 -7.766 -3.851) 12.308 6.679 ( 1.258 5.736 6.668) 8.886 6.872 ( 6.798 -11.719 8.230) 15.852 7.383 ( -9.450 1.980 -4.423) 10.620 7.432 ( -9.430 -3.252 -4.406) 10.905 7.574 ( -14.847 14.068 -7.970) 21.952 7.813 ( -4.050 -3.334 -0.028) 5.246 7.875 ( -5.207 -0.800 -3.086) 6.105 7.929 ( -5.208 -3.567 -1.044) 6.399 8.106 ( -11.500 -1.728 5.812) 13.001 8.167 ( -11.778 -8.857 6.570) 16.134 9.493 ( 5.190 10.067 2.208) 11.540 9.653 ( 2.714 -4.701 -0.251) 5.434 9.801 ( -1.643 2.113 7.786) 8.234 9.892 ( -2.621 -4.747 8.087) 9.736 10.366 ( 3.677 9.504 -1.060) 10.246 10.444 ( -0.358 4.407 -4.140) 6.058 10.586 ( 0.373 -7.530 -2.671) 7.998 10.637 ( 4.028 -13.694 0.073) 14.275 11.829 ( 6.023 26.352 2.234) 27.124 12.122 ( -3.776 22.482 7.488) 23.995 12.297 ( 9.681 -20.968 2.760) 23.260 12.486 ( 2.732 -12.257 2.129) 12.737 12.927 ( 3.865 3.123 -4.871) 6.958 13.059 ( 11.427 -7.808 -6.584) 15.326 13.430 ( -9.118 17.911 -1.611) 20.163 13.732 ( -12.892 -12.161 -4.822) 18.367 14.013 ( 27.913 13.654 0.672) 31.081 14.307 ( 23.443 -16.428 -5.846) 29.217 14.715 ( 5.647 17.122 -1.980) 18.138 15.109 ( 10.363 -20.418 -0.912) 22.915 15.502 ( -10.204 6.807 -1.566) 12.366 15.747 ( -10.866 -15.220 -2.738) 18.900 16.024 ( -15.861 8.322 -4.075) 18.369 16.179 ( -12.907 -3.763 -9.071) 16.219 16.380 ( 0.180 4.507 8.506) 9.628 16.516 ( 3.147 -7.015 5.282) 9.328 16.666 ( -3.873 -0.295 8.523) 9.367 16.742 ( -1.259 -6.021 4.915) 7.874 19.120 ( 9.558 4.965 -0.598) 10.788 19.193 ( 7.256 -2.371 -1.965) 7.882 19.478 ( -2.298 5.988 -1.763) 6.652 19.541 ( -3.859 -0.824 -1.537) 4.234 ======================= Grid point 94 (40/120) ======================= q-point: ( 0.44 0.43 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 6.570 3.079 2.429) 7.651 2.244 ( 3.706 0.092 1.324) 3.936 2.340 ( -1.233 -6.502 2.322) 7.014 2.351 ( -2.570 -4.807 0.529) 5.477 2.928 ( 3.694 0.660 -3.775) 5.323 2.941 ( 2.489 0.043 -0.579) 2.556 3.061 ( -1.941 -4.347 -3.002) 5.628 3.094 ( -4.652 -6.555 1.613) 8.198 3.588 ( -2.534 4.200 -2.057) 5.319 3.629 ( -4.681 5.261 -0.783) 7.086 3.689 ( -3.490 -2.937 -0.797) 4.630 3.760 ( -7.942 -5.119 0.612) 9.469 5.694 ( 14.959 14.443 -7.226) 22.013 5.801 ( 7.714 9.364 -8.567) 14.852 5.962 ( 7.667 4.308 -2.780) 9.224 6.129 ( -5.941 -8.423 -4.135) 11.106 6.490 ( 18.902 6.248 -7.756) 21.366 6.590 ( 10.018 -3.308 -0.612) 10.568 6.734 ( -2.153 9.110 0.508) 9.374 6.902 ( -11.126 -5.804 -1.481) 12.636 7.126 ( -1.907 10.480 8.077) 13.368 7.292 ( -6.016 3.706 5.450) 8.924 7.366 ( -2.567 -7.272 4.220) 8.791 7.573 ( -15.802 -15.710 3.711) 22.589 7.837 ( 0.342 8.456 2.140) 8.730 7.861 ( -2.080 6.038 0.441) 6.401 8.000 ( -0.162 -7.627 -2.278) 7.962 8.033 ( -3.261 -10.270 0.557) 10.789 9.599 ( 5.267 7.860 4.398) 10.434 9.683 ( -1.491 4.800 4.106) 6.490 9.764 ( 0.185 -5.572 5.194) 7.620 9.820 ( -3.936 -5.409 5.284) 8.524 10.411 ( 1.725 10.055 -1.969) 10.391 10.439 ( -0.772 9.212 -2.085) 9.477 10.620 ( 2.507 -11.032 -2.868) 11.671 10.663 ( -1.088 -13.366 -1.473) 13.491 11.940 ( 5.163 28.173 4.374) 28.974 12.039 ( -4.599 27.054 6.942) 28.306 12.457 ( 6.054 -25.185 4.022) 26.213 12.525 ( -0.267 -22.225 5.324) 22.856 13.009 ( 6.769 11.897 -5.189) 14.638 13.207 ( -11.230 14.207 -4.277) 18.608 13.258 ( 9.164 -11.624 -7.895) 16.776 13.477 ( -12.155 -12.477 -6.521) 18.599 14.601 ( 24.686 16.072 -5.798) 30.022 14.801 ( 9.068 12.145 -5.940) 16.279 14.891 ( 21.555 2.585 0.221) 21.711 15.311 ( 3.143 -24.584 0.229) 24.786 15.349 ( -1.004 0.694 -3.878) 4.065 15.508 ( -10.248 -1.139 1.626) 10.438 15.632 ( -16.094 -6.424 3.072) 17.599 15.774 ( -23.023 -8.990 -1.132) 24.742 16.468 ( 5.865 6.465 5.469) 10.301 16.574 ( -3.758 4.431 6.167) 8.473 16.618 ( 3.913 -7.893 3.154) 9.357 16.699 ( -3.232 -7.147 3.258) 8.494 19.299 ( 7.981 3.176 -2.067) 8.835 19.324 ( 5.732 0.818 -2.659) 6.372 19.416 ( -3.916 3.912 -2.500) 6.073 19.443 ( -5.870 0.835 -1.984) 6.253 ======================= Grid point 126 (41/120) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.095 ( 0.000 0.000 27.296) 27.296 1.192 ( 0.000 0.000 28.901) 28.901 2.164 ( 0.000 0.000 49.062) 49.062 2.660 ( 0.000 0.000 7.983) 7.983 2.872 ( 0.000 0.000 -16.439) 16.439 3.225 ( 0.000 0.000 2.163) 2.163 3.309 ( 0.000 0.000 -4.430) 4.430 3.535 ( 0.000 0.000 0.253) 0.253 3.558 ( 0.000 0.000 -8.984) 8.984 3.568 ( 0.000 0.000 -22.982) 22.982 3.888 ( 0.000 0.000 -12.277) 12.277 4.742 ( 0.000 0.000 0.010) 0.010 4.795 ( 0.000 0.000 -5.306) 5.306 4.984 ( 0.000 0.000 5.403) 5.403 5.124 ( 0.000 0.000 14.264) 14.264 5.507 ( 0.000 0.000 -1.249) 1.249 5.878 ( 0.000 0.000 14.351) 14.351 5.899 ( 0.000 0.000 15.110) 15.110 6.901 ( 0.000 0.000 -6.189) 6.189 7.198 ( 0.000 0.000 3.321) 3.321 7.487 ( 0.000 0.000 -1.332) 1.332 7.538 ( 0.000 0.000 -2.032) 2.032 7.782 ( 0.000 0.000 -17.833) 17.833 8.032 ( 0.000 0.000 11.931) 11.931 8.199 ( 0.000 0.000 -17.559) 17.559 8.380 ( 0.000 0.000 -7.986) 7.986 8.431 ( 0.000 0.000 -3.543) 3.543 9.234 ( 0.000 0.000 -5.048) 5.048 9.234 ( 0.000 0.000 -7.356) 7.356 9.486 ( 0.000 0.000 -4.562) 4.562 9.632 ( 0.000 0.000 -6.063) 6.063 9.687 ( 0.000 0.000 -7.556) 7.556 10.141 ( 0.000 0.000 1.312) 1.312 10.710 ( 0.000 0.000 13.327) 13.327 10.889 ( 0.000 0.000 21.552) 21.552 11.219 ( 0.000 0.000 -5.758) 5.758 11.234 ( 0.000 0.000 9.452) 9.452 11.270 ( 0.000 0.000 1.396) 1.396 11.715 ( 0.000 0.000 -0.493) 0.493 11.988 ( 0.000 0.000 9.896) 9.896 12.021 ( 0.000 0.000 6.400) 6.400 12.481 ( 0.000 0.000 25.715) 25.715 12.829 ( 0.000 0.000 4.169) 4.169 13.285 ( 0.000 0.000 -18.100) 18.100 14.062 ( 0.000 0.000 -17.696) 17.696 14.413 ( 0.000 0.000 -22.600) 22.600 14.816 ( 0.000 0.000 -7.872) 7.872 15.231 ( 0.000 0.000 -22.307) 22.307 15.647 ( 0.000 0.000 -7.297) 7.297 16.134 ( 0.000 0.000 15.666) 15.666 16.388 ( 0.000 0.000 4.460) 4.460 16.471 ( 0.000 0.000 -10.824) 10.824 16.561 ( 0.000 0.000 -3.357) 3.357 16.868 ( 0.000 0.000 -4.225) 4.225 16.977 ( 0.000 0.000 16.474) 16.474 17.275 ( 0.000 0.000 2.275) 2.275 18.800 ( 0.000 0.000 16.235) 16.235 18.960 ( 0.000 0.000 0.003) 0.003 19.123 ( 0.000 0.000 -1.452) 1.452 19.612 ( 0.000 0.000 -0.584) 0.584 ======================= Grid point 127 (42/120) ======================= q-point: ( 0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.263 ( 14.329 0.000 22.263) 26.476 1.385 ( 17.439 0.000 23.651) 29.385 2.392 ( 20.514 0.000 38.762) 43.856 2.678 ( 1.574 0.000 7.409) 7.574 2.911 ( 4.020 0.000 -12.300) 12.941 3.128 ( -5.798 0.000 -2.173) 6.191 3.367 ( -0.712 0.000 2.197) 2.310 3.444 ( -7.901 0.000 -13.523) 15.662 3.505 ( 1.260 0.000 -3.047) 3.297 3.554 ( -4.852 0.000 -14.380) 15.176 3.870 ( -1.802 0.000 -11.700) 11.838 4.706 ( -8.628 0.000 -4.637) 9.795 4.725 ( -1.159 0.000 -0.226) 1.181 4.924 ( -3.364 0.000 6.342) 7.179 5.163 ( 2.554 0.000 6.866) 7.326 5.383 ( -8.145 0.000 1.560) 8.293 5.984 ( 5.930 0.000 14.216) 15.403 6.028 ( 13.459 0.000 16.212) 21.071 6.914 ( 1.031 0.000 -6.172) 6.257 7.285 ( 7.271 0.000 0.056) 7.271 7.449 ( -3.764 0.000 -1.550) 4.070 7.483 ( -5.945 0.000 -1.600) 6.157 7.754 ( -2.407 0.000 -15.274) 15.462 7.882 ( -12.365 0.000 2.788) 12.676 8.156 ( -3.682 0.000 -14.401) 14.864 8.339 ( -7.963 0.000 -0.891) 8.013 8.523 ( 11.392 0.000 -0.355) 11.398 8.857 ( -16.552 0.000 5.943) 17.587 9.208 ( -11.896 0.000 -4.823) 12.837 9.534 ( 3.884 0.000 -4.494) 5.940 9.643 ( -2.218 0.000 -9.281) 9.542 9.816 ( 9.915 0.000 -11.561) 15.230 10.245 ( 8.571 0.000 2.192) 8.847 10.734 ( 2.426 0.000 13.104) 13.326 10.872 ( -5.144 0.000 14.455) 15.343 11.138 ( -8.769 0.000 10.939) 14.020 11.346 ( 7.462 0.000 2.007) 7.727 11.361 ( 13.206 0.000 -12.573) 18.234 11.793 ( 1.362 0.000 7.714) 7.833 11.878 ( -1.147 0.000 1.876) 2.199 12.270 ( 21.689 0.000 5.632) 22.408 12.739 ( 21.702 0.000 23.560) 32.032 12.805 ( -0.797 0.000 3.227) 3.324 13.353 ( 6.040 0.000 -12.461) 13.847 14.000 ( -5.854 0.000 -17.260) 18.225 14.438 ( 2.611 0.000 -22.397) 22.549 14.745 ( -7.310 0.000 -5.769) 9.312 15.036 ( -15.673 0.000 -21.601) 26.688 15.756 ( 6.874 0.000 -6.367) 9.370 15.973 ( -8.234 0.000 13.824) 16.091 16.488 ( 1.968 0.000 -5.169) 5.531 16.582 ( 1.969 0.000 -3.010) 3.597 16.605 ( 12.766 0.000 -0.476) 12.774 16.864 ( -0.294 0.000 -3.637) 3.649 16.888 ( -6.051 0.000 19.470) 20.389 17.318 ( 1.811 0.000 -1.069) 2.103 18.814 ( 1.520 0.000 14.229) 14.310 18.951 ( -0.909 0.000 -0.603) 1.091 19.077 ( -4.007 0.000 -2.937) 4.969 19.589 ( -2.269 0.000 -0.850) 2.423 ======================= Grid point 128 (43/120) ======================= q-point: ( 0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( 17.533 0.000 15.252) 23.238 1.807 ( 22.787 0.000 15.021) 27.292 2.706 ( 0.548 0.000 5.304) 5.332 2.778 ( 11.231 0.000 -1.329) 11.309 2.960 ( -2.975 0.000 5.513) 6.264 3.133 ( 6.731 0.000 7.859) 10.347 3.263 ( -9.783 0.000 -9.145) 13.392 3.321 ( 4.499 0.000 -3.565) 5.740 3.381 ( -10.784 0.000 -9.102) 14.112 3.619 ( 8.512 0.000 -0.067) 8.512 3.821 ( -2.669 0.000 -9.903) 10.256 4.475 ( -13.182 0.000 -2.259) 13.374 4.721 ( 0.511 0.000 -2.559) 2.609 4.871 ( -2.433 0.000 4.637) 5.236 5.244 ( 6.778 0.000 -0.619) 6.806 5.264 ( -3.193 0.000 -0.992) 3.343 6.119 ( 8.249 0.000 14.709) 16.864 6.355 ( 17.896 0.000 16.735) 24.502 6.917 ( -1.845 0.000 -8.476) 8.674 7.267 ( -14.898 0.000 -5.828) 15.997 7.335 ( -7.631 0.000 -3.163) 8.261 7.441 ( 5.611 0.000 -2.794) 6.268 7.601 ( -13.712 0.000 1.100) 13.756 7.695 ( -2.937 0.000 -6.787) 7.395 8.104 ( -0.136 0.000 -9.708) 9.709 8.154 ( -10.032 0.000 2.178) 10.266 8.614 ( -8.976 0.000 7.526) 11.713 8.780 ( 13.562 0.000 4.169) 14.189 8.928 ( -14.327 0.000 -3.682) 14.793 9.599 ( 1.762 0.000 -3.329) 3.766 9.602 ( -0.947 0.000 -9.253) 9.301 9.960 ( 4.695 0.000 -7.875) 9.168 10.405 ( 5.145 0.000 5.104) 7.247 10.738 ( -7.755 0.000 5.792) 9.680 10.806 ( 4.593 0.000 12.829) 13.627 10.944 ( -7.295 0.000 8.949) 11.546 11.547 ( 2.851 0.000 -9.208) 9.639 11.553 ( 9.923 0.000 4.926) 11.078 11.640 ( -5.804 0.000 11.659) 13.024 12.114 ( 16.046 0.000 -7.385) 17.664 12.753 ( 21.741 0.000 -4.202) 22.143 12.882 ( 11.345 0.000 7.542) 13.623 13.257 ( 27.622 0.000 21.067) 34.739 13.497 ( 7.644 0.000 -6.289) 9.898 13.860 ( -6.088 0.000 -15.584) 16.731 14.486 ( -7.168 0.000 -20.501) 21.718 14.571 ( 0.475 0.000 -1.077) 1.177 14.680 ( -19.069 0.000 -21.418) 28.677 15.828 ( -0.964 0.000 -2.488) 2.668 15.875 ( -2.226 0.000 9.170) 9.436 16.501 ( -1.046 0.000 -3.982) 4.117 16.631 ( 2.739 0.000 -1.456) 3.101 16.814 ( -0.340 0.000 15.563) 15.566 16.822 ( 8.280 0.000 2.392) 8.619 16.861 ( -0.042 0.000 -2.123) 2.123 17.295 ( -4.277 0.000 0.683) 4.331 18.865 ( 3.735 0.000 9.049) 9.789 18.926 ( -1.458 0.000 -2.378) 2.789 18.990 ( -4.122 0.000 -6.402) 7.615 19.521 ( -4.468 0.000 -1.544) 4.728 ======================= Grid point 129 (44/120) ======================= q-point: ( 0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.950 ( 17.794 0.000 9.161) 20.014 2.237 ( 18.566 0.000 6.913) 19.811 2.681 ( -2.983 0.000 1.650) 3.409 2.776 ( -7.380 0.000 -2.936) 7.943 2.983 ( 4.104 0.000 -12.271) 12.939 3.059 ( -9.216 0.000 -3.653) 9.914 3.123 ( -1.893 0.000 3.314) 3.817 3.204 ( -6.113 0.000 -4.878) 7.821 3.473 ( 1.341 0.000 -1.627) 2.109 3.733 ( -4.469 0.000 -10.704) 11.599 3.951 ( 19.101 0.000 12.744) 22.962 4.250 ( -6.974 0.000 3.009) 7.596 4.719 ( -0.761 0.000 -1.003) 1.259 4.813 ( -3.414 0.000 3.949) 5.220 5.288 ( 7.413 0.000 -5.448) 9.199 5.473 ( 16.050 0.000 -8.898) 18.351 6.322 ( 10.418 0.000 10.470) 14.770 6.698 ( 11.107 0.000 6.612) 12.926 6.763 ( -10.975 0.000 -9.804) 14.716 6.885 ( -21.047 0.000 -6.278) 21.963 7.189 ( -4.774 0.000 2.246) 5.276 7.402 ( -9.894 0.000 -4.928) 11.053 7.413 ( -4.260 0.000 4.465) 6.171 7.737 ( 7.430 0.000 0.267) 7.434 7.936 ( -11.805 0.000 4.612) 12.674 8.152 ( 3.375 0.000 -9.126) 9.730 8.446 ( -7.940 0.000 7.544) 10.952 8.675 ( -10.223 0.000 -2.721) 10.579 9.051 ( 13.094 0.000 4.921) 13.989 9.588 ( -2.942 0.000 -0.906) 3.078 9.631 ( 4.043 0.000 -6.003) 7.238 10.011 ( 0.033 0.000 -3.263) 3.264 10.414 ( -2.909 0.000 5.522) 6.242 10.532 ( -10.872 0.000 3.327) 11.370 10.917 ( 6.453 0.000 12.755) 14.294 10.957 ( 6.757 0.000 5.674) 8.823 11.424 ( -9.570 0.000 14.332) 17.234 11.492 ( -6.868 0.000 -1.323) 6.994 11.901 ( 17.909 0.000 0.244) 17.910 12.420 ( 12.140 0.000 -7.790) 14.425 13.060 ( 14.340 0.000 -9.258) 17.069 13.239 ( 16.420 0.000 5.513) 17.321 13.550 ( -0.876 0.000 -6.689) 6.746 13.631 ( 4.907 0.000 -3.924) 6.283 14.064 ( 29.610 0.000 9.202) 31.007 14.182 ( -17.454 0.000 -5.182) 18.207 14.286 ( -19.857 0.000 -20.550) 28.577 14.796 ( 17.524 0.000 -9.104) 19.748 15.687 ( -13.344 0.000 2.303) 13.541 15.821 ( -5.085 0.000 1.784) 5.389 16.483 ( 0.964 0.000 1.909) 2.139 16.694 ( 3.564 0.000 0.507) 3.600 16.836 ( 0.738 0.000 8.833) 8.864 16.856 ( -0.677 0.000 -0.236) 0.717 16.942 ( 3.848 0.000 2.256) 4.460 17.164 ( -7.599 0.000 7.312) 10.546 18.897 ( -1.337 0.000 -5.187) 5.357 18.921 ( -2.651 0.000 -8.549) 8.950 18.966 ( 6.248 0.000 3.132) 6.989 19.411 ( -6.416 0.000 -2.315) 6.821 ======================= Grid point 130 (45/120) ======================= q-point: ( 0.44 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.294 ( 16.076 0.000 4.743) 16.761 2.498 ( 7.339 0.000 -0.954) 7.401 2.579 ( -12.075 0.000 1.425) 12.159 2.603 ( -4.429 0.000 -1.334) 4.626 2.986 ( 2.855 0.000 0.371) 2.879 3.051 ( 3.047 0.000 -10.968) 11.383 3.095 ( -5.807 0.000 -0.400) 5.821 3.104 ( -1.420 0.000 -8.242) 8.363 3.473 ( 1.883 0.000 -3.366) 3.857 3.585 ( -8.263 0.000 -7.673) 11.276 4.193 ( 4.206 0.000 11.258) 12.018 4.220 ( 1.495 0.000 9.665) 9.780 4.710 ( 0.395 0.000 1.817) 1.860 4.745 ( -2.951 0.000 3.345) 4.460 5.625 ( 25.355 0.000 -8.562) 26.762 5.865 ( 22.214 0.000 -15.099) 26.860 6.185 ( -26.203 0.000 -7.806) 27.341 6.332 ( -23.424 0.000 -18.741) 29.998 6.790 ( 14.087 0.000 6.099) 15.351 6.971 ( 9.432 0.000 9.685) 13.519 7.108 ( -4.865 0.000 5.753) 7.535 7.125 ( -16.555 0.000 1.689) 16.641 7.453 ( 8.268 0.000 6.166) 10.314 7.683 ( -12.949 0.000 6.485) 14.482 7.920 ( 9.964 0.000 -1.349) 10.055 8.115 ( -8.225 0.000 -4.903) 9.576 8.392 ( 3.871 0.000 2.331) 4.519 8.510 ( -6.874 0.000 -1.344) 7.004 9.295 ( 10.968 0.000 3.926) 11.650 9.482 ( -7.501 0.000 1.810) 7.716 9.760 ( 8.475 0.000 -1.777) 8.660 9.936 ( -7.544 0.000 0.195) 7.547 10.355 ( -1.394 0.000 2.359) 2.740 10.382 ( -3.957 0.000 1.585) 4.263 11.063 ( 8.026 0.000 12.992) 15.271 11.129 ( 9.441 0.000 5.258) 10.807 11.236 ( -9.085 0.000 13.583) 16.341 11.321 ( -9.426 0.000 3.391) 10.018 12.259 ( 16.559 0.000 -1.891) 16.667 12.501 ( -5.323 0.000 -4.760) 7.140 13.356 ( 13.721 0.000 -8.701) 16.248 13.461 ( 5.005 0.000 -0.174) 5.008 13.602 ( 9.350 0.000 -15.698) 18.272 13.683 ( 1.468 0.000 -2.553) 2.945 13.840 ( -15.135 0.000 -2.421) 15.328 13.897 ( -18.209 0.000 -18.867) 26.221 14.717 ( 32.219 0.000 11.326) 34.151 15.217 ( 22.325 0.000 -7.032) 23.406 15.299 ( -24.829 0.000 7.309) 25.882 15.614 ( -15.774 0.000 -4.718) 16.464 16.577 ( 8.075 0.000 5.772) 9.926 16.761 ( -8.423 0.000 5.694) 10.168 16.767 ( 3.512 0.000 1.424) 3.789 16.827 ( -2.278 0.000 1.136) 2.545 17.001 ( 2.589 0.000 5.611) 6.180 17.053 ( -3.121 0.000 9.129) 9.647 18.878 ( -0.384 0.000 -7.770) 7.780 18.884 ( -1.035 0.000 -8.589) 8.651 19.110 ( 7.784 0.000 -0.935) 7.840 19.268 ( -7.718 0.000 -2.464) 8.102 ======================= Grid point 135 (46/120) ======================= q-point: ( 0.00 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( 0.000 6.411 25.732) 26.518 1.285 ( 0.000 18.153 22.501) 28.911 2.394 ( 0.000 20.584 41.186) 46.043 2.639 ( 0.000 -3.742 2.935) 4.755 2.891 ( 0.000 2.946 -11.029) 11.416 3.117 ( 0.000 -8.532 -1.814) 8.723 3.216 ( 0.000 -11.613 -3.516) 12.133 3.442 ( 0.000 2.014 -8.844) 9.070 3.637 ( 0.000 5.166 -19.850) 20.511 3.644 ( 0.000 -0.428 -2.633) 2.668 3.844 ( 0.000 -3.814 -9.059) 9.829 4.680 ( 0.000 -9.556 -5.803) 11.180 4.851 ( 0.000 8.138 0.070) 8.138 5.124 ( 0.000 11.230 8.930) 14.348 5.210 ( 0.000 9.654 9.728) 13.706 5.427 ( 0.000 -4.757 1.560) 5.006 5.869 ( 0.000 -2.219 14.624) 14.791 5.895 ( 0.000 1.052 12.102) 12.148 6.927 ( 0.000 2.457 -6.719) 7.154 7.107 ( 0.000 -8.962 3.746) 9.714 7.466 ( 0.000 -7.807 -0.849) 7.853 7.487 ( 0.000 -2.564 -6.345) 6.843 7.813 ( 0.000 4.897 -13.460) 14.323 8.078 ( 0.000 4.443 12.656) 13.413 8.191 ( 0.000 -0.679 -16.940) 16.953 8.445 ( 0.000 1.683 -4.566) 4.866 8.491 ( 0.000 8.823 -8.524) 12.268 9.100 ( 0.000 -10.542 -7.230) 12.783 9.211 ( 0.000 -2.186 -5.133) 5.579 9.431 ( 0.000 -6.487 -3.436) 7.341 9.655 ( 0.000 1.380 -8.044) 8.162 9.675 ( 0.000 -0.828 -8.203) 8.244 10.123 ( 0.000 -1.546 3.679) 3.990 10.617 ( 0.000 -18.651 19.536) 27.010 10.796 ( 0.000 7.414 12.691) 14.698 11.031 ( 0.000 -4.744 11.735) 12.657 11.248 ( 0.000 2.196 9.070) 9.332 11.761 ( 0.000 26.269 -11.738) 28.772 11.763 ( 0.000 4.795 -1.758) 5.107 11.978 ( 0.000 -1.766 5.991) 6.246 12.229 ( 0.000 20.100 5.699) 20.892 12.509 ( 0.000 2.781 24.586) 24.743 12.795 ( 0.000 -2.688 5.562) 6.177 13.302 ( 0.000 1.966 -18.447) 18.551 14.022 ( 0.000 -4.508 -17.078) 17.663 14.401 ( 0.000 -1.306 -21.821) 21.860 14.759 ( 0.000 -5.267 -5.741) 7.791 15.254 ( 0.000 0.933 -18.170) 18.194 15.686 ( 0.000 3.571 -3.944) 5.320 15.989 ( 0.000 -10.683 8.775) 13.825 16.231 ( 0.000 -17.375 0.617) 17.386 16.418 ( 0.000 -4.977 -7.220) 8.769 16.490 ( 0.000 -3.253 -5.412) 6.314 16.886 ( 0.000 0.985 2.671) 2.847 16.993 ( 0.000 0.722 16.710) 16.726 17.213 ( 0.000 -6.463 0.288) 6.470 18.803 ( 0.000 1.089 14.537) 14.577 19.090 ( 0.000 11.496 0.722) 11.518 19.102 ( 0.000 -2.069 0.894) 2.254 19.628 ( 0.000 1.405 -0.679) 1.560 ======================= Grid point 136 (47/120) ======================= q-point: ( 0.11 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.379 ( 13.731 5.692 21.844) 26.421 1.432 ( 12.722 12.298 20.338) 26.958 2.569 ( 13.142 12.193 23.922) 29.894 2.659 ( 3.057 0.219 9.750) 10.220 2.925 ( 4.527 1.319 -7.801) 9.115 3.059 ( -4.781 -6.020 -2.492) 8.082 3.187 ( -2.962 -11.663 -4.028) 12.689 3.467 ( 0.502 0.536 -6.901) 6.940 3.576 ( -4.663 1.326 -12.300) 13.221 3.594 ( -3.804 5.580 -5.851) 8.936 3.838 ( -1.063 -2.896 -9.737) 10.214 4.587 ( -8.624 -9.159 -5.209) 13.616 4.807 ( -2.802 6.462 1.007) 7.115 5.076 ( -2.440 12.629 6.228) 14.291 5.251 ( 1.038 5.883 6.901) 9.127 5.356 ( -3.887 1.844 0.646) 4.350 5.929 ( 5.676 -2.899 14.775) 16.091 6.052 ( 13.404 0.752 14.371) 19.666 6.942 ( 1.231 2.449 -6.392) 6.955 7.184 ( 6.389 -8.980 1.429) 11.113 7.405 ( -6.204 -8.288 1.125) 10.414 7.483 ( -0.584 -0.188 -6.949) 6.976 7.735 ( -7.241 1.924 -12.907) 14.924 7.957 ( -9.758 5.844 4.637) 12.283 8.141 ( -3.975 -1.529 -13.669) 14.317 8.353 ( -8.183 1.292 -2.493) 8.652 8.625 ( 9.524 6.483 -0.677) 11.541 8.783 ( -14.093 -3.932 2.839) 14.904 9.164 ( -10.899 -4.374 -4.330) 12.517 9.490 ( 2.812 -2.779 -5.226) 6.553 9.695 ( 2.033 3.039 -8.324) 9.091 9.803 ( 9.735 -1.144 -11.605) 15.191 10.208 ( 7.275 -3.301 4.358) 9.100 10.738 ( 5.959 -10.891 13.645) 18.448 10.821 ( 0.414 2.394 14.704) 14.903 10.980 ( 1.677 -10.854 3.491) 11.524 11.156 ( -7.613 3.683 9.298) 12.569 11.818 ( 4.302 18.777 -4.645) 19.815 11.868 ( 7.776 10.301 -5.038) 13.855 12.043 ( -5.026 14.693 5.595) 16.506 12.257 ( 19.428 -0.332 4.933) 20.048 12.698 ( 6.732 -4.771 10.209) 13.127 12.861 ( 13.901 6.896 15.361) 21.835 13.353 ( 4.626 0.279 -12.585) 13.411 13.979 ( -4.347 -2.475 -17.149) 17.863 14.401 ( 0.298 -4.110 -21.703) 22.091 14.696 ( -6.292 -4.349 -3.853) 8.564 15.090 ( -13.411 4.584 -19.111) 23.793 15.766 ( 4.900 -0.131 1.167) 5.039 15.938 ( -2.163 -2.389 5.108) 6.039 16.303 ( 4.578 -20.020 -2.146) 20.648 16.467 ( 3.556 -8.611 -9.712) 13.458 16.506 ( 1.648 -4.714 -0.928) 5.079 16.901 ( -4.262 0.922 9.474) 10.429 16.911 ( 0.129 1.668 11.679) 11.798 17.252 ( 1.543 -6.781 -1.056) 7.034 18.815 ( 1.255 1.032 12.370) 12.476 19.076 ( -2.084 0.447 -1.448) 2.577 19.083 ( -0.766 10.819 0.557) 10.860 19.606 ( -2.140 1.541 -0.942) 2.800 ======================= Grid point 137 (48/120) ======================= q-point: ( 0.22 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.689 ( 15.469 9.289 14.072) 22.882 1.777 ( 20.738 -1.292 16.205) 26.350 2.647 ( -0.192 -5.479 2.606) 6.071 2.807 ( 4.794 0.962 -5.861) 7.633 2.935 ( -7.687 -3.834 -2.100) 8.843 3.021 ( -1.009 -7.680 2.827) 8.246 3.248 ( 7.561 -2.250 0.235) 7.892 3.391 ( -1.642 5.367 0.931) 5.689 3.448 ( -5.249 5.920 -8.842) 11.865 3.634 ( 6.257 2.713 -0.862) 6.874 3.789 ( -3.389 -2.846 -8.000) 9.143 4.362 ( -12.892 -8.600 -3.275) 15.839 4.789 ( 0.827 6.062 -2.024) 6.445 5.054 ( 0.413 15.031 5.809) 16.120 5.227 ( -1.221 -1.428 -0.172) 1.887 5.357 ( 3.788 10.293 -2.299) 11.206 6.090 ( 10.310 -1.022 14.388) 17.730 6.369 ( 17.048 0.295 15.367) 22.954 6.956 ( -0.886 3.430 -7.716) 8.490 7.177 ( -13.458 -8.651 -3.975) 16.485 7.324 ( 1.741 -4.615 -0.586) 4.967 7.434 ( -6.285 3.328 -4.348) 8.335 7.561 ( -6.222 -3.730 -7.160) 10.193 7.776 ( -7.060 6.360 0.003) 9.502 8.065 ( -2.392 -3.291 -7.735) 8.740 8.171 ( -8.968 0.712 0.788) 9.030 8.545 ( -8.479 -5.960 5.956) 11.954 8.798 ( -3.793 -2.678 -2.181) 5.130 8.973 ( 1.636 8.056 2.606) 8.624 9.526 ( 1.448 -1.375 -5.183) 5.555 9.736 ( 1.428 7.106 -6.579) 9.789 9.943 ( 4.454 -1.305 -7.262) 8.618 10.357 ( 5.581 -4.539 6.021) 9.381 10.687 ( -9.346 -3.993 8.043) 12.961 10.803 ( 1.081 -3.412 7.716) 8.506 11.029 ( -2.241 9.679 9.747) 13.918 11.182 ( 10.939 -17.080 1.115) 20.314 11.755 ( -9.290 12.600 14.066) 21.045 11.944 ( 3.814 19.159 -7.200) 20.820 12.204 ( 15.632 8.645 -8.185) 19.649 12.726 ( 21.784 -2.894 -4.012) 22.339 12.814 ( 10.376 -6.658 6.330) 13.859 13.304 ( 25.142 4.799 20.079) 32.532 13.471 ( 6.862 -1.945 -5.245) 8.854 13.864 ( -5.569 0.193 -15.346) 16.326 14.401 ( -2.756 -8.303 -21.925) 23.606 14.526 ( -8.749 -2.360 -0.185) 9.064 14.814 ( -11.066 10.477 -17.590) 23.273 15.816 ( -0.099 0.128 5.447) 5.449 15.928 ( -0.617 3.477 -0.032) 3.531 16.377 ( 3.057 -21.738 -2.543) 22.099 16.496 ( -0.545 -2.869 -6.730) 7.337 16.559 ( 2.552 -15.990 1.244) 16.240 16.812 ( -1.967 -0.994 14.222) 14.392 16.957 ( 2.209 1.695 4.472) 5.268 17.229 ( -3.970 -6.886 1.214) 8.041 18.858 ( 3.197 1.159 6.313) 7.170 19.032 ( -1.895 3.337 -4.780) 6.130 19.064 ( -1.015 11.437 -0.766) 11.508 19.542 ( -4.259 1.900 -1.625) 4.938 ======================= Grid point 138 (49/120) ======================= q-point: ( 0.33 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( 15.036 4.961 8.897) 18.162 2.186 ( 18.529 -4.713 8.969) 21.118 2.619 ( -2.393 -5.240 0.944) 5.837 2.744 ( -10.045 -6.591 -1.404) 12.096 2.864 ( 1.327 -2.245 -10.539) 10.857 2.997 ( -1.572 -8.688 -5.004) 10.149 3.173 ( -4.509 2.064 -4.831) 6.923 3.293 ( -5.592 6.060 -0.240) 8.249 3.500 ( -0.988 2.605 -2.831) 3.972 3.715 ( -4.434 -2.631 -7.280) 8.921 3.872 ( 12.071 -5.334 9.372) 16.186 4.128 ( -8.252 -8.656 1.599) 12.065 4.836 ( 4.740 10.567 -0.226) 11.583 5.061 ( -0.980 21.206 5.404) 21.905 5.292 ( 9.562 0.507 -7.089) 11.914 5.527 ( 13.761 6.110 -8.604) 17.341 6.334 ( 12.667 2.076 10.498) 16.582 6.677 ( 9.082 -2.501 7.756) 12.202 6.765 ( -19.391 -3.195 -12.457) 23.268 6.889 ( -11.311 3.531 -6.086) 13.321 7.214 ( -6.530 2.523 2.879) 7.569 7.306 ( -5.184 -1.995 0.270) 5.562 7.565 ( -0.266 2.988 -2.249) 3.749 7.689 ( 0.488 0.534 3.174) 3.256 7.980 ( -7.962 2.026 4.739) 9.485 8.097 ( 3.198 -5.019 -7.823) 9.830 8.372 ( -9.149 -6.599 6.277) 12.909 8.584 ( -10.711 -8.370 -2.260) 13.780 9.167 ( 11.537 10.551 5.342) 16.521 9.563 ( 1.836 0.367 -1.378) 2.324 9.743 ( -0.148 8.268 -4.867) 9.595 9.995 ( 0.465 -1.558 -2.641) 3.101 10.382 ( -2.592 -3.062 5.528) 6.830 10.477 ( -9.838 -4.271 3.600) 11.313 10.879 ( 6.739 -6.674 4.352) 10.435 11.068 ( 4.726 12.292 11.568) 17.529 11.298 ( 0.021 -13.625 1.758) 13.738 11.563 ( -9.472 13.205 13.568) 21.170 12.080 ( 10.901 13.932 -2.434) 17.857 12.502 ( 11.607 7.832 -9.154) 16.729 13.015 ( 13.673 -5.219 -6.952) 16.202 13.134 ( 13.056 -9.310 0.390) 16.040 13.558 ( -1.413 -3.189 0.782) 3.575 13.645 ( 7.427 4.801 -5.059) 10.189 13.930 ( 6.160 -9.225 -1.459) 11.188 14.287 ( 0.926 6.899 1.157) 7.056 14.331 ( -8.718 3.266 -18.700) 20.889 14.841 ( 13.951 4.958 -7.438) 16.569 15.711 ( -12.032 2.900 3.686) 12.913 15.868 ( -5.864 3.948 -1.507) 7.228 16.440 ( 2.717 -19.901 0.986) 20.109 16.488 ( 1.842 -4.388 0.536) 4.789 16.586 ( 0.241 -19.538 2.136) 19.656 16.810 ( 0.362 -3.391 6.754) 7.566 16.982 ( 0.085 -0.835 3.593) 3.689 17.109 ( -7.031 -6.019 7.581) 11.964 18.934 ( 3.527 3.205 -2.895) 5.576 19.009 ( -0.505 7.466 -6.007) 9.596 19.055 ( 1.074 8.930 -0.831) 9.033 19.436 ( -6.213 2.339 -2.383) 7.053 ======================= Grid point 139 (50/120) ======================= q-point: ( 0.44 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( 12.107 -1.375 3.872) 12.785 2.450 ( 1.603 -4.232 -0.976) 4.629 2.538 ( -1.211 -5.730 4.934) 7.658 2.607 ( -2.797 -0.087 0.130) 2.801 2.887 ( 0.923 -4.863 -8.248) 9.620 2.925 ( -3.706 -8.437 -6.409) 11.225 3.162 ( 1.311 4.469 -4.493) 6.471 3.201 ( -3.346 4.071 -2.154) 5.692 3.481 ( 1.522 0.467 -3.273) 3.639 3.582 ( -7.490 -0.964 -5.552) 9.373 3.985 ( 2.650 -14.281 7.550) 16.370 4.045 ( -2.837 -12.651 7.534) 14.995 4.951 ( 4.860 18.852 1.855) 19.556 5.021 ( -2.593 22.158 3.518) 22.585 5.644 ( 24.726 2.089 -9.814) 26.684 5.897 ( 22.144 3.505 -14.216) 26.547 6.188 ( -26.305 0.260 -10.230) 28.226 6.378 ( -24.193 4.346 -17.143) 29.968 6.725 ( 14.256 -4.225 7.433) 16.623 6.937 ( -0.215 -3.915 5.212) 6.522 7.122 ( -1.205 5.016 8.222) 9.706 7.206 ( -5.179 4.530 4.972) 8.489 7.554 ( 3.281 8.154 4.675) 9.955 7.682 ( -6.225 0.150 3.960) 7.380 7.925 ( 5.445 -0.154 2.931) 6.186 8.090 ( -7.834 -2.739 -3.204) 8.896 8.281 ( 3.894 -10.784 1.695) 11.590 8.408 ( -7.434 -9.620 -1.557) 12.257 9.385 ( 9.725 8.471 4.762) 13.748 9.540 ( -5.038 5.326 3.101) 7.960 9.792 ( 5.887 3.478 -2.571) 7.305 9.935 ( -6.499 -0.184 0.336) 6.510 10.318 ( -1.245 -3.159 1.225) 3.610 10.349 ( -3.606 -2.723 1.388) 4.727 11.037 ( 8.147 -8.696 5.032) 12.935 11.158 ( -0.017 -1.350 9.225) 9.323 11.252 ( 0.582 4.649 7.268) 8.648 11.379 ( -8.585 13.931 12.629) 20.670 12.351 ( 14.241 8.627 -3.129) 16.942 12.572 ( -5.416 6.965 -6.237) 10.805 13.321 ( 16.693 -6.842 -3.707) 18.418 13.334 ( 8.612 -10.573 -6.974) 15.316 13.479 ( -5.298 -8.534 -6.229) 11.819 13.652 ( -13.042 -7.008 0.805) 14.828 13.871 ( 4.117 8.751 -13.875) 16.913 14.050 ( -11.980 11.153 -16.478) 23.226 14.779 ( 30.031 5.754 10.710) 32.399 15.232 ( 20.205 1.278 -5.811) 21.063 15.343 ( -21.998 4.490 6.983) 23.512 15.646 ( -16.537 2.833 -5.408) 17.628 16.497 ( 3.473 -18.084 4.737) 19.014 16.552 ( -0.622 -19.277 2.008) 19.391 16.605 ( 5.619 -8.246 4.761) 11.056 16.753 ( -6.768 -3.043 3.499) 8.204 16.976 ( 0.449 -4.099 5.456) 6.838 17.008 ( -2.662 -4.670 8.433) 10.000 18.974 ( 1.025 8.282 -7.909) 11.498 18.994 ( -1.016 10.021 -6.920) 12.220 19.146 ( 6.992 3.558 -1.129) 7.926 19.296 ( -7.524 2.737 -2.532) 8.397 ======================= Grid point 144 (51/120) ======================= q-point: ( 0.00 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 0.000 15.898 15.879) 22.469 1.706 ( 0.000 24.276 14.865) 28.465 2.490 ( 0.000 -11.358 -1.040) 11.406 2.766 ( 0.000 12.258 19.563) 23.086 2.901 ( 0.000 -5.127 -6.642) 8.390 2.978 ( 0.000 -11.305 1.940) 11.470 3.076 ( 0.000 8.035 -3.331) 8.698 3.468 ( 0.000 -0.688 -8.885) 8.911 3.674 ( 0.000 8.036 -6.243) 10.176 3.715 ( 0.000 2.416 -17.641) 17.805 3.739 ( 0.000 -7.835 -2.386) 8.190 4.461 ( 0.000 -13.233 -6.349) 14.677 4.972 ( 0.000 5.790 4.272) 7.195 5.315 ( 0.000 6.197 16.882) 17.984 5.387 ( 0.000 4.547 9.045) 10.124 5.526 ( 0.000 17.726 -0.423) 17.731 5.788 ( 0.000 -6.157 14.930) 16.149 5.965 ( 0.000 6.890 4.203) 8.071 6.849 ( 0.000 -13.139 4.421) 13.863 7.029 ( 0.000 4.531 -8.464) 9.600 7.227 ( 0.000 -16.124 4.167) 16.654 7.404 ( 0.000 -5.844 -13.340) 14.564 7.936 ( 0.000 6.657 -10.606) 12.522 8.144 ( 0.000 0.020 -5.232) 5.232 8.212 ( 0.000 4.662 2.249) 5.176 8.516 ( 0.000 6.512 -5.086) 8.263 8.572 ( 0.000 -2.860 -1.308) 3.145 8.977 ( 0.000 0.139 -11.758) 11.759 9.163 ( 0.000 -2.576 -6.100) 6.622 9.247 ( 0.000 -12.307 -2.280) 12.517 9.660 ( 0.000 -0.686 -10.297) 10.319 9.665 ( 0.000 -0.381 -10.127) 10.134 10.097 ( 0.000 -0.779 8.918) 8.952 10.336 ( 0.000 -10.807 21.272) 23.860 10.910 ( 0.000 3.191 13.649) 14.017 10.963 ( 0.000 -2.548 14.598) 14.819 11.360 ( 0.000 10.073 7.526) 12.574 11.882 ( 0.000 7.387 -4.231) 8.513 11.896 ( 0.000 -4.645 6.210) 7.755 12.198 ( 0.000 15.357 -13.641) 20.541 12.508 ( 0.000 1.474 0.461) 1.545 12.575 ( 0.000 3.643 20.431) 20.753 12.932 ( 0.000 25.273 9.287) 26.926 13.366 ( 0.000 4.914 -19.351) 19.965 13.883 ( 0.000 -9.713 -16.890) 19.483 14.360 ( 0.000 -3.497 -18.823) 19.145 14.658 ( 0.000 -4.481 -1.839) 4.844 15.133 ( 0.000 -17.630 -1.481) 17.692 15.732 ( 0.000 0.424 7.684) 7.696 15.895 ( 0.000 2.519 -11.983) 12.245 15.921 ( 0.000 -9.386 -13.508) 16.449 16.293 ( 0.000 -7.780 -1.334) 7.893 16.456 ( 0.000 -0.062 -10.048) 10.049 16.878 ( 0.000 -3.099 0.535) 3.145 16.993 ( 0.000 -0.539 17.830) 17.838 17.053 ( 0.000 -8.435 6.136) 10.431 18.844 ( 0.000 3.065 12.819) 13.180 19.052 ( 0.000 -3.115 4.613) 5.566 19.328 ( 0.000 12.283 0.182) 12.284 19.650 ( 0.000 0.529 -0.785) 0.947 ======================= Grid point 145 (52/120) ======================= q-point: ( 0.11 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( 8.188 12.364 15.666) 21.572 1.782 ( 6.786 21.058 14.136) 26.255 2.491 ( 0.353 -10.724 0.000) 10.730 2.839 ( -0.042 2.522 1.003) 2.714 2.856 ( -1.064 -7.688 -1.264) 7.864 2.992 ( 1.871 -3.129 6.315) 7.292 3.061 ( -0.020 2.174 -3.102) 3.789 3.475 ( 1.378 3.780 -5.652) 6.938 3.610 ( -6.190 -0.914 -8.057) 10.201 3.687 ( 0.678 4.961 -4.916) 7.017 3.791 ( 1.580 0.223 -11.170) 11.283 4.389 ( -6.850 -11.490 -5.845) 14.598 4.936 ( -2.893 7.486 5.216) 9.572 5.238 ( -2.569 -0.418 6.473) 6.977 5.353 ( -4.742 12.547 6.662) 14.977 5.582 ( 4.886 14.809 6.170) 16.771 5.910 ( 9.557 1.082 13.768) 16.795 6.059 ( 9.711 1.151 7.725) 12.461 6.905 ( 4.414 -10.766 1.964) 11.800 7.069 ( 3.606 2.013 -6.388) 7.607 7.179 ( -4.494 -14.474 2.759) 15.405 7.417 ( 1.166 -5.422 -12.077) 13.289 7.832 ( -9.416 6.320 -9.700) 14.923 8.073 ( -10.418 4.866 0.733) 11.522 8.102 ( -4.160 -1.390 -6.448) 7.798 8.375 ( -12.143 -0.107 -2.983) 12.504 8.568 ( -3.672 -4.764 1.922) 6.314 8.887 ( -3.806 5.141 -5.643) 8.530 9.070 ( -1.851 -1.894 -1.940) 3.282 9.451 ( 7.369 -1.949 -5.248) 9.254 9.715 ( 4.277 -0.723 -8.844) 9.850 9.788 ( 11.585 -0.307 -12.256) 16.868 10.144 ( 3.945 -2.638 9.361) 10.495 10.463 ( 11.327 -13.506 15.817) 23.683 10.845 ( -7.700 -1.261 12.690) 14.897 10.877 ( -5.076 -2.677 9.852) 11.401 11.340 ( -0.692 14.887 6.957) 16.447 11.971 ( 9.231 5.568 -2.253) 11.013 12.122 ( 14.091 -0.845 5.585) 15.181 12.249 ( 5.558 14.285 -10.575) 18.622 12.404 ( -3.850 10.937 2.781) 11.924 12.581 ( 0.785 -5.231 8.741) 10.217 13.107 ( 14.544 20.286 13.732) 28.489 13.382 ( 1.919 3.324 -13.180) 13.728 13.885 ( -0.212 -7.978 -17.649) 19.370 14.288 ( -6.124 -7.201 -16.744) 19.228 14.615 ( -4.298 -3.506 -1.421) 5.726 15.105 ( -3.281 -8.063 -6.979) 11.157 15.709 ( 0.009 -4.740 4.892) 6.811 15.861 ( 0.282 -6.008 -5.196) 7.948 16.042 ( 5.310 -1.447 -14.414) 15.429 16.269 ( -1.730 -10.313 -0.900) 10.496 16.467 ( 0.942 0.077 -7.635) 7.693 16.890 ( -1.584 -2.718 2.327) 3.913 16.922 ( -2.132 0.009 17.694) 17.822 17.083 ( 0.448 -9.619 4.201) 10.505 18.858 ( 1.479 3.288 10.695) 11.286 19.056 ( 0.504 -1.980 2.431) 3.175 19.321 ( -0.750 12.208 -0.247) 12.234 19.632 ( -1.800 0.749 -1.055) 2.217 ======================= Grid point 146 (53/120) ======================= q-point: ( 0.22 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( 14.969 4.065 13.028) 20.257 1.948 ( 9.176 14.735 11.856) 21.021 2.503 ( 0.768 -9.771 1.813) 9.967 2.718 ( -7.599 -6.980 -4.028) 11.076 2.863 ( -0.821 -7.562 -7.381) 10.599 2.965 ( -3.208 5.437 -3.067) 7.018 3.100 ( 0.443 -12.165 0.716) 12.195 3.464 ( -7.282 -3.414 -2.742) 8.497 3.574 ( 6.013 9.132 -2.669) 11.255 3.717 ( 0.189 0.788 -5.474) 5.534 3.778 ( -0.397 6.834 -4.434) 8.156 4.204 ( -10.844 -7.663 -4.121) 13.903 4.922 ( 2.597 7.448 0.665) 7.916 5.183 ( -1.120 -1.877 0.167) 2.192 5.369 ( 6.189 16.665 5.876) 18.723 5.652 ( 2.329 19.159 1.451) 19.355 6.130 ( 12.314 4.922 13.040) 18.598 6.330 ( 15.735 -4.939 11.752) 20.250 6.975 ( -8.175 -11.499 -1.887) 14.234 6.993 ( -1.048 -2.947 -3.258) 4.517 7.210 ( 6.357 -3.250 -2.899) 7.706 7.442 ( 1.009 -4.066 -7.797) 8.851 7.583 ( -15.240 6.658 -7.699) 18.327 7.880 ( -7.317 3.665 -1.578) 8.334 8.000 ( -5.007 -3.126 -1.841) 6.183 8.146 ( -9.232 -3.441 -1.273) 9.935 8.448 ( -7.836 -3.127 3.078) 8.981 8.680 ( -14.026 -7.881 -1.990) 16.211 9.187 ( 9.469 11.994 3.616) 15.703 9.548 ( 3.740 2.836 -3.841) 6.065 9.808 ( 4.463 0.111 -5.639) 7.192 9.976 ( 5.021 6.182 -5.953) 9.943 10.244 ( 5.647 -7.143 7.239) 11.632 10.599 ( -6.517 -5.983 9.873) 13.257 10.706 ( -1.260 -5.480 5.712) 8.015 10.839 ( 4.706 -13.824 4.515) 15.285 11.364 ( 3.060 20.178 7.037) 21.588 12.033 ( -5.117 14.979 9.535) 18.478 12.271 ( 2.592 13.704 -7.855) 16.007 12.365 ( 11.076 4.052 -1.646) 11.909 12.646 ( 19.218 -4.497 -3.724) 20.085 12.682 ( 9.511 -4.126 -0.607) 10.385 13.424 ( 11.852 6.383 15.516) 20.541 13.470 ( 10.394 4.207 -3.946) 11.887 13.854 ( -3.262 -1.631 -15.073) 15.508 14.186 ( -1.392 -13.870 -15.329) 20.719 14.502 ( -5.787 0.640 0.255) 5.828 15.011 ( -4.798 7.911 -11.859) 15.042 15.764 ( 4.687 -17.409 5.849) 18.954 15.887 ( 1.506 -1.395 -1.187) 2.371 16.038 ( -5.520 -7.393 -14.179) 16.917 16.266 ( 0.520 -9.298 0.057) 9.313 16.483 ( 0.444 -0.125 -2.679) 2.719 16.796 ( -4.674 0.007 14.382) 15.122 16.935 ( 0.302 -3.733 4.708) 6.015 17.050 ( -3.701 -11.023 4.057) 12.315 18.911 ( 3.962 3.955 5.238) 7.667 19.076 ( 1.518 0.776 -1.538) 2.296 19.299 ( -1.438 11.872 -1.431) 12.044 19.577 ( -3.695 1.346 -1.756) 4.307 ======================= Grid point 147 (54/120) ======================= q-point: ( 0.33 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( 15.502 -2.668 7.911) 17.607 2.124 ( 7.780 5.939 8.336) 12.856 2.526 ( -0.350 -4.063 2.703) 4.893 2.560 ( -5.786 -9.471 -1.750) 11.236 2.819 ( -3.339 -8.058 -9.304) 12.753 2.914 ( -1.692 4.709 -6.360) 8.092 3.110 ( 1.957 -8.429 -0.286) 8.658 3.327 ( -6.096 -3.279 -2.336) 7.306 3.585 ( -4.156 5.477 -3.134) 7.556 3.637 ( -4.679 -3.898 -2.984) 6.782 3.819 ( -1.468 -0.446 1.107) 1.892 4.001 ( -8.139 -4.457 -1.087) 9.343 5.056 ( 11.214 10.636 -1.412) 15.520 5.282 ( 9.723 -0.005 -9.250) 13.420 5.521 ( 7.070 24.153 7.201) 26.177 5.727 ( 7.607 15.032 -6.887) 18.201 6.401 ( 14.190 2.444 12.538) 19.093 6.606 ( 1.822 -3.313 3.478) 5.137 6.652 ( -12.155 -7.129 -7.236) 15.841 6.986 ( -6.562 3.675 -10.292) 12.747 7.277 ( -6.892 3.671 4.686) 9.107 7.306 ( -1.756 2.023 0.792) 2.793 7.480 ( 4.056 -6.465 -2.628) 8.072 7.799 ( -1.708 5.316 2.296) 6.038 7.938 ( -1.348 -5.675 -0.290) 5.841 8.007 ( -4.031 -4.943 -0.785) 6.426 8.242 ( -12.852 -6.067 3.064) 14.539 8.411 ( -11.557 -8.155 1.077) 14.185 9.382 ( 9.623 10.367 5.755) 15.270 9.619 ( 3.272 5.039 -0.384) 6.020 9.877 ( 1.952 3.156 -1.974) 4.204 9.996 ( -2.035 4.730 0.256) 5.156 10.315 ( 0.075 -3.640 3.622) 5.136 10.408 ( -8.441 -2.450 3.074) 9.311 10.723 ( 3.553 -8.809 2.899) 9.931 10.950 ( 2.764 -16.842 2.833) 17.301 11.454 ( 5.697 22.040 8.766) 24.394 11.893 ( -7.667 20.168 11.835) 24.609 12.347 ( 7.029 13.311 -3.779) 15.520 12.635 ( 13.040 -0.239 -7.202) 14.899 12.865 ( 5.955 -6.291 0.044) 8.663 12.950 ( 11.784 -8.849 -12.535) 19.346 13.460 ( -5.914 -5.871 8.724) 12.064 13.743 ( -8.619 -5.110 -7.460) 12.492 13.791 ( 16.920 4.655 -9.198) 19.814 14.335 ( 12.243 -3.964 -12.015) 17.605 14.452 ( 5.211 11.503 3.681) 13.154 14.991 ( 5.332 10.492 -5.961) 13.193 15.794 ( -11.952 3.832 1.239) 12.612 15.860 ( 1.092 -20.071 -0.040) 20.101 15.938 ( -1.903 -14.689 -6.534) 16.189 16.226 ( -4.615 -11.952 3.350) 13.243 16.488 ( 0.873 0.425 3.257) 3.399 16.739 ( -0.952 -3.291 8.713) 9.363 16.910 ( -3.251 -6.754 1.508) 7.645 16.955 ( -4.439 -8.529 8.747) 12.999 19.017 ( 6.274 4.967 -0.915) 8.054 19.118 ( 2.795 3.847 -3.866) 6.128 19.264 ( -1.997 10.926 -2.970) 11.497 19.484 ( -5.610 2.161 -2.559) 6.534 ======================= Grid point 148 (55/120) ======================= q-point: ( 0.44 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( 5.852 -0.967 2.661) 6.501 2.368 ( 6.599 -4.581 0.100) 8.033 2.391 ( -2.254 -6.922 3.630) 8.134 2.546 ( -4.074 -6.786 4.116) 8.921 2.794 ( 2.711 -2.406 -8.693) 9.419 2.874 ( -3.139 2.004 -6.537) 7.524 3.174 ( 3.364 -4.651 -0.353) 5.752 3.230 ( -3.274 -2.366 -1.633) 4.357 3.508 ( -2.105 3.763 -1.426) 4.541 3.536 ( -4.628 -2.633 -1.186) 5.455 3.772 ( 0.441 -7.717 1.919) 7.964 3.857 ( -6.710 -6.611 1.602) 9.555 5.305 ( 10.429 16.340 -2.658) 19.565 5.418 ( -0.043 16.299 -2.722) 16.525 5.715 ( 16.639 5.914 -10.432) 20.510 5.992 ( 11.935 4.811 -10.254) 16.454 6.204 ( -15.380 3.545 -11.484) 19.519 6.489 ( -20.682 7.430 -11.919) 25.000 6.694 ( 13.178 1.420 8.389) 15.686 6.880 ( -3.901 -2.113 2.808) 5.251 7.226 ( 2.011 5.183 10.226) 11.639 7.288 ( -2.043 4.051 4.477) 6.374 7.611 ( 8.333 -4.273 0.608) 9.384 7.757 ( -4.079 7.619 5.664) 10.333 7.886 ( -1.211 -3.500 5.479) 6.613 7.977 ( -9.778 -12.968 5.597) 17.179 8.058 ( 5.656 -7.693 -4.733) 10.657 8.212 ( -8.780 -9.025 -0.526) 12.602 9.565 ( 8.074 8.962 7.065) 13.979 9.660 ( -0.435 7.097 4.875) 8.621 9.883 ( -0.295 4.489 -0.781) 4.566 9.924 ( -4.181 -0.695 1.454) 4.481 10.278 ( -0.530 0.173 -0.906) 1.064 10.311 ( -2.925 0.044 -0.263) 2.937 10.829 ( 5.984 -12.437 3.109) 14.147 10.933 ( -3.744 -14.874 3.245) 15.678 11.585 ( 7.240 23.124 10.765) 26.514 11.737 ( -7.744 22.698 11.849) 26.750 12.546 ( 11.452 10.892 -5.058) 16.594 12.737 ( -5.154 9.130 -9.479) 14.134 13.006 ( 10.657 -20.205 4.298) 23.244 13.146 ( 4.077 -13.272 -9.831) 17.012 13.312 ( -2.595 -9.308 0.266) 9.666 13.499 ( -13.772 -8.976 -8.863) 18.676 14.104 ( 13.078 15.321 -12.843) 23.890 14.311 ( -7.346 16.317 -13.694) 22.533 14.891 ( 27.337 4.361 6.490) 28.434 15.253 ( 15.192 0.747 -3.262) 15.557 15.443 ( -18.230 3.944 4.040) 19.084 15.683 ( -16.930 -0.261 -5.746) 17.880 15.996 ( 5.204 -28.230 5.804) 29.286 16.110 ( -6.110 -21.573 5.610) 23.113 16.560 ( 6.165 -0.490 5.634) 8.366 16.693 ( -5.471 -2.663 4.606) 7.631 16.853 ( 0.164 -8.105 5.368) 9.723 16.892 ( -2.669 -6.961 5.421) 9.217 19.134 ( 4.474 7.529 -5.734) 10.469 19.183 ( 1.481 7.774 -5.117) 9.424 19.236 ( 1.863 6.044 -2.609) 6.842 19.356 ( -6.973 2.965 -2.825) 8.086 ======================= Grid point 153 (56/120) ======================= q-point: ( 0.00 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( 0.000 18.522 6.524) 19.637 2.065 ( 0.000 0.374 3.058) 3.080 2.324 ( 0.000 6.679 8.099) 10.498 2.653 ( 0.000 -17.136 2.069) 17.260 2.830 ( 0.000 -0.978 -7.529) 7.592 2.868 ( 0.000 -4.144 2.992) 5.111 3.288 ( 0.000 12.657 -1.810) 12.786 3.517 ( 0.000 -7.318 -2.726) 7.809 3.591 ( 0.000 4.472 -6.673) 8.033 3.709 ( 0.000 -3.441 -14.115) 14.528 3.903 ( 0.000 14.253 -6.521) 15.674 4.188 ( 0.000 -15.117 -6.333) 16.390 5.125 ( 0.000 10.256 11.291) 15.253 5.306 ( 0.000 -6.625 18.091) 19.265 5.498 ( 0.000 7.044 13.151) 14.919 5.645 ( 0.000 -8.200 14.510) 16.666 5.880 ( 0.000 17.336 -1.186) 17.376 6.084 ( 0.000 -0.292 0.248) 0.383 6.672 ( 0.000 0.242 4.838) 4.844 6.891 ( 0.000 -17.779 4.600) 18.365 7.143 ( 0.000 6.870 -11.253) 13.184 7.279 ( 0.000 -7.105 -12.806) 14.645 8.045 ( 0.000 4.664 -11.468) 12.381 8.114 ( 0.000 -2.626 -12.204) 12.483 8.318 ( 0.000 6.042 6.583) 8.935 8.448 ( 0.000 -7.626 3.405) 8.352 8.703 ( 0.000 12.785 -2.215) 12.976 8.968 ( 0.000 -12.883 -1.683) 12.993 9.057 ( 0.000 2.247 -10.731) 10.964 9.115 ( 0.000 -2.633 -8.321) 8.728 9.648 ( 0.000 -0.174 -11.995) 11.997 9.655 ( 0.000 -0.662 -12.150) 12.168 10.108 ( 0.000 2.218 15.046) 15.208 10.184 ( 0.000 -5.760 19.509) 20.341 10.930 ( 0.000 -0.050 14.831) 14.831 10.933 ( 0.000 -0.685 15.156) 15.172 11.587 ( 0.000 12.032 6.848) 13.844 11.778 ( 0.000 -7.934 6.410) 10.200 12.042 ( 0.000 9.599 -5.936) 11.286 12.234 ( 0.000 -8.915 -7.625) 11.731 12.565 ( 0.000 5.754 3.230) 6.598 12.620 ( 0.000 0.288 12.320) 12.324 13.491 ( 0.000 8.183 -20.232) 21.824 13.557 ( 0.000 31.885 -1.060) 31.902 13.692 ( 0.000 -5.953 -13.202) 14.482 14.178 ( 0.000 -20.895 -8.164) 22.433 14.605 ( 0.000 -0.536 -0.589) 0.796 14.717 ( 0.000 -16.450 3.985) 16.926 15.766 ( 0.000 3.779 -1.331) 4.007 15.842 ( 0.000 -3.039 -13.065) 13.414 16.003 ( 0.000 7.031 -11.918) 13.838 16.143 ( 0.000 -7.675 -5.763) 9.598 16.518 ( 0.000 7.305 -11.172) 13.349 16.716 ( 0.000 -11.890 -11.942) 16.851 16.976 ( 0.000 -0.649 19.298) 19.309 16.980 ( 0.000 -0.649 19.006) 19.017 18.912 ( 0.000 3.860 10.581) 11.263 18.986 ( 0.000 -3.764 7.827) 8.685 19.526 ( 0.000 8.072 -0.388) 8.081 19.630 ( 0.000 -3.021 -0.708) 3.103 ======================= Grid point 154 (57/120) ======================= q-point: ( 0.11 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.824 ( 2.955 16.751 6.977) 18.385 2.082 ( 1.472 -1.681 2.931) 3.686 2.342 ( 1.935 7.049 9.202) 11.752 2.643 ( -0.896 -15.407 2.919) 15.706 2.804 ( -2.437 -0.398 -8.330) 8.688 2.871 ( -0.350 -7.336 -0.135) 7.346 3.223 ( -5.297 11.932 -2.070) 13.218 3.454 ( -6.118 -11.413 -0.993) 12.987 3.640 ( 4.659 8.630 -9.473) 13.636 3.742 ( 1.772 -1.596 -13.398) 13.608 3.917 ( 1.110 11.660 -5.592) 12.979 4.157 ( -3.033 -12.765 -5.496) 14.225 5.099 ( -3.688 8.653 9.756) 13.552 5.213 ( -5.466 -2.943 9.303) 11.184 5.552 ( 2.121 8.534 13.193) 15.856 5.695 ( 11.035 -4.642 16.834) 20.657 6.020 ( 9.512 10.380 3.817) 14.587 6.124 ( 3.597 2.328 0.083) 4.285 6.721 ( 4.362 -3.062 4.132) 6.743 6.871 ( -2.071 -15.255 3.819) 15.861 7.174 ( 2.995 6.425 -10.689) 12.825 7.300 ( 2.118 -6.592 -11.929) 13.793 7.941 ( -9.021 5.056 -9.665) 14.154 8.028 ( -7.855 -4.076 -11.020) 14.134 8.197 ( -9.307 5.783 4.017) 11.671 8.306 ( -12.125 -5.711 0.175) 13.404 8.606 ( -6.694 7.604 -1.108) 10.191 8.787 ( -11.667 -10.048 -2.253) 15.562 9.199 ( 11.250 10.084 -3.908) 15.605 9.370 ( 12.070 -7.114 -4.853) 14.827 9.719 ( 6.368 1.887 -9.979) 11.987 9.767 ( 11.838 -2.278 -12.339) 17.250 10.142 ( 2.579 2.956 14.093) 14.629 10.254 ( 6.727 -8.547 15.769) 19.157 10.824 ( -8.880 -0.308 12.019) 14.946 10.837 ( -7.919 -1.564 11.633) 14.159 11.654 ( 5.366 16.554 6.504) 18.578 11.923 ( 11.505 -10.602 5.456) 16.569 12.166 ( 10.604 6.766 -3.768) 13.131 12.310 ( 7.777 -7.236 -7.512) 13.010 12.542 ( -1.485 7.338 1.441) 7.624 12.601 ( -0.516 1.553 10.158) 10.289 13.491 ( 0.643 8.251 -15.000) 17.132 13.611 ( 4.479 27.948 2.343) 28.401 13.691 ( 0.365 -9.291 -14.584) 17.296 14.096 ( -7.719 -16.358 -7.515) 19.586 14.587 ( -1.247 1.749 -0.068) 2.150 14.769 ( 5.188 -18.874 3.915) 19.962 15.734 ( -5.592 6.074 -9.308) 12.442 15.819 ( 0.383 -1.405 -11.718) 11.808 16.048 ( 1.569 0.053 -10.243) 10.363 16.097 ( -1.708 -6.636 0.203) 6.855 16.544 ( 1.951 8.343 -9.226) 12.591 16.748 ( 2.431 -11.333 -10.022) 15.322 16.930 ( -3.971 0.951 18.888) 19.325 16.963 ( -2.365 -2.929 16.860) 17.275 18.930 ( 1.888 4.027 8.562) 9.648 19.003 ( 1.780 -3.472 5.811) 7.000 19.516 ( -0.999 7.906 -0.744) 8.003 19.617 ( -1.377 -2.801 -1.006) 3.280 ======================= Grid point 155 (58/120) ======================= q-point: ( 0.22 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.921 ( 6.724 10.597 6.960) 14.351 2.116 ( 1.934 -4.799 2.364) 5.688 2.405 ( 4.064 7.297 10.772) 13.631 2.601 ( -4.118 -7.545 3.206) 9.174 2.754 ( -1.878 -1.648 -10.154) 10.457 2.851 ( -0.488 -11.488 -2.473) 11.761 3.117 ( -4.753 9.823 -2.028) 11.099 3.318 ( -6.686 -10.483 -0.930) 12.468 3.693 ( -1.271 4.133 -10.226) 11.103 3.735 ( -2.818 0.094 -10.526) 10.897 3.934 ( -0.074 7.815 -3.398) 8.522 4.069 ( -5.681 -6.751 -3.540) 9.507 5.052 ( 1.717 5.770 1.844) 6.296 5.136 ( -0.205 -3.206 0.776) 3.305 5.713 ( 12.909 18.920 11.970) 25.844 5.958 ( 11.784 4.152 14.982) 19.508 6.163 ( 5.664 -0.892 4.684) 7.404 6.249 ( 8.252 -0.975 2.957) 8.820 6.785 ( -3.241 -5.373 0.459) 6.291 6.840 ( 4.024 -9.094 1.524) 10.061 7.256 ( 4.809 5.260 -8.164) 10.838 7.356 ( 2.935 -4.869 -8.207) 9.984 7.720 ( -13.137 7.325 -8.613) 17.332 7.852 ( -8.572 -5.905 -9.285) 13.948 8.000 ( -8.976 2.705 3.323) 9.946 8.066 ( -10.277 -4.211 -1.431) 11.198 8.443 ( -9.796 2.718 2.459) 10.459 8.537 ( -12.857 -6.624 2.014) 14.603 9.392 ( 7.992 9.451 0.241) 12.379 9.540 ( 6.149 -5.191 -2.675) 8.480 9.872 ( 7.362 8.172 -1.700) 11.130 10.047 ( 12.903 -7.168 -5.500) 15.752 10.178 ( 0.718 8.254 8.985) 12.222 10.404 ( 5.290 -13.162 7.682) 16.132 10.646 ( -6.700 -0.411 6.169) 9.116 10.680 ( -6.326 -4.042 6.133) 9.694 11.772 ( 6.404 21.733 5.510) 23.317 12.148 ( 10.480 -15.558 2.937) 18.987 12.304 ( 1.195 9.697 3.024) 10.227 12.461 ( 2.297 -3.293 -0.247) 4.023 12.608 ( 11.068 5.969 -6.990) 14.387 12.700 ( 10.378 -0.139 -1.615) 10.504 13.555 ( 4.696 9.249 -4.198) 11.190 13.633 ( -1.298 8.303 -2.437) 8.750 13.787 ( 7.528 -4.434 -10.804) 13.895 13.913 ( -6.317 -13.363 -4.662) 15.498 14.601 ( 3.919 11.191 3.180) 12.276 14.919 ( 9.531 -18.230 3.662) 20.894 15.576 ( -9.165 5.327 -12.047) 16.047 15.781 ( -6.215 -12.500 -14.647) 20.234 16.020 ( 0.074 6.466 -0.291) 6.473 16.154 ( 2.860 -6.285 -1.442) 7.054 16.562 ( -0.784 8.836 -1.966) 9.085 16.776 ( -1.279 -12.155 -2.948) 12.572 16.824 ( -5.271 2.818 13.659) 14.909 16.896 ( -3.704 -4.776 12.640) 14.011 18.993 ( 4.429 4.225 3.758) 7.183 19.059 ( 3.746 -2.415 1.468) 4.692 19.485 ( -2.096 7.341 -1.714) 7.825 19.574 ( -2.912 -2.139 -1.799) 4.037 ======================= Grid point 156 (59/120) ======================= q-point: ( 0.33 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( 8.963 2.544 5.327) 10.732 2.165 ( 3.125 -3.650 1.324) 4.984 2.458 ( -1.600 0.498 6.062) 6.290 2.489 ( -4.941 -1.516 3.553) 6.272 2.741 ( 1.820 2.108 -8.131) 8.595 2.898 ( 4.743 -11.848 -0.693) 12.781 3.037 ( -3.395 7.741 -2.035) 8.695 3.200 ( -4.951 -8.802 -0.838) 10.133 3.610 ( -5.272 1.400 -5.794) 7.958 3.643 ( -5.001 -0.597 -6.479) 8.206 3.854 ( -8.193 3.921 -0.977) 9.135 3.932 ( -7.949 -3.640 -1.839) 8.934 5.204 ( 13.118 5.087 -6.219) 15.383 5.265 ( 12.503 -1.760 -9.377) 15.727 5.974 ( 5.947 21.851 8.562) 24.210 6.057 ( 3.819 18.407 -3.806) 19.180 6.295 ( 0.782 -11.655 7.615) 13.944 6.416 ( 10.904 -16.153 4.538) 20.010 6.721 ( 0.414 10.665 -1.668) 10.803 6.928 ( 1.638 -9.271 -3.402) 10.010 7.340 ( 2.161 2.879 -2.293) 4.268 7.391 ( 0.271 -2.937 -1.270) 3.212 7.443 ( -10.974 12.563 -0.563) 16.690 7.721 ( -3.756 -14.073 -5.488) 15.566 7.880 ( -2.940 0.542 1.155) 3.205 7.913 ( -4.944 -3.225 -1.144) 6.013 8.207 ( -13.078 2.728 4.764) 14.183 8.292 ( -11.440 -5.194 5.709) 13.800 9.543 ( 7.534 7.130 2.554) 10.683 9.653 ( 5.601 -3.361 -0.036) 6.533 9.960 ( 0.362 8.083 7.256) 10.868 10.088 ( -5.953 -1.487 10.966) 12.566 10.296 ( 7.426 4.917 -6.054) 10.769 10.386 ( -2.775 -1.028 -0.348) 2.980 10.581 ( -1.804 -4.681 2.573) 5.638 10.649 ( 1.752 -12.730 1.813) 12.978 11.913 ( 7.560 25.007 6.591) 26.943 12.276 ( -2.102 18.410 6.774) 19.729 12.366 ( 10.409 -21.317 4.074) 24.070 12.515 ( 4.781 -1.322 0.677) 5.006 12.785 ( 4.316 0.136 -8.949) 9.936 12.889 ( 7.667 -3.473 -10.634) 13.562 13.416 ( -13.187 3.972 0.149) 13.773 13.574 ( -12.457 -9.886 -11.612) 19.691 13.970 ( 22.119 11.125 -5.456) 25.353 14.186 ( 23.351 -10.676 -5.957) 26.358 14.750 ( 9.508 20.046 6.166) 23.027 15.137 ( 11.657 -8.186 3.768) 14.735 15.390 ( -8.703 -6.328 -8.241) 13.554 15.604 ( -9.576 -16.533 -11.486) 22.293 15.988 ( -6.360 8.277 1.740) 10.582 16.122 ( -7.689 -4.761 1.289) 9.135 16.536 ( -0.203 5.542 5.477) 7.794 16.679 ( -3.518 -6.522 10.295) 12.684 16.772 ( -2.767 -1.865 1.718) 3.753 16.830 ( -3.022 -5.358 5.819) 8.467 19.105 ( 6.531 3.876 -0.961) 7.655 19.150 ( 5.178 -0.542 -2.183) 5.645 19.431 ( -3.331 6.244 -2.999) 7.687 19.499 ( -4.607 -1.064 -2.784) 5.487 ======================= Grid point 157 (60/120) ======================= q-point: ( 0.44 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( 4.881 -0.309 1.639) 5.158 2.266 ( 7.770 -3.702 2.218) 8.888 2.346 ( -5.825 0.488 -0.332) 5.855 2.408 ( -5.586 -6.004 3.124) 8.776 2.836 ( 6.423 6.405 -3.042) 9.567 2.958 ( -5.055 6.578 -2.639) 8.705 3.008 ( 5.626 -10.508 0.730) 11.941 3.111 ( -4.461 -8.666 -0.145) 9.748 3.546 ( 0.380 3.417 -2.074) 4.016 3.597 ( -0.077 2.006 -2.415) 3.140 3.680 ( -5.899 -0.594 -0.450) 5.946 3.755 ( -8.659 -5.087 -1.077) 10.100 5.527 ( 16.715 6.901 -10.278) 20.800 5.576 ( 16.579 1.776 -12.427) 20.796 5.861 ( -10.035 7.734 -9.151) 15.629 5.981 ( -15.732 -4.728 -10.070) 19.268 6.421 ( 14.034 16.117 0.095) 21.371 6.610 ( 3.629 0.731 1.885) 4.154 6.753 ( -0.784 4.027 2.747) 4.937 6.827 ( -7.457 -3.725 -2.403) 8.675 7.323 ( 1.609 5.271 8.694) 10.294 7.379 ( -1.891 7.432 2.082) 7.946 7.453 ( 7.525 -9.277 4.860) 12.896 7.633 ( -7.571 -17.653 2.281) 19.343 7.867 ( 0.892 1.408 0.620) 1.779 7.891 ( 2.551 2.230 2.286) 4.088 7.986 ( -6.042 0.686 2.565) 6.600 8.077 ( -9.628 -6.128 3.898) 12.060 9.701 ( 8.067 5.794 5.489) 11.348 9.768 ( 5.159 1.153 4.148) 6.720 9.888 ( -5.683 1.032 6.973) 9.055 9.938 ( -7.675 -1.389 6.206) 9.968 10.362 ( 2.149 8.636 -2.889) 9.357 10.396 ( -0.032 8.713 -2.108) 8.964 10.588 ( 2.588 -12.061 0.377) 12.341 10.646 ( -2.166 -14.448 0.722) 14.627 12.068 ( 7.575 26.612 8.712) 29.008 12.201 ( -5.288 24.843 9.069) 26.970 12.559 ( 7.344 -22.827 5.311) 24.560 12.621 ( 2.535 -16.253 3.817) 16.887 12.855 ( 6.776 8.857 -10.178) 15.099 13.032 ( 3.400 -0.520 -13.785) 14.208 13.137 ( -9.019 -3.016 -3.125) 10.010 13.303 ( -13.314 -11.432 -11.386) 20.919 14.436 ( 20.684 18.380 -10.277) 29.517 14.625 ( 11.049 9.934 -10.969) 18.469 14.890 ( 7.256 0.529 -2.940) 7.847 15.188 ( -13.952 -16.930 -9.655) 23.968 15.385 ( 13.736 0.965 6.067) 15.048 15.555 ( 8.854 -14.245 4.689) 17.415 15.731 ( -17.060 5.269 8.324) 19.700 15.857 ( -16.576 -7.265 7.737) 19.683 16.585 ( 4.563 3.441 5.201) 7.727 16.674 ( -0.822 -0.883 4.962) 5.107 16.703 ( -1.107 -4.837 3.877) 6.297 16.763 ( -3.658 -5.978 3.586) 7.872 19.240 ( 6.386 3.437 -3.919) 8.244 19.261 ( 5.942 1.276 -3.474) 7.000 19.351 ( -4.539 4.486 -4.049) 7.558 19.390 ( -6.092 0.225 -3.406) 6.983 ======================= Grid point 189 (61/120) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( 0.000 0.000 24.968) 24.968 1.710 ( 0.000 0.000 24.874) 24.874 2.582 ( 0.000 0.000 -12.163) 12.163 2.806 ( 0.000 0.000 6.743) 6.743 2.829 ( 0.000 0.000 12.158) 12.158 3.151 ( 0.000 0.000 -19.684) 19.684 3.189 ( 0.000 0.000 -9.633) 9.633 3.295 ( 0.000 0.000 5.177) 5.177 3.380 ( 0.000 0.000 -9.206) 9.206 3.554 ( 0.000 0.000 7.478) 7.478 3.772 ( 0.000 0.000 2.593) 2.593 4.680 ( 0.000 0.000 -6.820) 6.820 4.741 ( 0.000 0.000 0.256) 0.256 5.020 ( 0.000 0.000 -1.611) 1.611 5.437 ( 0.000 0.000 17.746) 17.746 5.538 ( 0.000 0.000 6.305) 6.305 6.185 ( 0.000 0.000 16.421) 16.421 6.213 ( 0.000 0.000 17.085) 17.085 6.768 ( 0.000 0.000 -6.911) 6.911 7.236 ( 0.000 0.000 0.593) 0.593 7.356 ( 0.000 0.000 -16.248) 16.248 7.438 ( 0.000 0.000 -4.170) 4.170 7.551 ( 0.000 0.000 -6.169) 6.169 7.761 ( 0.000 0.000 -27.923) 27.923 8.143 ( 0.000 0.000 -1.908) 1.908 8.212 ( 0.000 0.000 -8.840) 8.840 8.494 ( 0.000 0.000 11.407) 11.407 9.108 ( 0.000 0.000 -5.281) 5.281 9.145 ( 0.000 0.000 -4.145) 4.145 9.375 ( 0.000 0.000 -6.993) 6.993 9.507 ( 0.000 0.000 -8.654) 8.654 9.530 ( 0.000 0.000 -4.899) 4.899 10.258 ( 0.000 0.000 8.844) 8.844 11.005 ( 0.000 0.000 16.589) 16.589 11.020 ( 0.000 0.000 -7.401) 7.401 11.301 ( 0.000 0.000 1.827) 1.827 11.349 ( 0.000 0.000 17.398) 17.398 11.400 ( 0.000 0.000 7.796) 7.796 11.710 ( 0.000 0.000 0.842) 0.842 12.088 ( 0.000 0.000 2.270) 2.270 12.193 ( 0.000 0.000 10.345) 10.345 12.931 ( 0.000 0.000 -17.725) 17.725 12.975 ( 0.000 0.000 9.630) 9.630 13.049 ( 0.000 0.000 32.003) 32.003 13.708 ( 0.000 0.000 -17.657) 17.657 14.001 ( 0.000 0.000 -20.054) 20.054 14.748 ( 0.000 0.000 -26.394) 26.394 14.755 ( 0.000 0.000 2.441) 2.441 15.426 ( 0.000 0.000 -15.965) 15.965 16.139 ( 0.000 0.000 -19.197) 19.197 16.405 ( 0.000 0.000 12.182) 12.182 16.541 ( 0.000 0.000 6.622) 6.622 16.546 ( 0.000 0.000 1.220) 1.220 16.787 ( 0.000 0.000 -4.039) 4.039 17.238 ( 0.000 0.000 10.484) 10.484 17.325 ( 0.000 0.000 2.876) 2.876 18.962 ( 0.000 0.000 0.230) 0.230 19.088 ( 0.000 0.000 -2.173) 2.173 19.089 ( 0.000 0.000 13.497) 13.497 19.592 ( 0.000 0.000 -1.569) 1.569 ======================= Grid point 190 (62/120) ======================= q-point: ( 0.11 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.684 ( 7.657 0.000 21.070) 22.418 1.828 ( 10.988 0.000 21.923) 24.523 2.575 ( -0.029 0.000 -10.361) 10.361 2.815 ( 0.517 0.000 6.675) 6.695 2.958 ( 8.691 0.000 -0.152) 8.693 3.118 ( -2.838 0.000 -17.939) 18.162 3.147 ( -0.509 0.000 3.767) 3.802 3.336 ( -4.515 0.000 -9.505) 10.523 3.372 ( 5.811 0.000 -5.503) 8.003 3.502 ( -4.522 0.000 10.648) 11.569 3.772 ( 0.899 0.000 5.397) 5.471 4.603 ( -7.220 0.000 -6.045) 9.417 4.725 ( -1.537 0.000 0.501) 1.616 4.992 ( -2.602 0.000 -0.408) 2.634 5.362 ( -4.951 0.000 14.257) 15.092 5.452 ( -7.150 0.000 7.483) 10.350 6.272 ( 5.044 0.000 15.653) 16.445 6.339 ( 12.824 0.000 14.235) 19.159 6.773 ( -0.016 0.000 -7.118) 7.118 7.247 ( -0.464 0.000 -4.908) 4.929 7.338 ( -4.671 0.000 -13.260) 14.058 7.397 ( -4.044 0.000 -4.040) 5.717 7.508 ( 1.304 0.000 -11.030) 11.106 7.825 ( 4.330 0.000 -17.765) 18.285 7.896 ( -14.049 0.000 -0.393) 14.054 8.268 ( -3.330 0.000 -6.772) 7.547 8.626 ( 12.420 0.000 10.534) 16.285 8.921 ( -10.499 0.000 1.630) 10.625 9.115 ( -9.167 0.000 -4.679) 10.292 9.428 ( 4.578 0.000 -6.568) 8.006 9.466 ( -2.120 0.000 -7.618) 7.907 9.622 ( 7.829 0.000 -8.493) 11.551 10.344 ( 7.689 0.000 7.454) 10.709 11.026 ( 2.258 0.000 16.620) 16.773 11.105 ( -6.247 0.000 -3.289) 7.060 11.175 ( -0.132 0.000 5.434) 5.435 11.370 ( -3.612 0.000 10.527) 11.130 11.395 ( 8.725 0.000 3.153) 9.277 11.772 ( 6.418 0.000 -2.276) 6.809 12.100 ( -7.782 0.000 12.862) 15.033 12.316 ( 18.282 0.000 1.664) 18.357 12.906 ( 0.909 0.000 2.211) 2.390 13.114 ( 10.052 0.000 -7.849) 12.754 13.253 ( 18.553 0.000 28.736) 34.205 13.650 ( -5.530 0.000 -17.512) 18.364 14.009 ( 0.746 0.000 -21.526) 21.539 14.590 ( -13.485 0.000 -23.699) 27.267 14.737 ( -1.637 0.000 5.373) 5.617 15.534 ( 8.162 0.000 -16.513) 18.420 16.125 ( -1.573 0.000 -7.977) 8.130 16.342 ( -2.444 0.000 2.969) 3.846 16.571 ( 2.451 0.000 1.339) 2.793 16.667 ( 8.391 0.000 3.430) 9.065 16.795 ( 0.793 0.000 -3.477) 3.566 17.194 ( -3.628 0.000 12.261) 12.786 17.333 ( 0.360 0.000 2.135) 2.166 18.938 ( -2.271 0.000 -0.615) 2.352 19.028 ( -5.561 0.000 -2.346) 6.035 19.073 ( -1.416 0.000 12.359) 12.440 19.564 ( -2.799 0.000 -1.861) 3.361 ======================= Grid point 191 (63/120) ======================= q-point: ( 0.22 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( 10.301 0.000 13.000) 16.586 2.103 ( 14.916 0.000 15.023) 21.170 2.592 ( 1.620 0.000 -10.965) 11.084 2.792 ( -3.574 0.000 2.926) 4.619 2.950 ( -5.267 0.000 -3.167) 6.146 3.063 ( -2.510 0.000 -10.754) 11.043 3.210 ( -6.785 0.000 -7.727) 10.283 3.248 ( -0.671 0.000 -5.456) 5.497 3.421 ( 3.742 0.000 9.088) 9.828 3.520 ( 4.450 0.000 -7.272) 8.526 3.879 ( 12.679 0.000 16.446) 20.766 4.424 ( -9.261 0.000 -3.020) 9.741 4.692 ( -1.170 0.000 -0.140) 1.178 4.930 ( -3.405 0.000 0.459) 3.435 5.302 ( -6.903 0.000 6.189) 9.272 5.310 ( 0.494 0.000 7.776) 7.792 6.394 ( 6.838 0.000 13.962) 15.547 6.563 ( 2.731 0.000 -6.375) 6.935 6.779 ( 4.921 0.000 5.982) 7.746 7.045 ( -17.046 0.000 -16.254) 23.553 7.300 ( -4.345 0.000 -0.814) 4.421 7.313 ( 0.808 0.000 -9.948) 9.981 7.613 ( 6.798 0.000 -3.676) 7.728 7.645 ( -10.419 0.000 3.131) 10.880 7.905 ( 3.719 0.000 -10.043) 10.710 8.144 ( -7.898 0.000 -3.466) 8.625 8.732 ( -8.271 0.000 4.617) 9.473 8.870 ( -13.128 0.000 -2.252) 13.320 8.902 ( 14.030 0.000 8.481) 16.394 9.455 ( 1.683 0.000 -5.207) 5.473 9.522 ( 3.953 0.000 -4.738) 6.170 9.783 ( 7.256 0.000 -9.355) 11.839 10.496 ( 5.078 0.000 4.666) 6.897 10.854 ( -13.194 0.000 4.083) 13.811 11.095 ( 4.402 0.000 16.937) 17.500 11.105 ( -5.551 0.000 6.734) 8.727 11.464 ( 7.303 0.000 0.164) 7.305 11.623 ( 13.474 0.000 3.963) 14.044 11.892 ( -5.648 0.000 7.634) 9.496 12.004 ( 9.333 0.000 -0.034) 9.333 12.647 ( 12.373 0.000 -2.552) 12.634 13.034 ( 12.586 0.000 4.510) 13.370 13.323 ( 9.834 0.000 -9.083) 13.387 13.495 ( -8.610 0.000 -13.859) 16.316 13.732 ( 26.927 0.000 19.643) 33.330 14.013 ( -1.434 0.000 -24.861) 24.902 14.276 ( -16.798 0.000 -19.143) 25.468 14.726 ( 2.375 0.000 13.655) 13.860 15.664 ( 3.364 0.000 -14.060) 14.457 16.079 ( -3.240 0.000 9.080) 9.641 16.329 ( 0.869 0.000 -10.414) 10.451 16.638 ( 3.993 0.000 1.840) 4.397 16.814 ( 5.481 0.000 -2.140) 5.884 16.820 ( 1.689 0.000 -2.060) 2.664 17.126 ( -2.422 0.000 13.742) 13.954 17.329 ( -0.869 0.000 2.859) 2.988 18.876 ( -3.764 0.000 -2.942) 4.778 18.893 ( -7.081 0.000 -3.623) 7.954 19.042 ( -1.345 0.000 8.993) 9.093 19.482 ( -5.285 0.000 -2.594) 5.887 ======================= Grid point 192 (64/120) ======================= q-point: ( 0.33 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( 11.406 0.000 4.499) 12.262 2.358 ( 8.752 0.000 4.959) 10.059 2.612 ( -0.924 0.000 -11.687) 11.724 2.684 ( -6.566 0.000 -2.156) 6.911 2.864 ( -1.915 0.000 -1.301) 2.315 2.986 ( -3.016 0.000 -2.399) 3.853 3.139 ( -6.733 0.000 -0.979) 6.804 3.145 ( -0.357 0.000 -1.318) 1.365 3.455 ( -1.555 0.000 -1.700) 2.304 3.551 ( -2.097 0.000 -6.782) 7.099 4.260 ( 20.039 0.000 17.250) 26.441 4.308 ( -0.559 0.000 3.305) 3.352 4.690 ( 0.790 0.000 -1.490) 1.687 4.857 ( -3.833 0.000 0.227) 3.840 5.216 ( 0.348 0.000 -0.843) 0.912 5.395 ( 8.203 0.000 0.694) 8.232 6.370 ( -16.660 0.000 -19.730) 25.823 6.455 ( -10.966 0.000 -1.887) 11.127 6.734 ( -3.119 0.000 -3.435) 4.639 6.999 ( 11.686 0.000 14.104) 18.316 7.257 ( -0.162 0.000 4.055) 4.058 7.291 ( -3.756 0.000 -6.202) 7.251 7.490 ( -4.239 0.000 3.662) 5.602 7.747 ( 6.483 0.000 -0.845) 6.538 7.965 ( -9.887 0.000 -1.556) 10.009 7.975 ( 2.786 0.000 -8.536) 8.979 8.574 ( -7.716 0.000 5.470) 9.458 8.645 ( -8.346 0.000 -0.312) 8.352 9.169 ( 12.240 0.000 7.218) 14.210 9.547 ( 7.419 0.000 -2.168) 7.729 9.566 ( 0.126 0.000 -1.547) 1.552 9.899 ( 3.925 0.000 -7.086) 8.101 10.491 ( -4.724 0.000 2.347) 5.275 10.586 ( -12.630 0.000 1.744) 12.750 11.119 ( 6.191 0.000 10.006) 11.767 11.200 ( 6.066 0.000 16.335) 17.425 11.525 ( -1.342 0.000 3.892) 4.116 11.707 ( -9.714 0.000 13.270) 16.445 11.924 ( 15.711 0.000 3.032) 16.001 12.271 ( 12.872 0.000 -7.433) 14.864 12.871 ( 11.842 0.000 -7.566) 14.052 13.298 ( 10.205 0.000 -0.689) 10.228 13.323 ( -6.991 0.000 -14.213) 15.840 13.484 ( 6.064 0.000 -8.414) 10.371 13.901 ( -17.345 0.000 -19.576) 26.154 13.913 ( -8.389 0.000 -21.552) 23.127 14.339 ( 29.420 0.000 17.695) 34.331 14.902 ( 15.426 0.000 17.000) 22.956 15.631 ( -7.136 0.000 -7.811) 10.580 15.955 ( -9.952 0.000 11.502) 15.210 16.396 ( 6.268 0.000 -9.475) 11.361 16.725 ( 4.492 0.000 2.486) 5.134 16.853 ( 1.216 0.000 -0.132) 1.223 16.860 ( -1.414 0.000 -5.038) 5.233 17.116 ( 1.474 0.000 12.216) 12.305 17.296 ( -2.412 0.000 6.157) 6.612 18.767 ( -4.832 0.000 -6.523) 8.118 18.798 ( -3.904 0.000 -5.457) 6.710 19.036 ( 1.076 0.000 4.022) 4.163 19.357 ( -6.942 0.000 -3.289) 7.682 ======================= Grid point 193 (65/120) ======================= q-point: ( 0.44 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( 11.276 0.000 -2.864) 11.634 2.453 ( 2.916 0.000 -3.421) 4.495 2.519 ( -7.954 0.000 -8.245) 11.456 2.544 ( -6.439 0.000 -4.814) 8.040 2.897 ( 4.392 0.000 -2.524) 5.066 3.008 ( -6.220 0.000 -1.710) 6.450 3.027 ( 5.459 0.000 4.061) 6.804 3.121 ( -2.928 0.000 2.778) 4.036 3.423 ( -0.375 0.000 -2.533) 2.561 3.466 ( -4.432 0.000 -4.597) 6.386 4.385 ( 6.498 0.000 10.042) 11.961 4.478 ( 0.261 0.000 15.796) 15.799 4.720 ( 2.235 0.000 -0.776) 2.366 4.780 ( -3.633 0.000 0.037) 3.633 5.438 ( 22.193 0.000 -10.624) 24.605 5.638 ( 15.627 0.000 -8.077) 17.591 5.978 ( -28.513 0.000 -13.603) 31.592 5.997 ( -19.241 0.000 -15.665) 24.811 6.908 ( 12.758 0.000 6.266) 14.214 7.149 ( -10.200 0.000 0.847) 10.235 7.163 ( 4.988 0.000 10.168) 11.326 7.239 ( -2.682 0.000 7.683) 8.137 7.535 ( 8.620 0.000 2.134) 8.880 7.750 ( -11.328 0.000 0.521) 11.340 7.877 ( 6.337 0.000 -3.288) 7.139 7.979 ( -2.928 0.000 -7.690) 8.228 8.474 ( -0.980 0.000 4.895) 4.992 8.520 ( -4.609 0.000 2.108) 5.068 9.384 ( 8.942 0.000 5.148) 10.318 9.521 ( -4.598 0.000 2.070) 5.042 9.733 ( 10.300 0.000 -0.741) 10.326 9.903 ( -4.683 0.000 -3.001) 5.562 10.379 ( -3.335 0.000 0.460) 3.366 10.408 ( -5.155 0.000 0.696) 5.202 11.278 ( 8.528 0.000 9.562) 12.813 11.340 ( 7.894 0.000 15.159) 17.091 11.436 ( -6.731 0.000 7.876) 10.360 11.514 ( -9.312 0.000 14.270) 17.040 12.230 ( 13.616 0.000 -0.557) 13.627 12.405 ( -1.667 0.000 -4.647) 4.937 13.132 ( 13.378 0.000 -11.286) 17.503 13.299 ( 6.416 0.000 -15.434) 16.714 13.348 ( -5.860 0.000 -9.359) 11.043 13.550 ( -16.450 0.000 -17.227) 23.820 13.600 ( 6.102 0.000 -6.153) 8.666 13.734 ( -7.887 0.000 -11.523) 13.964 14.916 ( 26.700 0.000 9.498) 28.339 15.286 ( 20.811 0.000 13.482) 24.797 15.374 ( -18.237 0.000 0.653) 18.248 15.678 ( -17.248 0.000 10.828) 20.365 16.567 ( 9.975 0.000 -5.688) 11.483 16.759 ( -8.125 0.000 -5.084) 9.585 16.808 ( 3.487 0.000 2.624) 4.365 16.856 ( -1.146 0.000 1.751) 2.093 17.169 ( 3.355 0.000 10.114) 10.655 17.237 ( -3.279 0.000 8.934) 9.517 18.711 ( -0.761 0.000 -8.342) 8.377 18.731 ( -2.481 0.000 -7.790) 8.175 19.094 ( 4.681 0.000 -0.611) 4.721 19.214 ( -6.955 0.000 -3.015) 7.580 ======================= Grid point 198 (66/120) ======================= q-point: ( 0.00 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 0.000 0.802 22.390) 22.404 1.719 ( 0.000 11.912 22.100) 25.106 2.534 ( 0.000 -4.252 -9.409) 10.325 2.858 ( 0.000 4.304 4.047) 5.908 2.937 ( 0.000 9.186 3.933) 9.992 3.030 ( 0.000 -9.071 -8.801) 12.639 3.161 ( 0.000 -14.855 3.562) 15.276 3.241 ( 0.000 4.808 -10.994) 12.000 3.354 ( 0.000 3.836 -6.695) 7.716 3.621 ( 0.000 -2.036 -1.262) 2.395 3.740 ( 0.000 -1.046 2.588) 2.791 4.551 ( 0.000 -10.574 -7.607) 13.026 4.855 ( 0.000 11.196 2.191) 11.408 5.219 ( 0.000 17.103 0.605) 17.113 5.470 ( 0.000 2.363 15.418) 15.598 5.535 ( 0.000 2.889 11.188) 11.555 6.161 ( 0.000 -2.405 16.149) 16.327 6.191 ( 0.000 -2.498 17.151) 17.332 6.785 ( 0.000 1.816 -7.627) 7.841 7.157 ( 0.000 -8.261 1.304) 8.363 7.253 ( 0.000 -5.908 -12.732) 14.036 7.469 ( 0.000 -8.143 -4.785) 9.445 7.579 ( 0.000 8.409 -10.007) 13.071 7.763 ( 0.000 0.293 -27.170) 27.171 8.219 ( 0.000 7.728 -1.244) 7.827 8.315 ( 0.000 9.751 -8.917) 13.213 8.467 ( 0.000 -2.519 9.734) 10.054 8.978 ( 0.000 -11.233 -5.189) 12.373 9.121 ( 0.000 -2.639 -4.158) 4.925 9.344 ( 0.000 -4.853 -5.715) 7.498 9.487 ( 0.000 -1.628 -8.974) 9.121 9.516 ( 0.000 -1.160 -6.414) 6.518 10.276 ( 0.000 1.884 10.331) 10.502 10.838 ( 0.000 -11.207 4.172) 11.958 11.093 ( 0.000 8.040 17.135) 18.928 11.316 ( 0.000 -2.244 15.797) 15.956 11.404 ( 0.000 1.137 7.283) 7.371 11.579 ( 0.000 19.695 -6.942) 20.883 11.734 ( 0.000 2.543 -0.408) 2.576 12.053 ( 0.000 -2.734 2.952) 4.023 12.353 ( 0.000 13.532 6.261) 14.910 12.943 ( 0.000 1.122 -17.292) 17.328 12.968 ( 0.000 0.610 10.753) 10.770 13.025 ( 0.000 -2.302 26.145) 26.246 13.685 ( 0.000 -2.754 -16.087) 16.321 14.031 ( 0.000 3.008 -15.166) 15.461 14.733 ( 0.000 -1.950 3.654) 4.142 14.822 ( 0.000 6.957 -25.197) 26.139 15.474 ( 0.000 4.824 -16.401) 17.096 16.124 ( 0.000 -1.855 -18.769) 18.861 16.193 ( 0.000 -17.132 10.288) 19.984 16.274 ( 0.000 -22.512 3.079) 22.721 16.524 ( 0.000 -4.553 4.011) 6.067 16.821 ( 0.000 -0.513 -5.960) 5.982 17.264 ( 0.000 1.703 11.208) 11.336 17.308 ( 0.000 -1.263 6.606) 6.726 19.007 ( 0.000 3.017 4.553) 5.462 19.099 ( 0.000 0.912 -0.893) 1.277 19.157 ( 0.000 7.665 8.074) 11.133 19.606 ( 0.000 1.264 -1.653) 2.081 ======================= Grid point 199 (67/120) ======================= q-point: ( 0.11 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 6.564 8.763 19.542) 22.400 1.819 ( 9.945 1.298 19.215) 21.675 2.542 ( 0.957 -3.252 -8.837) 9.465 2.827 ( -2.702 0.645 3.556) 4.512 2.961 ( -2.921 -4.193 -7.110) 8.756 3.045 ( 1.521 -3.725 -8.782) 9.660 3.146 ( 3.228 -5.177 9.364) 11.176 3.279 ( 1.691 6.175 -9.538) 11.488 3.401 ( 4.980 0.584 -5.306) 7.300 3.548 ( -6.066 0.065 -1.611) 6.277 3.746 ( 0.902 -1.988 4.863) 5.331 4.473 ( -7.297 -10.361 -6.748) 14.357 4.840 ( -1.645 11.168 3.444) 11.802 5.190 ( -2.375 16.568 2.582) 16.936 5.423 ( -4.599 1.985 11.895) 12.906 5.435 ( -6.447 4.292 9.692) 12.406 6.229 ( 5.069 -3.149 16.155) 17.222 6.340 ( 12.995 -0.789 14.210) 19.272 6.794 ( 0.524 2.085 -8.048) 8.330 7.176 ( 0.789 -6.982 -3.097) 7.679 7.262 ( -2.500 -4.963 -10.274) 11.681 7.408 ( -1.147 -8.672 -7.789) 11.712 7.515 ( -6.043 7.142 -9.279) 13.176 7.796 ( 1.394 -1.532 -18.217) 18.335 8.015 ( -10.757 9.555 -0.067) 14.389 8.287 ( -5.119 1.154 -5.102) 7.319 8.662 ( 12.962 3.470 5.299) 14.427 8.816 ( -9.963 -9.339 0.784) 13.678 9.087 ( -6.438 -2.350 -3.282) 7.598 9.382 ( 2.295 -2.393 -5.577) 6.488 9.519 ( 3.419 2.275 -8.711) 9.630 9.607 ( 8.476 -1.460 -8.699) 12.233 10.344 ( 6.098 0.166 9.069) 10.930 10.940 ( 7.270 -11.994 2.422) 14.233 11.101 ( -4.905 2.118 13.094) 14.143 11.129 ( -5.947 1.803 14.843) 16.092 11.331 ( -7.234 0.025 8.618) 11.252 11.664 ( 7.643 18.063 -6.150) 20.555 11.826 ( 8.438 4.591 -2.020) 9.816 12.214 ( -4.316 9.016 8.343) 13.020 12.305 ( 13.113 0.635 2.831) 13.430 12.879 ( -0.640 -2.791 6.279) 6.901 13.093 ( 9.419 -1.076 -8.887) 12.994 13.267 ( 18.684 1.383 19.872) 27.311 13.643 ( -4.015 -1.217 -15.677) 16.229 14.023 ( -0.551 1.504 -15.101) 15.186 14.648 ( -11.895 3.564 -17.509) 21.465 14.744 ( -1.781 2.938 0.591) 3.486 15.581 ( 7.971 4.535 -16.822) 19.159 16.096 ( -2.210 -4.623 0.359) 5.137 16.214 ( 2.363 -10.474 -7.064) 12.852 16.312 ( 3.144 -23.460 2.601) 23.812 16.547 ( 1.787 -7.596 2.489) 8.191 16.848 ( 2.409 -0.242 -5.615) 6.115 17.218 ( -3.709 1.568 12.710) 13.332 17.313 ( -0.056 -1.856 5.506) 5.811 18.986 ( -2.040 2.897 3.670) 5.101 19.047 ( -4.455 2.695 -1.477) 5.412 19.145 ( -1.343 7.370 7.230) 10.411 19.579 ( -2.661 1.403 -1.938) 3.578 ======================= Grid point 200 (68/120) ======================= q-point: ( 0.22 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( 8.792 7.087 11.406) 16.050 2.079 ( 14.536 -1.770 14.290) 20.461 2.575 ( 2.164 -1.867 -8.962) 9.407 2.757 ( -4.215 -4.415 2.636) 6.649 2.853 ( -7.127 -4.569 -6.206) 10.497 2.992 ( -3.240 -10.751 -3.512) 11.766 3.192 ( -4.358 2.047 -5.267) 7.136 3.322 ( 0.384 3.640 -4.490) 5.792 3.456 ( 0.814 1.554 0.145) 1.761 3.536 ( 4.835 2.196 -9.505) 10.888 3.828 ( 9.740 -4.539 12.310) 16.340 4.291 ( -9.632 -10.122 -4.132) 14.571 4.805 ( -0.786 10.665 4.216) 11.495 5.150 ( -1.338 17.985 2.548) 18.214 5.290 ( -6.250 -0.336 7.803) 10.003 5.377 ( -0.177 7.827 5.359) 9.488 6.365 ( 8.133 -1.360 14.163) 16.388 6.572 ( 5.116 0.472 -2.456) 5.694 6.797 ( 1.263 1.192 -0.676) 1.864 6.996 ( -15.477 -5.294 -13.505) 21.212 7.270 ( 3.015 -3.015 -4.927) 6.516 7.368 ( -6.627 5.640 -3.139) 9.251 7.486 ( 4.792 -8.617 -2.021) 10.065 7.743 ( -4.590 3.223 -4.230) 7.025 7.923 ( 0.499 3.718 -4.773) 6.070 8.159 ( -6.751 0.375 -2.526) 7.218 8.639 ( -7.811 -8.213 3.771) 11.945 8.756 ( -7.616 -7.060 -1.963) 10.569 9.062 ( 9.105 11.317 6.493) 15.910 9.433 ( 3.569 -0.183 -3.793) 5.211 9.603 ( 4.078 5.414 -6.867) 9.649 9.778 ( 7.425 0.072 -8.801) 11.515 10.469 ( 4.473 -2.622 5.975) 7.911 10.817 ( -14.089 -3.122 3.745) 14.908 10.995 ( -2.727 -6.584 10.337) 12.555 11.246 ( 5.476 9.090 10.929) 15.233 11.263 ( 5.386 -11.123 9.236) 15.428 11.840 ( 9.055 14.844 -3.517) 17.739 12.027 ( -7.273 8.064 12.257) 16.375 12.055 ( 11.135 9.582 -6.784) 16.181 12.615 ( 11.670 -3.400 -2.852) 12.485 12.977 ( 10.450 -5.710 6.242) 13.445 13.290 ( 9.509 -1.797 -9.739) 13.729 13.539 ( -5.416 2.174 -15.041) 16.134 13.679 ( 17.931 -3.907 7.043) 19.657 14.040 ( 5.031 1.892 -6.201) 8.207 14.349 ( -16.446 6.866 -19.591) 26.484 14.754 ( 3.682 3.498 11.933) 12.968 15.703 ( 2.761 3.445 -14.728) 15.376 16.051 ( -2.624 -3.379 9.864) 10.752 16.280 ( 4.043 -5.202 -13.133) 14.693 16.389 ( 4.549 -23.433 2.608) 24.013 16.582 ( 1.676 -12.185 0.477) 12.309 16.891 ( 0.997 -1.093 -4.368) 4.612 17.145 ( -2.889 0.492 12.672) 13.007 17.298 ( -1.570 -3.440 5.252) 6.472 18.919 ( -4.610 2.786 -0.479) 5.408 18.962 ( -3.219 6.881 -2.729) 8.072 19.108 ( -2.002 6.828 5.658) 9.091 19.501 ( -5.059 1.774 -2.655) 5.982 ======================= Grid point 201 (69/120) ======================= q-point: ( 0.33 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( 9.139 3.533 3.760) 10.494 2.337 ( 9.233 -2.064 4.815) 10.616 2.606 ( -0.212 -1.283 -7.154) 7.272 2.682 ( -5.063 0.174 -3.082) 5.930 2.703 ( -3.071 -9.744 -0.195) 10.218 2.941 ( -2.620 -11.477 -0.178) 11.774 3.099 ( -2.586 5.076 -3.432) 6.650 3.266 ( -3.938 3.629 -2.066) 5.740 3.456 ( -1.876 0.614 -2.817) 3.440 3.565 ( -2.082 1.184 -7.274) 7.658 4.062 ( 6.448 -14.753 7.759) 17.872 4.173 ( 1.512 -10.381 3.547) 11.074 4.851 ( 5.890 12.441 2.846) 14.056 5.135 ( -1.380 23.091 1.034) 23.156 5.205 ( 0.689 -0.943 -0.576) 1.303 5.453 ( 8.061 6.820 1.216) 10.629 6.375 ( -16.984 0.781 -16.112) 23.424 6.490 ( -11.265 3.518 -8.064) 14.294 6.682 ( 0.175 -4.374 1.528) 4.637 6.968 ( 7.765 -3.023 8.287) 11.752 7.296 ( -0.633 4.458 4.736) 6.535 7.304 ( -0.285 1.335 -0.133) 1.372 7.532 ( 0.950 -1.321 -0.813) 1.819 7.726 ( 1.662 2.526 -0.913) 3.159 7.953 ( 1.935 -1.538 -5.453) 5.987 8.036 ( -4.996 3.785 0.306) 6.275 8.482 ( -8.076 -8.651 4.915) 12.815 8.559 ( -8.975 -7.733 -0.357) 11.852 9.288 ( 11.143 11.213 6.976) 17.279 9.541 ( 6.975 0.973 -0.597) 7.068 9.658 ( 1.230 7.583 -3.778) 8.561 9.895 ( 4.122 -0.077 -6.466) 7.669 10.458 ( -5.328 -3.240 2.486) 6.714 10.537 ( -12.684 -4.039 1.958) 13.454 11.021 ( 5.872 -8.192 9.596) 13.917 11.340 ( 5.678 8.652 16.110) 19.147 11.378 ( 1.950 -8.950 5.798) 10.841 11.830 ( -9.344 11.705 12.475) 19.492 12.049 ( 11.395 10.586 -0.285) 15.556 12.326 ( 11.947 5.439 -8.766) 15.785 12.824 ( 11.041 -4.914 -8.300) 14.661 13.149 ( 4.441 -8.865 -2.436) 10.210 13.440 ( -4.631 2.951 -9.500) 10.973 13.481 ( 9.439 1.805 -9.380) 13.430 13.786 ( -3.547 -8.811 -16.660) 19.177 13.992 ( -17.219 6.657 -16.001) 24.430 14.412 ( 26.324 6.304 12.524) 29.825 14.938 ( 14.788 3.707 15.574) 21.794 15.659 ( -7.418 2.117 -8.959) 11.822 15.948 ( -8.636 -0.859 9.981) 13.227 16.383 ( 6.628 -2.336 -9.376) 11.717 16.490 ( 5.128 -22.032 3.433) 22.880 16.616 ( 1.695 -15.732 0.218) 15.825 16.867 ( -3.547 -2.461 -2.632) 5.056 17.113 ( -0.474 -2.477 9.976) 10.289 17.249 ( -3.178 -5.119 6.695) 9.007 18.840 ( -2.593 6.628 -5.115) 8.764 18.906 ( -2.600 9.499 -5.186) 11.131 19.083 ( 0.088 4.885 2.954) 5.710 19.381 ( -6.730 2.222 -3.333) 7.832 ======================= Grid point 202 (70/120) ======================= q-point: ( 0.44 0.14 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.290 ( 6.820 -2.038 -2.180) 7.445 2.395 ( -2.923 -4.485 -4.963) 7.300 2.569 ( -0.832 5.261 -4.635) 7.060 2.596 ( -1.905 2.049 -2.704) 3.891 2.763 ( 5.151 -9.441 0.516) 10.767 2.866 ( -4.705 -9.948 1.193) 11.069 3.111 ( 2.857 4.299 -1.153) 5.288 3.183 ( -4.101 2.592 -0.103) 4.853 3.430 ( 0.330 1.029 -2.371) 2.605 3.482 ( -4.516 1.444 -4.472) 6.518 4.130 ( 4.061 -18.069 7.321) 19.914 4.207 ( -2.078 -17.331 8.665) 19.488 4.981 ( 5.128 16.448 1.641) 17.307 5.066 ( -3.954 19.814 1.105) 20.235 5.438 ( 20.953 0.438 -11.222) 23.773 5.699 ( 16.018 7.041 -6.045) 18.512 5.930 ( -24.912 -2.227 -15.562) 29.458 6.089 ( -21.503 7.397 -13.077) 26.232 6.875 ( 11.329 -2.071 7.979) 14.011 7.035 ( -2.704 -5.136 4.838) 7.556 7.273 ( -0.095 5.829 6.921) 9.049 7.299 ( -1.218 3.994 4.900) 6.438 7.596 ( 5.735 3.422 -0.072) 6.679 7.713 ( -4.088 1.010 -0.540) 4.245 7.968 ( 0.771 4.432 -0.172) 4.502 7.997 ( -0.592 2.510 -3.410) 4.275 8.364 ( -1.758 -10.962 5.260) 12.285 8.415 ( -5.544 -10.026 2.053) 11.640 9.483 ( 8.027 9.812 5.228) 13.712 9.601 ( -3.224 7.752 2.916) 8.888 9.747 ( 9.282 1.770 -1.572) 9.579 9.908 ( -4.261 0.512 -2.608) 5.022 10.327 ( -3.430 -4.545 0.069) 5.695 10.364 ( -5.476 -3.952 -0.053) 6.754 11.175 ( 8.266 -9.575 8.754) 15.383 11.322 ( -5.676 -11.114 8.102) 14.879 11.485 ( 7.520 13.706 15.126) 21.753 11.647 ( -8.675 13.082 14.082) 21.088 12.290 ( 11.449 5.847 -2.570) 13.110 12.443 ( -1.756 3.838 -6.296) 7.580 13.059 ( 11.751 -6.638 -12.699) 18.532 13.257 ( 2.669 -7.068 -9.672) 12.273 13.311 ( -1.519 -2.467 -9.728) 10.150 13.580 ( -14.307 -5.232 -11.924) 19.345 13.654 ( 4.168 7.101 -7.127) 10.890 13.751 ( -5.077 9.089 -13.926) 17.387 14.950 ( 25.398 2.652 7.122) 26.511 15.288 ( 13.454 0.176 9.546) 16.498 15.422 ( -11.197 4.091 2.560) 12.193 15.694 ( -16.306 1.656 10.366) 19.393 16.536 ( 7.240 -7.047 -4.522) 11.069 16.575 ( 2.643 -20.549 3.213) 20.966 16.646 ( 1.735 -13.647 0.557) 13.768 16.754 ( -7.246 -2.466 -2.557) 8.070 17.124 ( 1.696 -5.487 8.818) 10.523 17.179 ( -3.493 -6.146 8.190) 10.819 18.822 ( 0.644 10.002 -7.351) 12.429 18.855 ( -2.372 11.141 -7.172) 13.460 19.126 ( 4.242 3.138 -0.773) 5.333 19.241 ( -6.779 2.587 -3.066) 7.877 ======================= Grid point 207 (71/120) ======================= q-point: ( 0.00 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.779 ( 0.000 7.094 15.857) 17.372 2.000 ( 0.000 15.439 14.240) 21.004 2.453 ( 0.000 -3.315 -0.572) 3.364 2.790 ( 0.000 -8.877 -5.802) 10.605 2.855 ( 0.000 -13.565 -1.821) 13.687 3.032 ( 0.000 8.096 -1.097) 8.169 3.137 ( 0.000 6.097 3.776) 7.171 3.287 ( 0.000 -3.723 -9.593) 10.290 3.413 ( 0.000 2.185 -12.227) 12.421 3.562 ( 0.000 2.799 -4.217) 5.061 3.686 ( 0.000 -5.861 -2.170) 6.250 4.318 ( 0.000 -13.628 -8.439) 16.029 5.132 ( 0.000 17.251 12.912) 21.548 5.568 ( 0.000 9.024 10.910) 14.159 5.575 ( 0.000 17.707 7.184) 19.109 5.670 ( 0.000 10.252 13.909) 17.279 6.104 ( 0.000 -3.014 13.341) 13.677 6.106 ( 0.000 -6.527 16.575) 17.814 6.838 ( 0.000 3.131 -7.557) 8.180 6.940 ( 0.000 -12.864 1.153) 12.916 7.134 ( 0.000 -7.627 -11.671) 13.942 7.260 ( 0.000 -12.791 -3.677) 13.309 7.704 ( 0.000 4.689 -13.544) 14.333 7.772 ( 0.000 0.515 -24.990) 24.995 8.417 ( 0.000 7.399 -4.698) 8.765 8.420 ( 0.000 3.313 10.563) 11.071 8.506 ( 0.000 6.917 -4.780) 8.408 8.778 ( 0.000 -6.452 -8.207) 10.440 9.050 ( 0.000 -4.545 -5.301) 6.983 9.188 ( 0.000 -10.890 -3.915) 11.572 9.458 ( 0.000 -1.330 -9.422) 9.516 9.483 ( 0.000 -2.209 -7.956) 8.257 10.331 ( 0.000 3.982 13.702) 14.269 10.664 ( 0.000 -7.285 12.277) 14.275 11.219 ( 0.000 3.030 16.810) 17.081 11.268 ( 0.000 -2.415 15.842) 16.025 11.505 ( 0.000 10.816 8.333) 13.654 11.804 ( 0.000 4.743 -3.300) 5.778 11.927 ( 0.000 11.742 -12.386) 17.067 12.001 ( 0.000 0.379 4.286) 4.303 12.539 ( 0.000 2.757 1.688) 3.233 12.915 ( 0.000 -5.703 3.772) 6.838 13.025 ( 0.000 3.973 -6.902) 7.964 13.117 ( 0.000 16.953 6.789) 18.262 13.599 ( 0.000 -5.214 -9.377) 10.729 14.101 ( 0.000 3.526 -5.625) 6.639 14.703 ( 0.000 -0.811 6.630) 6.680 14.952 ( 0.000 3.886 -17.591) 18.015 15.581 ( 0.000 4.728 -18.423) 19.020 15.768 ( 0.000 -25.148 -1.021) 25.169 15.895 ( 0.000 -11.166 6.493) 12.917 16.099 ( 0.000 -2.192 -17.427) 17.564 16.410 ( 0.000 -6.357 2.829) 6.958 16.716 ( 0.000 -9.778 -9.577) 13.687 17.284 ( 0.000 0.454 12.219) 12.227 17.293 ( 0.000 -0.331 11.595) 11.600 19.053 ( 0.000 2.039 8.125) 8.377 19.113 ( 0.000 0.399 2.061) 2.099 19.346 ( 0.000 10.588 2.085) 10.792 19.628 ( 0.000 0.592 -1.643) 1.747 ======================= Grid point 208 (72/120) ======================= q-point: ( 0.11 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 7.213 5.091 15.716) 18.026 2.035 ( 3.303 13.361 11.141) 17.707 2.474 ( 2.017 -2.940 -0.287) 3.577 2.747 ( -4.056 -7.400 -4.912) 9.764 2.830 ( -2.437 -12.767 -1.551) 13.090 2.959 ( -5.597 4.602 -3.842) 8.202 3.192 ( 2.649 -0.168 4.815) 5.498 3.334 ( 3.059 0.036 -8.008) 8.572 3.410 ( 0.853 -0.161 -11.990) 12.022 3.565 ( 0.187 3.962 -7.543) 8.522 3.684 ( 0.921 -3.589 -0.065) 3.706 4.257 ( -5.830 -11.987 -7.868) 15.478 5.120 ( -2.456 16.942 13.763) 21.965 5.432 ( -8.656 2.245 13.744) 16.397 5.492 ( -4.675 13.633 8.378) 16.670 5.697 ( 0.351 19.963 4.101) 20.383 6.185 ( 7.561 -1.051 14.792) 16.646 6.284 ( 13.819 -5.596 15.269) 21.341 6.844 ( 0.312 2.125 -8.360) 8.631 6.995 ( 3.701 -10.655 -1.376) 11.363 7.129 ( -4.221 -10.729 -7.210) 13.598 7.223 ( 1.218 -8.416 -8.990) 12.374 7.637 ( -6.172 5.235 -11.362) 13.950 7.770 ( -0.595 -1.236 -18.527) 18.578 8.187 ( -11.337 6.265 3.173) 13.336 8.302 ( -9.619 1.396 -4.023) 10.519 8.590 ( -3.011 -8.165 0.719) 8.732 8.782 ( -1.194 2.871 -5.128) 5.997 9.048 ( 6.492 -0.080 0.206) 6.495 9.351 ( 7.687 -1.556 -5.098) 9.354 9.523 ( 5.639 -1.405 -9.484) 11.123 9.577 ( 10.959 -1.611 -9.547) 14.623 10.364 ( 2.713 2.324 12.787) 13.277 10.737 ( 6.596 -9.177 10.605) 15.498 11.077 ( -13.774 -1.683 11.545) 18.052 11.137 ( -8.826 -2.986 14.644) 17.356 11.487 ( 0.039 15.042 8.831) 17.443 11.906 ( 8.855 5.106 -4.066) 11.001 12.011 ( 7.011 15.236 -9.734) 19.392 12.219 ( 16.881 -3.595 3.328) 17.577 12.450 ( -6.866 6.073 2.347) 9.462 12.817 ( -4.359 -3.042 9.999) 11.324 13.108 ( 7.812 2.996 -12.353) 14.920 13.338 ( 14.994 7.272 3.229) 16.975 13.588 ( -0.741 -3.737 -8.551) 9.361 14.063 ( -3.164 1.984 -2.560) 4.528 14.664 ( -4.814 0.178 2.634) 5.490 14.884 ( -4.112 8.216 -12.176) 15.253 15.652 ( 5.125 -1.311 -16.042) 16.892 15.788 ( 1.865 -25.979 -0.700) 26.055 15.921 ( 2.409 -7.628 4.893) 9.377 16.121 ( 2.302 -2.044 -14.582) 14.903 16.412 ( 0.378 -6.043 1.476) 6.232 16.752 ( 3.042 -9.150 -9.416) 13.477 17.235 ( -4.452 0.249 12.994) 13.738 17.277 ( -1.919 -1.681 10.535) 10.840 19.032 ( -1.993 2.324 6.523) 7.205 19.094 ( -1.594 1.532 1.668) 2.770 19.329 ( -1.607 10.507 1.619) 10.752 19.604 ( -2.337 0.788 -1.939) 3.137 ======================= Grid point 209 (73/120) ======================= q-point: ( 0.22 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( 10.347 1.223 13.486) 17.042 2.126 ( 5.937 7.936 5.501) 11.336 2.530 ( 3.352 -1.855 0.528) 3.867 2.641 ( -6.174 -5.969 -2.410) 8.919 2.769 ( -3.080 -10.335 -1.770) 10.929 2.842 ( -5.795 1.441 -5.760) 8.297 3.165 ( -3.454 -5.049 2.907) 6.773 3.341 ( -3.050 -1.264 -6.983) 7.724 3.479 ( 3.911 0.627 -10.310) 11.045 3.575 ( 0.444 -0.845 -7.354) 7.415 3.759 ( 6.447 0.027 1.085) 6.538 4.105 ( -8.515 -8.718 -6.102) 13.629 5.035 ( -3.564 11.123 10.724) 15.857 5.261 ( -7.693 -0.595 8.347) 11.367 5.514 ( 6.358 18.636 9.545) 21.882 5.674 ( -2.526 22.237 -0.325) 22.382 6.383 ( 11.556 3.023 13.455) 17.992 6.548 ( 10.035 -4.110 7.507) 13.189 6.799 ( -12.732 -3.458 -13.386) 18.794 6.871 ( -5.007 -4.994 -7.853) 10.568 7.172 ( 6.991 -7.336 -1.781) 10.289 7.329 ( 7.099 -6.795 -4.441) 10.784 7.490 ( -7.162 6.344 -3.596) 10.221 7.737 ( -2.165 -2.183 -8.849) 9.368 8.031 ( -4.448 4.406 2.295) 6.669 8.118 ( -7.484 -4.650 -1.938) 9.022 8.482 ( -7.154 -6.276 1.041) 9.573 8.638 ( -10.265 -4.751 -2.427) 11.569 9.273 ( 12.074 8.966 5.204) 15.914 9.476 ( 6.277 4.365 -3.421) 8.376 9.659 ( 7.751 1.214 -8.431) 11.517 9.825 ( 10.522 4.531 -8.524) 14.280 10.413 ( 1.320 -2.466 9.821) 10.212 10.765 ( -14.242 -1.729 4.040) 14.904 10.865 ( -1.253 -7.344 10.787) 13.110 10.990 ( 0.128 -13.876 10.352) 17.313 11.541 ( 5.018 18.326 11.598) 22.260 12.081 ( 6.822 7.252 -5.406) 11.329 12.177 ( 7.426 13.285 -3.627) 15.645 12.321 ( -1.577 11.624 0.828) 11.760 12.525 ( 9.790 -5.654 -3.042) 11.708 12.835 ( 6.354 -8.201 8.971) 13.715 13.292 ( 10.360 2.251 -10.992) 15.272 13.538 ( 0.729 -1.430 -16.999) 17.075 13.620 ( 4.433 -2.020 -1.811) 5.198 14.050 ( 4.726 -1.828 7.527) 9.073 14.512 ( -7.807 10.315 -6.079) 14.293 14.877 ( 3.887 9.265 3.981) 10.807 15.706 ( -0.851 -7.449 -16.808) 18.404 15.849 ( 4.074 -30.508 2.970) 30.921 15.970 ( 2.210 -1.033 5.813) 6.304 16.195 ( 4.479 -2.598 -8.776) 10.190 16.429 ( 1.336 -3.811 -1.452) 4.292 16.809 ( 1.881 -7.149 -7.737) 10.701 17.121 ( -6.269 -2.316 12.475) 14.152 17.215 ( -4.248 -4.610 9.342) 11.251 18.988 ( -1.816 4.082 2.220) 4.989 19.065 ( -0.918 3.427 0.387) 3.568 19.283 ( -2.911 10.220 0.332) 10.632 19.535 ( -4.526 1.316 -2.681) 5.423 ======================= Grid point 210 (74/120) ======================= q-point: ( 0.33 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( 4.620 2.177 2.773) 5.812 2.291 ( 8.198 -2.618 5.665) 10.303 2.514 ( -5.117 -5.989 1.778) 8.075 2.600 ( 3.338 -0.318 0.468) 3.386 2.726 ( -3.738 -9.058 2.201) 10.043 2.739 ( -1.559 3.668 -9.569) 10.366 3.123 ( -0.102 -2.646 -0.614) 2.718 3.259 ( -4.543 -3.682 -3.942) 7.053 3.496 ( -1.143 2.455 -6.202) 6.768 3.565 ( -2.061 -2.081 -4.694) 5.533 3.844 ( -0.861 -6.580 1.141) 6.734 3.975 ( -2.777 -8.843 -1.619) 9.409 5.055 ( 6.107 7.479 2.583) 9.995 5.187 ( 1.775 -0.854 -0.390) 2.008 5.589 ( -4.933 21.881 -3.014) 22.631 5.701 ( 10.487 20.068 6.088) 23.448 6.371 ( -22.817 -2.820 -17.633) 28.974 6.583 ( -8.663 5.806 -9.528) 14.126 6.638 ( 11.520 1.723 11.799) 16.580 6.900 ( 4.986 -4.395 3.008) 7.296 7.298 ( 4.551 -2.683 -0.572) 5.314 7.394 ( -1.208 3.783 3.597) 5.358 7.463 ( 4.800 -2.606 1.164) 5.585 7.755 ( 5.532 -2.089 -3.890) 7.078 7.956 ( -4.023 0.322 0.814) 4.117 8.028 ( -1.419 -4.747 2.074) 5.371 8.296 ( -10.994 -8.299 2.870) 14.070 8.431 ( -9.955 -4.080 0.655) 10.779 9.496 ( 10.500 6.831 5.587) 13.716 9.612 ( 7.001 6.607 -0.232) 9.629 9.811 ( 6.357 7.897 -4.149) 10.954 9.950 ( 1.941 8.393 -3.878) 9.447 10.377 ( -5.181 -5.190 2.979) 7.915 10.471 ( -13.258 -2.252 2.332) 13.649 10.839 ( 2.389 -10.189 8.424) 13.434 11.067 ( 2.477 -17.730 8.412) 19.780 11.670 ( 7.460 20.048 13.544) 25.318 12.089 ( -4.934 13.716 6.416) 15.926 12.281 ( 6.701 13.567 -2.680) 15.367 12.456 ( 9.282 6.735 -9.319) 14.777 12.697 ( 9.160 -7.752 -9.182) 15.110 12.946 ( 3.519 -12.517 3.507) 13.466 13.410 ( -6.891 -3.980 -13.895) 16.013 13.536 ( 1.249 -3.768 -11.406) 12.077 13.660 ( 5.866 2.877 -3.906) 7.612 14.129 ( -2.057 5.062 -9.978) 11.376 14.557 ( 15.500 9.911 6.271) 19.438 15.042 ( 12.264 7.196 11.394) 18.221 15.620 ( -7.355 -9.825 -12.507) 17.523 15.887 ( -2.083 -13.641 4.675) 14.569 16.030 ( 4.188 -13.427 7.436) 15.909 16.256 ( 0.593 -8.256 -1.082) 8.348 16.475 ( 3.695 0.484 -3.346) 5.008 16.803 ( -2.693 -3.861 -3.807) 6.054 17.012 ( -4.009 -7.200 9.568) 12.628 17.115 ( -5.322 -8.153 7.581) 12.340 18.978 ( 1.005 6.983 -2.523) 7.492 19.065 ( 0.866 5.651 -2.425) 6.210 19.219 ( -3.084 8.867 -1.038) 9.446 19.426 ( -6.210 1.995 -3.424) 7.367 ======================= Grid point 211 (75/120) ======================= q-point: ( 0.44 0.29 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( 2.928 -0.902 -0.684) 3.139 2.327 ( -3.341 -2.109 -2.955) 4.934 2.520 ( 4.818 -9.101 7.882) 12.968 2.621 ( -4.681 -7.515 -0.100) 8.854 2.688 ( 4.011 4.612 -0.586) 6.140 2.741 ( -0.620 2.464 -5.084) 5.684 3.146 ( 1.459 -1.510 -3.321) 3.929 3.180 ( -2.724 -3.158 -3.072) 5.180 3.474 ( -0.431 3.683 -2.013) 4.219 3.502 ( -3.018 0.368 -2.356) 3.847 3.828 ( 1.727 -12.594 3.721) 13.245 3.908 ( -4.902 -13.082 3.500) 14.402 5.230 ( 9.167 8.715 -4.115) 13.301 5.332 ( 6.422 5.573 -5.710) 10.242 5.502 ( 2.596 7.568 -11.048) 13.641 5.818 ( -14.553 -1.356 -11.826) 18.801 6.024 ( 5.304 18.813 -3.383) 19.837 6.303 ( -16.080 15.701 -7.317) 23.635 6.863 ( 9.043 0.666 8.888) 12.697 6.963 ( -0.391 -3.295 5.326) 6.275 7.347 ( 1.070 1.404 1.698) 2.450 7.367 ( -1.410 3.399 3.941) 5.392 7.609 ( 9.759 -1.351 -0.353) 9.858 7.802 ( -7.168 3.600 -0.732) 8.055 7.968 ( 7.810 -3.081 2.001) 8.631 8.036 ( 2.281 -3.100 3.617) 5.282 8.102 ( -5.877 -12.757 6.601) 15.519 8.226 ( -10.617 -6.330 1.495) 12.451 9.699 ( 9.041 8.911 6.141) 14.102 9.749 ( 6.071 6.920 4.000) 10.037 9.859 ( -1.417 11.630 -0.663) 11.734 9.927 ( -4.452 1.979 -0.574) 4.905 10.251 ( -3.162 -2.358 -1.609) 4.260 10.293 ( -5.437 -2.075 -1.821) 6.098 10.940 ( 6.240 -14.517 7.790) 17.617 11.049 ( -3.848 -16.774 7.922) 18.945 11.825 ( 7.600 21.116 13.426) 26.151 11.968 ( -6.628 19.368 10.814) 23.151 12.435 ( 7.758 9.130 -5.711) 13.272 12.545 ( -1.583 6.633 -8.635) 11.003 12.902 ( 10.875 -9.570 -12.438) 19.093 13.041 ( 3.973 -15.016 -2.287) 15.700 13.223 ( -5.664 -6.840 -10.346) 13.635 13.377 ( -12.486 -13.637 -4.226) 18.967 13.882 ( 10.766 16.474 -9.462) 21.837 14.045 ( -5.675 19.059 -13.078) 23.801 14.956 ( 20.540 -4.020 0.898) 20.949 15.256 ( -1.688 -6.105 -1.210) 6.448 15.493 ( 3.909 3.181 7.136) 8.736 15.739 ( -12.261 2.939 9.563) 15.825 16.124 ( 4.903 -22.340 6.843) 23.873 16.217 ( -3.859 -16.829 4.624) 17.874 16.581 ( 6.483 0.686 -2.599) 7.018 16.712 ( -5.971 -1.622 -2.333) 6.612 16.973 ( 0.308 -9.568 6.994) 11.855 17.019 ( -3.872 -9.906 6.310) 12.367 19.022 ( 2.973 9.700 -5.468) 11.525 19.074 ( -1.304 10.274 -5.848) 11.894 19.196 ( 2.243 3.830 -1.529) 4.695 19.295 ( -6.405 2.529 -3.315) 7.643 ======================= Grid point 216 (76/120) ======================= q-point: ( 0.00 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.961 ( 0.000 11.097 9.258) 14.452 2.139 ( 0.000 -4.344 4.582) 6.313 2.484 ( 0.000 7.098 6.517) 9.636 2.634 ( 0.000 -9.360 -1.124) 9.428 2.735 ( 0.000 6.361 -0.300) 6.368 2.991 ( 0.000 -16.011 8.292) 18.031 3.205 ( 0.000 8.966 -8.204) 12.153 3.294 ( 0.000 1.235 -17.224) 17.268 3.440 ( 0.000 1.059 -11.034) 11.085 3.514 ( 0.000 -7.838 -4.070) 8.832 3.766 ( 0.000 13.355 -7.582) 15.357 4.043 ( 0.000 -15.007 -8.699) 17.346 5.478 ( 0.000 17.710 24.190) 29.980 5.725 ( 0.000 -5.026 23.286) 23.822 5.761 ( 0.000 9.979 12.935) 16.337 5.917 ( 0.000 14.560 5.641) 15.614 5.945 ( 0.000 -9.513 15.968) 18.587 6.095 ( 0.000 -0.856 1.582) 1.798 6.722 ( 0.000 -2.612 0.963) 2.783 6.897 ( 0.000 -15.712 -3.848) 16.177 6.946 ( 0.000 5.903 -9.604) 11.273 7.070 ( 0.000 -7.215 -8.822) 11.396 7.763 ( 0.000 1.734 -17.622) 17.707 7.778 ( 0.000 -0.028 -21.650) 21.650 8.413 ( 0.000 1.609 2.509) 2.981 8.483 ( 0.000 -5.212 0.815) 5.275 8.679 ( 0.000 14.344 -0.185) 14.345 8.825 ( 0.000 7.171 -10.756) 12.928 8.950 ( 0.000 -13.664 -2.131) 13.829 8.952 ( 0.000 -5.796 -7.902) 9.800 9.439 ( 0.000 -0.495 -9.302) 9.316 9.446 ( 0.000 -1.316 -8.686) 8.785 10.425 ( 0.000 5.710 16.443) 17.406 10.540 ( 0.000 -6.212 16.301) 17.445 11.233 ( 0.000 -0.254 14.875) 14.877 11.236 ( 0.000 -0.843 14.943) 14.966 11.742 ( 0.000 11.039 10.109) 14.968 11.890 ( 0.000 -5.494 4.338) 7.000 11.929 ( 0.000 9.068 -5.269) 10.488 12.091 ( 0.000 -3.496 -5.396) 6.429 12.586 ( 0.000 6.699 -1.021) 6.776 12.763 ( 0.000 -9.673 -0.080) 9.673 13.142 ( 0.000 7.865 -14.118) 16.161 13.293 ( 0.000 -5.420 -16.475) 17.344 13.735 ( 0.000 22.901 8.573) 24.453 14.088 ( 0.000 -8.507 1.095) 8.578 14.707 ( 0.000 1.903 10.759) 10.925 14.844 ( 0.000 -12.554 6.693) 14.227 15.506 ( 0.000 -1.579 -17.730) 17.800 15.561 ( 0.000 -4.965 -18.296) 18.958 15.878 ( 0.000 7.080 -3.543) 7.917 16.025 ( 0.000 -6.516 -10.983) 12.771 16.355 ( 0.000 2.576 -3.773) 4.568 16.502 ( 0.000 -11.204 -9.252) 14.530 17.288 ( 0.000 0.060 12.832) 12.832 17.289 ( 0.000 -0.108 12.950) 12.951 19.088 ( 0.000 1.584 7.395) 7.563 19.110 ( 0.000 -0.717 5.125) 5.175 19.520 ( 0.000 7.195 -0.133) 7.197 19.612 ( 0.000 -2.600 -1.193) 2.860 ======================= Grid point 217 (77/120) ======================= q-point: ( 0.11 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( 3.622 9.403 9.805) 14.059 2.153 ( 1.327 -3.834 4.481) 6.045 2.497 ( 1.440 5.697 5.250) 7.880 2.624 ( -0.993 -8.290 -1.494) 8.482 2.704 ( -2.861 5.789 -0.588) 6.484 2.925 ( -5.338 -12.162 2.312) 13.482 3.188 ( -2.334 7.314 -0.820) 7.721 3.346 ( 1.424 -5.535 -13.280) 14.458 3.411 ( -0.465 3.446 -11.371) 11.890 3.497 ( -0.258 -6.073 -8.654) 10.576 3.798 ( 2.497 11.239 -6.940) 13.443 4.025 ( -1.895 -12.267 -8.141) 14.844 5.394 ( -10.010 9.324 19.608) 23.908 5.467 ( -12.858 0.307 16.295) 20.759 5.781 ( 2.504 17.441 10.376) 20.448 6.056 ( 10.735 8.916 15.689) 20.998 6.112 ( 5.968 -7.417 4.739) 10.634 6.192 ( 11.499 0.086 11.474) 16.244 6.753 ( 2.067 -4.890 -0.390) 5.323 6.860 ( -4.846 -12.943 -4.806) 14.633 6.982 ( 3.999 4.465 -9.273) 11.042 7.093 ( 3.330 -6.256 -10.287) 12.492 7.711 ( -4.755 2.656 -14.290) 15.293 7.747 ( -2.861 -1.369 -16.830) 17.127 8.235 ( -11.872 1.529 0.058) 11.970 8.291 ( -14.708 -3.770 -1.336) 15.242 8.584 ( -3.989 7.132 -0.958) 8.227 8.735 ( -8.724 -6.870 -3.142) 11.541 9.135 ( 17.325 7.803 -2.288) 19.138 9.280 ( 14.874 -6.309 -4.439) 16.755 9.511 ( 7.626 0.846 -9.907) 12.531 9.543 ( 11.258 -1.953 -10.287) 15.375 10.442 ( 1.208 5.899 15.919) 17.020 10.577 ( 3.454 -7.891 15.568) 17.792 11.058 ( -13.995 -0.049 11.434) 18.072 11.080 ( -12.735 -2.296 12.135) 17.740 11.797 ( 3.992 15.538 8.412) 18.114 11.970 ( 8.073 -0.314 -1.254) 8.175 12.137 ( 14.961 -1.652 -0.465) 15.059 12.174 ( 8.386 -2.206 -2.461) 9.014 12.536 ( -3.920 8.261 -1.747) 9.309 12.721 ( -3.100 -8.329 0.548) 8.904 13.207 ( 6.152 7.113 -13.486) 16.441 13.357 ( 5.393 -7.357 -15.901) 18.332 13.734 ( -0.466 19.251 6.420) 20.298 14.031 ( -5.198 -8.046 3.194) 10.097 14.706 ( 0.579 5.613 10.740) 12.132 14.891 ( 4.671 -10.005 6.956) 13.050 15.442 ( -4.610 -2.411 -14.300) 15.217 15.542 ( -2.407 -8.909 -18.218) 20.422 15.946 ( 5.162 5.801 -3.354) 8.459 16.060 ( 3.249 -5.218 -7.297) 9.541 16.380 ( 2.594 4.213 -5.559) 7.442 16.544 ( 3.884 -11.316 -9.848) 15.496 17.238 ( -4.907 0.339 12.890) 13.796 17.251 ( -3.854 -1.059 12.467) 13.092 19.075 ( -1.086 2.024 6.110) 6.527 19.101 ( -0.699 -0.636 4.403) 4.503 19.502 ( -1.742 7.106 -0.556) 7.337 19.592 ( -1.989 -2.435 -1.538) 3.500 ======================= Grid point 218 (78/120) ======================= q-point: ( 0.22 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( 5.677 4.567 10.172) 12.512 2.186 ( 1.832 -2.896 4.513) 5.666 2.535 ( 1.022 1.116 0.873) 1.747 2.593 ( -2.063 -3.997 -3.959) 5.992 2.644 ( -1.695 5.564 3.846) 6.973 2.823 ( -3.729 -7.424 -3.126) 8.876 3.115 ( -3.972 4.220 1.841) 6.080 3.264 ( -5.838 -7.795 -5.204) 11.042 3.479 ( 3.349 0.298 -12.292) 12.744 3.510 ( 0.554 -2.972 -9.775) 10.232 3.843 ( 1.431 6.303 -6.095) 8.884 3.964 ( -4.188 -6.512 -7.115) 10.516 5.183 ( -7.858 4.826 11.255) 14.550 5.241 ( -8.782 -1.716 10.090) 13.486 5.929 ( 9.867 23.203 9.930) 27.099 6.089 ( -3.215 17.974 -2.123) 18.382 6.361 ( 13.025 -12.331 15.519) 23.718 6.413 ( 8.460 -7.061 13.070) 17.095 6.692 ( -8.832 -0.956 -9.425) 12.952 6.786 ( 0.982 -7.055 -7.042) 10.016 7.108 ( 7.717 2.847 -6.439) 10.446 7.211 ( 7.621 -6.244 -7.117) 12.154 7.598 ( -5.667 5.108 -5.206) 9.236 7.684 ( -2.778 -3.633 -7.527) 8.807 8.026 ( -8.714 -2.484 -1.189) 9.138 8.034 ( -9.976 -3.135 -0.511) 10.469 8.469 ( -7.550 4.011 0.669) 8.575 8.559 ( -8.962 -4.382 0.062) 9.976 9.399 ( 9.610 5.388 0.562) 11.032 9.489 ( 7.918 -3.505 -2.382) 8.980 9.758 ( 15.200 8.216 -7.729) 18.928 9.869 ( 17.660 -1.818 -9.639) 20.201 10.437 ( -3.041 6.615 14.560) 16.279 10.651 ( 1.318 -13.958 14.621) 20.256 10.762 ( -12.748 1.419 5.443) 13.934 10.818 ( -11.472 -4.647 7.398) 14.420 11.906 ( 7.037 18.668 8.139) 21.547 12.147 ( 9.494 -2.605 -2.903) 10.264 12.344 ( 4.881 -0.824 1.131) 5.078 12.405 ( 9.606 -5.900 -2.895) 11.639 12.493 ( 1.514 12.681 -4.999) 13.714 12.702 ( 2.253 -7.496 -0.090) 7.828 13.363 ( 7.798 4.826 -12.711) 15.673 13.467 ( 3.827 -5.654 -13.864) 15.454 13.699 ( -1.923 11.053 0.748) 11.244 13.934 ( -1.529 -10.598 6.861) 12.717 14.763 ( 5.070 16.409 9.665) 19.707 15.028 ( 8.745 -0.736 6.563) 10.959 15.357 ( -3.639 -12.825 -6.888) 15.006 15.469 ( -4.165 -13.684 -15.555) 21.132 16.033 ( 3.068 5.251 -0.020) 6.081 16.134 ( 3.197 -4.727 -3.006) 6.450 16.456 ( 4.644 6.737 -7.017) 10.780 16.634 ( 4.419 -10.465 -9.217) 14.628 17.097 ( -8.734 0.416 12.489) 15.246 17.136 ( -7.404 -3.385 11.247) 13.885 19.059 ( -0.061 3.067 2.898) 4.220 19.093 ( 0.208 -0.346 2.101) 2.140 19.451 ( -3.348 6.779 -1.684) 7.746 19.533 ( -3.898 -1.943 -2.427) 4.986 ======================= Grid point 219 (79/120) ======================= q-point: ( 0.33 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( 3.985 0.338 5.609) 6.889 2.235 ( 3.904 -2.901 6.511) 8.127 2.465 ( -5.727 1.060 0.035) 5.824 2.545 ( -3.853 -6.750 -1.155) 7.857 2.695 ( 5.589 7.506 3.327) 9.933 2.811 ( 2.425 -0.763 -7.465) 7.885 3.054 ( -1.994 -0.150 1.488) 2.493 3.156 ( -4.728 -7.159 -3.827) 9.395 3.507 ( 0.447 -0.841 -7.203) 7.266 3.508 ( -0.500 -1.976 -4.372) 4.823 3.813 ( -5.520 1.668 -3.215) 6.602 3.863 ( -5.456 -3.577 -5.062) 8.258 5.142 ( 4.328 2.478 0.729) 5.040 5.171 ( 2.865 -0.949 -0.034) 3.018 5.931 ( -11.627 14.216 -8.477) 20.227 6.067 ( -4.217 7.137 -3.455) 8.981 6.340 ( -2.926 8.282 1.181) 8.863 6.614 ( 9.017 -8.406 12.311) 17.422 6.729 ( 8.552 5.508 4.649) 11.184 6.801 ( 0.291 -3.570 -7.451) 8.267 7.257 ( 6.736 1.347 -3.777) 7.839 7.348 ( 4.929 -5.694 -3.326) 8.233 7.520 ( -1.929 6.239 3.834) 7.572 7.672 ( 2.382 -7.547 -0.230) 7.918 7.880 ( -5.303 -3.814 -1.326) 6.665 7.908 ( -2.563 -5.279 1.649) 6.096 8.286 ( -10.218 4.753 3.409) 11.774 8.372 ( -9.808 -3.486 2.596) 10.727 9.581 ( 9.290 3.808 1.288) 10.123 9.646 ( 8.163 -2.426 -0.709) 8.545 10.022 ( 9.046 12.360 -0.426) 15.323 10.170 ( 11.019 5.791 -6.280) 13.942 10.286 ( -10.943 2.034 9.466) 14.611 10.446 ( -11.360 -2.605 4.729) 12.578 10.668 ( -3.778 -6.216 6.192) 9.553 10.736 ( 0.824 -14.422 7.381) 16.222 12.075 ( 9.341 21.305 9.815) 25.248 12.317 ( 4.177 9.594 -2.660) 10.797 12.427 ( 8.530 -10.245 1.447) 13.409 12.512 ( 4.473 -0.894 -0.847) 4.639 12.590 ( 5.189 3.979 -11.783) 13.476 12.746 ( 0.274 -6.611 -2.626) 7.118 13.333 ( -10.848 -1.635 -11.390) 15.814 13.396 ( -10.874 -6.960 -3.220) 13.306 13.859 ( 17.860 13.713 -4.424) 22.948 14.095 ( 16.376 -8.779 -3.410) 18.891 14.837 ( -0.340 19.496 -1.472) 19.554 15.201 ( -0.714 4.976 -2.670) 5.692 15.284 ( 4.733 -17.965 1.703) 18.656 15.481 ( 7.641 -17.873 4.955) 20.060 16.050 ( -2.301 5.170 3.272) 6.537 16.148 ( -2.729 -4.745 0.365) 5.486 16.548 ( 4.328 6.850 -3.661) 8.892 16.702 ( 2.093 -7.650 -5.585) 9.700 16.913 ( -8.710 -0.967 10.533) 13.702 16.972 ( -8.178 -6.121 8.119) 13.049 19.084 ( 2.717 3.946 -0.992) 4.892 19.120 ( 2.546 0.382 -0.942) 2.742 19.370 ( -4.600 6.037 -3.069) 8.187 19.438 ( -5.488 -1.170 -3.431) 6.577 ======================= Grid point 220 (80/120) ======================= q-point: ( 0.44 0.43 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 315 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( 3.186 1.841 2.393) 4.390 2.321 ( 1.292 -0.359 1.530) 2.034 2.371 ( -0.770 -3.447 4.968) 6.095 2.452 ( -5.035 -7.959 2.266) 9.687 2.814 ( 5.352 8.420 -0.460) 9.988 2.866 ( 1.094 7.444 -5.897) 9.559 3.031 ( 0.060 -8.144 -0.528) 8.161 3.074 ( -3.487 -7.992 -3.932) 9.565 3.517 ( 2.344 2.069 -0.932) 3.262 3.545 ( 2.797 1.678 -2.628) 4.188 3.673 ( -5.545 -2.677 0.046) 6.158 3.728 ( -7.515 -6.325 -1.353) 9.915 5.331 ( 13.139 2.921 -8.719) 16.037 5.362 ( 15.204 -0.425 -9.449) 17.906 5.645 ( -15.477 6.246 -12.412) 20.799 5.747 ( -20.142 -4.759 -13.880) 24.920 6.471 ( 9.845 24.032 4.482) 26.354 6.646 ( -6.151 17.080 1.640) 18.228 6.833 ( 4.413 -9.684 5.270) 11.875 6.867 ( 2.323 -5.090 5.987) 8.195 7.369 ( 4.181 2.192 -0.886) 4.803 7.424 ( 0.844 2.099 0.080) 2.263 7.510 ( 3.734 -5.680 1.410) 6.942 7.653 ( -6.695 -15.046 -0.839) 16.490 7.909 ( 7.604 0.121 4.072) 8.626 7.946 ( 6.937 -1.852 4.187) 8.312 8.082 ( -9.447 3.948 5.730) 11.734 8.159 ( -11.275 -3.263 4.045) 12.415 9.783 ( 10.872 3.021 2.656) 11.592 9.826 ( 9.875 -0.668 1.694) 10.042 10.004 ( -9.803 4.563 4.260) 11.622 10.044 ( -11.714 2.304 5.186) 13.016 10.312 ( 5.007 11.838 -1.846) 12.986 10.372 ( 0.012 10.540 -0.271) 10.543 10.645 ( 1.771 -15.313 5.376) 16.325 10.710 ( -3.174 -17.862 5.575) 18.979 12.249 ( 7.025 22.240 8.682) 24.886 12.335 ( -1.503 18.253 3.221) 18.596 12.564 ( 4.411 -4.991 -4.981) 8.317 12.643 ( -1.820 -2.374 -7.020) 7.631 12.725 ( 13.788 -7.788 2.327) 16.006 12.773 ( 6.249 -1.685 -10.722) 12.524 13.073 ( -12.358 -7.131 -10.421) 17.668 13.116 ( -14.887 -11.719 0.510) 18.953 14.246 ( 17.676 20.253 -8.839) 28.298 14.409 ( 7.623 14.230 -10.997) 19.532 14.779 ( 0.407 -9.453 -6.843) 11.677 14.985 ( -13.989 -20.249 -10.860) 26.901 15.575 ( 16.878 5.841 12.983) 22.080 15.713 ( 12.430 -7.985 10.436) 18.088 15.910 ( -10.717 1.989 9.356) 14.365 16.005 ( -11.077 -6.788 6.709) 14.621 16.633 ( 4.321 4.988 -0.143) 6.601 16.711 ( -2.109 1.126 -1.431) 2.786 16.794 ( -1.575 -7.561 5.640) 9.563 16.838 ( -4.766 -8.064 3.788) 10.105 19.162 ( 4.668 4.758 -3.803) 7.674 19.195 ( 4.493 1.732 -3.438) 5.917 19.273 ( -4.629 4.121 -3.784) 7.262 19.319 ( -6.056 -0.425 -3.805) 7.165 ======================= Grid point 252 (81/120) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( 0.000 0.000 21.452) 21.452 2.140 ( 0.000 0.000 19.852) 19.852 2.459 ( 0.000 0.000 0.345) 0.345 2.730 ( 0.000 0.000 -14.379) 14.379 2.775 ( 0.000 0.000 -14.618) 14.618 2.909 ( 0.000 0.000 -16.816) 16.816 2.961 ( 0.000 0.000 4.452) 4.452 3.213 ( 0.000 0.000 -8.092) 8.092 3.421 ( 0.000 0.000 7.701) 7.701 3.657 ( 0.000 0.000 -1.111) 1.111 4.039 ( 0.000 0.000 18.948) 18.948 4.531 ( 0.000 0.000 -8.805) 8.805 4.764 ( 0.000 0.000 2.382) 2.382 4.944 ( 0.000 0.000 -5.563) 5.563 5.788 ( 0.000 0.000 18.465) 18.465 5.822 ( 0.000 0.000 24.067) 24.067 6.355 ( 0.000 0.000 -4.222) 4.222 6.528 ( 0.000 0.000 14.555) 14.555 6.759 ( 0.000 0.000 10.663) 10.663 7.065 ( 0.000 0.000 -13.145) 13.145 7.149 ( 0.000 0.000 -33.203) 33.203 7.241 ( 0.000 0.000 -0.435) 0.435 7.306 ( 0.000 0.000 -10.119) 10.119 7.423 ( 0.000 0.000 -7.485) 7.485 8.067 ( 0.000 0.000 -4.018) 4.018 8.070 ( 0.000 0.000 -5.300) 5.300 8.757 ( 0.000 0.000 14.126) 14.126 9.040 ( 0.000 0.000 -1.874) 1.874 9.075 ( 0.000 0.000 -3.065) 3.065 9.217 ( 0.000 0.000 -9.502) 9.502 9.395 ( 0.000 0.000 -2.857) 2.857 9.443 ( 0.000 0.000 -3.955) 3.955 10.445 ( 0.000 0.000 10.300) 10.300 10.845 ( 0.000 0.000 -10.044) 10.044 11.279 ( 0.000 0.000 9.479) 9.479 11.337 ( 0.000 0.000 1.713) 1.713 11.531 ( 0.000 0.000 5.766) 5.766 11.590 ( 0.000 0.000 6.193) 6.193 11.805 ( 0.000 0.000 10.908) 10.908 12.182 ( 0.000 0.000 8.404) 8.404 12.303 ( 0.000 0.000 -1.773) 1.773 12.626 ( 0.000 0.000 -13.983) 13.983 13.160 ( 0.000 0.000 9.672) 9.672 13.477 ( 0.000 0.000 -3.378) 3.378 13.616 ( 0.000 0.000 21.271) 21.271 13.648 ( 0.000 0.000 -16.652) 16.652 14.315 ( 0.000 0.000 -12.880) 12.880 14.925 ( 0.000 0.000 14.929) 14.929 15.037 ( 0.000 0.000 -24.195) 24.195 15.731 ( 0.000 0.000 -22.752) 22.752 16.589 ( 0.000 0.000 2.924) 2.924 16.590 ( 0.000 0.000 6.882) 6.882 16.643 ( 0.000 0.000 3.570) 3.570 16.715 ( 0.000 0.000 -3.532) 3.532 17.378 ( 0.000 0.000 4.244) 4.244 17.380 ( 0.000 0.000 2.587) 2.587 18.973 ( 0.000 0.000 0.964) 0.964 19.043 ( 0.000 0.000 -2.417) 2.417 19.310 ( 0.000 0.000 9.569) 9.569 19.547 ( 0.000 0.000 -3.327) 3.327 ======================= Grid point 253 (82/120) ======================= q-point: ( 0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( 0.661 0.000 16.861) 16.874 2.211 ( 6.555 0.000 17.807) 18.975 2.436 ( -1.495 0.000 -3.640) 3.935 2.797 ( 1.081 0.000 -15.135) 15.173 2.811 ( 6.366 0.000 -9.851) 11.729 2.935 ( -1.627 0.000 5.552) 5.785 2.982 ( 6.040 0.000 -13.437) 14.732 3.171 ( -3.883 0.000 -7.608) 8.541 3.419 ( 0.542 0.000 6.267) 6.290 3.603 ( -4.859 0.000 -0.330) 4.870 4.063 ( 2.724 0.000 16.865) 17.084 4.474 ( -5.192 0.000 -7.503) 9.124 4.753 ( -1.199 0.000 2.560) 2.826 4.929 ( -1.465 0.000 -5.163) 5.366 5.685 ( -8.170 0.000 18.571) 20.289 5.744 ( -7.168 0.000 23.746) 24.804 6.363 ( -1.324 0.000 -12.290) 12.361 6.563 ( 3.219 0.000 13.407) 13.788 6.830 ( 7.077 0.000 13.289) 15.056 6.965 ( -13.971 0.000 -27.027) 30.424 7.064 ( 1.071 0.000 -12.183) 12.230 7.287 ( -1.293 0.000 -7.629) 7.737 7.354 ( 9.261 0.000 -1.936) 9.461 7.562 ( 9.215 0.000 -10.339) 13.850 7.904 ( -9.110 0.000 1.821) 9.290 8.115 ( -1.632 0.000 -8.301) 8.460 8.860 ( 9.366 0.000 12.671) 15.757 8.943 ( -6.935 0.000 1.164) 7.032 9.034 ( -6.762 0.000 -3.721) 7.719 9.281 ( 5.769 0.000 -8.808) 10.529 9.378 ( -0.337 0.000 -1.547) 1.584 9.485 ( 4.701 0.000 -5.941) 7.576 10.512 ( 5.591 0.000 9.694) 11.190 10.916 ( 3.855 0.000 -10.835) 11.500 11.313 ( 4.199 0.000 11.033) 11.805 11.357 ( -10.624 0.000 8.384) 13.533 11.457 ( 10.559 0.000 2.255) 10.797 11.505 ( -6.754 0.000 2.622) 7.245 11.800 ( -0.037 0.000 7.618) 7.618 12.246 ( -5.208 0.000 -0.497) 5.232 12.404 ( 17.099 0.000 7.741) 18.769 12.772 ( 12.096 0.000 -10.440) 15.979 13.158 ( 0.297 0.000 7.118) 7.124 13.412 ( -5.398 0.000 -3.233) 6.292 13.629 ( -1.955 0.000 -17.839) 17.946 13.727 ( 8.098 0.000 9.875) 12.771 14.250 ( -3.909 0.000 -1.825) 4.314 14.955 ( 3.176 0.000 16.866) 17.163 15.137 ( 8.498 0.000 -24.380) 25.819 15.782 ( 4.963 0.000 -21.980) 22.533 16.511 ( -5.250 0.000 9.130) 10.532 16.615 ( 2.522 0.000 2.843) 3.800 16.699 ( 2.953 0.000 -0.362) 2.975 16.732 ( 1.668 0.000 -3.134) 3.550 17.361 ( -1.543 0.000 5.334) 5.553 17.382 ( 0.186 0.000 2.485) 2.492 18.933 ( -3.830 0.000 0.194) 3.835 18.984 ( -5.573 0.000 -2.158) 5.976 19.280 ( -2.935 0.000 9.096) 9.558 19.513 ( -3.267 0.000 -3.529) 4.809 ======================= Grid point 254 (83/120) ======================= q-point: ( 0.22 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.077 ( 1.960 0.000 8.977) 9.189 2.362 ( 6.929 0.000 11.748) 13.639 2.415 ( -0.651 0.000 -8.163) 8.189 2.743 ( -6.268 0.000 -8.483) 10.547 2.896 ( 1.164 0.000 -1.067) 1.579 2.957 ( 2.815 0.000 0.854) 2.942 3.090 ( -2.307 0.000 -4.975) 5.484 3.094 ( 3.541 0.000 -8.973) 9.647 3.460 ( 1.994 0.000 0.674) 2.105 3.499 ( -3.936 0.000 0.760) 4.009 4.183 ( 10.429 0.000 11.124) 15.248 4.365 ( -3.928 0.000 -2.953) 4.915 4.717 ( -2.094 0.000 2.702) 3.418 4.886 ( -2.801 0.000 -4.339) 5.165 5.537 ( -5.430 0.000 15.261) 16.198 5.560 ( -10.615 0.000 21.303) 23.801 6.250 ( -9.760 0.000 -19.620) 21.914 6.577 ( -11.889 0.000 -12.849) 17.506 6.717 ( -0.639 0.000 0.164) 0.660 7.021 ( 11.010 0.000 12.658) 16.776 7.114 ( 3.350 0.000 -10.286) 10.817 7.280 ( 0.882 0.000 -1.900) 2.094 7.550 ( 9.319 0.000 -1.501) 9.439 7.725 ( -8.520 0.000 5.491) 10.136 7.728 ( 6.902 0.000 -8.662) 11.076 8.029 ( -6.293 0.000 -8.059) 10.225 8.792 ( -7.587 0.000 1.943) 7.832 8.841 ( -10.734 0.000 -1.045) 10.785 9.085 ( 12.050 0.000 9.975) 15.643 9.414 ( 6.649 0.000 -6.589) 9.361 9.418 ( 4.576 0.000 1.261) 4.747 9.618 ( 7.638 0.000 -7.797) 10.915 10.595 ( 0.723 0.000 5.892) 5.936 10.842 ( -10.916 0.000 -4.686) 11.879 11.242 ( -0.688 0.000 8.027) 8.057 11.427 ( 5.972 0.000 16.238) 17.302 11.472 ( 4.436 0.000 -1.437) 4.663 11.720 ( 13.902 0.000 5.227) 14.852 11.840 ( 5.454 0.000 -3.417) 6.436 12.122 ( -6.150 0.000 1.452) 6.319 12.706 ( 10.349 0.000 8.373) 13.312 13.030 ( 12.924 0.000 -4.054) 13.545 13.213 ( 5.857 0.000 -1.893) 6.155 13.276 ( -7.908 0.000 -3.663) 8.715 13.567 ( -4.265 0.000 -20.832) 21.264 13.762 ( -7.018 0.000 -18.593) 19.873 14.332 ( 14.133 0.000 24.968) 28.690 15.069 ( 8.574 0.000 21.247) 22.912 15.313 ( 7.750 0.000 -21.908) 23.239 15.925 ( 9.122 0.000 -19.545) 21.569 16.391 ( -6.947 0.000 11.258) 13.228 16.685 ( 4.264 0.000 2.740) 5.069 16.738 ( 0.657 0.000 -5.769) 5.806 16.781 ( 3.085 0.000 -2.147) 3.759 17.326 ( -1.554 0.000 7.119) 7.287 17.387 ( 0.239 0.000 2.505) 2.516 18.825 ( -6.878 0.000 -1.768) 7.101 18.842 ( -7.606 0.000 -2.066) 7.882 19.202 ( -4.508 0.000 7.504) 8.754 19.420 ( -5.909 0.000 -3.959) 7.112 ======================= Grid point 255 (84/120) ======================= q-point: ( 0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( 3.783 0.000 1.894) 4.231 2.395 ( -1.853 0.000 -10.768) 10.927 2.424 ( -0.999 0.000 2.497) 2.689 2.591 ( -8.264 0.000 -6.360) 10.428 2.894 ( -0.045 0.000 4.141) 4.141 3.009 ( 4.328 0.000 3.918) 5.838 3.091 ( -3.173 0.000 -4.009) 5.113 3.129 ( 3.982 0.000 -1.039) 4.116 3.414 ( -2.869 0.000 -0.895) 3.005 3.477 ( -2.709 0.000 -2.554) 3.723 4.384 ( 6.572 0.000 4.630) 8.039 4.493 ( 19.045 0.000 4.760) 19.631 4.685 ( -0.752 0.000 1.335) 1.532 4.821 ( -3.544 0.000 -3.629) 5.073 5.334 ( -11.173 0.000 14.639) 18.416 5.486 ( 0.436 0.000 8.316) 8.327 6.006 ( -13.480 0.000 -17.789) 22.319 6.177 ( -23.514 0.000 -21.598) 31.928 6.845 ( 8.911 0.000 9.927) 13.340 7.172 ( 1.737 0.000 -6.430) 6.660 7.235 ( 8.917 0.000 9.329) 12.905 7.325 ( 4.100 0.000 2.623) 4.867 7.570 ( -6.469 0.000 5.570) 8.537 7.708 ( 6.231 0.000 -1.789) 6.483 7.830 ( 3.077 0.000 -6.847) 7.506 7.881 ( -8.116 0.000 -6.880) 10.639 8.648 ( -7.396 0.000 2.217) 7.721 8.657 ( -5.929 0.000 1.248) 6.059 9.314 ( 10.173 0.000 7.410) 12.586 9.523 ( 3.719 0.000 -3.145) 4.871 9.556 ( 8.754 0.000 2.942) 9.235 9.765 ( 6.457 0.000 -6.722) 9.321 10.520 ( -7.059 0.000 1.277) 7.174 10.591 ( -12.219 0.000 -1.205) 12.278 11.316 ( 6.930 0.000 10.222) 12.350 11.524 ( 3.956 0.000 16.693) 17.155 11.576 ( 3.536 0.000 -0.316) 3.550 11.849 ( -3.212 0.000 2.040) 3.805 12.033 ( 10.680 0.000 5.150) 11.856 12.145 ( 11.964 0.000 -5.404) 13.128 12.838 ( 5.328 0.000 5.106) 7.380 13.114 ( -7.446 0.000 -4.546) 8.723 13.255 ( 6.410 0.000 -1.907) 6.688 13.339 ( 5.173 0.000 -7.281) 8.931 13.474 ( -3.137 0.000 -21.949) 22.172 13.530 ( -14.203 0.000 -18.868) 23.616 14.705 ( 20.329 0.000 19.862) 28.422 15.308 ( 15.031 0.000 23.399) 27.811 15.408 ( 0.965 0.000 -14.859) 14.890 16.138 ( 11.492 0.000 -16.896) 20.434 16.220 ( -10.132 0.000 14.642) 17.806 16.714 ( -3.332 0.000 -9.748) 10.301 16.777 ( 4.679 0.000 2.700) 5.402 16.846 ( 3.077 0.000 -0.729) 3.162 17.312 ( 0.308 0.000 7.685) 7.691 17.388 ( -0.219 0.000 3.117) 3.125 18.674 ( -6.896 0.000 -3.045) 7.538 18.704 ( -6.347 0.000 -4.034) 7.520 19.118 ( -3.279 0.000 4.470) 5.543 19.286 ( -6.997 0.000 -4.040) 8.080 ======================= Grid point 256 (85/120) ======================= q-point: ( 0.44 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 5.209 0.000 -4.572) 6.931 2.330 ( -4.570 0.000 -9.493) 10.536 2.390 ( -0.471 0.000 -2.517) 2.561 2.442 ( -5.615 0.000 -5.026) 7.536 2.923 ( 3.044 0.000 3.484) 4.626 3.005 ( -4.669 0.000 0.175) 4.672 3.121 ( 5.218 0.000 4.902) 7.160 3.177 ( 0.000 0.000 2.321) 2.321 3.375 ( -0.617 0.000 -1.797) 1.900 3.402 ( -3.287 0.000 -2.486) 4.122 4.593 ( 12.596 0.000 11.520) 17.070 4.695 ( 1.777 0.000 -1.087) 2.083 4.749 ( -3.367 0.000 -2.760) 4.354 4.776 ( 0.764 0.000 12.811) 12.834 5.250 ( 10.541 0.000 -6.694) 12.486 5.557 ( 6.639 0.000 -0.693) 6.675 5.675 ( -25.519 0.000 -17.448) 30.914 5.745 ( -11.771 0.000 -10.342) 15.669 7.029 ( 8.597 0.000 6.140) 10.564 7.157 ( -3.591 0.000 -0.182) 3.595 7.340 ( 3.427 0.000 7.770) 8.493 7.403 ( -1.536 0.000 9.227) 9.354 7.536 ( 6.428 0.000 -1.755) 6.663 7.709 ( -8.973 0.000 -4.620) 10.092 7.804 ( 3.474 0.000 -3.523) 4.948 7.849 ( -0.938 0.000 -5.601) 5.679 8.554 ( -1.781 0.000 3.135) 3.606 8.568 ( -2.847 0.000 2.236) 3.620 9.479 ( 6.080 0.000 4.423) 7.519 9.551 ( -1.029 0.000 0.777) 1.289 9.741 ( 8.639 0.000 1.586) 8.783 9.842 ( -0.110 0.000 -3.105) 3.106 10.379 ( -4.388 0.000 -0.186) 4.392 10.403 ( -6.012 0.000 -1.020) 6.098 11.468 ( 7.251 0.000 9.396) 11.868 11.579 ( -3.160 0.000 5.523) 6.363 11.609 ( 4.948 0.000 11.764) 12.762 11.727 ( -6.660 0.000 6.617) 9.388 12.259 ( 10.104 0.000 3.502) 10.694 12.348 ( 3.610 0.000 -0.870) 3.714 12.979 ( 8.990 0.000 -3.624) 9.693 13.043 ( 2.834 0.000 -9.703) 10.108 13.176 ( -9.563 0.000 -8.586) 12.852 13.236 ( -14.000 0.000 -15.260) 20.709 13.448 ( 4.044 0.000 -8.387) 9.311 13.479 ( 0.729 0.000 -11.430) 11.453 15.085 ( 16.428 0.000 8.133) 18.331 15.336 ( -8.201 0.000 -4.180) 9.205 15.641 ( 17.144 0.000 21.159) 27.232 15.965 ( -14.611 0.000 16.982) 22.402 16.384 ( 11.925 0.000 -12.854) 17.533 16.595 ( -8.552 0.000 -11.614) 14.423 16.858 ( 3.019 0.000 2.377) 3.843 16.886 ( 0.442 0.000 1.098) 1.184 17.337 ( 1.892 0.000 6.681) 6.944 17.373 ( -1.402 0.000 4.810) 5.010 18.581 ( -1.925 0.000 -4.760) 5.134 18.600 ( -3.528 0.000 -5.391) 6.443 19.091 ( 0.952 0.000 0.430) 1.044 19.157 ( -5.349 0.000 -2.789) 6.033 ======================= Grid point 261 (86/120) ======================= q-point: ( 0.00 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( 0.000 -5.352 14.838) 15.774 2.099 ( 0.000 4.294 15.679) 16.256 2.436 ( 0.000 0.264 1.369) 1.394 2.774 ( 0.000 3.900 -11.548) 12.189 2.787 ( 0.000 -0.791 -9.870) 9.902 2.967 ( 0.000 6.031 -15.068) 16.230 2.989 ( 0.000 2.963 5.262) 6.039 3.192 ( 0.000 -3.994 -4.216) 5.807 3.346 ( 0.000 -6.465 3.427) 7.317 3.563 ( 0.000 -7.773 -4.907) 9.192 3.951 ( 0.000 -8.481 13.901) 16.284 4.388 ( 0.000 -11.582 -9.408) 14.922 4.947 ( 0.000 17.555 6.308) 18.654 5.171 ( 0.000 19.516 -4.691) 20.072 5.828 ( 0.000 2.355 21.325) 21.455 5.851 ( 0.000 5.172 22.272) 22.865 6.375 ( 0.000 1.638 -1.289) 2.084 6.502 ( 0.000 -2.631 14.446) 14.683 6.736 ( 0.000 -2.094 8.424) 8.681 7.016 ( 0.000 -4.140 -11.356) 12.087 7.159 ( 0.000 -1.965 -17.823) 17.931 7.185 ( 0.000 -2.979 -14.158) 14.468 7.298 ( 0.000 -4.011 -11.914) 12.571 7.407 ( 0.000 0.172 -9.179) 9.181 8.154 ( 0.000 8.502 -3.341) 9.135 8.175 ( 0.000 10.279 -5.215) 11.526 8.691 ( 0.000 -5.984 11.164) 12.666 8.904 ( 0.000 -11.456 -2.708) 11.771 9.060 ( 0.000 -2.262 -1.758) 2.865 9.214 ( 0.000 -2.566 -7.462) 7.891 9.369 ( 0.000 -2.227 -3.239) 3.931 9.412 ( 0.000 -2.702 -4.345) 5.117 10.484 ( 0.000 3.932 10.910) 11.597 10.823 ( 0.000 -1.473 -4.813) 5.034 11.375 ( 0.000 8.989 9.334) 12.959 11.464 ( 0.000 11.524 -1.207) 11.587 11.525 ( 0.000 0.003 5.140) 5.140 11.569 ( 0.000 -1.821 5.191) 5.501 11.812 ( 0.000 0.944 10.842) 10.883 12.147 ( 0.000 -2.024 6.802) 7.097 12.405 ( 0.000 8.033 -2.438) 8.394 12.639 ( 0.000 1.298 -13.710) 13.771 13.114 ( 0.000 -3.792 3.120) 4.911 13.334 ( 0.000 -14.667 -0.013) 14.667 13.542 ( 0.000 6.077 4.904) 7.808 13.958 ( 0.000 17.058 8.526) 19.070 14.369 ( 0.000 5.590 -16.991) 17.887 14.900 ( 0.000 -1.857 10.964) 11.121 15.095 ( 0.000 5.286 -20.125) 20.808 15.720 ( 0.000 -0.983 -22.527) 22.549 16.349 ( 0.000 -22.380 3.973) 22.730 16.351 ( 0.000 -19.065 5.760) 19.916 16.592 ( 0.000 -5.200 2.799) 5.906 16.711 ( 0.000 -4.121 -5.025) 6.499 17.417 ( 0.000 2.932 4.371) 5.263 17.420 ( 0.000 2.919 5.073) 5.853 19.039 ( 0.000 5.900 0.623) 5.932 19.076 ( 0.000 3.074 -1.334) 3.351 19.335 ( 0.000 2.705 8.707) 9.117 19.560 ( 0.000 1.230 -3.321) 3.541 ======================= Grid point 262 (87/120) ======================= q-point: ( 0.11 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( 0.240 1.712 10.882) 11.019 2.152 ( 6.122 -3.460 14.213) 15.858 2.425 ( -0.568 0.535 -1.936) 2.087 2.761 ( -1.214 -2.775 -9.125) 9.615 2.856 ( 6.130 2.695 -7.445) 10.013 2.932 ( -3.275 0.997 2.722) 4.373 3.077 ( 5.392 6.585 -8.070) 11.728 3.176 ( -0.500 -0.239 -5.943) 5.969 3.350 ( 0.985 -6.171 1.549) 6.438 3.507 ( -4.738 -8.165 -3.470) 10.058 3.958 ( 1.072 -9.492 11.954) 15.302 4.328 ( -5.440 -11.582 -8.244) 15.222 4.945 ( -0.468 17.982 6.415) 19.098 5.160 ( -1.091 19.836 -4.290) 20.324 5.722 ( -8.494 3.201 18.682) 20.771 5.764 ( -7.551 2.937 24.270) 25.587 6.392 ( -0.819 2.728 -10.956) 11.320 6.532 ( 2.885 -2.610 13.403) 13.957 6.796 ( 5.368 -3.001 9.289) 11.140 6.956 ( -13.557 -1.736 -23.082) 26.825 7.053 ( 3.642 -1.181 -8.838) 9.632 7.281 ( 8.293 -6.919 -1.215) 10.868 7.311 ( -0.364 0.969 -11.204) 11.251 7.527 ( 8.071 -2.481 -10.205) 13.245 8.016 ( -8.302 10.124 0.841) 13.120 8.168 ( -3.474 4.635 -6.511) 8.714 8.777 ( 4.095 -6.191 4.786) 8.832 8.826 ( -5.731 -11.198 0.407) 12.586 9.064 ( 1.253 2.272 1.784) 3.148 9.284 ( 5.714 -0.721 -5.367) 7.872 9.386 ( 2.336 0.649 -4.154) 4.809 9.465 ( 5.725 -1.853 -6.074) 8.550 10.534 ( 4.231 2.441 10.399) 11.489 10.887 ( 3.950 -2.350 -6.229) 7.741 11.316 ( -11.622 -2.599 8.033) 14.365 11.411 ( 1.601 7.659 12.220) 14.511 11.445 ( -6.355 -1.857 2.256) 6.995 11.596 ( 8.492 10.188 -1.598) 13.359 11.849 ( 2.737 4.570 6.879) 8.700 12.285 ( 0.056 2.912 -2.015) 3.542 12.413 ( 10.254 1.500 7.438) 12.757 12.775 ( 11.211 0.303 -10.337) 15.252 13.100 ( -0.379 -4.733 1.992) 5.149 13.356 ( 0.447 -11.259 -6.331) 12.925 13.524 ( -1.527 4.548 0.856) 4.873 14.008 ( 4.112 17.949 4.617) 18.984 14.281 ( -5.880 2.931 -5.517) 8.579 14.945 ( 4.131 -0.586 14.403) 14.995 15.188 ( 7.977 4.695 -22.181) 24.035 15.772 ( 5.104 -0.891 -21.768) 22.376 16.337 ( -1.262 -16.747 7.388) 18.347 16.377 ( 2.575 -22.276 3.465) 22.691 16.584 ( -0.480 -6.566 1.631) 6.782 16.735 ( 1.908 -4.106 -5.830) 7.381 17.395 ( -2.252 2.293 5.934) 6.748 17.412 ( -0.647 2.035 4.061) 4.588 19.004 ( -3.297 6.338 -0.105) 7.144 19.022 ( -5.035 3.661 -1.082) 6.319 19.307 ( -2.685 2.928 8.166) 9.081 19.528 ( -3.112 1.382 -3.509) 4.889 ======================= Grid point 263 (88/120) ======================= q-point: ( 0.22 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( 1.599 2.197 5.386) 6.032 2.292 ( 5.873 -4.969 4.570) 8.947 2.432 ( 1.634 1.684 -2.085) 3.138 2.730 ( -3.009 -2.852 -6.342) 7.576 2.851 ( -3.662 -2.031 6.553) 7.777 2.951 ( 2.755 -2.844 0.099) 3.961 3.081 ( -3.373 3.203 -5.935) 7.541 3.213 ( 1.270 5.734 -7.523) 9.544 3.405 ( 2.526 -4.909 -2.452) 6.041 3.434 ( -0.144 -5.223 -2.162) 5.655 4.023 ( 6.183 -13.030 6.751) 15.924 4.206 ( -5.196 -12.109 -4.530) 13.934 4.924 ( -1.229 17.468 6.709) 18.752 5.129 ( -1.931 20.259 -3.712) 20.686 5.568 ( -11.057 1.679 19.126) 22.156 5.582 ( -4.546 4.389 17.231) 18.353 6.284 ( -9.710 3.427 -19.449) 22.006 6.546 ( -10.932 -2.406 -11.889) 16.329 6.703 ( -0.300 -1.321 1.552) 2.060 6.943 ( 6.830 -4.890 4.143) 9.366 7.182 ( 8.027 2.490 -1.775) 8.590 7.313 ( 1.316 3.337 -3.386) 4.933 7.462 ( 8.213 -7.613 0.672) 11.219 7.639 ( 2.100 -3.048 -5.962) 7.017 7.892 ( -2.890 10.024 0.994) 10.480 8.074 ( -4.860 3.166 -5.983) 8.333 8.689 ( -6.745 -9.140 1.657) 11.480 8.728 ( -7.879 -9.268 -0.969) 12.203 9.204 ( 10.936 10.052 7.771) 16.764 9.403 ( 6.393 -0.307 0.825) 6.454 9.477 ( 6.125 4.093 -6.097) 9.562 9.617 ( 8.310 0.512 -7.878) 11.463 10.592 ( -0.430 -0.215 6.767) 6.784 10.817 ( -11.562 -1.984 -3.114) 12.138 11.174 ( -2.162 -6.033 8.405) 10.569 11.360 ( 3.487 -9.067 1.648) 9.853 11.537 ( 6.721 10.118 15.072) 19.358 11.817 ( 11.526 8.370 1.154) 14.291 11.933 ( 7.254 7.709 -4.162) 11.374 12.173 ( -6.862 5.870 0.133) 9.031 12.663 ( 8.480 -4.455 7.948) 12.447 13.008 ( 10.510 -2.089 -3.013) 11.131 13.149 ( 5.795 -3.062 -5.064) 8.283 13.320 ( -3.007 -3.908 -7.401) 8.893 13.481 ( -2.757 1.083 -10.712) 11.114 13.941 ( -11.252 12.700 -20.391) 26.527 14.367 ( 14.757 3.667 25.518) 29.705 15.071 ( 8.779 0.533 18.477) 20.463 15.352 ( 7.109 3.258 -20.001) 21.476 15.920 ( 9.356 -0.569 -19.448) 21.589 16.293 ( -3.455 -10.866 9.871) 15.081 16.449 ( 4.516 -21.543 2.685) 22.175 16.583 ( 0.495 -10.033 0.173) 10.046 16.771 ( 1.270 -3.911 -7.294) 8.373 17.338 ( -3.081 0.040 7.134) 7.771 17.390 ( -1.539 -0.521 3.615) 3.964 18.895 ( -7.004 5.511 -1.066) 8.976 18.917 ( -5.080 7.737 -1.984) 9.466 19.234 ( -4.316 3.300 6.626) 8.569 19.438 ( -5.662 1.776 -3.912) 7.107 ======================= Grid point 264 (89/120) ======================= q-point: ( 0.33 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( 3.514 1.786 0.469) 3.970 2.339 ( -0.724 -3.266 -6.193) 7.038 2.459 ( -0.475 2.767 -1.231) 3.066 2.626 ( -6.411 2.051 -4.199) 7.934 2.824 ( 0.811 -6.227 8.925) 10.913 2.975 ( -0.503 -6.841 2.689) 7.368 3.038 ( 0.859 1.508 -2.122) 2.742 3.205 ( -1.053 2.124 -4.741) 5.301 3.401 ( -0.859 -1.004 -1.851) 2.274 3.458 ( -0.989 -0.971 -4.148) 4.373 4.149 ( 3.921 -17.494 2.974) 18.173 4.227 ( 8.465 -16.408 0.571) 18.472 4.935 ( 3.546 14.884 4.427) 15.928 5.091 ( -1.329 19.522 -3.792) 19.931 5.334 ( -11.091 0.533 13.548) 17.517 5.561 ( 1.985 8.988 9.501) 13.229 6.020 ( -16.529 0.626 -18.505) 24.820 6.193 ( -18.820 2.955 -19.579) 27.318 6.841 ( 9.278 -0.033 10.219) 13.803 7.063 ( 4.667 -5.312 0.798) 7.116 7.323 ( 4.618 1.909 2.076) 5.411 7.366 ( 3.711 3.374 1.823) 5.336 7.541 ( -0.376 -3.237 2.122) 3.889 7.670 ( 2.632 1.075 -3.698) 4.665 7.885 ( 0.826 5.303 -1.412) 5.550 8.002 ( -1.974 7.198 -3.761) 8.357 8.553 ( -7.009 -9.418 2.353) 11.973 8.566 ( -6.649 -8.265 0.811) 10.638 9.419 ( 9.566 10.440 6.183) 15.451 9.559 ( 9.042 0.350 2.734) 9.453 9.593 ( 4.619 6.694 -3.136) 8.716 9.771 ( 6.596 1.153 -6.348) 9.227 10.492 ( -8.329 -2.654 1.496) 8.869 10.548 ( -13.065 -3.636 -0.602) 13.574 11.217 ( 5.545 -8.845 10.256) 14.635 11.456 ( 3.189 -10.126 0.934) 10.657 11.661 ( 5.487 11.738 16.261) 20.792 11.951 ( -1.191 8.595 1.193) 8.759 12.101 ( 5.052 5.980 2.957) 8.369 12.179 ( 13.681 4.664 -6.336) 15.782 12.762 ( 3.790 -7.044 2.688) 8.439 13.086 ( -1.829 -1.874 -1.037) 2.816 13.245 ( -6.532 -6.346 -12.491) 15.458 13.320 ( 9.120 0.306 -7.492) 11.807 13.472 ( 3.173 5.032 -10.651) 12.200 13.673 ( -13.982 10.795 -16.323) 24.052 14.725 ( 18.960 1.642 18.356) 26.441 15.289 ( 10.939 -1.639 12.793) 16.911 15.452 ( 4.073 3.439 -5.602) 7.733 16.133 ( 10.722 -1.002 -16.396) 19.617 16.183 ( -7.081 -4.038 13.120) 15.446 16.541 ( 3.550 -18.717 -0.770) 19.066 16.608 ( 2.219 -13.377 0.733) 13.580 16.771 ( -1.444 -4.648 -5.992) 7.720 17.286 ( -1.879 -3.649 7.089) 8.191 17.350 ( -2.369 -4.372 3.455) 6.055 18.768 ( -5.023 8.565 -2.159) 10.161 18.814 ( -4.815 10.059 -4.088) 11.878 19.151 ( -3.374 3.270 3.959) 6.144 19.310 ( -6.784 2.224 -3.986) 8.177 ======================= Grid point 265 (90/120) ======================= q-point: ( 0.44 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( 3.657 0.378 -2.902) 4.684 2.293 ( -3.059 -1.680 -4.983) 6.084 2.442 ( 0.463 4.480 -5.218) 6.893 2.504 ( -5.209 4.816 -5.608) 9.043 2.863 ( 2.969 -5.914 6.612) 9.355 2.932 ( -3.344 -6.535 4.157) 8.436 3.104 ( 4.096 -1.755 -0.026) 4.456 3.171 ( -2.543 -1.654 -1.738) 3.496 3.394 ( 0.367 1.833 -1.059) 2.148 3.417 ( -1.933 1.610 -2.353) 3.444 4.261 ( 6.250 -20.513 6.075) 22.288 4.336 ( 0.401 -20.754 3.811) 21.105 5.027 ( 2.570 14.398 2.217) 14.793 5.090 ( -2.876 14.758 2.804) 15.295 5.248 ( 10.842 0.071 -6.736) 12.764 5.611 ( -15.604 -1.908 -12.656) 20.182 5.671 ( 1.620 10.716 -2.206) 11.060 5.868 ( -13.179 11.486 -9.714) 20.000 7.020 ( 7.581 -0.552 6.699) 10.132 7.109 ( -0.800 -3.135 2.445) 4.056 7.374 ( 1.299 0.872 4.006) 4.301 7.396 ( -0.901 -0.572 4.166) 4.301 7.576 ( 4.552 2.295 -1.015) 5.198 7.669 ( -3.318 3.415 -3.652) 6.001 7.923 ( 2.959 6.755 -1.289) 7.486 7.974 ( -1.667 10.090 -1.748) 10.375 8.451 ( -2.319 -10.457 3.365) 11.227 8.465 ( -3.346 -10.214 2.371) 11.006 9.573 ( 5.578 9.625 3.848) 11.771 9.635 ( -0.442 8.710 0.476) 8.734 9.752 ( 8.967 1.217 2.045) 9.277 9.854 ( 0.248 1.466 -2.709) 3.090 10.324 ( -5.289 -5.089 -0.232) 7.343 10.349 ( -6.548 -5.056 -1.279) 8.371 11.347 ( 6.511 -10.418 8.451) 14.911 11.452 ( -3.305 -10.503 4.524) 11.904 11.762 ( 4.695 12.394 12.049) 17.912 11.859 ( -5.164 11.298 6.611) 14.072 12.283 ( 9.246 2.741 2.220) 9.896 12.372 ( 2.722 3.099 -0.433) 4.147 12.866 ( 7.215 -8.070 -6.746) 12.755 13.049 ( -8.524 -7.540 -11.781) 16.380 13.115 ( 4.119 1.523 -7.718) 8.880 13.317 ( -11.660 0.918 -13.789) 18.081 13.525 ( 1.975 9.181 -5.840) 11.059 13.538 ( 1.512 8.473 -7.694) 11.545 15.079 ( 15.386 -1.299 6.668) 16.819 15.313 ( -7.181 -3.176 -4.384) 8.993 15.672 ( 15.465 3.098 19.511) 25.088 15.967 ( -13.077 0.073 16.087) 20.732 16.367 ( 10.744 -2.437 -12.380) 16.572 16.534 ( -4.834 -8.922 -9.000) 13.563 16.673 ( 3.330 -15.486 2.921) 16.107 16.726 ( -2.341 -10.858 0.031) 11.108 17.271 ( 0.459 -7.023 5.840) 9.146 17.301 ( -2.297 -7.342 4.278) 8.802 18.709 ( -0.685 11.522 -3.989) 12.212 18.734 ( -2.895 12.061 -4.975) 13.364 19.121 ( 0.765 2.809 0.297) 2.926 19.184 ( -5.222 2.515 -2.781) 6.429 ======================= Grid point 270 (91/120) ======================= q-point: ( 0.00 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( 0.000 0.480 8.020) 8.035 2.163 ( 0.000 2.960 1.487) 3.312 2.560 ( 0.000 12.208 11.881) 17.035 2.682 ( 0.000 -9.547 -3.041) 10.020 2.849 ( 0.000 2.230 -0.588) 2.306 3.006 ( 0.000 -12.406 -8.247) 14.897 3.067 ( 0.000 4.137 4.775) 6.318 3.117 ( 0.000 7.354 -10.884) 13.135 3.244 ( 0.000 -2.886 -6.487) 7.100 3.450 ( 0.000 -3.603 -8.802) 9.511 3.748 ( 0.000 -11.573 8.324) 14.255 4.139 ( 0.000 -14.211 -10.090) 17.429 5.368 ( 0.000 25.230 9.147) 26.837 5.590 ( 0.000 22.885 -3.429) 23.140 5.905 ( 0.000 6.166 23.714) 24.503 5.992 ( 0.000 8.801 19.902) 21.761 6.374 ( 0.000 -3.248 10.589) 11.076 6.440 ( 0.000 -3.688 13.923) 14.403 6.707 ( 0.000 0.202 -0.701) 0.729 6.924 ( 0.000 -5.709 -9.937) 11.460 6.976 ( 0.000 -13.230 2.783) 13.519 7.139 ( 0.000 -11.474 -8.741) 14.424 7.226 ( 0.000 3.629 -30.724) 30.938 7.414 ( 0.000 -0.577 -16.550) 16.560 8.349 ( 0.000 10.220 -1.998) 10.413 8.411 ( 0.000 13.117 -4.598) 13.899 8.583 ( 0.000 -3.398 5.891) 6.801 8.675 ( 0.000 -11.287 -2.815) 11.633 8.980 ( 0.000 -5.899 -1.390) 6.061 9.100 ( 0.000 -8.795 -5.047) 10.140 9.330 ( 0.000 -1.689 -3.901) 4.251 9.359 ( 0.000 -2.659 -4.820) 5.505 10.583 ( 0.000 6.134 11.889) 13.378 10.805 ( 0.000 -0.700 2.444) 2.542 11.461 ( 0.000 -0.742 7.282) 7.320 11.504 ( 0.000 -3.223 7.210) 7.897 11.656 ( 0.000 13.191 2.751) 13.475 11.729 ( 0.000 12.936 -7.021) 14.718 11.854 ( 0.000 4.103 13.566) 14.173 12.121 ( 0.000 -0.479 7.883) 7.897 12.526 ( 0.000 3.020 -4.379) 5.319 12.664 ( 0.000 0.518 -14.036) 14.046 13.055 ( 0.000 -2.122 -8.310) 8.577 13.082 ( 0.000 -11.142 -2.279) 11.373 13.698 ( 0.000 10.758 16.587) 19.771 14.224 ( 0.000 8.316 17.531) 19.404 14.537 ( 0.000 12.904 -23.665) 26.955 14.889 ( 0.000 1.614 9.557) 9.693 15.200 ( 0.000 4.282 -18.004) 18.506 15.701 ( 0.000 -1.695 -19.311) 19.385 15.848 ( 0.000 -26.980 3.578) 27.216 15.975 ( 0.000 -18.125 1.376) 18.177 16.462 ( 0.000 -7.764 2.147) 8.055 16.566 ( 0.000 -10.001 -5.685) 11.504 17.459 ( 0.000 1.166 6.006) 6.118 17.460 ( 0.000 1.374 5.838) 5.998 19.140 ( 0.000 3.191 0.930) 3.324 19.144 ( 0.000 4.129 1.819) 4.511 19.418 ( 0.000 5.758 5.010) 7.633 19.584 ( 0.000 1.037 -2.949) 3.125 ======================= Grid point 271 (92/120) ======================= q-point: ( 0.11 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( 5.020 0.222 5.801) 7.675 2.172 ( 1.084 3.325 2.694) 4.414 2.520 ( -2.409 9.641 4.580) 10.942 2.660 ( -1.536 -8.328 -2.078) 8.720 2.872 ( -0.164 -4.344 6.322) 7.672 2.951 ( -5.888 0.537 2.360) 6.366 3.076 ( 6.137 -2.587 -10.886) 12.762 3.228 ( 0.574 -4.888 -6.323) 8.012 3.245 ( 4.500 4.527 -4.803) 7.988 3.400 ( -3.474 -1.604 -9.394) 10.143 3.752 ( 0.613 -10.708 6.631) 12.610 4.091 ( -4.507 -12.866 -9.230) 16.463 5.362 ( -1.818 23.923 9.192) 25.693 5.573 ( -2.006 21.112 -1.746) 21.279 5.795 ( -7.603 5.169 22.954) 24.726 5.870 ( -9.210 8.005 17.756) 21.545 6.440 ( 3.362 0.839 0.686) 3.533 6.497 ( 3.330 0.015 7.340) 8.060 6.733 ( 2.969 -3.358 3.652) 5.782 6.880 ( -12.096 -6.520 -15.322) 20.582 6.997 ( 4.424 -5.637 -4.515) 8.469 7.092 ( 8.291 -11.338 0.295) 14.049 7.327 ( 3.467 1.035 -18.108) 18.466 7.487 ( 6.179 -2.041 -12.495) 14.088 8.215 ( -10.886 7.625 0.188) 13.292 8.239 ( -8.697 2.443 -2.292) 9.320 8.604 ( -3.357 -9.241 0.988) 9.881 8.695 ( -1.567 -1.910 -3.839) 4.565 9.087 ( 13.042 0.534 3.707) 13.570 9.261 ( 10.192 -1.602 -4.261) 11.163 9.380 ( 5.234 -1.253 -4.961) 7.320 9.424 ( 7.592 -2.288 -6.251) 10.097 10.605 ( 1.610 4.939 11.715) 12.815 10.849 ( 3.320 -1.684 1.164) 3.900 11.266 ( -14.679 -2.484 7.408) 16.629 11.341 ( -12.957 -5.338 5.400) 15.018 11.666 ( 3.588 14.778 7.524) 16.967 11.802 ( 6.717 9.685 -5.159) 12.866 11.969 ( 7.227 8.612 6.853) 13.166 12.302 ( 12.219 -1.161 4.163) 12.961 12.468 ( -3.551 2.809 -0.356) 4.542 12.765 ( 7.845 -2.720 -10.678) 13.526 13.005 ( -0.108 -4.571 -3.172) 5.565 13.166 ( 4.156 -6.836 -11.820) 14.273 13.666 ( -3.103 9.877 12.571) 16.285 14.266 ( 2.717 2.364 18.129) 18.484 14.422 ( -7.419 17.205 -18.085) 26.040 14.961 ( 5.786 3.054 11.242) 13.007 15.269 ( 5.617 1.827 -19.263) 20.148 15.750 ( 4.782 -2.860 -17.466) 18.333 15.880 ( 3.460 -25.767 3.151) 26.188 16.002 ( 2.428 -15.342 1.355) 15.592 16.450 ( -0.914 -7.340 2.075) 7.682 16.593 ( 2.330 -9.788 -6.649) 12.060 17.420 ( -3.808 0.414 6.457) 7.508 17.435 ( -2.566 0.324 5.588) 6.157 19.098 ( -3.666 3.970 1.437) 5.592 19.121 ( -2.306 4.635 0.684) 5.221 19.392 ( -2.475 5.786 4.597) 7.793 19.556 ( -2.803 1.199 -3.140) 4.377 ======================= Grid point 272 (93/120) ======================= q-point: ( 0.22 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( 2.637 3.749 -0.174) 4.586 2.234 ( 5.219 -0.235 3.663) 6.380 2.502 ( 0.912 5.904 -0.642) 6.009 2.635 ( -0.933 -6.168 -0.348) 6.248 2.807 ( -6.252 -5.361 8.234) 11.646 2.865 ( -1.901 -4.309 5.733) 7.419 3.127 ( -3.507 0.395 -7.632) 8.409 3.208 ( -1.745 -5.637 -7.856) 9.825 3.313 ( 4.542 -2.955 -3.746) 6.587 3.422 ( 3.717 2.886 -8.198) 9.453 3.791 ( 3.669 -9.613 2.529) 10.595 3.981 ( -5.502 -10.648 -6.490) 13.629 5.257 ( -7.441 14.634 10.734) 19.615 5.469 ( -8.571 8.769 7.639) 14.447 5.672 ( -9.092 13.917 6.225) 17.751 5.753 ( 2.819 14.797 14.857) 21.157 6.366 ( -11.266 4.156 -19.201) 22.647 6.514 ( -9.579 -0.216 -14.173) 17.108 6.679 ( 5.192 -0.653 9.088) 10.486 6.855 ( 6.455 -5.024 4.019) 9.113 7.148 ( 8.023 -5.573 0.139) 9.770 7.299 ( 9.951 -8.666 1.955) 13.339 7.390 ( 4.214 3.610 -6.471) 8.525 7.595 ( 4.054 -1.888 -6.618) 7.988 8.055 ( -5.328 4.749 0.279) 7.142 8.081 ( -5.469 -3.195 -1.495) 6.508 8.504 ( -6.378 -7.631 1.429) 10.048 8.588 ( -7.427 -4.145 -2.696) 8.922 9.381 ( 11.894 3.687 5.685) 13.689 9.432 ( 9.633 6.220 -0.480) 11.476 9.519 ( 9.199 1.172 -5.806) 10.941 9.664 ( 13.001 3.783 -8.133) 15.795 10.601 ( -3.756 1.816 9.204) 10.105 10.795 ( -12.287 0.256 -0.431) 12.298 11.047 ( -5.577 -6.959 7.676) 11.766 11.152 ( -1.292 -12.283 4.742) 13.230 11.788 ( 7.980 15.039 12.422) 21.075 11.981 ( 9.792 7.382 -3.558) 12.768 12.093 ( 5.508 10.259 -2.346) 11.878 12.330 ( -3.772 8.474 -2.910) 9.722 12.549 ( 5.066 -6.833 5.779) 10.283 12.909 ( 6.150 -10.412 -3.352) 12.548 13.106 ( 8.545 -0.264 -7.216) 11.187 13.232 ( 3.021 -1.827 -13.917) 14.358 13.588 ( -3.522 7.890 5.438) 10.210 14.132 ( -12.122 4.382 -12.450) 17.921 14.496 ( 10.979 11.373 16.653) 22.961 15.102 ( 7.965 2.949 11.624) 14.396 15.374 ( 4.535 -3.242 -13.619) 14.715 15.873 ( 6.644 -10.868 -9.036) 15.617 15.995 ( 7.900 -15.738 -2.489) 17.785 16.064 ( 3.648 -10.133 2.356) 11.024 16.433 ( -0.683 -5.971 1.813) 6.278 16.646 ( 2.601 -8.580 -8.374) 12.268 17.313 ( -6.514 -2.106 7.232) 9.958 17.356 ( -5.293 -2.772 4.912) 7.735 19.012 ( -4.359 6.046 0.962) 7.515 19.063 ( -3.145 6.124 -1.023) 6.960 19.322 ( -4.318 5.750 3.509) 8.001 19.475 ( -5.173 1.629 -3.574) 6.495 ======================= Grid point 273 (94/120) ======================= q-point: ( 0.33 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( 2.504 3.870 -0.498) 4.637 2.307 ( 1.203 0.208 -1.787) 2.164 2.537 ( 1.088 5.435 -3.073) 6.338 2.623 ( -0.549 -2.799 -0.887) 2.987 2.697 ( -2.890 -6.515 11.030) 13.132 2.835 ( -1.434 -6.976 6.805) 9.850 3.051 ( -1.949 -0.829 -6.387) 6.729 3.169 ( -2.616 -5.330 -6.422) 8.746 3.392 ( 3.048 0.141 -3.326) 4.513 3.463 ( 0.130 0.659 -5.358) 5.400 3.864 ( 1.491 -10.942 1.101) 11.098 3.936 ( 2.475 -13.212 -2.399) 13.654 5.147 ( -1.869 6.972 6.282) 9.569 5.286 ( -7.849 0.390 9.981) 12.703 5.485 ( -9.432 14.726 -6.132) 18.532 5.836 ( 0.665 14.288 3.386) 14.699 6.033 ( -15.093 5.745 -13.125) 20.810 6.344 ( -7.258 13.288 -13.292) 20.148 6.859 ( 9.610 1.833 10.294) 14.202 6.983 ( 5.753 -4.056 3.487) 7.855 7.285 ( 5.345 -4.452 -0.272) 6.961 7.394 ( 1.313 -1.236 -2.715) 3.259 7.513 ( 4.706 -0.171 3.662) 5.966 7.703 ( 7.864 0.558 -2.774) 8.358 7.962 ( -3.076 -0.716 1.287) 3.410 8.055 ( 1.422 -2.304 -0.160) 2.712 8.353 ( -8.137 -8.099 2.907) 11.842 8.429 ( -8.256 -3.890 -0.873) 9.168 9.571 ( 9.519 0.980 2.069) 9.790 9.619 ( 8.367 5.002 0.642) 9.769 9.754 ( 11.647 12.460 -0.765) 17.073 9.870 ( 6.734 10.373 -4.264) 13.082 10.434 ( -11.290 -2.931 2.812) 11.998 10.492 ( -15.191 -1.281 0.128) 15.245 11.017 ( 2.321 -11.623 9.453) 15.160 11.199 ( 2.069 -16.095 3.542) 16.610 11.950 ( 6.823 17.366 14.557) 23.665 12.108 ( 1.848 7.446 -1.690) 7.856 12.208 ( 5.521 6.501 -5.397) 10.093 12.355 ( 8.284 10.898 -2.691) 13.951 12.605 ( 2.455 -8.829 0.012) 9.164 12.958 ( -1.374 -12.645 -6.845) 14.444 13.160 ( -4.901 0.089 -5.119) 7.088 13.338 ( 4.941 0.253 -8.545) 9.874 13.604 ( 5.743 9.000 -0.545) 10.690 13.908 ( -8.227 12.336 -12.736) 19.546 14.742 ( 12.605 -0.346 12.662) 17.870 15.223 ( 1.713 -7.055 -3.415) 8.023 15.500 ( 9.932 1.436 8.667) 13.260 15.983 ( 3.289 -15.296 2.605) 15.861 16.131 ( 4.210 -3.108 -1.384) 5.413 16.176 ( 7.357 -12.166 -2.434) 14.424 16.431 ( 1.137 -3.364 0.694) 3.618 16.678 ( 0.072 -5.290 -8.048) 9.631 17.178 ( -6.308 -6.676 6.789) 11.422 17.230 ( -6.799 -7.447 4.025) 10.857 18.945 ( -1.893 8.842 -0.608) 9.063 19.008 ( -2.101 8.600 -3.191) 9.410 19.231 ( -4.274 4.937 2.018) 6.835 19.356 ( -6.399 2.106 -3.771) 7.720 ======================= Grid point 274 (95/120) ======================= q-point: ( 0.44 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( 2.197 2.644 0.222) 3.445 2.294 ( -1.798 1.933 0.059) 2.641 2.543 ( 0.785 5.054 -5.671) 7.637 2.582 ( -2.679 2.275 -3.382) 4.877 2.725 ( 3.701 -7.171 8.267) 11.552 2.796 ( -2.795 -6.243 6.176) 9.216 3.053 ( 1.503 -3.937 -5.947) 7.289 3.103 ( -3.390 -5.373 -5.422) 8.352 3.442 ( 1.650 3.214 -1.077) 3.770 3.456 ( -0.122 2.322 -1.926) 3.019 3.905 ( 3.346 -15.871 4.023) 16.711 3.966 ( -1.300 -17.169 1.873) 17.320 5.195 ( 2.672 3.896 0.942) 4.817 5.231 ( 5.326 0.792 -3.224) 6.276 5.315 ( -4.910 6.887 -7.994) 11.638 5.548 ( -18.707 -3.494 -14.258) 23.779 6.048 ( 7.023 26.024 3.552) 27.188 6.197 ( -7.508 22.788 -4.248) 24.366 7.019 ( 5.596 0.167 6.858) 8.853 7.062 ( 1.414 -2.292 4.355) 5.120 7.357 ( 1.943 -1.418 -0.294) 2.423 7.386 ( -1.369 -0.400 -1.255) 1.900 7.621 ( 7.047 0.563 2.025) 7.354 7.758 ( -4.588 1.351 -3.393) 5.865 8.016 ( 8.469 1.168 3.381) 9.193 8.098 ( 2.043 -0.421 1.276) 2.445 8.210 ( -5.118 -10.558 4.304) 12.497 8.255 ( -8.632 -7.342 1.237) 11.400 9.765 ( 8.368 3.350 0.825) 9.052 9.784 ( 7.766 6.523 0.023) 10.142 9.904 ( 0.925 17.633 4.295) 18.172 9.932 ( 0.480 8.995 1.495) 9.131 10.221 ( -7.086 -5.153 -1.372) 8.868 10.249 ( -7.942 -3.350 -2.411) 8.950 11.098 ( 4.930 -15.602 7.874) 18.158 11.187 ( -3.164 -17.089 5.078) 18.106 12.040 ( 2.862 15.367 6.543) 16.945 12.089 ( -2.142 11.819 1.579) 12.115 12.376 ( 9.459 7.430 1.868) 12.172 12.489 ( 0.633 8.667 2.563) 9.060 12.697 ( 7.398 -9.052 -8.246) 14.306 12.871 ( -7.998 -10.262 -13.071) 18.443 13.092 ( 3.295 -4.057 -2.347) 5.729 13.267 ( -10.094 -5.269 -7.230) 13.488 13.752 ( 6.828 16.145 -4.016) 17.983 13.833 ( -1.630 19.265 -8.488) 21.115 14.982 ( 10.954 -10.573 2.463) 15.422 15.164 ( -6.615 -13.922 -6.162) 16.600 15.750 ( 12.929 4.708 16.265) 21.304 15.956 ( -6.441 -1.530 11.562) 13.324 16.214 ( 3.810 -12.749 0.308) 13.310 16.256 ( 0.320 -13.629 -0.887) 13.661 16.510 ( 6.334 0.394 -2.703) 6.898 16.632 ( -4.727 -0.881 -5.268) 7.132 17.089 ( -1.916 -11.223 4.553) 12.262 17.112 ( -4.081 -11.689 3.271) 12.806 18.940 ( 1.209 11.279 -2.742) 11.670 18.974 ( -1.687 11.573 -4.222) 12.434 19.179 ( -0.120 2.821 -0.176) 2.829 19.235 ( -5.089 2.259 -2.841) 6.251 ======================= Grid point 279 (96/120) ======================= q-point: ( 0.00 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 0.000 8.104 5.296) 9.681 2.222 ( 0.000 0.064 3.215) 3.216 2.499 ( 0.000 -3.289 -3.386) 4.721 2.655 ( 0.000 -15.060 -0.096) 15.061 2.861 ( 0.000 16.791 11.023) 20.086 2.986 ( 0.000 4.829 -8.864) 10.094 3.073 ( 0.000 -3.363 -1.397) 3.641 3.132 ( 0.000 -8.675 3.707) 9.434 3.278 ( 0.000 5.591 -7.768) 9.571 3.392 ( 0.000 -4.893 -8.602) 9.897 3.641 ( 0.000 5.064 -3.651) 6.243 3.860 ( 0.000 -14.531 -9.985) 17.631 5.842 ( 0.000 21.714 5.527) 22.406 5.953 ( 0.000 11.307 -0.914) 11.344 6.047 ( 0.000 8.249 23.936) 25.318 6.165 ( 0.000 8.976 19.084) 21.089 6.251 ( 0.000 -9.823 17.243) 19.844 6.328 ( 0.000 -8.197 20.324) 21.915 6.727 ( 0.000 -6.086 -2.019) 6.412 6.774 ( 0.000 3.798 -5.345) 6.557 6.784 ( 0.000 -8.984 -6.664) 11.186 6.914 ( 0.000 -10.149 -8.107) 12.989 7.304 ( 0.000 4.249 -27.124) 27.455 7.377 ( 0.000 -3.169 -22.302) 22.526 8.438 ( 0.000 0.895 1.037) 1.370 8.495 ( 0.000 -5.681 0.416) 5.696 8.652 ( 0.000 10.186 -6.427) 12.044 8.668 ( 0.000 10.220 -2.070) 10.427 8.849 ( 0.000 -7.332 -1.996) 7.599 8.906 ( 0.000 -10.930 -2.433) 11.197 9.308 ( 0.000 -0.428 -4.342) 4.363 9.318 ( 0.000 -1.463 -4.632) 4.857 10.699 ( 0.000 5.522 11.316) 12.591 10.778 ( 0.000 -2.601 7.992) 8.404 11.442 ( 0.000 -0.587 6.424) 6.451 11.452 ( 0.000 -1.809 6.655) 6.896 11.843 ( 0.000 5.228 -1.552) 5.454 11.883 ( 0.000 1.987 -2.964) 3.568 12.011 ( 0.000 11.089 15.543) 19.093 12.131 ( 0.000 -0.236 8.112) 8.116 12.533 ( 0.000 0.464 -4.750) 4.773 12.614 ( 0.000 -5.931 -12.020) 13.404 12.962 ( 0.000 -0.616 -6.479) 6.508 13.007 ( 0.000 -3.378 -12.187) 12.646 13.963 ( 0.000 16.180 14.744) 21.890 14.221 ( 0.000 -8.315 10.140) 13.114 14.838 ( 0.000 16.547 -8.495) 18.600 14.978 ( 0.000 6.365 15.916) 17.141 15.179 ( 0.000 -6.098 -19.553) 20.482 15.341 ( 0.000 -21.137 3.445) 21.415 15.724 ( 0.000 0.815 -18.452) 18.470 15.753 ( 0.000 -4.329 -9.751) 10.669 16.342 ( 0.000 -3.190 0.690) 3.264 16.385 ( 0.000 -7.366 -3.090) 7.988 17.471 ( 0.000 0.296 6.317) 6.324 17.473 ( 0.000 0.150 6.261) 6.263 19.185 ( 0.000 1.372 2.738) 3.063 19.190 ( 0.000 0.939 3.214) 3.349 19.525 ( 0.000 4.795 0.830) 4.867 19.585 ( 0.000 -1.365 -1.667) 2.154 ======================= Grid point 280 (97/120) ======================= q-point: ( 0.11 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( 3.768 6.849 4.785) 9.165 2.238 ( 1.481 0.680 3.701) 4.044 2.510 ( 1.024 -2.715 -2.968) 4.150 2.650 ( -0.619 -12.994 -0.198) 13.010 2.751 ( -6.267 12.051 5.537) 14.669 2.938 ( -7.862 -5.285 2.565) 9.815 3.097 ( 4.628 3.751 -7.257) 9.389 3.183 ( -0.243 -2.912 -6.175) 6.832 3.263 ( -0.592 2.603 -0.616) 2.739 3.375 ( 0.216 -5.530 -5.170) 7.574 3.671 ( 2.462 5.063 -4.813) 7.407 3.853 ( -0.972 -11.867 -9.457) 15.205 5.733 ( -13.056 11.059 12.597) 21.247 5.803 ( -13.902 2.343 14.568) 20.273 5.986 ( 2.579 15.318 14.207) 21.051 6.087 ( -2.206 10.734 2.892) 11.333 6.425 ( 10.132 -1.063 13.943) 17.269 6.486 ( 9.826 -3.805 13.389) 17.038 6.669 ( -7.124 -3.198 -9.406) 12.225 6.714 ( -8.220 -8.757 -8.196) 14.541 6.870 ( 6.726 -3.031 -1.138) 7.465 6.922 ( 8.373 -6.402 -3.629) 11.148 7.369 ( 4.691 3.250 -19.586) 20.400 7.436 ( 5.071 -3.377 -16.656) 17.735 8.227 ( -13.107 -0.130 -0.245) 13.110 8.262 ( -14.480 -3.079 -1.580) 14.887 8.579 ( -3.004 5.324 0.606) 6.143 8.670 ( -5.642 -2.669 -3.499) 7.156 9.119 ( 20.992 3.471 0.585) 21.285 9.205 ( 18.532 -4.474 -3.355) 19.358 9.365 ( 5.878 0.136 -5.143) 7.811 9.384 ( 7.743 -1.736 -6.029) 9.966 10.712 ( 0.910 5.857 11.421) 12.868 10.805 ( 2.437 -3.460 7.564) 8.668 11.232 ( -16.611 -0.600 6.270) 17.766 11.256 ( -15.855 -3.124 5.639) 17.116 11.907 ( 4.795 7.887 0.955) 9.280 11.933 ( 5.600 4.045 -1.433) 7.056 12.157 ( 10.274 9.182 8.435) 16.156 12.269 ( 11.028 -2.326 7.237) 13.394 12.492 ( -3.444 1.939 -2.729) 4.802 12.627 ( 0.369 -10.199 -8.427) 13.235 12.989 ( 4.402 2.869 -9.098) 10.507 13.070 ( 5.167 -4.683 -13.164) 14.897 13.913 ( -4.798 15.423 12.422) 20.376 14.179 ( -4.323 -10.412 8.277) 13.986 14.801 ( -1.379 20.641 -4.398) 21.150 15.068 ( 7.185 5.961 14.977) 17.649 15.176 ( -0.953 -10.045 -18.352) 20.943 15.367 ( 3.120 -21.121 7.078) 22.492 15.789 ( 6.552 2.105 -16.347) 17.737 15.833 ( 6.726 -3.295 -11.565) 13.779 16.345 ( 0.535 -2.045 0.385) 2.149 16.408 ( 2.247 -8.057 -4.101) 9.316 17.424 ( -4.721 0.202 6.504) 8.039 17.431 ( -4.227 -0.496 6.172) 7.497 19.157 ( -2.416 2.067 2.768) 4.216 19.171 ( -1.815 0.755 2.506) 3.185 19.500 ( -2.472 4.784 0.504) 5.408 19.559 ( -2.564 -1.277 -1.920) 3.448 ======================= Grid point 281 (98/120) ======================= q-point: ( 0.22 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.234 ( 4.668 4.327 2.610) 6.880 2.274 ( 2.170 1.910 5.299) 6.036 2.534 ( 1.201 -1.531 -1.357) 2.372 2.629 ( -1.052 -6.301 -1.668) 6.602 2.658 ( -3.197 5.072 6.473) 8.824 2.797 ( -5.576 -5.238 2.753) 8.130 3.090 ( -3.218 -1.715 -8.200) 8.974 3.117 ( -4.616 -3.439 -8.440) 10.216 3.321 ( 4.870 3.447 -1.062) 6.061 3.410 ( 2.152 -4.500 -1.514) 5.213 3.722 ( 2.331 2.364 -5.354) 6.300 3.817 ( -2.482 -6.791 -7.667) 10.539 5.440 ( -13.866 5.590 14.489) 20.819 5.504 ( -14.437 -1.508 16.115) 21.689 5.986 ( -9.546 14.179 -7.014) 18.476 6.070 ( 1.058 10.397 2.337) 10.709 6.417 ( -10.914 5.818 -11.213) 16.694 6.576 ( 1.521 4.264 -10.266) 11.220 6.669 ( 10.326 -2.860 9.778) 14.506 6.700 ( 7.753 -10.388 10.807) 16.876 7.052 ( 9.289 -1.236 1.215) 9.450 7.132 ( 10.620 -8.049 0.856) 13.354 7.463 ( 4.578 4.224 -8.990) 10.937 7.545 ( 5.353 -3.806 -8.249) 10.545 8.003 ( -8.806 -2.412 -0.154) 9.132 8.030 ( -8.208 -4.461 -0.403) 9.351 8.483 ( -6.224 3.435 0.949) 7.172 8.542 ( -6.870 -2.146 -1.543) 7.361 9.416 ( 8.926 1.861 1.167) 9.193 9.456 ( 8.282 -2.047 -1.033) 8.594 9.631 ( 19.999 6.867 -4.604) 21.641 9.705 ( 19.937 -0.545 -7.166) 21.193 10.690 ( -5.725 7.980 10.901) 14.672 10.831 ( -8.001 2.761 2.707) 8.886 10.896 ( -8.363 -10.315 8.444) 15.737 10.937 ( -12.612 -7.316 4.710) 15.322 12.043 ( 9.002 9.334 4.510) 13.730 12.086 ( 8.914 3.457 -2.318) 9.838 12.332 ( 5.872 13.058 0.436) 14.324 12.416 ( -1.098 0.831 0.171) 1.388 12.443 ( 2.043 -2.504 1.514) 3.569 12.647 ( 2.603 -15.423 -4.950) 16.406 13.143 ( 9.349 3.269 -9.045) 13.412 13.203 ( 7.743 -2.426 -12.176) 14.632 13.798 ( -4.993 14.288 9.145) 17.684 14.062 ( -6.098 -10.753 3.292) 12.793 14.797 ( -0.054 18.526 -2.377) 18.678 15.117 ( -4.365 -10.017 -14.958) 18.524 15.263 ( 11.927 2.038 17.201) 21.030 15.481 ( 8.309 -18.579 12.006) 23.630 15.952 ( 8.153 1.790 -11.501) 14.211 15.983 ( 7.576 -1.239 -10.611) 13.097 16.373 ( 2.432 0.801 -1.071) 2.775 16.473 ( 4.139 -8.564 -6.512) 11.527 17.285 ( -8.901 -0.393 6.860) 11.245 17.304 ( -8.353 -2.219 5.884) 10.455 19.104 ( -2.471 3.298 1.892) 4.534 19.128 ( -2.020 0.865 1.161) 2.486 19.429 ( -4.527 4.695 -0.345) 6.531 19.484 ( -4.764 -1.016 -2.542) 5.495 ======================= Grid point 282 (99/120) ======================= q-point: ( 0.33 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( 1.918 4.742 3.097) 5.980 2.333 ( 2.779 1.174 3.884) 4.918 2.548 ( -0.702 -2.984 4.164) 5.171 2.578 ( -3.364 -5.411 7.348) 9.726 2.654 ( 2.591 5.868 -6.062) 8.826 2.738 ( 0.245 -3.560 0.726) 3.642 3.015 ( -3.428 -1.622 -6.056) 7.145 3.050 ( -3.064 -5.465 -7.379) 9.680 3.408 ( 4.248 1.674 -2.083) 5.019 3.450 ( 2.026 -2.097 -2.028) 3.552 3.747 ( -1.096 -2.124 -3.110) 3.922 3.765 ( -1.970 -4.414 -4.317) 6.480 5.231 ( -5.813 2.763 8.146) 10.381 5.270 ( -7.739 -1.498 9.887) 12.645 5.716 ( -15.668 9.259 -13.161) 22.460 5.853 ( -18.542 -5.299 -15.828) 24.948 6.415 ( 7.170 24.623 5.481) 26.224 6.641 ( 3.850 12.741 -6.615) 14.863 6.848 ( 6.283 -9.146 9.242) 14.441 6.878 ( 9.053 -2.992 7.701) 12.256 7.217 ( 7.327 -0.780 -0.202) 7.371 7.298 ( 5.637 -7.620 -1.433) 9.586 7.532 ( 1.183 3.111 -1.482) 3.643 7.645 ( 3.386 -7.101 -3.906) 8.783 7.890 ( -1.064 -1.364 2.713) 3.217 7.946 ( 0.184 -6.210 1.549) 6.403 8.339 ( -7.891 3.536 2.156) 8.912 8.394 ( -8.054 -1.701 -0.191) 8.234 9.597 ( 9.728 1.646 0.574) 9.883 9.629 ( 9.347 -1.441 -1.045) 9.515 9.999 ( 14.586 9.940 -0.956) 17.677 10.064 ( 14.686 5.066 -4.449) 16.159 10.438 ( -15.645 5.601 5.987) 17.663 10.510 ( -15.033 1.823 1.783) 15.248 10.809 ( -3.051 -8.072 7.724) 11.581 10.883 ( -1.234 -14.932 6.057) 16.161 12.226 ( 4.708 7.758 0.487) 9.088 12.268 ( 10.728 9.108 3.244) 14.442 12.374 ( 1.300 10.400 -9.438) 14.104 12.442 ( 1.629 -2.965 3.156) 4.626 12.491 ( 6.825 -0.147 -3.257) 7.564 12.680 ( 0.066 -15.469 -5.305) 16.354 13.210 ( -5.614 4.639 -1.455) 7.427 13.302 ( -1.526 -3.989 -5.398) 6.883 13.834 ( 10.609 14.315 2.093) 17.940 14.035 ( 5.953 -2.503 -3.962) 7.576 14.761 ( -3.794 5.826 -2.420) 7.361 14.991 ( -8.188 -15.358 -11.931) 21.101 15.544 ( 15.272 4.173 17.613) 23.683 15.689 ( 11.686 -11.969 13.188) 21.301 16.065 ( 2.812 0.517 -3.041) 4.174 16.105 ( 3.207 -2.604 -5.727) 7.061 16.455 ( 5.966 4.702 -3.779) 8.484 16.568 ( 5.008 -6.273 -7.314) 10.860 17.080 ( -10.917 -2.410 6.443) 12.904 17.105 ( -10.959 -4.708 5.026) 12.943 19.075 ( -0.032 4.481 0.134) 4.483 19.106 ( 0.048 1.529 -0.758) 1.707 19.325 ( -5.620 4.247 -1.314) 7.166 19.373 ( -6.086 -0.655 -3.123) 6.872 ======================= Grid point 283 (100/120) ======================= q-point: ( 0.44 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 316 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.336 ( 2.375 5.895 4.533) 7.807 2.366 ( 0.188 4.991 4.037) 6.422 2.504 ( -1.421 -7.263 7.005) 10.190 2.523 ( -2.531 -6.781 5.193) 8.908 2.740 ( 5.033 6.919 -5.992) 10.446 2.781 ( 2.034 3.559 -3.003) 5.082 2.949 ( -2.577 -5.933 -7.525) 9.923 2.974 ( -4.071 -7.348 -6.342) 10.525 3.506 ( 4.162 2.924 -0.376) 5.100 3.511 ( 4.225 3.260 -0.735) 5.387 3.686 ( -2.895 -6.556 1.141) 7.257 3.714 ( -4.036 -8.772 -0.240) 9.659 5.230 ( 4.042 0.745 -1.353) 4.327 5.237 ( 6.538 -0.030 -3.004) 7.195 5.415 ( -13.071 3.964 -10.795) 17.410 5.483 ( -16.550 -3.419 -12.751) 21.170 6.570 ( 7.088 26.339 5.161) 27.760 6.668 ( -1.980 23.731 0.386) 23.817 6.952 ( 4.178 -10.486 6.242) 12.899 6.990 ( 1.458 -7.190 5.509) 9.175 7.348 ( 5.115 1.058 -0.995) 5.318 7.386 ( 2.842 -0.084 -2.827) 4.010 7.520 ( 0.098 -7.296 0.225) 7.300 7.606 ( -5.734 -13.178 -3.420) 14.773 7.998 ( 9.073 0.384 4.385) 10.085 8.027 ( 7.163 -1.753 3.376) 8.111 8.174 ( -8.223 2.263 3.661) 9.281 8.216 ( -9.599 -1.234 1.625) 9.813 9.810 ( 11.286 2.181 0.667) 11.514 9.836 ( 11.070 0.028 -0.423) 11.078 10.059 ( -9.103 2.174 2.175) 9.608 10.110 ( -13.075 -3.508 0.903) 13.567 10.315 ( 7.140 20.521 2.318) 21.851 10.377 ( 0.915 15.911 0.329) 15.941 10.768 ( -0.131 -17.762 6.488) 18.911 10.822 ( -4.232 -20.086 4.835) 21.089 12.277 ( 2.232 10.223 -3.832) 11.143 12.326 ( -2.139 12.462 -5.050) 13.615 12.472 ( 3.140 -9.634 -5.511) 11.535 12.511 ( 2.621 -1.284 -3.212) 4.340 12.656 ( 9.547 4.735 -0.660) 10.677 12.762 ( 8.685 0.339 0.502) 8.706 13.006 ( -9.744 -1.126 3.150) 10.302 13.127 ( -13.082 -9.071 -0.258) 15.921 14.118 ( 13.617 20.760 -3.996) 25.147 14.219 ( 6.230 18.187 -8.413) 20.985 14.678 ( -1.526 -17.144 -2.857) 17.447 14.796 ( -10.415 -22.032 -8.290) 25.741 15.837 ( 12.694 4.302 13.186) 18.802 15.911 ( 8.678 -3.226 9.272) 13.103 16.056 ( -3.499 -2.309 4.581) 6.210 16.092 ( -4.097 -4.956 2.094) 6.763 16.597 ( 7.211 6.928 -2.614) 10.336 16.656 ( 2.726 2.174 -3.893) 5.226 16.883 ( -7.201 -8.615 3.343) 11.716 16.899 ( -8.049 -9.135 2.315) 12.393 19.106 ( 2.896 5.723 -1.824) 6.668 19.133 ( 2.059 3.961 -2.803) 5.271 19.219 ( -3.994 1.771 -1.607) 4.655 19.252 ( -5.453 -0.699 -2.948) 6.238 ======================= Grid point 315 (101/120) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( 0.000 0.000 -17.374) 17.374 2.415 ( 0.000 0.000 17.374) 17.374 2.480 ( 0.000 0.000 -16.012) 16.012 2.480 ( 0.000 0.000 16.012) 16.012 2.604 ( 0.000 0.000 -13.640) 13.640 2.604 ( 0.000 0.000 13.640) 13.640 3.073 ( 0.000 0.000 -6.550) 6.550 3.073 ( 0.000 0.000 6.550) 6.550 3.570 ( 0.000 0.000 -7.014) 7.014 3.570 ( 0.000 0.000 7.014) 7.014 4.334 ( 0.000 0.000 -12.103) 12.103 4.334 ( 0.000 0.000 12.103) 12.103 4.836 ( 0.000 0.000 -5.032) 5.032 4.836 ( 0.000 0.000 5.032) 5.032 6.126 ( 0.000 0.000 -16.113) 16.113 6.126 ( 0.000 0.000 16.113) 16.113 6.406 ( 0.000 0.000 -33.129) 33.129 6.406 ( 0.000 0.000 33.129) 33.129 6.845 ( 0.000 0.000 -9.583) 9.583 6.845 ( 0.000 0.000 9.583) 9.583 7.051 ( 0.000 0.000 -15.838) 15.838 7.051 ( 0.000 0.000 15.838) 15.838 7.290 ( 0.000 0.000 -5.287) 5.287 7.290 ( 0.000 0.000 5.287) 5.287 8.022 ( 0.000 0.000 -0.240) 0.240 8.022 ( 0.000 0.000 0.240) 0.240 9.010 ( 0.000 0.000 -12.038) 12.038 9.010 ( 0.000 0.000 12.038) 12.038 9.034 ( 0.000 0.000 -1.110) 1.110 9.034 ( 0.000 0.000 1.110) 1.110 9.387 ( 0.000 0.000 -1.616) 1.616 9.387 ( 0.000 0.000 1.616) 1.616 10.646 ( 0.000 0.000 -10.553) 10.553 10.646 ( 0.000 0.000 10.553) 10.553 11.356 ( 0.000 0.000 -0.277) 0.277 11.356 ( 0.000 0.000 0.277) 0.277 11.613 ( 0.000 0.000 -2.390) 2.390 11.613 ( 0.000 0.000 2.390) 2.390 12.101 ( 0.000 0.000 -16.613) 16.613 12.101 ( 0.000 0.000 16.613) 16.613 12.384 ( 0.000 0.000 -11.688) 11.688 12.384 ( 0.000 0.000 11.688) 11.688 13.367 ( 0.000 0.000 -12.513) 12.513 13.367 ( 0.000 0.000 12.513) 12.513 13.601 ( 0.000 0.000 -12.871) 12.871 13.601 ( 0.000 0.000 12.871) 12.871 14.531 ( 0.000 0.000 -26.401) 26.401 14.531 ( 0.000 0.000 26.401) 26.401 15.292 ( 0.000 0.000 -22.088) 22.088 15.292 ( 0.000 0.000 22.088) 22.088 16.650 ( 0.000 0.000 -3.325) 3.325 16.650 ( 0.000 0.000 3.325) 3.325 16.667 ( 0.000 0.000 -1.227) 1.227 16.667 ( 0.000 0.000 1.227) 1.227 17.412 ( 0.000 0.000 -0.378) 0.378 17.412 ( 0.000 0.000 0.378) 0.378 19.000 ( 0.000 0.000 -1.917) 1.917 19.000 ( 0.000 0.000 1.917) 1.917 19.459 ( 0.000 0.000 -6.009) 6.009 19.459 ( 0.000 0.000 6.009) 6.009 ======================= Grid point 317 (102/120) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( -5.194 0.000 -10.826) 12.007 2.322 ( -5.194 0.000 10.826) 12.007 2.517 ( 3.228 0.000 -14.619) 14.971 2.517 ( 3.228 0.000 14.619) 14.971 2.765 ( 10.977 0.000 -7.046) 13.044 2.765 ( 10.977 0.000 7.046) 13.044 3.043 ( -2.581 0.000 -5.938) 6.475 3.043 ( -2.581 0.000 5.938) 6.475 3.540 ( -2.530 0.000 -5.573) 6.121 3.540 ( -2.530 0.000 5.573) 6.121 4.311 ( -1.787 0.000 -9.869) 10.030 4.311 ( -1.787 0.000 9.869) 10.030 4.826 ( -1.072 0.000 -4.964) 5.079 4.826 ( -1.072 0.000 4.964) 5.079 6.048 ( -7.196 0.000 -18.630) 19.972 6.048 ( -7.196 0.000 18.630) 19.972 6.314 ( -8.956 0.000 -32.934) 34.131 6.314 ( -8.956 0.000 32.934) 34.131 6.845 ( 1.345 0.000 -11.074) 11.155 6.845 ( 1.345 0.000 11.074) 11.155 7.095 ( 4.206 0.000 -12.447) 13.138 7.095 ( 4.206 0.000 12.447) 13.138 7.400 ( 8.998 0.000 -6.067) 10.852 7.400 ( 8.998 0.000 6.067) 10.852 7.976 ( -4.328 0.000 -5.735) 7.185 7.976 ( -4.328 0.000 5.735) 7.185 8.975 ( -5.910 0.000 -2.307) 6.344 8.975 ( -5.910 0.000 2.307) 6.344 9.090 ( 7.313 0.000 -11.084) 13.279 9.090 ( 7.313 0.000 11.084) 13.279 9.396 ( 2.029 0.000 -3.085) 3.692 9.396 ( 2.029 0.000 3.085) 3.692 10.709 ( 4.426 0.000 -10.682) 11.563 10.709 ( 4.426 0.000 10.682) 11.563 11.441 ( 8.261 0.000 -3.597) 9.011 11.441 ( 8.261 0.000 3.597) 9.011 11.482 ( -9.056 0.000 -4.358) 10.050 11.482 ( -9.056 0.000 4.358) 10.050 12.062 ( -3.611 0.000 -15.777) 16.185 12.062 ( -3.611 0.000 15.777) 16.185 12.580 ( 15.829 0.000 -9.726) 18.578 12.580 ( 15.829 0.000 9.726) 18.578 13.338 ( -2.823 0.000 -12.180) 12.503 13.338 ( -2.823 0.000 12.180) 12.503 13.549 ( -5.030 0.000 -14.760) 15.593 13.549 ( -5.030 0.000 14.760) 15.593 14.623 ( 8.639 0.000 -27.935) 29.240 14.623 ( 8.639 0.000 27.935) 29.240 15.345 ( 5.281 0.000 -22.580) 23.189 15.345 ( 5.281 0.000 22.580) 23.189 16.648 ( -1.830 0.000 -4.975) 5.301 16.648 ( -1.830 0.000 4.975) 5.301 16.673 ( 2.238 0.000 -3.080) 3.808 16.673 ( 2.238 0.000 3.080) 3.808 17.409 ( -0.233 0.000 -0.128) 0.266 17.409 ( -0.233 0.000 0.128) 0.266 18.949 ( -4.969 0.000 -1.426) 5.169 18.949 ( -4.969 0.000 1.426) 5.169 19.424 ( -3.421 0.000 -5.970) 6.881 19.424 ( -3.421 0.000 5.970) 6.881 ======================= Grid point 319 (103/120) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -2.369 0.000 -9.163) 9.464 2.247 ( -2.369 0.000 9.163) 9.464 2.562 ( -0.397 0.000 -9.614) 9.622 2.562 ( -0.397 0.000 9.614) 9.622 2.946 ( 5.784 0.000 -5.869) 8.240 2.946 ( 5.784 0.000 5.869) 8.240 3.009 ( 0.726 0.000 -3.605) 3.678 3.009 ( 0.726 0.000 3.605) 3.678 3.489 ( -2.403 0.000 -1.539) 2.854 3.489 ( -2.403 0.000 1.539) 2.854 4.307 ( 3.041 0.000 -3.531) 4.660 4.307 ( 3.041 0.000 3.531) 4.660 4.792 ( -2.296 0.000 -4.818) 5.337 4.792 ( -2.296 0.000 4.818) 5.337 5.872 ( -9.392 0.000 -19.127) 21.309 5.872 ( -9.392 0.000 19.127) 21.309 6.068 ( -14.957 0.000 -29.332) 32.925 6.068 ( -14.957 0.000 29.332) 32.925 6.914 ( 5.115 0.000 -10.967) 12.101 6.914 ( 5.115 0.000 10.967) 12.101 7.206 ( 6.397 0.000 -6.398) 9.048 7.206 ( 6.397 0.000 6.398) 9.048 7.586 ( 8.577 0.000 -5.226) 10.044 7.586 ( 8.577 0.000 5.226) 10.044 7.862 ( -6.711 0.000 -8.547) 10.867 7.862 ( -6.711 0.000 8.547) 10.867 8.820 ( -8.446 0.000 -1.181) 8.529 8.820 ( -8.446 0.000 1.181) 8.529 9.267 ( 9.437 0.000 -8.693) 12.830 9.267 ( 9.437 0.000 8.693) 12.830 9.488 ( 6.715 0.000 -5.556) 8.716 9.488 ( 6.715 0.000 5.556) 8.716 10.721 ( -4.791 0.000 -6.969) 8.457 10.721 ( -4.791 0.000 6.969) 8.457 11.390 ( 1.471 0.000 -6.642) 6.803 11.390 ( 1.471 0.000 6.642) 6.803 11.662 ( 12.304 0.000 -8.329) 14.858 11.662 ( 12.304 0.000 8.329) 14.858 11.983 ( -2.968 0.000 -12.847) 13.186 11.983 ( -2.968 0.000 12.847) 13.186 12.903 ( 14.432 0.000 -9.608) 17.338 12.903 ( 14.432 0.000 9.608) 17.338 13.266 ( -3.676 0.000 -8.886) 9.616 13.266 ( -3.676 0.000 8.886) 9.616 13.408 ( -8.755 0.000 -15.388) 17.704 13.408 ( -8.755 0.000 15.388) 17.704 14.844 ( 12.362 0.000 -26.419) 29.168 14.844 ( 12.362 0.000 26.419) 29.168 15.504 ( 10.488 0.000 -23.214) 25.473 15.504 ( 10.488 0.000 23.214) 25.473 16.594 ( -3.705 0.000 -9.225) 9.941 16.594 ( -3.705 0.000 9.225) 9.941 16.736 ( 3.940 0.000 -2.530) 4.683 16.736 ( 3.940 0.000 2.530) 4.683 17.404 ( -0.264 0.000 -1.217) 1.245 17.404 ( -0.264 0.000 1.217) 1.245 18.815 ( -7.888 0.000 -0.596) 7.911 18.815 ( -7.888 0.000 0.596) 7.911 19.328 ( -5.846 0.000 -5.653) 8.132 19.328 ( -5.846 0.000 5.653) 8.132 ======================= Grid point 321 (104/120) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -0.915 0.000 -7.127) 7.185 2.216 ( -0.915 0.000 7.127) 7.185 2.484 ( -6.160 0.000 -4.288) 7.506 2.484 ( -6.160 0.000 4.288) 7.506 2.995 ( 0.065 0.000 -5.621) 5.622 2.995 ( 0.065 0.000 5.621) 5.622 3.087 ( 5.842 0.000 -3.439) 6.779 3.087 ( 5.842 0.000 3.439) 6.779 3.431 ( -3.543 0.000 -2.078) 4.108 3.431 ( -3.543 0.000 2.078) 4.108 4.476 ( 13.624 0.000 -4.262) 14.275 4.476 ( 13.624 0.000 4.262) 14.275 4.740 ( -2.586 0.000 -4.101) 4.848 4.740 ( -2.586 0.000 4.101) 4.848 5.701 ( -7.170 0.000 -13.814) 15.564 5.701 ( -7.170 0.000 13.814) 15.564 5.727 ( -18.734 0.000 -23.824) 30.307 5.727 ( -18.734 0.000 23.824) 30.307 7.030 ( 5.947 0.000 -8.644) 10.492 7.030 ( 5.947 0.000 8.644) 10.492 7.337 ( 6.459 0.000 -1.839) 6.716 7.337 ( 6.459 0.000 1.839) 6.716 7.720 ( -7.115 0.000 -9.185) 11.618 7.720 ( -7.115 0.000 9.185) 11.618 7.722 ( 4.736 0.000 -3.624) 5.963 7.722 ( 4.736 0.000 3.624) 5.963 8.670 ( -6.034 0.000 -0.266) 6.040 8.670 ( -6.034 0.000 0.266) 6.040 9.440 ( 7.227 0.000 -5.527) 9.098 9.440 ( 7.227 0.000 5.527) 9.098 9.644 ( 8.234 0.000 -5.748) 10.042 9.644 ( 8.234 0.000 5.748) 10.042 10.553 ( -9.993 0.000 -2.189) 10.230 10.553 ( -9.993 0.000 2.189) 10.230 11.494 ( 6.738 0.000 -7.609) 10.163 11.494 ( 6.738 0.000 7.609) 10.163 11.792 ( -0.850 0.000 -9.312) 9.350 11.792 ( -0.850 0.000 9.312) 9.350 12.073 ( 12.880 0.000 -2.064) 13.044 12.073 ( 12.880 0.000 2.064) 13.044 13.061 ( -0.339 0.000 -16.962) 16.965 13.061 ( -0.339 0.000 16.962) 16.965 13.208 ( -10.852 0.000 -13.060) 16.980 13.208 ( -10.852 0.000 13.060) 16.980 13.265 ( 5.095 0.000 -3.091) 5.960 13.265 ( 5.095 0.000 3.091) 5.960 15.081 ( 10.294 0.000 -18.771) 21.408 15.081 ( 10.294 0.000 18.771) 21.408 15.755 ( 13.957 0.000 -22.292) 26.301 15.755 ( 13.957 0.000 22.292) 26.301 16.493 ( -6.513 0.000 -13.178) 14.699 16.493 ( -6.513 0.000 13.178) 14.699 16.822 ( 4.281 0.000 -1.847) 4.663 16.822 ( 4.281 0.000 1.847) 4.663 17.403 ( 0.263 0.000 -1.850) 1.869 17.403 ( 0.263 0.000 1.850) 1.869 18.654 ( -7.519 0.000 -0.935) 7.577 18.654 ( -7.519 0.000 0.935) 7.577 19.204 ( -5.957 0.000 -4.465) 7.445 19.204 ( -5.957 0.000 4.465) 7.445 ======================= Grid point 323 (105/120) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( -0.308 0.000 -2.833) 2.850 2.204 ( -0.308 0.000 2.833) 2.850 2.377 ( -3.300 0.000 -1.375) 3.575 2.377 ( -3.300 0.000 1.375) 3.575 2.986 ( -0.439 0.000 -2.385) 2.425 2.986 ( -0.439 0.000 2.385) 2.425 3.187 ( 3.041 0.000 -1.552) 3.415 3.187 ( 3.041 0.000 1.552) 3.415 3.367 ( -2.019 0.000 -0.936) 2.225 3.367 ( -2.019 0.000 0.936) 2.225 4.700 ( -1.171 0.000 -1.734) 2.092 4.700 ( -1.171 0.000 1.734) 2.092 4.804 ( 16.409 0.000 -8.783) 18.612 4.804 ( 16.409 0.000 8.783) 18.612 5.344 ( -17.483 0.000 -15.255) 23.203 5.344 ( -17.483 0.000 15.255) 23.203 5.599 ( -2.651 0.000 -4.943) 5.610 5.599 ( -2.651 0.000 4.943) 5.610 7.126 ( 2.894 0.000 -3.451) 4.503 7.126 ( 2.894 0.000 3.451) 4.503 7.461 ( 5.988 0.000 -4.793) 7.670 7.461 ( 5.988 0.000 4.793) 7.670 7.584 ( -6.365 0.000 -7.950) 10.184 7.584 ( -6.365 0.000 7.950) 10.184 7.778 ( 1.084 0.000 -1.337) 1.722 7.778 ( 1.084 0.000 1.337) 1.722 8.588 ( -2.032 0.000 -0.351) 2.062 8.588 ( -2.032 0.000 0.351) 2.062 9.542 ( 2.667 0.000 -1.901) 3.275 9.542 ( 2.667 0.000 1.901) 3.275 9.786 ( 4.716 0.000 -2.764) 5.466 9.786 ( 4.716 0.000 2.764) 5.466 10.383 ( -5.533 0.000 -0.752) 5.584 10.383 ( -5.533 0.000 0.752) 5.584 11.602 ( 3.146 0.000 -3.483) 4.694 11.602 ( 3.146 0.000 3.483) 4.694 11.756 ( -1.294 0.000 -3.240) 3.488 11.756 ( -1.294 0.000 3.240) 3.488 12.330 ( 9.388 0.000 -2.775) 9.789 12.330 ( 9.388 0.000 2.775) 9.789 13.005 ( -7.525 0.000 -6.650) 10.042 13.005 ( -7.525 0.000 6.650) 10.042 13.014 ( -1.958 0.000 -6.810) 7.086 13.014 ( -1.958 0.000 6.810) 7.086 13.362 ( 2.825 0.000 -1.053) 3.015 13.362 ( 2.825 0.000 1.053) 3.015 15.228 ( 3.931 0.000 -6.752) 7.813 15.228 ( 3.931 0.000 6.752) 7.813 16.032 ( 12.268 0.000 -17.656) 21.500 16.032 ( 12.268 0.000 17.656) 21.500 16.331 ( -8.979 0.000 -14.590) 17.132 16.331 ( -8.979 0.000 14.590) 17.132 16.890 ( 2.010 0.000 -0.754) 2.147 16.890 ( 2.010 0.000 0.754) 2.147 17.411 ( 0.378 0.000 -0.942) 1.015 17.411 ( 0.378 0.000 0.942) 1.015 18.539 ( -3.237 0.000 -0.587) 3.290 18.539 ( -3.237 0.000 0.587) 3.290 19.112 ( -2.639 0.000 -1.787) 3.187 19.112 ( -2.639 0.000 1.787) 3.187 ======================= Grid point 333 (106/120) ======================= q-point: ( 0.00 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( 0.000 -10.057 -1.243) 10.134 2.237 ( 0.000 -10.057 1.243) 10.134 2.597 ( 0.000 7.548 -9.274) 11.957 2.597 ( 0.000 7.548 9.274) 11.957 2.706 ( 0.000 7.470 -6.575) 9.951 2.706 ( 0.000 7.470 6.575) 9.951 3.094 ( 0.000 1.056 -5.379) 5.482 3.094 ( 0.000 1.056 5.379) 5.482 3.446 ( 0.000 -11.294 -6.419) 12.990 3.446 ( 0.000 -11.294 6.419) 12.990 4.190 ( 0.000 -11.808 -11.177) 16.259 4.190 ( 0.000 -11.808 11.177) 16.259 5.066 ( 0.000 19.964 -5.916) 20.822 5.066 ( 0.000 19.964 5.916) 20.822 6.167 ( 0.000 4.123 -15.729) 16.261 6.167 ( 0.000 4.123 15.729) 16.261 6.432 ( 0.000 2.723 -31.826) 31.942 6.432 ( 0.000 2.723 31.826) 31.942 6.818 ( 0.000 -2.597 -8.492) 8.881 6.818 ( 0.000 -2.597 8.492) 8.881 7.026 ( 0.000 -2.795 -16.052) 16.294 7.026 ( 0.000 -2.795 16.052) 16.294 7.243 ( 0.000 -4.876 -6.585) 8.194 7.243 ( 0.000 -4.876 6.585) 8.194 8.122 ( 0.000 9.746 -0.377) 9.753 8.122 ( 0.000 9.746 0.377) 9.753 8.847 ( 0.000 -10.815 -4.574) 11.742 8.847 ( 0.000 -10.815 4.574) 11.742 9.084 ( 0.000 -0.608 -4.873) 4.911 9.084 ( 0.000 -0.608 4.873) 4.911 9.354 ( 0.000 -2.812 -1.415) 3.148 9.354 ( 0.000 -2.812 1.415) 3.148 10.681 ( 0.000 3.498 -9.334) 9.968 10.681 ( 0.000 3.498 9.334) 9.968 11.448 ( 0.000 8.810 -0.758) 8.842 11.448 ( 0.000 8.810 0.758) 8.842 11.596 ( 0.000 -1.573 -1.845) 2.424 11.596 ( 0.000 -1.573 1.845) 2.424 12.107 ( 0.000 1.163 -14.961) 15.006 12.107 ( 0.000 1.163 14.961) 15.006 12.416 ( 0.000 2.686 -8.935) 9.330 12.416 ( 0.000 2.686 8.935) 9.330 13.203 ( 0.000 -11.474 -7.837) 13.895 13.203 ( 0.000 -11.474 7.837) 13.895 13.801 ( 0.000 15.009 -18.156) 23.556 13.801 ( 0.000 15.009 18.156) 23.556 14.568 ( 0.000 3.519 -26.075) 26.311 14.568 ( 0.000 3.519 26.075) 26.311 15.288 ( 0.000 -0.075 -21.497) 21.498 15.288 ( 0.000 -0.075 21.497) 21.498 16.401 ( 0.000 -20.895 -0.619) 20.904 16.401 ( 0.000 -20.895 0.619) 20.904 16.638 ( 0.000 -5.327 -2.612) 5.934 16.638 ( 0.000 -5.327 2.612) 5.934 17.464 ( 0.000 3.776 -0.283) 3.786 17.464 ( 0.000 3.776 0.283) 3.786 19.053 ( 0.000 4.894 -0.964) 4.988 19.053 ( 0.000 4.894 0.964) 4.988 19.474 ( 0.000 1.531 -5.769) 5.969 19.474 ( 0.000 1.531 5.769) 5.969 ======================= Grid point 335 (107/120) ======================= q-point: ( 0.11 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -1.046 -7.130 -4.644) 8.573 2.228 ( -1.046 -7.130 4.644) 8.573 2.547 ( -0.484 3.497 -12.203) 12.703 2.547 ( -0.484 3.497 12.203) 12.703 2.860 ( 9.555 7.332 -6.415) 13.645 2.860 ( 9.555 7.332 6.415) 13.645 3.068 ( -2.213 1.826 -4.707) 5.512 3.068 ( -2.213 1.826 4.707) 5.512 3.420 ( -2.012 -11.172 -4.898) 12.363 3.420 ( -2.012 -11.172 4.898) 12.363 4.159 ( -2.683 -12.226 -9.420) 15.666 4.159 ( -2.683 -12.226 9.420) 15.666 5.061 ( -0.597 20.248 -5.658) 21.033 5.061 ( -0.597 20.248 5.659) 21.033 6.084 ( -7.496 3.608 -18.497) 20.282 6.084 ( -7.496 3.608 18.497) 20.282 6.330 ( -9.800 1.538 -31.591) 33.112 6.330 ( -9.800 1.538 31.591) 33.112 6.814 ( 1.182 -2.658 -9.138) 9.590 6.814 ( 1.182 -2.658 9.138) 9.590 7.091 ( 5.828 -0.955 -11.051) 12.530 7.091 ( 5.828 -0.955 11.051) 12.530 7.353 ( 8.908 -4.586 -7.440) 12.479 7.353 ( 8.908 -4.586 7.440) 12.479 8.062 ( -5.142 8.032 -4.060) 10.365 8.062 ( -5.142 8.032 4.060) 10.365 8.824 ( -3.404 -11.098 -0.861) 11.640 8.824 ( -3.404 -11.098 0.861) 11.640 9.158 ( 7.508 2.913 -6.915) 10.615 9.158 ( 7.508 2.913 6.915) 10.615 9.379 ( 2.887 -1.571 -2.643) 4.217 9.379 ( 2.887 -1.571 2.643) 4.217 10.730 ( 3.404 2.235 -9.623) 10.449 10.730 ( 3.404 2.235 9.623) 10.449 11.425 ( -8.542 -2.622 -3.594) 9.631 11.425 ( -8.542 -2.622 3.594) 9.631 11.552 ( 5.883 7.915 -3.859) 10.590 11.552 ( 5.883 7.915 3.859) 10.590 12.097 ( -2.127 3.787 -15.238) 15.845 12.097 ( -2.127 3.787 15.238) 15.845 12.584 ( 14.341 0.153 -9.621) 17.270 12.584 ( 14.341 0.153 9.621) 17.270 13.180 ( -2.169 -10.830 -8.391) 13.871 13.180 ( -2.169 -10.830 8.391) 13.871 13.737 ( -5.914 13.882 -17.824) 23.353 13.737 ( -5.914 13.882 17.824) 23.353 14.660 ( 8.466 3.525 -27.391) 28.885 14.660 ( 8.466 3.525 27.391) 28.885 15.344 ( 5.583 0.222 -21.823) 22.527 15.344 ( 5.583 0.222 21.823) 22.527 16.415 ( 1.287 -20.325 -0.566) 20.373 16.415 ( 1.287 -20.325 0.566) 20.373 16.635 ( -0.251 -5.229 -4.165) 6.690 16.635 ( -0.251 -5.229 4.165) 6.690 17.452 ( -1.207 2.874 -0.177) 3.122 17.452 ( -1.207 2.874 0.177) 3.122 19.006 ( -4.419 5.412 -0.474) 7.003 19.006 ( -4.419 5.412 0.474) 7.003 19.440 ( -3.232 1.710 -5.701) 6.772 19.440 ( -3.232 1.710 5.701) 6.772 ======================= Grid point 337 (108/120) ======================= q-point: ( 0.22 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( -0.822 -2.974 -6.571) 7.260 2.205 ( -0.822 -2.974 6.571) 7.260 2.571 ( 0.964 0.660 -9.875) 9.944 2.571 ( 0.964 0.660 9.875) 9.944 2.960 ( -0.368 1.303 -3.586) 3.833 2.960 ( -0.368 1.303 3.586) 3.833 3.058 ( 1.952 3.449 -7.251) 8.263 3.058 ( 1.952 3.449 7.251) 8.263 3.400 ( 0.350 -8.067 -1.206) 8.165 3.400 ( 0.350 -8.067 1.206) 8.165 4.121 ( 0.226 -14.127 -4.389) 14.795 4.121 ( 0.226 -14.127 4.389) 14.795 5.038 ( -1.555 20.079 -5.338) 20.835 5.038 ( -1.555 20.079 5.338) 20.835 5.904 ( -9.863 3.111 -18.392) 21.101 5.904 ( -9.863 3.111 18.392) 21.101 6.074 ( -14.488 0.819 -27.323) 30.937 6.074 ( -14.488 0.819 27.323) 30.937 6.883 ( 5.324 -2.180 -8.531) 10.289 6.883 ( 5.324 -2.180 8.531) 10.289 7.231 ( 7.342 1.087 -4.718) 8.795 7.231 ( 7.342 1.087 4.718) 8.795 7.526 ( 6.987 -4.315 -5.337) 9.793 7.526 ( 6.987 -4.315 5.337) 9.793 7.956 ( -4.423 7.520 -5.447) 10.285 7.956 ( -4.423 7.520 5.447) 10.285 8.712 ( -6.944 -9.639 -0.887) 11.913 8.712 ( -6.944 -9.639 0.887) 11.913 9.345 ( 9.701 6.642 -6.652) 13.508 9.345 ( 9.701 6.642 6.652) 13.508 9.482 ( 7.339 -0.318 -5.757) 9.333 9.482 ( 7.339 -0.318 5.757) 9.333 10.721 ( -6.128 0.199 -6.321) 8.806 10.721 ( -6.128 0.199 6.321) 8.806 11.312 ( 0.242 -6.914 -5.596) 8.899 11.312 ( 0.242 -6.914 5.596) 8.899 11.757 ( 12.685 8.416 -7.492) 16.967 11.757 ( 12.685 8.416 7.492) 16.967 12.032 ( -3.357 5.279 -11.616) 13.194 12.032 ( -3.357 5.279 11.616) 13.194 12.875 ( 11.519 -3.780 -11.307) 16.578 12.875 ( 11.519 -3.780 11.307) 16.578 13.134 ( -0.958 -7.190 -5.582) 9.153 13.134 ( -0.958 -7.190 5.582) 9.153 13.585 ( -8.712 12.424 -15.290) 21.541 13.585 ( -8.712 12.424 15.290) 21.541 14.869 ( 11.274 2.104 -25.453) 27.918 14.869 ( 11.274 2.104 25.453) 27.918 15.511 ( 10.875 0.900 -22.109) 24.655 15.511 ( 10.875 0.900 22.109) 24.655 16.440 ( 0.715 -17.061 -4.456) 17.648 16.440 ( 0.715 -17.061 4.456) 17.648 16.636 ( 0.649 -6.565 -5.838) 8.809 16.636 ( 0.649 -6.565 5.838) 8.809 17.417 ( -2.200 0.165 -1.147) 2.487 17.417 ( -2.200 0.165 1.147) 2.487 18.890 ( -6.673 7.036 -0.651) 9.719 18.890 ( -6.673 7.036 0.651) 9.719 19.350 ( -5.584 2.136 -5.351) 8.024 19.350 ( -5.584 2.136 5.351) 8.024 ======================= Grid point 339 (109/120) ======================= q-point: ( 0.33 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( 0.490 -0.475 -5.403) 5.446 2.202 ( 0.490 -0.475 5.403) 5.446 2.524 ( -5.314 3.151 -5.572) 8.319 2.524 ( -5.314 3.151 5.572) 8.319 2.959 ( 0.479 -2.957 -4.211) 5.168 2.959 ( 0.479 -2.957 4.211) 5.168 3.091 ( 1.761 -1.145 -6.265) 6.608 3.091 ( 1.761 -1.145 6.265) 6.608 3.401 ( -0.749 -2.244 -1.675) 2.898 3.401 ( -0.749 -2.244 1.675) 2.898 4.202 ( 7.382 -18.178 -2.454) 19.772 4.202 ( 7.382 -18.178 2.454) 19.772 5.013 ( -0.270 17.681 -4.080) 18.147 5.013 ( -0.270 17.681 4.080) 18.147 5.660 ( -15.511 -2.498 -17.294) 23.365 5.660 ( -15.511 -2.498 17.295) 23.365 5.825 ( -8.341 9.201 -16.031) 20.279 5.825 ( -8.341 9.201 16.031) 20.279 7.007 ( 6.419 -1.379 -6.280) 9.085 7.007 ( 6.419 -1.379 6.280) 9.085 7.362 ( 5.219 0.040 -1.645) 5.473 7.362 ( 5.219 0.040 1.645) 5.473 7.601 ( 0.606 -1.720 -3.520) 3.964 7.601 ( 0.606 -1.720 3.520) 3.964 7.915 ( 0.286 9.459 -4.173) 10.342 7.915 ( 0.286 9.459 4.173) 10.342 8.576 ( -6.079 -9.078 -0.187) 10.927 8.576 ( -6.079 -9.078 0.187) 10.927 9.518 ( 7.291 7.243 -4.282) 11.133 9.518 ( 7.291 7.243 4.282) 11.133 9.652 ( 8.799 1.563 -5.864) 10.689 9.652 ( 8.799 1.563 5.864) 10.689 10.523 ( -11.427 -2.693 -1.694) 11.862 10.523 ( -11.427 -2.693 1.694) 11.862 11.391 ( 5.206 -9.239 -7.096) 12.760 11.391 ( 5.206 -9.239 7.096) 12.760 11.915 ( -0.489 10.714 -7.774) 13.246 11.915 ( -0.489 10.714 7.774) 13.246 12.098 ( 13.154 3.019 -0.659) 13.512 12.098 ( 13.154 3.019 0.659) 13.512 12.933 ( -3.364 -10.201 -14.049) 17.685 12.933 ( -3.364 -10.201 14.049) 17.685 13.190 ( 1.445 0.429 -6.825) 6.989 13.190 ( 1.445 0.429 6.825) 6.989 13.435 ( -3.401 12.182 -6.150) 14.064 13.435 ( -3.401 12.182 6.150) 14.064 15.079 ( 8.923 -0.853 -17.764) 19.897 15.079 ( 8.923 -0.853 17.764) 19.897 15.767 ( 14.007 1.294 -21.038) 25.307 15.767 ( 14.007 1.294 21.038) 25.307 16.418 ( -3.416 -9.362 -10.398) 14.403 16.418 ( -3.416 -9.362 10.398) 14.403 16.670 ( 2.559 -11.358 -4.376) 12.438 16.670 ( 2.559 -11.358 4.376) 12.438 17.370 ( -2.256 -4.040 -1.603) 4.897 17.370 ( -2.256 -4.040 1.603) 4.897 18.760 ( -5.750 9.729 -1.339) 11.380 18.760 ( -5.750 9.729 1.339) 11.380 19.230 ( -5.801 2.511 -4.226) 7.604 19.230 ( -5.801 2.511 4.226) 7.604 ======================= Grid point 341 (110/120) ======================= q-point: ( 0.44 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.218 ( 0.848 1.739 -2.143) 2.888 2.218 ( 0.848 1.739 2.143) 2.888 2.418 ( -3.727 3.872 -2.388) 5.881 2.418 ( -3.727 3.872 2.388) 5.881 2.961 ( -0.062 -2.720 -2.409) 3.634 2.961 ( -0.062 -2.720 2.409) 3.634 3.121 ( 0.687 -6.106 -2.492) 6.631 3.121 ( 0.687 -6.106 2.492) 6.631 3.390 ( 0.020 1.930 -0.567) 2.012 3.390 ( 0.020 1.930 0.567) 2.012 4.347 ( 4.852 -21.362 -2.344) 22.031 4.347 ( 4.852 -21.362 2.344) 22.031 5.069 ( 6.628 11.781 -3.370) 13.931 5.069 ( 6.628 11.781 3.370) 13.931 5.335 ( -14.817 -0.864 -12.935) 19.688 5.335 ( -14.817 -0.864 12.935) 19.688 5.723 ( -2.395 13.903 -5.329) 15.081 5.723 ( -2.395 13.903 5.329) 15.081 7.112 ( 3.197 -0.893 -2.422) 4.109 7.112 ( 3.197 -0.893 2.422) 4.109 7.426 ( 1.226 -4.509 -1.092) 4.798 7.426 ( 1.226 -4.509 1.092) 4.798 7.596 ( -0.247 5.069 -3.178) 5.988 7.596 ( -0.247 5.069 3.178) 5.988 7.933 ( 0.691 10.846 -1.921) 11.037 7.933 ( 0.691 10.846 1.921) 11.037 8.487 ( -2.407 -10.217 -0.311) 10.501 8.487 ( -2.407 -10.217 0.311) 10.501 9.625 ( 2.928 8.434 -1.543) 9.060 9.625 ( 2.928 8.434 1.543) 9.060 9.803 ( 5.116 2.229 -2.787) 6.238 9.803 ( 5.116 2.229 2.787) 6.238 10.327 ( -6.510 -5.286 -0.701) 8.415 10.327 ( -6.510 -5.286 0.701) 8.415 11.467 ( 1.898 -10.807 -3.183) 11.424 11.467 ( 1.898 -10.807 3.183) 11.425 11.898 ( -0.317 10.519 -2.172) 10.746 11.898 ( -0.317 10.519 2.172) 10.746 12.356 ( 9.318 3.487 -3.575) 10.572 12.356 ( 9.318 3.487 3.575) 10.572 12.851 ( -3.483 -9.575 -6.259) 11.957 12.851 ( -3.483 -9.575 6.259) 11.957 13.104 ( -5.168 3.036 -6.708) 8.996 13.104 ( -5.168 3.036 6.708) 8.996 13.464 ( 2.422 10.308 -0.191) 10.591 13.464 ( 2.422 10.308 0.191) 10.591 15.206 ( 3.363 -3.167 -6.346) 7.849 15.206 ( 3.363 -3.167 6.346) 7.849 16.040 ( 11.973 0.590 -16.985) 20.790 16.040 ( 11.973 0.590 16.985) 20.790 16.300 ( -7.703 -3.505 -13.614) 16.030 16.300 ( -7.703 -3.505 13.614) 16.030 16.718 ( 1.591 -14.254 -1.394) 14.410 16.718 ( 1.591 -14.254 1.394) 14.410 17.336 ( -0.982 -7.752 -0.798) 7.855 17.336 ( -0.982 -7.752 0.798) 7.855 18.677 ( -2.197 12.307 -0.738) 12.524 18.677 ( -2.197 12.307 0.738) 12.524 19.140 ( -2.627 2.588 -1.707) 4.064 19.140 ( -2.627 2.588 1.707) 4.064 ======================= Grid point 351 (111/120) ======================= q-point: ( 0.00 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.119 ( 0.000 -1.182 -4.199) 4.363 2.119 ( 0.000 -1.182 4.199) 4.363 2.716 ( 0.000 -0.483 -7.667) 7.682 2.716 ( 0.000 -0.483 7.667) 7.682 2.849 ( 0.000 9.269 -14.769) 17.437 2.849 ( 0.000 9.269 14.769) 17.437 3.062 ( 0.000 -3.076 -6.678) 7.352 3.062 ( 0.000 -3.076 6.678) 7.352 3.262 ( 0.000 -5.226 -9.222) 10.600 3.262 ( 0.000 -5.226 9.222) 10.600 3.938 ( 0.000 -14.249 -10.618) 17.770 3.938 ( 0.000 -14.249 10.618) 17.770 5.499 ( 0.000 24.014 -5.530) 24.642 5.499 ( 0.000 24.014 5.530) 24.642 6.271 ( 0.000 6.414 -14.726) 16.062 6.271 ( 0.000 6.414 14.726) 16.062 6.501 ( 0.000 3.953 -24.022) 24.345 6.501 ( 0.000 3.953 24.022) 24.345 6.758 ( 0.000 -3.202 -3.554) 4.784 6.758 ( 0.000 -3.202 3.554) 4.784 6.938 ( 0.000 -6.424 -12.089) 13.690 6.938 ( 0.000 -6.424 12.089) 13.690 7.109 ( 0.000 -8.904 -12.598) 15.427 7.109 ( 0.000 -8.904 12.598) 15.427 8.347 ( 0.000 12.493 -1.773) 12.618 8.347 ( 0.000 12.493 1.773) 12.618 8.645 ( 0.000 -9.261 -1.304) 9.352 8.645 ( 0.000 -9.261 1.304) 9.352 9.008 ( 0.000 -6.664 -3.907) 7.725 9.008 ( 0.000 -6.664 3.907) 7.725 9.303 ( 0.000 -2.348 -0.928) 2.525 9.303 ( 0.000 -2.348 0.928) 2.525 10.764 ( 0.000 4.629 -6.325) 7.838 10.764 ( 0.000 4.629 6.325) 7.838 11.539 ( 0.000 -2.073 -1.822) 2.760 11.539 ( 0.000 -2.073 1.822) 2.760 11.668 ( 0.000 10.978 -0.611) 10.995 11.668 ( 0.000 10.978 0.611) 10.995 12.164 ( 0.000 4.845 -11.171) 12.176 12.164 ( 0.000 4.845 11.171) 12.176 12.453 ( 0.000 0.436 -5.137) 5.155 12.453 ( 0.000 0.436 5.137) 5.155 13.001 ( 0.000 -8.957 -2.923) 9.422 13.001 ( 0.000 -8.957 2.923) 9.422 14.087 ( 0.000 13.366 -22.565) 26.226 14.087 ( 0.000 13.366 22.565) 26.226 14.654 ( 0.000 5.878 -24.115) 24.821 14.654 ( 0.000 5.878 24.115) 24.821 15.307 ( 0.000 2.238 -19.305) 19.434 15.307 ( 0.000 2.238 19.305) 19.434 15.943 ( 0.000 -25.170 -4.265) 25.529 15.943 ( 0.000 -25.170 4.265) 25.529 16.497 ( 0.000 -8.634 -2.040) 8.872 16.497 ( 0.000 -8.634 2.040) 8.872 17.516 ( 0.000 1.598 -0.011) 1.598 17.516 ( 0.000 1.598 0.011) 1.598 19.153 ( 0.000 4.756 -0.334) 4.768 19.153 ( 0.000 4.756 0.334) 4.768 19.513 ( 0.000 2.381 -4.499) 5.090 19.513 ( 0.000 2.381 4.499) 5.090 ======================= Grid point 353 (112/120) ======================= q-point: ( 0.11 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( 2.153 -0.269 -3.596) 4.200 2.144 ( 2.153 -0.269 3.596) 4.200 2.625 ( -4.458 2.707 -4.853) 7.124 2.625 ( -4.458 2.707 4.853) 7.124 2.944 ( 3.976 -1.768 -3.005) 5.288 2.944 ( 3.976 -1.768 3.005) 5.288 3.083 ( 1.395 0.565 -10.030) 10.143 3.083 ( 1.395 0.565 10.030) 10.143 3.236 ( -0.897 -3.667 -6.178) 7.240 3.236 ( -0.897 -3.667 6.178) 7.240 3.911 ( -2.415 -13.228 -9.285) 16.341 3.911 ( -2.415 -13.228 9.285) 16.341 5.493 ( -1.050 23.523 -5.465) 24.172 5.493 ( -1.050 23.523 5.465) 24.172 6.176 ( -8.086 5.775 -17.893) 20.467 6.176 ( -8.086 5.775 17.893) 20.467 6.362 ( -12.080 1.454 -26.842) 29.471 6.362 ( -12.080 1.454 26.842) 29.471 6.759 ( 1.995 -3.245 -6.125) 7.212 6.759 ( 1.995 -3.245 6.125) 7.212 7.047 ( 8.499 -3.460 -10.092) 13.641 7.047 ( 8.499 -3.460 10.092) 13.641 7.237 ( 10.246 -7.239 -12.598) 17.779 7.237 ( 10.246 -7.239 12.598) 17.779 8.215 ( -9.238 5.713 -0.339) 10.867 8.215 ( -9.238 5.713 0.339) 10.867 8.635 ( -2.761 -6.657 -2.366) 7.586 8.635 ( -2.761 -6.657 2.366) 7.586 9.174 ( 14.353 -0.805 -4.891) 15.185 9.174 ( 14.353 -0.805 4.891) 15.185 9.347 ( 4.286 -1.709 -1.453) 4.837 9.347 ( 4.286 -1.709 1.453) 4.837 10.790 ( 1.674 3.770 -6.901) 8.040 10.790 ( 1.674 3.770 6.901) 8.040 11.359 ( -13.524 -3.808 -2.421) 14.257 11.359 ( -13.524 -3.808 2.421) 14.257 11.740 ( 6.675 10.651 -2.124) 12.748 11.740 ( 6.675 10.651 2.124) 12.748 12.207 ( 1.152 7.457 -13.317) 15.306 12.207 ( 1.152 7.457 13.317) 15.306 12.562 ( 10.047 -3.176 -9.680) 14.309 12.562 ( 10.047 -3.176 9.680) 14.309 12.997 ( 0.134 -7.554 -4.616) 8.853 12.997 ( 0.134 -7.554 4.616) 8.853 13.999 ( -7.623 12.402 -20.340) 25.012 13.999 ( -7.623 12.402 20.340) 25.012 14.741 ( 7.313 4.798 -24.446) 25.964 14.741 ( 7.313 4.798 24.446) 25.964 15.369 ( 6.147 2.594 -19.406) 20.521 15.369 ( 6.147 2.594 19.406) 20.521 15.973 ( 2.875 -23.976 -4.071) 24.488 15.973 ( 2.875 -23.976 4.071) 24.488 16.499 ( 0.213 -8.269 -3.401) 8.944 16.499 ( 0.213 -8.269 3.401) 8.944 17.485 ( -3.090 0.650 -0.380) 3.180 17.485 ( -3.090 0.650 0.380) 3.180 19.118 ( -3.278 5.364 -0.761) 6.332 19.118 ( -3.278 5.364 0.761) 6.332 19.483 ( -2.932 2.505 -4.432) 5.875 19.483 ( -2.932 2.505 4.432) 5.875 ======================= Grid point 355 (113/120) ======================= q-point: ( 0.22 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 2.143 2.254 -3.925) 5.008 2.189 ( 2.143 2.254 3.925) 5.008 2.583 ( -0.203 0.246 -5.450) 5.459 2.583 ( -0.203 0.246 5.450) 5.459 2.966 ( -1.691 -1.764 -5.956) 6.438 2.966 ( -1.691 -1.764 5.956) 6.438 3.034 ( -3.981 -7.475 -9.427) 12.673 3.034 ( -3.981 -7.475 9.427) 12.673 3.305 ( 5.507 1.249 -2.851) 6.326 3.305 ( 5.507 1.249 2.851) 6.326 3.866 ( -1.134 -11.717 -5.233) 12.883 3.866 ( -1.134 -11.717 5.233) 12.883 5.429 ( -5.691 18.726 -7.016) 20.791 5.429 ( -5.691 18.726 7.016) 20.791 5.957 ( -15.380 0.952 -15.368) 21.763 5.957 ( -15.380 0.952 15.368) 21.763 6.142 ( -5.965 8.302 -17.418) 20.196 6.142 ( -5.965 8.302 17.418) 20.196 6.851 ( 6.556 -1.542 -4.999) 8.387 6.851 ( 6.556 -1.542 4.999) 8.387 7.212 ( 7.105 -2.733 -6.911) 10.281 7.212 ( 7.105 -2.733 6.911) 10.281 7.450 ( 9.979 -4.085 -8.412) 13.676 7.450 ( 9.979 -4.085 8.412) 13.676 8.061 ( -5.326 1.391 -0.679) 5.547 8.061 ( -5.326 1.391 0.679) 5.547 8.539 ( -6.208 -5.982 -2.252) 8.910 8.539 ( -6.208 -5.982 2.252) 8.910 9.438 ( 8.334 1.072 -2.577) 8.789 9.438 ( 8.334 1.072 2.577) 8.789 9.517 ( 14.566 5.363 -7.058) 17.051 9.517 ( 14.566 5.363 7.058) 17.051 10.743 ( -8.905 2.541 -5.171) 10.607 10.743 ( -8.905 2.541 5.171) 10.607 11.157 ( -3.563 -9.031 -3.496) 10.318 11.157 ( -3.563 -9.031 3.496) 10.318 11.928 ( 11.619 8.718 -3.225) 14.879 11.928 ( 11.619 8.718 3.225) 14.879 12.186 ( -2.307 10.409 -10.177) 14.739 12.186 ( -2.307 10.409 10.177) 14.739 12.735 ( 3.836 -10.205 -11.982) 16.200 12.735 ( 3.836 -10.205 11.982) 16.200 13.062 ( 7.686 -0.978 -3.134) 8.358 13.062 ( 7.686 -0.978 3.134) 8.358 13.821 ( -9.247 11.678 -16.287) 22.072 13.821 ( -9.247 11.678 16.287) 22.072 14.895 ( 7.095 -0.129 -21.247) 22.401 14.895 ( 7.095 -0.129 21.247) 22.401 15.549 ( 11.442 3.228 -19.054) 22.459 15.549 ( 11.442 3.228 19.054) 22.459 16.053 ( 4.878 -20.353 -3.243) 21.179 16.053 ( 4.878 -20.353 3.243) 21.179 16.507 ( 0.572 -7.122 -5.827) 9.220 16.507 ( 0.572 -7.122 5.827) 9.220 17.394 ( -5.949 -2.201 -1.093) 6.436 17.394 ( -5.949 -2.201 1.093) 6.436 19.035 ( -4.456 7.074 -1.520) 8.498 19.035 ( -4.456 7.074 1.520) 8.498 19.400 ( -5.198 2.787 -4.168) 7.222 19.400 ( -5.198 2.787 4.168) 7.222 ======================= Grid point 357 (114/120) ======================= q-point: ( 0.33 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( 2.410 4.221 -3.878) 6.218 2.233 ( 2.410 4.221 3.878) 6.218 2.569 ( -2.224 1.251 -4.217) 4.929 2.569 ( -2.224 1.251 4.217) 4.929 2.892 ( -2.945 -4.457 -7.680) 9.356 2.892 ( -2.945 -4.457 7.680) 9.356 3.008 ( -0.386 -6.912 -8.808) 11.203 3.008 ( -0.386 -6.912 8.808) 11.203 3.385 ( 2.660 0.858 -2.283) 3.609 3.385 ( 2.660 0.858 2.283) 3.609 3.892 ( 3.530 -13.348 -1.927) 13.941 3.892 ( 3.530 -13.348 1.927) 13.941 5.290 ( -6.853 10.627 -8.006) 14.966 5.290 ( -6.853 10.627 8.006) 14.966 5.608 ( -17.408 -2.941 -16.642) 24.262 5.608 ( -17.408 -2.941 16.642) 24.262 6.106 ( 0.538 20.250 -11.070) 23.085 6.106 ( 0.538 20.250 11.070) 23.085 6.994 ( 7.000 -0.364 -3.019) 7.632 6.994 ( 7.000 -0.364 3.019) 7.632 7.316 ( 3.286 -3.495 -3.871) 6.164 7.316 ( 3.286 -3.495 3.871) 6.164 7.613 ( 5.878 0.012 -5.980) 8.386 7.613 ( 5.878 0.012 5.980) 8.386 8.017 ( 0.945 -0.682 -3.342) 3.539 8.017 ( 0.945 -0.682 3.342) 3.539 8.401 ( -7.298 -6.031 -2.011) 9.679 8.401 ( -7.298 -6.031 2.011) 9.679 9.604 ( 8.760 0.993 -1.705) 8.979 9.604 ( 8.760 0.993 1.705) 8.979 9.791 ( 11.363 12.679 -3.702) 17.424 9.791 ( 11.363 12.679 3.702) 17.424 10.478 ( -14.835 -1.170 -1.632) 14.970 10.478 ( -14.835 -1.170 1.632) 14.970 11.173 ( 2.502 -13.266 -5.794) 14.690 11.173 ( 2.502 -13.266 5.794) 14.690 12.102 ( 0.023 7.253 -1.265) 7.362 12.102 ( 0.023 7.253 1.265) 7.362 12.230 ( 12.268 11.030 -9.759) 19.168 12.230 ( 12.268 11.030 9.759) 19.168 12.725 ( -2.941 -11.061 -11.827) 16.458 12.725 ( -2.941 -11.061 11.827) 16.458 13.208 ( 2.306 1.185 -5.459) 6.043 13.208 ( 2.306 1.185 5.459) 6.043 13.685 ( -1.980 13.785 -8.990) 16.576 13.685 ( -1.980 13.785 8.990) 16.576 15.006 ( 3.891 -7.862 -14.001) 16.522 15.006 ( 3.891 -7.862 14.001) 16.522 15.805 ( 13.186 2.596 -16.811) 21.523 15.805 ( 13.186 2.596 16.811) 21.523 16.149 ( 4.022 -14.811 -3.483) 15.738 16.149 ( 4.022 -14.811 3.483) 15.738 16.521 ( 0.792 -4.935 -7.594) 9.091 16.521 ( 0.792 -4.935 7.594) 9.091 17.257 ( -7.128 -6.899 -1.346) 10.011 17.257 ( -7.128 -6.899 1.346) 10.011 18.957 ( -2.957 9.545 -1.842) 10.160 18.957 ( -2.957 9.545 1.842) 10.160 19.286 ( -5.745 2.872 -3.407) 7.270 19.286 ( -5.745 2.872 3.407) 7.270 ======================= Grid point 359 (115/120) ======================= q-point: ( 0.44 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 2.001 5.269 -2.124) 6.023 2.283 ( 2.001 5.269 2.124) 6.023 2.504 ( -2.898 4.762 -2.652) 6.173 2.504 ( -2.898 4.762 2.652) 6.173 2.874 ( 0.421 -6.552 -4.269) 7.832 2.874 ( 0.421 -6.552 4.269) 7.832 2.984 ( -1.620 -7.768 -4.379) 9.063 2.984 ( -1.620 -7.768 4.379) 9.063 3.435 ( 1.986 2.927 -0.353) 3.555 3.435 ( 1.986 2.927 0.353) 3.555 3.966 ( 2.573 -17.607 -1.888) 17.894 3.966 ( 2.573 -17.607 1.888) 17.894 5.207 ( -0.162 3.890 -2.466) 4.608 5.207 ( -0.162 3.890 2.466) 4.608 5.314 ( -10.725 -1.278 -9.378) 14.304 5.314 ( -10.725 -1.278 9.378) 14.304 6.122 ( 0.601 26.392 -3.859) 26.680 6.122 ( 0.601 26.392 3.859) 26.680 7.101 ( 2.942 -0.716 -1.039) 3.201 7.101 ( 2.942 -0.716 1.039) 3.201 7.357 ( 1.045 -2.209 -0.898) 2.604 7.357 ( 1.045 -2.209 0.898) 2.604 7.683 ( 1.415 0.863 -4.030) 4.358 7.683 ( 1.415 0.863 4.030) 4.358 8.080 ( 4.204 2.190 -2.675) 5.443 8.080 ( 4.204 2.190 2.675) 5.443 8.261 ( -5.885 -9.329 -0.978) 11.074 8.261 ( -5.885 -9.329 0.978) 11.074 9.774 ( 6.780 4.117 -0.622) 7.957 9.774 ( 6.780 4.117 0.622) 7.957 9.955 ( 4.806 16.000 -0.332) 16.710 9.955 ( 4.806 16.000 0.332) 16.710 10.213 ( -9.883 -5.593 -0.928) 11.394 10.213 ( -9.883 -5.593 0.928) 11.394 11.209 ( 0.889 -16.339 -2.865) 16.612 11.209 ( 0.889 -16.339 2.865) 16.612 12.086 ( -0.423 8.596 -0.849) 8.648 12.086 ( -0.423 8.596 0.849) 8.648 12.491 ( 10.599 9.681 -5.896) 15.519 12.491 ( 10.599 9.681 5.896) 15.519 12.659 ( -3.204 -9.479 -6.914) 12.163 12.659 ( -3.204 -9.479 6.914) 12.163 13.128 ( -6.060 -0.526 -5.883) 8.463 13.128 ( -6.060 -0.526 5.883) 8.463 13.732 ( 3.171 17.378 -2.009) 17.779 13.732 ( 3.171 17.378 2.009) 17.779 15.054 ( 1.089 -14.188 -4.920) 15.056 15.054 ( 1.089 -14.188 4.920) 15.056 16.036 ( 8.521 -1.350 -10.893) 13.896 16.036 ( 8.521 -1.350 10.893) 13.896 16.186 ( -0.754 -7.371 -5.456) 9.202 16.186 ( -0.754 -7.371 5.456) 9.202 16.534 ( 0.408 -2.325 -4.280) 4.888 16.534 ( 0.408 -2.325 4.280) 4.888 17.139 ( -3.664 -12.076 -0.584) 12.633 17.139 ( -3.664 -12.076 0.584) 12.633 18.923 ( -0.628 11.948 -0.962) 12.003 18.923 ( -0.628 11.948 0.962) 12.003 19.192 ( -2.879 2.327 -1.501) 3.995 19.192 ( -2.879 2.327 1.501) 3.995 ======================= Grid point 369 (116/120) ======================= q-point: ( 0.00 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 0.000 8.521 -5.115) 9.938 2.201 ( 0.000 8.521 5.115) 9.938 2.523 ( 0.000 -13.803 -7.920) 15.914 2.523 ( 0.000 -13.803 7.920) 15.914 3.024 ( 0.000 5.797 -2.945) 6.502 3.024 ( 0.000 5.797 2.945) 6.502 3.098 ( 0.000 4.189 -4.106) 5.866 3.098 ( 0.000 4.189 4.106) 5.866 3.217 ( 0.000 0.223 -6.854) 6.858 3.217 ( 0.000 0.223 6.854) 6.858 3.683 ( 0.000 -10.393 -7.339) 12.723 3.683 ( 0.000 -10.393 7.339) 12.723 5.903 ( 0.000 15.122 -2.841) 15.386 5.903 ( 0.000 15.122 2.841) 15.386 6.389 ( 0.000 4.892 -10.049) 11.177 6.389 ( 0.000 4.892 10.049) 11.177 6.536 ( 0.000 -0.855 -1.780) 1.974 6.536 ( 0.000 -0.855 1.780) 1.974 6.700 ( 0.000 -4.327 -2.276) 4.889 6.700 ( 0.000 -4.327 2.276) 4.889 6.833 ( 0.000 -0.524 -9.698) 9.712 6.833 ( 0.000 -0.524 9.698) 9.712 6.938 ( 0.000 -7.930 -20.868) 22.324 6.938 ( 0.000 -7.930 20.868) 22.324 8.473 ( 0.000 -1.709 -2.467) 3.002 8.473 ( 0.000 -1.709 2.467) 3.002 8.614 ( 0.000 7.862 -2.054) 8.126 8.614 ( 0.000 7.862 2.054) 8.126 8.860 ( 0.000 -7.747 -2.102) 8.027 8.860 ( 0.000 -7.747 2.102) 8.027 9.270 ( 0.000 -0.963 -0.303) 1.009 9.270 ( 0.000 -0.963 0.303) 1.009 10.834 ( 0.000 2.170 -2.265) 3.137 10.834 ( 0.000 2.170 2.265) 3.137 11.501 ( 0.000 -1.296 -0.493) 1.387 11.501 ( 0.000 -1.296 0.493) 1.387 11.844 ( 0.000 5.789 -1.245) 5.922 11.844 ( 0.000 5.789 1.245) 5.922 12.264 ( 0.000 4.244 -3.046) 5.224 12.264 ( 0.000 4.244 3.046) 5.224 12.425 ( 0.000 -2.509 -1.254) 2.805 12.425 ( 0.000 -2.509 1.254) 2.805 12.886 ( 0.000 -2.947 -0.059) 2.948 12.886 ( 0.000 -2.947 0.059) 2.948 14.246 ( 0.000 3.223 -11.278) 11.730 14.246 ( 0.000 3.223 11.278) 11.730 14.820 ( 0.000 10.134 -12.416) 16.026 14.820 ( 0.000 10.134 12.416) 16.026 15.337 ( 0.000 -1.868 -17.956) 18.053 15.337 ( 0.000 -1.868 17.956) 18.053 15.538 ( 0.000 -12.730 -10.665) 16.607 15.538 ( 0.000 -12.730 10.665) 16.607 16.355 ( 0.000 -4.801 -0.707) 4.853 16.355 ( 0.000 -4.801 0.707) 4.853 17.532 ( 0.000 0.287 -0.056) 0.293 17.532 ( 0.000 0.287 0.056) 0.293 19.215 ( 0.000 1.683 -0.321) 1.713 19.215 ( 0.000 1.683 0.321) 1.713 19.551 ( 0.000 1.241 -1.700) 2.105 19.551 ( 0.000 1.241 1.700) 2.105 ======================= Grid point 371 (117/120) ======================= q-point: ( 0.11 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( 2.635 8.070 -4.549) 9.632 2.229 ( 2.635 8.070 4.549) 9.632 2.526 ( 0.308 -11.172 -6.995) 13.185 2.526 ( 0.308 -11.172 6.995) 13.185 2.946 ( -4.681 5.023 -11.166) 13.108 2.946 ( -4.681 5.023 11.166) 13.108 3.053 ( -5.043 -4.487 -6.951) 9.689 3.053 ( -5.043 -4.487 6.951) 9.689 3.291 ( 5.207 5.384 -4.196) 8.585 3.291 ( 5.207 5.384 4.196) 8.585 3.687 ( 0.352 -8.612 -6.484) 10.786 3.687 ( 0.352 -8.612 6.484) 10.786 5.871 ( -4.667 12.972 -3.280) 14.171 5.871 ( -4.667 12.972 3.280) 14.171 6.279 ( -11.532 3.321 -9.646) 15.397 6.279 ( -11.532 3.321 9.646) 15.397 6.391 ( -8.179 2.869 -12.853) 15.502 6.391 ( -8.179 2.869 12.853) 15.502 6.665 ( 2.815 -6.488 -2.565) 7.524 6.665 ( 2.815 -6.488 2.565) 7.524 6.997 ( 9.624 -0.768 -11.576) 15.074 6.997 ( 9.624 -0.768 11.576) 15.074 7.109 ( 13.024 -4.986 -13.397) 19.338 7.109 ( 13.024 -4.986 13.397) 19.338 8.235 ( -13.635 -1.526 -1.063) 13.761 8.235 ( -13.635 -1.526 1.064) 13.761 8.609 ( -3.497 1.643 -2.536) 4.622 8.609 ( -3.497 1.643 2.536) 4.622 9.150 ( 21.814 -1.105 -2.361) 21.969 9.150 ( 21.814 -1.105 2.361) 21.969 9.319 ( 4.664 -0.887 -0.542) 4.779 9.319 ( 4.664 -0.887 0.542) 4.779 10.853 ( 1.483 2.186 -2.679) 3.762 10.853 ( 1.483 2.186 2.679) 3.762 11.299 ( -16.444 -2.035 -0.788) 16.588 11.299 ( -16.444 -2.035 0.788) 16.588 11.913 ( 5.932 6.026 -0.704) 8.485 11.913 ( 5.932 6.026 0.704) 8.485 12.345 ( 4.717 5.731 -6.298) 9.735 12.345 ( 4.717 5.731 6.298) 9.735 12.469 ( 4.019 -5.226 -6.068) 8.960 12.469 ( 4.019 -5.226 6.068) 8.960 12.907 ( 3.271 -2.138 -2.270) 4.519 12.907 ( 3.271 -2.138 2.270) 4.519 14.162 ( -7.410 4.112 -10.693) 13.645 14.162 ( -7.410 4.112 10.693) 13.645 14.848 ( 1.904 5.572 -12.379) 13.708 14.848 ( 1.904 5.572 12.379) 13.708 15.422 ( 8.006 1.523 -18.997) 20.671 15.422 ( 8.006 1.523 18.997) 20.671 15.592 ( 5.404 -12.714 -12.818) 18.845 15.592 ( 5.404 -12.714 12.818) 18.845 16.363 ( 0.804 -4.612 -1.355) 4.874 16.363 ( 0.804 -4.612 1.355) 4.874 17.488 ( -4.411 -0.094 -0.205) 4.417 17.488 ( -4.411 -0.094 0.205) 4.417 19.189 ( -2.421 1.944 -0.511) 3.147 19.189 ( -2.421 1.944 0.511) 3.147 19.522 ( -2.805 1.268 -1.687) 3.511 19.522 ( -2.805 1.268 1.687) 3.511 ======================= Grid point 373 (118/120) ======================= q-point: ( 0.22 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.292 ( 3.190 7.227 -3.357) 8.583 2.292 ( 3.190 7.227 3.357) 8.583 2.537 ( 0.912 -5.711 -4.446) 7.295 2.537 ( 0.912 -5.711 4.446) 7.295 2.876 ( -3.388 -2.908 -11.297) 12.147 2.876 ( -3.388 -2.908 11.297) 12.147 2.935 ( -4.581 -3.145 -9.134) 10.691 2.935 ( -4.581 -3.145 9.134) 10.691 3.373 ( 2.549 3.334 -3.684) 5.585 3.373 ( 2.549 3.334 3.684) 5.585 3.698 ( 0.801 -5.319 -3.531) 6.435 3.698 ( 0.801 -5.319 3.531) 6.435 5.684 ( -12.688 7.285 -6.694) 16.089 5.684 ( -12.688 7.285 6.694) 16.089 5.939 ( -19.736 -1.688 -10.212) 22.285 5.939 ( -19.736 -1.688 10.212) 22.285 6.379 ( 5.217 12.952 -7.104) 15.666 6.379 ( 5.217 12.952 7.104) 15.666 6.791 ( 8.207 -5.138 -1.151) 9.751 6.791 ( 8.207 -5.138 1.151) 9.751 7.157 ( 6.252 -2.133 -5.887) 8.848 7.157 ( 6.252 -2.133 5.887) 8.848 7.374 ( 12.173 -2.934 -6.033) 13.899 7.374 ( 12.173 -2.934 6.033) 13.899 8.016 ( -7.805 -3.177 -1.013) 8.487 8.016 ( -7.805 -3.177 1.013) 8.487 8.509 ( -6.055 0.716 -1.726) 6.337 8.509 ( -6.055 0.716 1.726) 6.337 9.439 ( 7.424 -0.175 -1.101) 7.507 9.439 ( 7.424 -0.175 1.101) 7.507 9.608 ( 22.105 2.814 -2.378) 22.410 9.608 ( 22.105 2.814 2.378) 22.410 10.829 ( -9.399 6.456 -3.353) 11.886 10.829 ( -9.399 6.456 3.353) 11.886 10.982 ( -8.947 -8.998 -0.722) 12.710 10.982 ( -8.947 -8.998 0.722) 12.710 12.071 ( 9.587 5.357 -0.233) 10.984 12.071 ( 9.587 5.357 0.233) 10.984 12.373 ( -1.342 7.550 -3.875) 8.591 12.373 ( -1.342 7.550 3.875) 8.591 12.542 ( 2.112 -8.494 -6.548) 10.932 12.542 ( 2.112 -8.494 6.548) 10.932 13.060 ( 11.157 0.160 -1.519) 11.261 13.060 ( 11.157 0.160 1.519) 11.261 13.994 ( -7.998 5.437 -9.204) 13.351 13.994 ( -7.998 5.437 9.204) 13.351 14.864 ( -0.858 -2.027 -9.785) 10.030 14.864 ( -0.858 -2.027 9.785) 10.030 15.627 ( 11.564 4.623 -18.559) 22.350 15.627 ( 11.564 4.623 18.559) 22.350 15.751 ( 9.958 -10.387 -13.548) 19.763 15.751 ( 9.958 -10.387 13.548) 19.763 16.391 ( 2.091 -3.932 -2.498) 5.106 16.391 ( 2.091 -3.932 2.498) 5.106 17.356 ( -8.636 -1.247 -0.491) 8.739 17.356 ( -8.636 -1.247 0.491) 8.739 19.131 ( -2.952 2.643 -0.823) 4.047 19.131 ( -2.952 2.643 0.823) 4.047 19.442 ( -5.077 1.324 -1.626) 5.493 19.442 ( -5.077 1.324 1.626) 5.493 ======================= Grid point 375 (119/120) ======================= q-point: ( 0.33 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.352 ( 3.056 6.856 -2.765) 7.999 2.352 ( 3.056 6.856 2.765) 7.999 2.565 ( 1.554 -1.890 -1.872) 3.081 2.565 ( 1.554 -1.890 1.872) 3.081 2.772 ( -4.884 -6.198 -3.277) 8.545 2.772 ( -4.884 -6.198 3.277) 8.545 2.907 ( -0.859 -2.524 -1.987) 3.325 2.907 ( -0.859 -2.524 1.987) 3.325 3.414 ( 2.802 1.444 -1.718) 3.590 3.414 ( 2.802 1.444 1.718) 3.590 3.717 ( 0.725 -4.812 -0.465) 4.889 3.717 ( 0.725 -4.813 0.465) 4.889 5.427 ( -11.718 4.207 -8.606) 15.135 5.427 ( -11.718 4.207 8.606) 15.135 5.552 ( -17.480 -2.547 -11.263) 20.950 5.552 ( -17.480 -2.547 11.263) 20.950 6.523 ( 7.763 19.566 -5.731) 21.816 6.523 ( 7.763 19.566 5.731) 21.816 6.951 ( 6.784 -5.366 -0.906) 8.697 6.951 ( 6.784 -5.366 0.906) 8.697 7.257 ( 4.277 -2.234 -3.450) 5.932 7.257 ( 4.277 -2.234 3.450) 5.932 7.549 ( 3.969 -4.904 -4.297) 7.633 7.549 ( 3.969 -4.904 4.297) 7.633 7.944 ( 1.427 -3.033 -1.866) 3.837 7.944 ( 1.427 -3.033 1.866) 3.837 8.374 ( -7.257 0.723 -1.579) 7.462 8.374 ( -7.257 0.723 1.579) 7.462 9.610 ( 9.619 0.023 -0.857) 9.657 9.610 ( 9.619 0.023 0.857) 9.657 10.005 ( 16.194 6.905 -1.689) 17.686 10.005 ( 16.194 6.905 1.689) 17.686 10.512 ( -16.256 4.456 -1.732) 16.944 10.512 ( -16.256 4.456 1.732) 16.944 10.920 ( -2.387 -11.155 -2.579) 11.695 10.920 ( -2.387 -11.155 2.579) 11.695 12.238 ( 3.363 7.532 -3.583) 8.993 12.238 ( 3.363 7.532 3.583) 8.993 12.374 ( 4.406 -0.526 -6.511) 7.879 12.374 ( 4.406 -0.526 6.511) 7.879 12.566 ( 2.157 -2.891 -6.976) 7.854 12.566 ( 2.157 -2.891 6.976) 7.854 13.225 ( 1.060 0.430 -2.373) 2.635 13.225 ( 1.060 0.430 2.373) 2.635 13.927 ( 3.934 9.437 -6.516) 12.124 13.927 ( 3.934 9.437 6.516) 12.124 14.805 ( -5.028 -9.733 -6.731) 12.857 14.805 ( -5.028 -9.733 6.731) 12.857 15.858 ( 10.616 2.592 -10.404) 15.088 15.858 ( 10.616 2.592 10.404) 15.088 15.954 ( 9.104 -5.567 -6.212) 12.347 15.954 ( 9.104 -5.567 6.212) 12.347 16.457 ( 4.810 -1.811 -3.598) 6.274 16.457 ( 4.810 -1.811 3.598) 6.274 17.149 ( -11.603 -3.450 -0.623) 12.121 17.149 ( -11.603 -3.450 0.623) 12.121 19.088 ( -1.013 3.665 -0.989) 3.929 19.088 ( -1.013 3.665 0.989) 3.929 19.327 ( -6.126 1.203 -1.454) 6.410 19.327 ( -6.126 1.203 1.454) 6.410 ======================= Grid point 377 (120/120) ======================= q-point: ( 0.44 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.97e-04 1.97e-04 1.97e-04 1.97e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 189 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( 2.754 7.914 -1.789) 8.569 2.416 ( 2.754 7.914 1.789) 8.569 2.568 ( -1.465 -0.033 -0.689) 1.620 2.568 ( -1.465 -0.033 0.689) 1.620 2.738 ( 1.875 -5.212 -3.761) 6.696 2.738 ( 1.875 -5.212 3.761) 6.696 2.851 ( -4.153 -5.127 -2.751) 7.149 2.851 ( -4.153 -5.127 2.751) 7.149 3.505 ( 4.864 4.010 -0.182) 6.307 3.505 ( 4.864 4.010 0.182) 6.307 3.707 ( -1.732 -9.008 -0.750) 9.203 3.707 ( -1.732 -9.008 0.750) 9.203 5.255 ( -4.319 1.641 -4.324) 6.328 5.255 ( -4.319 1.641 4.324) 6.328 5.288 ( -7.784 -1.315 -6.347) 10.129 5.288 ( -7.784 -1.315 6.347) 10.129 6.648 ( 3.740 26.124 -2.650) 26.523 6.648 ( 3.740 26.124 2.650) 26.523 7.035 ( 1.617 -8.693 -1.408) 8.954 7.035 ( 1.617 -8.693 1.408) 8.954 7.345 ( 3.916 0.917 -1.021) 4.150 7.345 ( 3.916 0.917 1.021) 4.150 7.544 ( -2.425 -11.538 -2.505) 12.053 7.544 ( -2.425 -11.538 2.505) 12.053 8.053 ( 7.692 -0.377 -0.893) 7.752 8.053 ( 7.692 -0.377 0.893) 7.752 8.220 ( -7.964 0.439 -1.112) 8.054 8.220 ( -7.964 0.439 1.112) 8.054 9.822 ( 11.109 1.449 -0.737) 11.228 9.822 ( 11.109 1.449 0.737) 11.228 10.096 ( -9.641 -2.397 -1.652) 10.071 10.096 ( -9.641 -2.397 1.652) 10.071 10.365 ( 3.769 20.457 -1.880) 20.886 10.365 ( 3.769 20.457 1.880) 20.886 10.856 ( -2.976 -19.506 -1.749) 19.809 10.856 ( -2.976 -19.506 1.749) 19.809 12.244 ( -0.318 8.693 -1.498) 8.827 12.244 ( -0.318 8.693 1.498) 8.827 12.429 ( -0.055 -10.232 -2.281) 10.483 12.429 ( -0.055 -10.232 2.281) 10.483 12.730 ( 12.027 8.390 -4.231) 15.262 12.730 ( 12.027 8.390 4.231) 15.262 13.088 ( -10.986 -2.831 -3.750) 11.948 13.088 ( -10.986 -2.831 3.750) 11.948 14.106 ( 8.929 20.237 -2.873) 22.305 14.106 ( 8.929 20.237 2.873) 22.305 14.682 ( -5.595 -21.526 -3.268) 22.480 14.682 ( -5.595 -21.526 3.268) 22.480 16.019 ( 4.691 0.578 -2.464) 5.330 16.019 ( 4.691 0.578 2.464) 5.330 16.079 ( 2.948 -3.867 -2.204) 5.339 16.079 ( 2.948 -3.867 2.204) 5.339 16.587 ( 7.104 5.144 -2.235) 9.051 16.587 ( 7.104 5.144 2.235) 9.051 16.919 ( -9.762 -9.202 -0.388) 13.421 16.919 ( -9.762 -9.202 0.388) 13.422 19.096 ( 1.580 5.618 -0.808) 5.892 19.096 ( 1.580 5.618 0.808) 5.892 19.213 ( -4.432 -0.136 -0.974) 4.540 19.213 ( -4.432 -0.136 0.974) 4.540 =================== 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 3/37800 10.0 4521.176 5796.744 5310.216 0.000 0.000 0.000 3/37800 20.0 695.093 716.092 616.150 0.000 0.000 -0.000 3/37800 30.0 273.910 282.310 243.100 0.000 0.000 -0.000 3/37800 40.0 145.766 153.735 132.221 0.000 0.000 -0.000 3/37800 50.0 89.970 97.213 83.452 0.000 0.000 -0.000 3/37800 60.0 61.431 67.665 58.056 0.000 0.000 -0.000 3/37800 70.0 45.115 50.360 43.264 0.000 0.000 -0.000 3/37800 80.0 34.963 39.357 33.898 0.000 0.000 -0.000 3/37800 90.0 28.211 31.914 27.573 0.000 0.000 -0.000 3/37800 100.0 23.478 26.630 23.082 0.000 0.000 -0.000 3/37800 110.0 20.017 22.734 19.764 0.000 0.000 -0.000 3/37800 120.0 17.399 19.768 17.233 0.000 0.000 -0.000 3/37800 130.0 15.361 17.453 15.252 0.000 0.000 -0.000 3/37800 140.0 13.738 15.605 13.666 0.000 0.000 -0.000 3/37800 150.0 12.420 14.103 12.373 0.000 0.000 -0.000 3/37800 160.0 11.331 12.861 11.302 0.000 0.000 -0.000 3/37800 170.0 10.417 11.819 10.401 0.000 0.000 -0.000 3/37800 180.0 9.641 10.935 9.635 0.000 0.000 -0.000 3/37800 190.0 8.975 10.176 8.976 0.000 0.000 -0.000 3/37800 200.0 8.396 9.517 8.404 0.000 0.000 -0.000 3/37800 210.0 7.890 8.941 7.902 0.000 0.000 -0.000 3/37800 220.0 7.442 8.432 7.459 0.000 0.000 -0.000 3/37800 230.0 7.045 7.980 7.064 0.000 0.000 -0.000 3/37800 240.0 6.689 7.576 6.711 0.000 0.000 -0.000 3/37800 250.0 6.368 7.212 6.393 0.000 0.000 -0.000 3/37800 260.0 6.078 6.883 6.105 0.000 0.000 -0.000 3/37800 270.0 5.814 6.583 5.842 0.000 0.000 -0.000 3/37800 280.0 5.573 6.310 5.602 0.000 0.000 -0.000 3/37800 290.0 5.352 6.059 5.382 0.000 0.000 -0.000 3/37800 300.0 5.148 5.829 5.179 0.000 0.000 -0.000 3/37800 310.0 4.960 5.615 4.992 0.000 0.000 -0.000 3/37800 320.0 4.786 5.418 4.818 0.000 0.000 -0.000 3/37800 330.0 4.624 5.234 4.656 0.000 0.000 -0.000 3/37800 340.0 4.473 5.063 4.506 0.000 0.000 -0.000 3/37800 350.0 4.332 4.903 4.365 0.000 0.000 -0.000 3/37800 360.0 4.199 4.754 4.232 0.000 0.000 -0.000 3/37800 370.0 4.075 4.613 4.108 0.000 0.000 -0.000 3/37800 380.0 3.958 4.481 3.992 0.000 0.000 -0.000 3/37800 390.0 3.848 4.356 3.881 0.000 0.000 -0.000 3/37800 400.0 3.744 4.238 3.777 0.000 0.000 -0.000 3/37800 410.0 3.646 4.127 3.679 0.000 0.000 -0.000 3/37800 420.0 3.553 4.022 3.586 0.000 0.000 -0.000 3/37800 430.0 3.464 3.922 3.497 0.000 0.000 -0.000 3/37800 440.0 3.380 3.827 3.413 0.000 0.000 -0.000 3/37800 450.0 3.300 3.736 3.333 0.000 0.000 -0.000 3/37800 460.0 3.224 3.650 3.256 0.000 0.000 -0.000 3/37800 470.0 3.152 3.568 3.183 0.000 0.000 -0.000 3/37800 480.0 3.082 3.489 3.114 0.000 0.000 -0.000 3/37800 490.0 3.016 3.414 3.047 0.000 0.000 -0.000 3/37800 500.0 2.953 3.343 2.984 0.000 0.000 -0.000 3/37800 510.0 2.892 3.274 2.923 0.000 0.000 -0.000 3/37800 520.0 2.834 3.208 2.864 0.000 0.000 -0.000 3/37800 530.0 2.778 3.145 2.808 0.000 0.000 -0.000 3/37800 540.0 2.724 3.084 2.754 0.000 0.000 -0.000 3/37800 550.0 2.672 3.025 2.702 0.000 0.000 -0.000 3/37800 560.0 2.623 2.969 2.652 0.000 0.000 -0.000 3/37800 570.0 2.575 2.915 2.604 0.000 0.000 -0.000 3/37800 580.0 2.529 2.863 2.557 0.000 0.000 -0.000 3/37800 590.0 2.484 2.813 2.513 0.000 0.000 -0.000 3/37800 600.0 2.442 2.764 2.469 0.000 0.000 -0.000 3/37800 610.0 2.400 2.717 2.428 0.000 0.000 -0.000 3/37800 620.0 2.360 2.672 2.387 0.000 0.000 -0.000 3/37800 630.0 2.321 2.628 2.349 0.000 0.000 -0.000 3/37800 640.0 2.284 2.586 2.311 0.000 0.000 -0.000 3/37800 650.0 2.248 2.545 2.274 0.000 0.000 -0.000 3/37800 660.0 2.213 2.505 2.239 0.000 0.000 -0.000 3/37800 670.0 2.179 2.467 2.205 0.000 0.000 -0.000 3/37800 680.0 2.146 2.429 2.172 0.000 0.000 -0.000 3/37800 690.0 2.114 2.393 2.139 0.000 0.000 -0.000 3/37800 700.0 2.083 2.358 2.108 0.000 0.000 -0.000 3/37800 710.0 2.053 2.324 2.078 0.000 0.000 -0.000 3/37800 720.0 2.024 2.291 2.048 0.000 0.000 -0.000 3/37800 730.0 1.995 2.259 2.020 0.000 0.000 -0.000 3/37800 740.0 1.968 2.228 1.992 0.000 0.000 -0.000 3/37800 750.0 1.941 2.197 1.965 0.000 0.000 -0.000 3/37800 760.0 1.915 2.168 1.938 0.000 0.000 -0.000 3/37800 770.0 1.889 2.139 1.913 0.000 0.000 -0.000 3/37800 780.0 1.865 2.111 1.888 0.000 0.000 -0.000 3/37800 790.0 1.841 2.084 1.864 0.000 0.000 -0.000 3/37800 800.0 1.817 2.057 1.840 0.000 0.000 -0.000 3/37800 810.0 1.794 2.031 1.817 0.000 0.000 -0.000 3/37800 820.0 1.772 2.006 1.794 0.000 0.000 -0.000 3/37800 830.0 1.750 1.982 1.772 0.000 0.000 -0.000 3/37800 840.0 1.729 1.958 1.751 0.000 0.000 -0.000 3/37800 850.0 1.708 1.934 1.730 0.000 0.000 -0.000 3/37800 860.0 1.688 1.911 1.710 0.000 0.000 -0.000 3/37800 870.0 1.668 1.889 1.690 0.000 0.000 -0.000 3/37800 880.0 1.649 1.867 1.670 0.000 0.000 -0.000 3/37800 890.0 1.630 1.846 1.651 0.000 0.000 -0.000 3/37800 900.0 1.612 1.825 1.633 0.000 0.000 -0.000 3/37800 910.0 1.594 1.805 1.614 0.000 0.000 -0.000 3/37800 920.0 1.576 1.785 1.597 0.000 0.000 -0.000 3/37800 930.0 1.559 1.765 1.579 0.000 0.000 -0.000 3/37800 940.0 1.542 1.746 1.562 0.000 0.000 -0.000 3/37800 950.0 1.526 1.728 1.546 0.000 0.000 -0.000 3/37800 960.0 1.510 1.709 1.529 0.000 0.000 -0.000 3/37800 970.0 1.494 1.692 1.513 0.000 0.000 -0.000 3/37800 980.0 1.479 1.674 1.498 0.000 0.000 -0.000 3/37800 990.0 1.463 1.657 1.483 0.000 0.000 -0.000 3/37800 1000.0 1.449 1.640 1.468 0.000 0.000 -0.000 3/37800 Thermal conductivity related properties were written into "kappa-m9710.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 23:45:20]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|