# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/6608c5b1-be02-4733-a662-ed532dcf1f74/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [First-principles lattice thermal conductivity calculation for Li6ZnO4 / P4_2/nmc (137) / materials id 14495](https://mdr.nims.go.jp/datasets/815203b0-1c39-4d63-b485-2e506e9984a3) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-08 00:40:33]-------------------------Compiled with OpenMP support (max 128 threads).Running in phonopy.load mode.Python version 3.14.2Spglib version 2.6.1Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".Unit of length: angstromSettings: Supercell: [1 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P4_2/nmc (137)Number of symmetry operations in supercell: 32------------------------------ primitive cell ------------------------------Lattice vectors: a 6.488532670000000 0.000000000000000 0.000000000000000 b 0.000000000000000 6.488532670000000 0.000000000000000 c 0.000000000000000 0.000000000000000 4.629423240000000Atomic positions (fractional): *1 Li 0.50000000000000 0.00000000000000 0.45497655035459 6.941 2 Li 0.00000000000000 0.50000000000000 0.04502344964541 6.941 *3 Li 0.71763501458373 0.28236498541627 0.50000000000000 6.941 4 Li 0.21763501458373 0.21763501458373 0.00000000000000 6.941 5 Li 0.78236498541627 0.78236498541627 0.00000000000000 6.941 6 Li 0.28236498541627 0.71763501458373 0.50000000000000 6.941 7 Li 0.78236498541627 0.21763501458373 0.00000000000000 6.941 8 Li 0.28236498541627 0.28236498541627 0.50000000000000 6.941 9 Li 0.71763501458373 0.71763501458373 0.50000000000000 6.941 10 Li 0.00000000000000 0.50000000000000 0.54502344964541 6.941 11 Li 0.50000000000000 0.00000000000000 0.95497655035459 6.941 12 Li 0.21763501458373 0.78236498541627 0.00000000000000 6.941 *13 O 0.00000000000000 0.73622067026158 0.28368697532785 15.999 14 O 0.23622067026158 0.50000000000000 0.78368697532785 15.999 15 O 0.50000000000000 0.23622067026158 0.21631302467215 15.999 16 O 0.26377932973842 0.00000000000000 0.71631302467215 15.999 17 O 0.73622067026158 0.00000000000000 0.71631302467215 15.999 18 O 0.76377932973842 0.50000000000000 0.78368697532785 15.999 19 O 0.00000000000000 0.26377932973842 0.28368697532785 15.999 20 O 0.50000000000000 0.76377932973842 0.21631302467215 15.999 *21 Zn 0.50000000000000 0.50000000000000 0.00000000000000 65.380 22 Zn 0.00000000000000 0.00000000000000 0.50000000000000 65.380-------------------------------- unit cell ---------------------------------Lattice vectors: a 6.488532670000000 0.000000000000000 0.000000000000000 b 0.000000000000000 6.488532670000000 0.000000000000000 c 0.000000000000000 0.000000000000000 4.629423240000000Atomic positions (fractional): *1 Li 0.50000000000000 0.00000000000000 0.45497655035459 6.941 > 1 2 Li 0.00000000000000 0.50000000000000 0.04502344964541 6.941 > 2 *3 Li 0.71763501458373 0.28236498541627 0.50000000000000 6.941 > 3 4 Li 0.21763501458373 0.21763501458373 0.00000000000000 6.941 > 4 5 Li 0.78236498541627 0.78236498541627 0.00000000000000 6.941 > 5 6 Li 0.28236498541627 0.71763501458373 0.50000000000000 6.941 > 6 7 Li 0.78236498541627 0.21763501458373 0.00000000000000 6.941 > 7 8 Li 0.28236498541627 0.28236498541627 0.50000000000000 6.941 > 8 9 Li 0.71763501458373 0.71763501458373 0.50000000000000 6.941 > 9 10 Li 0.00000000000000 0.50000000000000 0.54502344964541 6.941 > 10 11 Li 0.50000000000000 0.00000000000000 0.95497655035459 6.941 > 11 12 Li 0.21763501458373 0.78236498541627 0.00000000000000 6.941 > 12 *13 O 0.00000000000000 0.73622067026158 0.28368697532785 15.999 > 13 14 O 0.23622067026158 0.50000000000000 0.78368697532785 15.999 > 14 15 O 0.50000000000000 0.23622067026158 0.21631302467215 15.999 > 15 16 O 0.26377932973842 0.00000000000000 0.71631302467215 15.999 > 16 17 O 0.73622067026158 0.00000000000000 0.71631302467215 15.999 > 17 18 O 0.76377932973842 0.50000000000000 0.78368697532785 15.999 > 18 19 O 0.00000000000000 0.26377932973842 0.28368697532785 15.999 > 19 20 O 0.50000000000000 0.76377932973842 0.21631302467215 15.999 > 20 *21 Zn 0.50000000000000 0.50000000000000 0.00000000000000 65.380 > 21 22 Zn 0.00000000000000 0.00000000000000 0.50000000000000 65.380 > 22-------------------------------- super cell --------------------------------Lattice vectors: a 6.488532670000000 0.000000000000000 0.000000000000000 b 0.000000000000000 6.488532670000000 0.000000000000000 c 0.000000000000000 0.000000000000000 9.258846480000001Atomic positions (fractional): *1 Li 0.50000000000000 0.00000000000000 0.22748827517729 6.941 > 1 2 Li 0.50000000000000 0.00000000000000 0.72748827517729 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.02251172482271 6.941 > 2 4 Li 0.00000000000000 0.50000000000000 0.52251172482271 6.941 > 2 *5 Li 0.71763501458373 0.28236498541627 0.25000000000000 6.941 > 3 6 Li 0.71763501458373 0.28236498541627 0.75000000000000 6.941 > 3 7 Li 0.21763501458373 0.21763501458373 0.00000000000000 6.941 > 4 8 Li 0.21763501458373 0.21763501458373 0.50000000000000 6.941 > 4 9 Li 0.78236498541627 0.78236498541627 0.00000000000000 6.941 > 5 10 Li 0.78236498541627 0.78236498541627 0.50000000000000 6.941 > 5 11 Li 0.28236498541627 0.71763501458373 0.25000000000000 6.941 > 6 12 Li 0.28236498541627 0.71763501458373 0.75000000000000 6.941 > 6 13 Li 0.78236498541627 0.21763501458373 0.00000000000000 6.941 > 7 14 Li 0.78236498541627 0.21763501458373 0.50000000000000 6.941 > 7 15 Li 0.28236498541627 0.28236498541627 0.25000000000000 6.941 > 8 16 Li 0.28236498541627 0.28236498541627 0.75000000000000 6.941 > 8 17 Li 0.71763501458373 0.71763501458373 0.25000000000000 6.941 > 9 18 Li 0.71763501458373 0.71763501458373 0.75000000000000 6.941 > 9 19 Li 0.00000000000000 0.50000000000000 0.27251172482271 6.941 > 10 20 Li 0.00000000000000 0.50000000000000 0.77251172482271 6.941 > 10 21 Li 0.50000000000000 0.00000000000000 0.47748827517729 6.941 > 11 22 Li 0.50000000000000 0.00000000000000 0.97748827517729 6.941 > 11 23 Li 0.21763501458373 0.78236498541627 0.00000000000000 6.941 > 12 24 Li 0.21763501458373 0.78236498541627 0.50000000000000 6.941 > 12 *25 O 0.00000000000000 0.73622067026158 0.14184348766392 15.999 > 13 26 O 0.00000000000000 0.73622067026158 0.64184348766392 15.999 > 13 27 O 0.23622067026158 0.50000000000000 0.39184348766393 15.999 > 14 28 O 0.23622067026158 0.50000000000000 0.89184348766392 15.999 > 14 29 O 0.50000000000000 0.23622067026158 0.10815651233607 15.999 > 15 30 O 0.50000000000000 0.23622067026158 0.60815651233608 15.999 > 15 31 O 0.26377932973842 0.00000000000000 0.35815651233607 15.999 > 16 32 O 0.26377932973842 0.00000000000000 0.85815651233608 15.999 > 16 33 O 0.73622067026158 0.00000000000000 0.35815651233607 15.999 > 17 34 O 0.73622067026158 0.00000000000000 0.85815651233608 15.999 > 17 35 O 0.76377932973842 0.50000000000000 0.39184348766393 15.999 > 18 36 O 0.76377932973842 0.50000000000000 0.89184348766392 15.999 > 18 37 O 0.00000000000000 0.26377932973842 0.14184348766392 15.999 > 19 38 O 0.00000000000000 0.26377932973842 0.64184348766392 15.999 > 19 39 O 0.50000000000000 0.76377932973842 0.10815651233607 15.999 > 20 40 O 0.50000000000000 0.76377932973842 0.60815651233608 15.999 > 20 *41 Zn 0.50000000000000 0.50000000000000 0.00000000000000 65.380 > 21 42 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 > 21 43 Zn 0.00000000000000 0.00000000000000 0.25000000000000 65.380 > 22 44 Zn 0.00000000000000 0.00000000000000 0.75000000000000 65.380 > 22----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 3.2610328 0.0000000 0.0000000 0.0000000 3.2610328 0.0000000 0.0000000 0.0000000 3.1065179-------------------------- Born effective charges -------------------------- 1 Li 0.9318729 0.0000000 0.0000000 0.0000000 0.9500307 0.0000000 0.0000000 0.0000000 0.9067312 2 Li 0.9318729 0.0000000 0.0000000 0.0000000 0.9500307 0.0000000 0.0000000 0.0000000 0.9067312 3 Li 0.9457519 -0.0531315 0.0015729 -0.0531315 0.9457519 0.0015729 0.0772282 0.0772282 0.9629938 4 Li 0.9457519 0.0531315 -0.0015729 0.0531315 0.9457519 0.0015729 -0.0772282 0.0772282 0.9629938 5 Li 0.9457519 0.0531315 0.0015729 0.0531315 0.9457519 -0.0015729 0.0772282 -0.0772282 0.9629938 6 Li 0.9457519 -0.0531315 -0.0015729 -0.0531315 0.9457519 -0.0015729 -0.0772282 -0.0772282 0.9629938 7 Li 0.9457519 -0.0531315 0.0015729 -0.0531315 0.9457519 0.0015729 0.0772282 0.0772282 0.9629938 8 Li 0.9457519 0.0531315 -0.0015729 0.0531315 0.9457519 0.0015729 -0.0772282 0.0772282 0.9629938 9 Li 0.9457519 0.0531315 0.0015729 0.0531315 0.9457519 -0.0015729 0.0772282 -0.0772282 0.9629938 10 Li 0.9500307 0.0000000 0.0000000 0.0000000 0.9318729 0.0000000 0.0000000 0.0000000 0.9067312 11 Li 0.9500307 0.0000000 0.0000000 0.0000000 0.9318729 0.0000000 0.0000000 0.0000000 0.9067312 12 Li 0.9457519 -0.0531315 -0.0015729 -0.0531315 0.9457519 -0.0015729 -0.0772282 -0.0772282 0.9629938 13 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 -0.2661503 0.0000000 -0.2005762 -1.7996260 14 O -2.0489990 0.0000000 -0.2661503 0.0000000 -1.7183863 0.0000000 -0.2005762 0.0000000 -1.7996260 15 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 0.2661503 0.0000000 0.2005762 -1.7996260 16 O -2.0489990 0.0000000 -0.2661503 0.0000000 -1.7183863 0.0000000 -0.2005762 0.0000000 -1.7996260 17 O -2.0489990 0.0000000 0.2661503 0.0000000 -1.7183863 0.0000000 0.2005762 0.0000000 -1.7996260 18 O -2.0489990 0.0000000 0.2661503 0.0000000 -1.7183863 0.0000000 0.2005762 0.0000000 -1.7996260 19 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 0.2661503 0.0000000 0.2005762 -1.7996260 20 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 -0.2661503 0.0000000 -0.2005762 -1.7996260 21 Zn 1.8698593 0.0000000 0.0000000 0.0000000 1.8698593 0.0000000 0.0000000 0.0000000 1.5330665 22 Zn 1.8698593 0.0000000 0.0000000 0.0000000 1.8698593 0.0000000 0.0000000 0.0000000 1.5330665----------------------------------------------------------------------------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: 132/132Permutation basis: 4422/4422Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 330Number of blocks in projector: 336Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 4--- Eigsh_solver_block: 1 / 4 ---Block_size: 112Use standard eigh solver.--- Eigsh_solver_block: 2 / 4 ---Block_size: 112Use standard eigh solver.--- Eigsh_solver_block: 3 / 4 ---Block_size: 62Use standard eigh solver.--- Eigsh_solver_block: 4 / 4 ---Block_size: 44Use standard eigh solver.Tree of FC basis block matrices:- (330, 315), data: False|-- (44, 43), data: True|-- (62, 58), data: True|-- (112, 108), data: True|-- (112, 106), data: True-----Solver_atoms: 1 -- 44 / 44Time (Solver_compr_matrix_reshape): 0.001Solver_block: 100 / 240 - Time: 0.082Solver_block: 200 / 240 - Time: 0.100Solver_block: 240 / 240 - Time: 0.046Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.232--------------------------------- Symfc end --------------------------------Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 132/132Permutation basis: 4422/4422Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 330Number of blocks in projector: 336Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 4--- Eigsh_solver_block: 1 / 4 ---Block_size: 112Use standard eigh solver.--- Eigsh_solver_block: 2 / 4 ---Block_size: 112Use standard eigh solver.--- Eigsh_solver_block: 3 / 4 ---Block_size: 62Use standard eigh solver.--- Eigsh_solver_block: 4 / 4 ---Block_size: 44Use standard eigh solver.Tree of FC basis block matrices:- (330, 315), data: False|-- (44, 43), data: True|-- (62, 58), data: True|-- (112, 108), data: True|-- (112, 106), data: TrueMax drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5".---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d)----------------------------------------------------------------------------Summary of calculation was written in "phonopy.yaml".-------------------------[time 2026-01-08 00:40:38]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 00:40:38]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: force constantsHDF5 data compression filter: gzipCrystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz".Supercell (dim): [1 1 2]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P4_2/nmc (137)------------------------------ primitive cell ------------------------------Lattice vectors: a 6.488532670000000 0.000000000000000 0.000000000000000 b 0.000000000000000 6.488532670000000 0.000000000000000 c 0.000000000000000 0.000000000000000 4.629423240000000Atomic positions (fractional): 1 Li 0.50000000000000 0.00000000000000 0.45497655035459 6.941 2 Li 0.00000000000000 0.50000000000000 0.04502344964541 6.941 3 Li 0.71763501458373 0.28236498541627 0.50000000000000 6.941 4 Li 0.21763501458373 0.21763501458373 0.00000000000000 6.941 5 Li 0.78236498541627 0.78236498541627 0.00000000000000 6.941 6 Li 0.28236498541627 0.71763501458373 0.50000000000000 6.941 7 Li 0.78236498541627 0.21763501458373 0.00000000000000 6.941 8 Li 0.28236498541627 0.28236498541627 0.50000000000000 6.941 9 Li 0.71763501458373 0.71763501458373 0.50000000000000 6.941 10 Li 0.00000000000000 0.50000000000000 0.54502344964541 6.941 11 Li 0.50000000000000 0.00000000000000 0.95497655035459 6.941 12 Li 0.21763501458373 0.78236498541627 0.00000000000000 6.941 13 O 0.00000000000000 0.73622067026158 0.28368697532785 15.999 14 O 0.23622067026158 0.50000000000000 0.78368697532785 15.999 15 O 0.50000000000000 0.23622067026158 0.21631302467215 15.999 16 O 0.26377932973842 0.00000000000000 0.71631302467215 15.999 17 O 0.73622067026158 0.00000000000000 0.71631302467215 15.999 18 O 0.76377932973842 0.50000000000000 0.78368697532785 15.999 19 O 0.00000000000000 0.26377932973842 0.28368697532785 15.999 20 O 0.50000000000000 0.76377932973842 0.21631302467215 15.999 21 Zn 0.50000000000000 0.50000000000000 0.00000000000000 65.380 22 Zn 0.00000000000000 0.00000000000000 0.50000000000000 65.380-------------------------------- supercell ---------------------------------Lattice vectors: a 6.488532670000000 0.000000000000000 0.000000000000000 b 0.000000000000000 6.488532670000000 0.000000000000000 c 0.000000000000000 0.000000000000000 9.258846480000001Atomic positions (fractional): 1 Li 0.50000000000000 0.00000000000000 0.22748827517729 6.941 > 1 2 Li 0.50000000000000 0.00000000000000 0.72748827517729 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.02251172482271 6.941 > 3 4 Li 0.00000000000000 0.50000000000000 0.52251172482271 6.941 > 3 5 Li 0.71763501458373 0.28236498541627 0.25000000000000 6.941 > 5 6 Li 0.71763501458373 0.28236498541627 0.75000000000000 6.941 > 5 7 Li 0.21763501458373 0.21763501458373 0.00000000000000 6.941 > 7 8 Li 0.21763501458373 0.21763501458373 0.50000000000000 6.941 > 7 9 Li 0.78236498541627 0.78236498541627 0.00000000000000 6.941 > 9 10 Li 0.78236498541627 0.78236498541627 0.50000000000000 6.941 > 9 11 Li 0.28236498541627 0.71763501458373 0.25000000000000 6.941 > 11 12 Li 0.28236498541627 0.71763501458373 0.75000000000000 6.941 > 11 13 Li 0.78236498541627 0.21763501458373 0.00000000000000 6.941 > 13 14 Li 0.78236498541627 0.21763501458373 0.50000000000000 6.941 > 13 15 Li 0.28236498541627 0.28236498541627 0.25000000000000 6.941 > 15 16 Li 0.28236498541627 0.28236498541627 0.75000000000000 6.941 > 15 17 Li 0.71763501458373 0.71763501458373 0.25000000000000 6.941 > 17 18 Li 0.71763501458373 0.71763501458373 0.75000000000000 6.941 > 17 19 Li 0.00000000000000 0.50000000000000 0.27251172482271 6.941 > 19 20 Li 0.00000000000000 0.50000000000000 0.77251172482271 6.941 > 19 21 Li 0.50000000000000 0.00000000000000 0.47748827517729 6.941 > 21 22 Li 0.50000000000000 0.00000000000000 0.97748827517729 6.941 > 21 23 Li 0.21763501458373 0.78236498541627 0.00000000000000 6.941 > 23 24 Li 0.21763501458373 0.78236498541627 0.50000000000000 6.941 > 23 25 O 0.00000000000000 0.73622067026158 0.14184348766392 15.999 > 25 26 O 0.00000000000000 0.73622067026158 0.64184348766392 15.999 > 25 27 O 0.23622067026158 0.50000000000000 0.39184348766393 15.999 > 27 28 O 0.23622067026158 0.50000000000000 0.89184348766392 15.999 > 27 29 O 0.50000000000000 0.23622067026158 0.10815651233607 15.999 > 29 30 O 0.50000000000000 0.23622067026158 0.60815651233608 15.999 > 29 31 O 0.26377932973842 0.00000000000000 0.35815651233607 15.999 > 31 32 O 0.26377932973842 0.00000000000000 0.85815651233608 15.999 > 31 33 O 0.73622067026158 0.00000000000000 0.35815651233607 15.999 > 33 34 O 0.73622067026158 0.00000000000000 0.85815651233608 15.999 > 33 35 O 0.76377932973842 0.50000000000000 0.39184348766393 15.999 > 35 36 O 0.76377932973842 0.50000000000000 0.89184348766392 15.999 > 35 37 O 0.00000000000000 0.26377932973842 0.14184348766392 15.999 > 37 38 O 0.00000000000000 0.26377932973842 0.64184348766392 15.999 > 37 39 O 0.50000000000000 0.76377932973842 0.10815651233607 15.999 > 39 40 O 0.50000000000000 0.76377932973842 0.60815651233608 15.999 > 39 41 Zn 0.50000000000000 0.50000000000000 0.00000000000000 65.380 > 41 42 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 > 41 43 Zn 0.00000000000000 0.00000000000000 0.25000000000000 65.380 > 43 44 Zn 0.00000000000000 0.00000000000000 0.75000000000000 65.380 > 43----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 3.2610328 0.0000000 0.0000000 0.0000000 3.2610328 0.0000000 0.0000000 0.0000000 3.1065179-------------------------- Born effective charges -------------------------- 1 Li 0.9318729 0.0000000 0.0000000 0.0000000 0.9500307 0.0000000 0.0000000 0.0000000 0.9067312 2 Li 0.9318729 0.0000000 0.0000000 0.0000000 0.9500307 0.0000000 0.0000000 0.0000000 0.9067312 3 Li 0.9457519 -0.0531315 0.0015729 -0.0531315 0.9457519 0.0015729 0.0772282 0.0772282 0.9629938 4 Li 0.9457519 0.0531315 -0.0015729 0.0531315 0.9457519 0.0015729 -0.0772282 0.0772282 0.9629938 5 Li 0.9457519 0.0531315 0.0015729 0.0531315 0.9457519 -0.0015729 0.0772282 -0.0772282 0.9629938 6 Li 0.9457519 -0.0531315 -0.0015729 -0.0531315 0.9457519 -0.0015729 -0.0772282 -0.0772282 0.9629938 7 Li 0.9457519 -0.0531315 0.0015729 -0.0531315 0.9457519 0.0015729 0.0772282 0.0772282 0.9629938 8 Li 0.9457519 0.0531315 -0.0015729 0.0531315 0.9457519 0.0015729 -0.0772282 0.0772282 0.9629938 9 Li 0.9457519 0.0531315 0.0015729 0.0531315 0.9457519 -0.0015729 0.0772282 -0.0772282 0.9629938 10 Li 0.9500307 0.0000000 0.0000000 0.0000000 0.9318729 0.0000000 0.0000000 0.0000000 0.9067312 11 Li 0.9500307 0.0000000 0.0000000 0.0000000 0.9318729 0.0000000 0.0000000 0.0000000 0.9067312 12 Li 0.9457519 -0.0531315 -0.0015729 -0.0531315 0.9457519 -0.0015729 -0.0772282 -0.0772282 0.9629938 13 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 -0.2661503 0.0000000 -0.2005762 -1.7996260 14 O -2.0489990 0.0000000 -0.2661503 0.0000000 -1.7183863 0.0000000 -0.2005762 0.0000000 -1.7996260 15 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 0.2661503 0.0000000 0.2005762 -1.7996260 16 O -2.0489990 0.0000000 -0.2661503 0.0000000 -1.7183863 0.0000000 -0.2005762 0.0000000 -1.7996260 17 O -2.0489990 0.0000000 0.2661503 0.0000000 -1.7183863 0.0000000 0.2005762 0.0000000 -1.7996260 18 O -2.0489990 0.0000000 0.2661503 0.0000000 -1.7183863 0.0000000 0.2005762 0.0000000 -1.7996260 19 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 0.2661503 0.0000000 0.2005762 -1.7996260 20 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 -0.2661503 0.0000000 -0.2005762 -1.7996260 21 Zn 1.8698593 0.0000000 0.0000000 0.0000000 1.8698593 0.0000000 0.0000000 0.0000000 1.5330665 22 Zn 1.8698593 0.0000000 0.0000000 0.0000000 1.8698593 0.0000000 0.0000000 0.0000000 1.5330665----------------------------------------------------------------------------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[ 5, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 25, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 41, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 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: -0.00000002 (xzx) -0.00000002 (xzx) -0.00000002 (xxz)fc3 was written into "fc3.hdf5".Max drift of fc2: -0.00000000 (xz) -0.00000000 (xz) fc2 was written into "fc2.hdf5".--------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperatures: 0.0 300.0 Cutoff frequency: 0.01Frequency conversion factor to THz: 15.63330----------- None of ph-ph interaction calculation was performed. -----------Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 00:40:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 00:40:42]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: conductivity-RTAHDF5 data compression filter: gzipCrystal structure was read from "phono3py.yaml".Supercell (dim): [1 1 2]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P4_2/nmc (137)------------------------------ primitive cell ------------------------------Lattice vectors: a 6.488532670000000 0.000000000000000 0.000000000000000 b 0.000000000000000 6.488532670000000 0.000000000000000 c 0.000000000000000 0.000000000000000 4.629423240000000Atomic positions (fractional): 1 Li 0.50000000000000 0.00000000000000 0.45497655035459 6.941 2 Li 0.00000000000000 0.50000000000000 0.04502344964541 6.941 3 Li 0.71763501458373 0.28236498541627 0.50000000000000 6.941 4 Li 0.21763501458373 0.21763501458373 0.00000000000000 6.941 5 Li 0.78236498541627 0.78236498541627 0.00000000000000 6.941 6 Li 0.28236498541627 0.71763501458373 0.50000000000000 6.941 7 Li 0.78236498541627 0.21763501458373 0.00000000000000 6.941 8 Li 0.28236498541627 0.28236498541627 0.50000000000000 6.941 9 Li 0.71763501458373 0.71763501458373 0.50000000000000 6.941 10 Li 0.00000000000000 0.50000000000000 0.54502344964541 6.941 11 Li 0.50000000000000 0.00000000000000 0.95497655035459 6.941 12 Li 0.21763501458373 0.78236498541627 0.00000000000000 6.941 13 O 0.00000000000000 0.73622067026158 0.28368697532785 15.999 14 O 0.23622067026158 0.50000000000000 0.78368697532785 15.999 15 O 0.50000000000000 0.23622067026158 0.21631302467215 15.999 16 O 0.26377932973842 0.00000000000000 0.71631302467215 15.999 17 O 0.73622067026158 0.00000000000000 0.71631302467215 15.999 18 O 0.76377932973842 0.50000000000000 0.78368697532785 15.999 19 O 0.00000000000000 0.26377932973842 0.28368697532785 15.999 20 O 0.50000000000000 0.76377932973842 0.21631302467215 15.999 21 Zn 0.50000000000000 0.50000000000000 0.00000000000000 65.380 22 Zn 0.00000000000000 0.00000000000000 0.50000000000000 65.380-------------------------------- supercell ---------------------------------Lattice vectors: a 6.488532670000000 0.000000000000000 0.000000000000000 b 0.000000000000000 6.488532670000000 0.000000000000000 c 0.000000000000000 0.000000000000000 9.258846480000001Atomic positions (fractional): 1 Li 0.50000000000000 0.00000000000000 0.22748827517729 6.941 > 1 2 Li 0.50000000000000 0.00000000000000 0.72748827517729 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.02251172482271 6.941 > 3 4 Li 0.00000000000000 0.50000000000000 0.52251172482271 6.941 > 3 5 Li 0.71763501458373 0.28236498541627 0.25000000000000 6.941 > 5 6 Li 0.71763501458373 0.28236498541627 0.75000000000000 6.941 > 5 7 Li 0.21763501458373 0.21763501458373 0.00000000000000 6.941 > 7 8 Li 0.21763501458373 0.21763501458373 0.50000000000000 6.941 > 7 9 Li 0.78236498541627 0.78236498541627 0.00000000000000 6.941 > 9 10 Li 0.78236498541627 0.78236498541627 0.50000000000000 6.941 > 9 11 Li 0.28236498541627 0.71763501458373 0.25000000000000 6.941 > 11 12 Li 0.28236498541627 0.71763501458373 0.75000000000000 6.941 > 11 13 Li 0.78236498541627 0.21763501458373 0.00000000000000 6.941 > 13 14 Li 0.78236498541627 0.21763501458373 0.50000000000000 6.941 > 13 15 Li 0.28236498541627 0.28236498541627 0.25000000000000 6.941 > 15 16 Li 0.28236498541627 0.28236498541627 0.75000000000000 6.941 > 15 17 Li 0.71763501458373 0.71763501458373 0.25000000000000 6.941 > 17 18 Li 0.71763501458373 0.71763501458373 0.75000000000000 6.941 > 17 19 Li 0.00000000000000 0.50000000000000 0.27251172482271 6.941 > 19 20 Li 0.00000000000000 0.50000000000000 0.77251172482271 6.941 > 19 21 Li 0.50000000000000 0.00000000000000 0.47748827517729 6.941 > 21 22 Li 0.50000000000000 0.00000000000000 0.97748827517729 6.941 > 21 23 Li 0.21763501458373 0.78236498541627 0.00000000000000 6.941 > 23 24 Li 0.21763501458373 0.78236498541627 0.50000000000000 6.941 > 23 25 O 0.00000000000000 0.73622067026158 0.14184348766392 15.999 > 25 26 O 0.00000000000000 0.73622067026158 0.64184348766392 15.999 > 25 27 O 0.23622067026158 0.50000000000000 0.39184348766393 15.999 > 27 28 O 0.23622067026158 0.50000000000000 0.89184348766392 15.999 > 27 29 O 0.50000000000000 0.23622067026158 0.10815651233607 15.999 > 29 30 O 0.50000000000000 0.23622067026158 0.60815651233608 15.999 > 29 31 O 0.26377932973842 0.00000000000000 0.35815651233607 15.999 > 31 32 O 0.26377932973842 0.00000000000000 0.85815651233608 15.999 > 31 33 O 0.73622067026158 0.00000000000000 0.35815651233607 15.999 > 33 34 O 0.73622067026158 0.00000000000000 0.85815651233608 15.999 > 33 35 O 0.76377932973842 0.50000000000000 0.39184348766393 15.999 > 35 36 O 0.76377932973842 0.50000000000000 0.89184348766392 15.999 > 35 37 O 0.00000000000000 0.26377932973842 0.14184348766392 15.999 > 37 38 O 0.00000000000000 0.26377932973842 0.64184348766392 15.999 > 37 39 O 0.50000000000000 0.76377932973842 0.10815651233607 15.999 > 39 40 O 0.50000000000000 0.76377932973842 0.60815651233608 15.999 > 39 41 Zn 0.50000000000000 0.50000000000000 0.00000000000000 65.380 > 41 42 Zn 0.50000000000000 0.50000000000000 0.50000000000000 65.380 > 41 43 Zn 0.00000000000000 0.00000000000000 0.25000000000000 65.380 > 43 44 Zn 0.00000000000000 0.00000000000000 0.75000000000000 65.380 > 43----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 3.2610328 0.0000000 0.0000000 0.0000000 3.2610328 0.0000000 0.0000000 0.0000000 3.1065179-------------------------- Born effective charges -------------------------- 1 Li 0.9318729 0.0000000 0.0000000 0.0000000 0.9500307 0.0000000 0.0000000 0.0000000 0.9067312 2 Li 0.9318729 0.0000000 0.0000000 0.0000000 0.9500307 0.0000000 0.0000000 0.0000000 0.9067312 3 Li 0.9457519 -0.0531315 0.0015729 -0.0531315 0.9457519 0.0015729 0.0772282 0.0772282 0.9629938 4 Li 0.9457519 0.0531315 -0.0015729 0.0531315 0.9457519 0.0015729 -0.0772282 0.0772282 0.9629938 5 Li 0.9457519 0.0531315 0.0015729 0.0531315 0.9457519 -0.0015729 0.0772282 -0.0772282 0.9629938 6 Li 0.9457519 -0.0531315 -0.0015729 -0.0531315 0.9457519 -0.0015729 -0.0772282 -0.0772282 0.9629938 7 Li 0.9457519 -0.0531315 0.0015729 -0.0531315 0.9457519 0.0015729 0.0772282 0.0772282 0.9629938 8 Li 0.9457519 0.0531315 -0.0015729 0.0531315 0.9457519 0.0015729 -0.0772282 0.0772282 0.9629938 9 Li 0.9457519 0.0531315 0.0015729 0.0531315 0.9457519 -0.0015729 0.0772282 -0.0772282 0.9629938 10 Li 0.9500307 0.0000000 0.0000000 0.0000000 0.9318729 0.0000000 0.0000000 0.0000000 0.9067312 11 Li 0.9500307 0.0000000 0.0000000 0.0000000 0.9318729 0.0000000 0.0000000 0.0000000 0.9067312 12 Li 0.9457519 -0.0531315 -0.0015729 -0.0531315 0.9457519 -0.0015729 -0.0772282 -0.0772282 0.9629938 13 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 -0.2661503 0.0000000 -0.2005762 -1.7996260 14 O -2.0489990 0.0000000 -0.2661503 0.0000000 -1.7183863 0.0000000 -0.2005762 0.0000000 -1.7996260 15 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 0.2661503 0.0000000 0.2005762 -1.7996260 16 O -2.0489990 0.0000000 -0.2661503 0.0000000 -1.7183863 0.0000000 -0.2005762 0.0000000 -1.7996260 17 O -2.0489990 0.0000000 0.2661503 0.0000000 -1.7183863 0.0000000 0.2005762 0.0000000 -1.7996260 18 O -2.0489990 0.0000000 0.2661503 0.0000000 -1.7183863 0.0000000 0.2005762 0.0000000 -1.7996260 19 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 0.2661503 0.0000000 0.2005762 -1.7996260 20 O -1.7183863 0.0000000 0.0000000 0.0000000 -2.0489990 -0.2661503 0.0000000 -0.2005762 -1.7996260 21 Zn 1.8698593 0.0000000 0.0000000 0.0000000 1.8698593 0.0000000 0.0000000 0.0000000 1.5330665 22 Zn 1.8698593 0.0000000 0.0000000 0.0000000 1.8698593 0.0000000 0.0000000 0.0000000 1.5330665----------------------------------------------------------------------------fc3 was read from "fc3.hdf5".fc2 was read from "fc2.hdf5".----------------------------- Force constants ------------------------------Max drift of fc3: -0.00000002 (xzx) -0.00000002 (xzx) -0.00000002 (xxz)Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0Cutoff frequency: 0.01Frequency conversion factor to THz: 15.63330Length for sampling mesh generation: 50.00Generating grid system ... [ 8 8 11 ]fc3-r2q-transformation over three atoms: True--------------------------- Phonon calculations ----------------------------Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.72, Number of G-points: 299, Lambda: 0.13Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/90) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency 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 4.014 ( 0.000 -0.000 0.000) 0.000 4.856 ( -0.000 0.000 0.000) 0.000 4.856 ( 0.000 -0.000 0.000) 0.000 5.649 ( 0.000 -0.000 0.000) 0.000 6.214 ( 0.000 -0.000 -0.000) 0.000 6.214 ( 0.000 0.000 0.000) 0.000 6.248 ( 0.000 0.000 -0.000) 0.000 6.884 ( 0.000 0.000 0.000) 0.000 7.071 ( 0.000 -0.000 0.000) 0.000 7.071 ( 0.000 -0.000 0.000) 0.000 7.945 ( 0.000 -0.000 0.000) 0.000 8.001 ( 0.000 0.000 0.000) 0.000 8.001 ( 0.000 0.000 -0.000) 0.000 8.263 ( -0.000 0.000 -0.000) 0.000 8.591 ( -0.000 0.000 -0.000) 0.000 8.678 ( -0.000 0.000 0.000) 0.000 8.989 ( 0.000 -0.000 -0.000) 0.000 9.002 ( -0.000 0.000 -0.000) 0.000 9.002 ( 0.000 0.000 0.000) 0.000 9.378 ( 0.000 -0.000 0.000) 0.000 9.378 ( -0.000 0.000 -0.000) 0.000 10.179 ( -0.000 0.000 0.000) 0.000 10.179 ( -0.000 0.000 0.000) 0.000 10.924 ( 0.000 -0.000 0.000) 0.000 11.258 ( -0.000 0.000 0.000) 0.000 11.837 ( 0.000 -0.000 0.000) 0.000 11.839 ( 0.000 0.000 0.000) 0.000 11.839 ( 0.000 0.000 0.000) 0.000 11.894 ( 0.000 -0.000 0.000) 0.000 11.945 ( 0.000 0.000 0.000) 0.000 11.997 ( 0.000 -0.000 -0.000) 0.000 11.997 ( 0.000 0.000 0.000) 0.000 12.041 ( 0.000 -0.000 0.000) 0.000 12.801 ( 0.000 0.000 0.000) 0.000 12.993 ( 0.000 0.000 0.000) 0.000 13.326 ( 0.000 0.000 0.000) 0.000 13.789 ( 0.000 0.000 0.000) 0.000 13.789 ( 0.000 -0.000 0.000) 0.000 13.850 ( 0.000 0.000 -0.000) 0.000 13.850 ( 0.000 0.000 0.000) 0.000 13.983 ( 0.000 -0.000 -0.000) 0.000 14.223 ( -0.000 0.000 0.000) 0.000 14.223 ( 0.000 0.000 0.000) 0.000 14.345 ( 0.000 -0.000 0.000) 0.000 15.145 ( 0.000 0.000 -0.000) 0.000 15.179 ( -0.000 0.000 0.000) 0.000 15.606 ( 0.000 0.000 -0.000) 0.000 15.606 ( 0.000 0.000 0.000) 0.000 15.679 ( -0.000 0.000 0.000) 0.000 15.679 ( 0.000 0.000 0.000) 0.000 17.154 ( 0.000 0.000 0.000) 0.000 17.201 ( 0.000 -0.000 0.000) 0.000 17.268 ( 0.000 0.000 0.000) 0.000 17.268 ( 0.000 0.000 0.000) 0.000 17.584 ( 0.000 0.000 0.000) 0.000 17.790 ( 0.000 0.000 0.000) 0.000 19.702 ( 0.000 0.000 0.000) 0.000 19.789 ( -0.000 0.000 0.000) 0.000 19.789 ( -0.000 0.000 -0.000) 0.000 20.542 ( 0.000 0.000 -0.000) 0.000 20.597 ( 0.000 0.000 -0.000) 0.000 20.668 ( -0.000 0.000 0.000) 0.000 20.668 ( 0.000 -0.000 -0.000) 0.000======================= Grid point 1 (2/90) =======================q-point: ( 0.12 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 120Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.896 ( 45.885 0.000 0.000) 45.885 0.913 ( 46.417 0.000 0.000) 46.417 1.454 ( 73.652 0.000 0.000) 73.652 3.999 ( -1.488 0.000 0.000) 1.488 4.662 ( -18.591 0.000 0.000) 18.591 4.868 ( 1.133 0.000 0.000) 1.133 5.677 ( 2.790 0.000 0.000) 2.790 6.170 ( -4.454 0.000 0.000) 4.454 6.267 ( 1.433 0.000 0.000) 1.433 6.615 ( -13.215 0.000 0.000) 13.215 6.968 ( 7.810 0.000 0.000) 7.810 7.017 ( -4.361 0.000 0.000) 4.361 7.163 ( -10.997 0.000 0.000) 10.997 8.003 ( -2.661 0.000 0.000) 2.661 8.013 ( 0.113 0.000 0.000) 0.113 8.154 ( 15.868 0.000 0.000) 15.868 8.338 ( 6.345 0.000 0.000) 6.345 8.531 ( -2.562 0.000 0.000) 2.562 8.544 ( -10.190 0.000 0.000) 10.190 8.958 ( -2.895 0.000 0.000) 2.895 9.123 ( 9.133 0.000 0.000) 9.133 9.250 ( 4.838 0.000 0.000) 4.838 9.379 ( -0.232 0.000 0.000) 0.232 9.400 ( 2.240 0.000 0.000) 2.240 10.179 ( 0.070 0.000 0.000) 0.070 10.201 ( 2.292 0.000 0.000) 2.292 10.960 ( 3.514 0.000 0.000) 3.514 11.326 ( 6.895 0.000 0.000) 6.895 11.569 ( -15.968 0.000 0.000) 15.968 11.723 ( -9.181 0.000 0.000) 9.181 11.756 ( -15.214 0.000 0.000) 15.214 11.910 ( 0.745 0.000 0.000) 0.745 11.923 ( 8.236 0.000 0.000) 8.236 12.132 ( 9.036 0.000 0.000) 9.036 12.189 ( 5.570 0.000 0.000) 5.570 12.222 ( 5.964 0.000 0.000) 5.964 12.752 ( -11.631 0.000 0.000) 11.631 12.876 ( -5.037 0.000 0.000) 5.037 13.264 ( -5.990 0.000 0.000) 5.990 13.636 ( -9.760 0.000 0.000) 9.760 13.796 ( 0.705 0.000 0.000) 0.705 13.899 ( 4.924 0.000 0.000) 4.924 13.914 ( -6.856 0.000 0.000) 6.856 14.153 ( -6.774 0.000 0.000) 6.774 14.214 ( -1.037 0.000 0.000) 1.037 14.615 ( 18.205 0.000 0.000) 18.205 15.046 ( -11.703 0.000 0.000) 11.703 15.185 ( 6.659 0.000 0.000) 6.659 15.205 ( 3.862 0.000 0.000) 3.862 15.592 ( 0.568 0.000 0.000) 0.568 15.651 ( 2.895 0.000 0.000) 2.895 15.667 ( -1.098 0.000 0.000) 1.098 17.080 ( -5.971 0.000 0.000) 5.971 17.202 ( 4.758 0.000 0.000) 4.758 17.333 ( 6.196 0.000 0.000) 6.196 17.449 ( 11.372 0.000 0.000) 11.372 17.507 ( -7.605 0.000 0.000) 7.605 17.800 ( 0.912 0.000 0.000) 0.912 19.590 ( -6.272 0.000 0.000) 6.272 19.602 ( 2.922 0.000 0.000) 2.922 19.798 ( 1.059 0.000 0.000) 1.059 19.905 ( 6.959 0.000 0.000) 6.959 20.505 ( -3.767 0.000 0.000) 3.767 20.624 ( -4.514 0.000 0.000) 4.514 20.649 ( 5.279 0.000 0.000) 5.279 21.754 ( -4.445 0.000 0.000) 4.445======================= Grid point 2 (3/90) =======================q-point: ( 0.25 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.754 ( 42.844 0.000 0.000) 42.844 1.769 ( 41.973 0.000 0.000) 41.973 2.776 ( 60.098 0.000 0.000) 60.098 3.975 ( 0.935 0.000 0.000) 0.935 4.213 ( -26.350 0.000 0.000) 26.350 4.894 ( 1.517 0.000 0.000) 1.517 5.745 ( 3.647 0.000 0.000) 3.647 6.064 ( -5.502 0.000 0.000) 5.502 6.245 ( -22.730 0.000 0.000) 22.730 6.280 ( -0.704 0.000 0.000) 0.704 6.952 ( -1.717 0.000 0.000) 1.717 7.033 ( -2.965 0.000 0.000) 2.965 7.134 ( 7.836 0.000 0.000) 7.836 7.820 ( -13.682 0.000 0.000) 13.682 7.933 ( -10.237 0.000 0.000) 10.237 8.283 ( -11.944 0.000 0.000) 11.944 8.440 ( 12.782 0.000 0.000) 12.782 8.528 ( 8.061 0.000 0.000) 8.061 8.606 ( 8.842 0.000 0.000) 8.842 8.890 ( -3.845 0.000 0.000) 3.845 9.285 ( 7.007 0.000 0.000) 7.007 9.366 ( -0.851 0.000 0.000) 0.851 9.372 ( 7.292 0.000 0.000) 7.292 9.475 ( 5.715 0.000 0.000) 5.715 10.200 ( 3.247 0.000 0.000) 3.247 10.276 ( 5.953 0.000 0.000) 5.953 11.048 ( 5.068 0.000 0.000) 5.068 11.310 ( -10.055 0.000 0.000) 10.055 11.440 ( -17.391 0.000 0.000) 17.391 11.507 ( 11.326 0.000 0.000) 11.326 11.535 ( -10.351 0.000 0.000) 10.351 11.925 ( 0.604 0.000 0.000) 0.604 12.132 ( 12.854 0.000 0.000) 12.854 12.228 ( -1.539 0.000 0.000) 1.539 12.248 ( 3.327 0.000 0.000) 3.327 12.253 ( -12.141 0.000 0.000) 12.141 12.380 ( -11.543 0.000 0.000) 11.543 12.910 ( 5.467 0.000 0.000) 5.467 13.112 ( -9.409 0.000 0.000) 9.409 13.531 ( -1.922 0.000 0.000) 1.922 13.734 ( -11.345 0.000 0.000) 11.345 13.821 ( 2.010 0.000 0.000) 2.010 13.985 ( -10.087 0.000 0.000) 10.087 14.026 ( 7.889 0.000 0.000) 7.889 14.177 ( -2.915 0.000 0.000) 2.915 14.796 ( -13.173 0.000 0.000) 13.173 14.857 ( 6.644 0.000 0.000) 6.644 15.196 ( -4.507 0.000 0.000) 4.507 15.436 ( 18.487 0.000 0.000) 18.487 15.643 ( -1.222 0.000 0.000) 1.222 15.680 ( 0.062 0.000 0.000) 0.062 15.714 ( 11.563 0.000 0.000) 11.563 16.981 ( -4.819 0.000 0.000) 4.819 17.311 ( -12.152 0.000 0.000) 12.152 17.324 ( 7.432 0.000 0.000) 7.432 17.472 ( 7.203 0.000 0.000) 7.203 17.650 ( 8.900 0.000 0.000) 8.900 17.821 ( 1.181 0.000 0.000) 1.181 19.511 ( -1.473 0.000 0.000) 1.473 19.662 ( 2.708 0.000 0.000) 2.708 19.839 ( 3.482 0.000 0.000) 3.482 20.022 ( 5.144 0.000 0.000) 5.144 20.406 ( -6.173 0.000 0.000) 6.173 20.499 ( -8.296 0.000 0.000) 8.296 20.793 ( 9.326 0.000 0.000) 9.326 21.630 ( -8.233 0.000 0.000) 8.233======================= Grid point 3 (4/90) =======================q-point: ( 0.38 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 120Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.515 ( 35.326 0.000 0.000) 35.326 2.525 ( 36.489 0.000 0.000) 36.489 3.413 ( 0.225 0.000 0.000) 0.225 3.687 ( -27.858 0.000 0.000) 27.858 4.305 ( 35.833 0.000 0.000) 35.833 4.923 ( 1.061 0.000 0.000) 1.061 5.778 ( -1.436 0.000 0.000) 1.436 5.840 ( -16.709 0.000 0.000) 16.709 6.005 ( 0.376 0.000 0.000) 0.376 6.220 ( -5.676 0.000 0.000) 5.676 6.959 ( 2.442 0.000 0.000) 2.442 7.035 ( 3.536 0.000 0.000) 3.536 7.180 ( -4.747 0.000 0.000) 4.747 7.605 ( -22.071 0.000 0.000) 22.071 7.664 ( 1.161 0.000 0.000) 1.161 8.040 ( -12.673 0.000 0.000) 12.673 8.635 ( 7.535 0.000 0.000) 7.535 8.680 ( 7.035 0.000 0.000) 7.035 8.761 ( 5.192 0.000 0.000) 5.192 8.816 ( -3.714 0.000 0.000) 3.714 9.362 ( 0.744 0.000 0.000) 0.744 9.378 ( 2.499 0.000 0.000) 2.499 9.509 ( 6.368 0.000 0.000) 6.368 9.585 ( 4.036 0.000 0.000) 4.036 10.366 ( 15.417 0.000 0.000) 15.417 10.449 ( 12.292 0.000 0.000) 12.292 11.092 ( -18.526 0.000 0.000) 18.526 11.125 ( 2.000 0.000 0.000) 2.000 11.186 ( -3.322 0.000 0.000) 3.322 11.264 ( -19.881 0.000 0.000) 19.881 11.739 ( 12.178 0.000 0.000) 12.178 11.915 ( -10.396 0.000 0.000) 10.396 11.920 ( -1.467 0.000 0.000) 1.467 12.139 ( -7.313 0.000 0.000) 7.313 12.281 ( 0.725 0.000 0.000) 0.725 12.332 ( -1.530 0.000 0.000) 1.530 12.397 ( 14.189 0.000 0.000) 14.189 12.909 ( -11.667 0.000 0.000) 11.667 13.058 ( 9.447 0.000 0.000) 9.447 13.498 ( -12.657 0.000 0.000) 12.657 13.539 ( 2.495 0.000 0.000) 2.495 13.788 ( -9.795 0.000 0.000) 9.795 13.880 ( 4.263 0.000 0.000) 4.263 14.097 ( -5.383 0.000 0.000) 5.383 14.191 ( 9.007 0.000 0.000) 9.007 14.561 ( -10.997 0.000 0.000) 10.997 14.937 ( 2.991 0.000 0.000) 2.991 15.091 ( -5.498 0.000 0.000) 5.498 15.627 ( -0.275 0.000 0.000) 0.275 15.662 ( -1.521 0.000 0.000) 1.521 15.801 ( 17.288 0.000 0.000) 17.288 15.949 ( 10.498 0.000 0.000) 10.498 16.890 ( -3.957 0.000 0.000) 3.957 17.067 ( -12.314 0.000 0.000) 12.314 17.468 ( 6.951 0.000 0.000) 6.951 17.575 ( 2.785 0.000 0.000) 2.785 17.779 ( 4.499 0.000 0.000) 4.499 17.839 ( 0.464 0.000 0.000) 0.464 19.536 ( 3.724 0.000 0.000) 3.724 19.684 ( -0.900 0.000 0.000) 0.900 19.941 ( 7.208 0.000 0.000) 7.208 20.108 ( 3.962 0.000 0.000) 3.962 20.284 ( -6.016 0.000 0.000) 6.016 20.315 ( -10.474 0.000 0.000) 10.474 20.996 ( 11.447 0.000 0.000) 11.447 21.444 ( -10.816 0.000 0.000) 10.816======================= Grid point 4 (5/90) =======================q-point: (-0.50 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.127 ( -24.899 0.000 0.000) 24.899 3.127 ( 24.899 0.000 0.000) 24.899 3.137 ( -29.739 0.000 0.000) 29.739 3.137 ( 29.739 0.000 0.000) 29.739 4.852 ( -13.564 0.000 0.000) 13.564 4.852 ( 13.564 0.000 0.000) 13.564 5.700 ( -2.717 0.000 0.000) 2.717 5.700 ( 2.717 0.000 0.000) 2.717 6.084 ( -7.018 0.000 0.000) 7.018 6.084 ( 7.018 0.000 0.000) 7.018 7.045 ( -6.510 0.000 0.000) 6.510 7.045 ( 6.510 0.000 0.000) 6.510 7.210 ( -15.699 0.000 0.000) 15.699 7.210 ( 15.699 0.000 0.000) 15.699 7.808 ( -11.004 0.000 0.000) 11.004 7.808 ( 11.004 0.000 0.000) 11.004 8.743 ( -4.232 0.000 0.000) 4.232 8.743 ( 4.232 0.000 0.000) 4.232 8.780 ( -2.781 0.000 0.000) 2.781 8.780 ( 2.781 0.000 0.000) 2.781 9.387 ( -1.135 0.000 0.000) 1.135 9.387 ( 1.135 0.000 0.000) 1.135 9.598 ( -2.459 0.000 0.000) 2.459 9.598 ( 2.459 0.000 0.000) 2.459 10.741 ( -17.351 0.000 0.000) 17.351 10.741 ( 17.351 0.000 0.000) 17.351 10.781 ( -25.747 0.000 0.000) 25.747 10.781 ( 25.747 0.000 0.000) 25.747 11.154 ( -0.627 0.000 0.000) 0.627 11.154 ( 0.627 0.000 0.000) 0.627 11.872 ( -2.504 0.000 0.000) 2.504 11.872 ( 2.504 0.000 0.000) 2.504 11.962 ( -10.705 0.000 0.000) 10.705 11.962 ( 10.705 0.000 0.000) 10.705 12.299 ( -1.470 0.000 0.000) 1.470 12.299 ( 1.470 0.000 0.000) 1.470 12.666 ( -13.452 0.000 0.000) 13.452 12.666 ( 13.452 0.000 0.000) 13.452 13.262 ( -11.586 0.000 0.000) 11.586 13.262 ( 11.586 0.000 0.000) 11.586 13.626 ( -6.611 0.000 0.000) 6.611 13.626 ( 6.611 0.000 0.000) 6.611 13.982 ( -6.053 0.000 0.000) 6.053 13.982 ( 6.053 0.000 0.000) 6.053 14.368 ( -9.380 0.000 0.000) 9.380 14.368 ( 9.380 0.000 0.000) 9.380 15.000 ( -3.865 0.000 0.000) 3.865 15.000 ( 3.865 0.000 0.000) 3.865 15.635 ( -1.063 0.000 0.000) 1.063 15.635 ( 1.063 0.000 0.000) 1.063 16.027 ( -4.240 0.000 0.000) 4.240 16.027 ( 4.240 0.000 0.000) 4.240 16.885 ( -4.931 0.000 0.000) 4.931 16.885 ( 4.931 0.000 0.000) 4.931 17.570 ( -3.139 0.000 0.000) 3.139 17.570 ( 3.139 0.000 0.000) 3.139 17.833 ( -1.313 0.000 0.000) 1.313 17.833 ( 1.313 0.000 0.000) 1.313 19.626 ( -4.648 0.000 0.000) 4.648 19.626 ( 4.648 0.000 0.000) 4.648 20.112 ( -10.139 0.000 0.000) 10.139 20.112 ( 10.139 0.000 0.000) 10.139 20.185 ( -4.318 0.000 0.000) 4.318 20.185 ( 4.318 0.000 0.000) 4.318 21.223 ( -11.898 0.000 0.000) 11.898 21.223 ( 11.898 0.000 0.000) 11.898======================= Grid point 10 (6/90) =======================q-point: ( 0.12 0.12 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 120Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.904 ( 23.474 23.474 0.000) 33.197 1.252 ( 31.297 31.297 0.000) 44.261 2.211 ( 53.464 53.464 0.000) 75.610 3.976 ( -1.915 -1.915 0.000) 2.709 4.610 ( -10.914 -10.914 0.000) 15.434 4.756 ( -4.802 -4.802 0.000) 6.791 5.697 ( 2.166 2.166 0.000) 3.063 6.089 ( -7.266 -7.266 0.000) 10.275 6.280 ( 0.640 0.640 0.000) 0.905 6.554 ( -8.087 -8.087 0.000) 11.437 6.991 ( -3.376 -3.376 0.000) 4.774 7.074 ( 9.583 9.583 0.000) 13.552 7.074 ( -6.247 -6.247 0.000) 8.835 7.691 ( -16.440 -16.440 0.000) 23.250 8.223 ( 6.429 6.429 0.000) 9.093 8.297 ( 11.845 11.845 0.000) 16.752 8.479 ( 9.659 9.659 0.000) 13.660 8.483 ( -5.647 -5.647 0.000) 7.986 8.498 ( -1.655 -1.655 0.000) 2.340 8.925 ( -3.035 -3.035 0.000) 4.292 9.184 ( 5.321 5.321 0.000) 7.524 9.229 ( 2.865 2.865 0.000) 4.052 9.360 ( -1.727 -1.727 0.000) 2.442 9.393 ( -0.777 -0.777 0.000) 1.099 10.193 ( 4.018 4.018 0.000) 5.682 10.239 ( 1.415 1.415 0.000) 2.002 10.959 ( 1.507 1.507 0.000) 2.132 11.362 ( 3.587 3.587 0.000) 5.073 11.593 ( -3.523 -3.523 0.000) 4.983 11.604 ( -15.360 -15.360 0.000) 21.723 11.652 ( -6.181 -6.181 0.000) 8.741 11.756 ( 0.388 0.388 0.000) 0.549 12.035 ( 3.771 3.771 0.000) 5.332 12.209 ( 5.813 5.813 0.000) 8.221 12.248 ( 2.678 2.678 0.000) 3.787 12.250 ( 1.486 1.486 0.000) 2.102 12.689 ( -7.528 -7.528 0.000) 10.647 12.789 ( -0.357 -0.357 0.000) 0.505 13.211 ( -5.690 -5.690 0.000) 8.046 13.569 ( -5.009 -5.009 0.000) 7.084 13.844 ( -7.093 -7.093 0.000) 10.031 13.864 ( 2.453 2.453 0.000) 3.469 13.910 ( 4.640 4.640 0.000) 6.562 14.064 ( -7.160 -7.160 0.000) 10.126 14.239 ( 0.803 0.803 0.000) 1.135 14.903 ( 17.135 17.135 0.000) 24.233 14.939 ( -9.197 -9.197 0.000) 13.006 15.137 ( 0.262 0.262 0.000) 0.371 15.303 ( 6.656 6.656 0.000) 9.413 15.458 ( -6.146 -6.146 0.000) 8.692 15.615 ( -2.570 -2.570 0.000) 3.635 15.747 ( 4.345 4.345 0.000) 6.145 17.015 ( -5.255 -5.255 0.000) 7.432 17.241 ( 3.884 3.884 0.000) 5.493 17.410 ( 6.776 6.776 0.000) 9.583 17.426 ( -8.054 -8.054 0.000) 11.391 17.527 ( 6.758 6.758 0.000) 9.557 17.835 ( 2.138 2.138 0.000) 3.024 19.559 ( -3.131 -3.131 0.000) 4.428 19.562 ( -0.379 -0.379 0.000) 0.537 19.735 ( -1.599 -1.599 0.000) 2.262 20.030 ( 8.053 8.053 0.000) 11.388 20.468 ( -3.674 -3.674 0.000) 5.196 20.662 ( -0.192 -0.192 0.000) 0.271 20.690 ( 4.305 4.305 0.000) 6.089 21.713 ( -4.157 -4.157 0.000) 5.878======================= Grid point 11 (7/90) =======================q-point: ( 0.25 0.12 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 192Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.618 ( 42.604 -4.523 0.000) 42.844 1.932 ( 36.883 17.292 0.000) 40.735 3.217 ( 45.684 35.634 0.000) 57.938 3.949 ( 1.666 -2.566 0.000) 3.059 4.225 ( -24.781 0.743 0.000) 24.792 4.759 ( 2.231 -12.756 0.000) 12.950 5.755 ( 3.469 1.191 0.000) 3.668 5.900 ( -12.495 -12.908 0.000) 17.965 6.250 ( -4.965 -4.147 0.000) 6.469 6.297 ( -15.762 -0.125 0.000) 15.763 6.927 ( -2.573 -2.303 0.000) 3.453 7.037 ( 3.245 2.543 0.000) 4.123 7.202 ( -4.076 3.017 0.000) 5.071 7.465 ( 0.614 -14.441 0.000) 14.454 8.297 ( -9.596 18.728 0.000) 21.043 8.311 ( -8.954 2.194 0.000) 9.219 8.373 ( 6.454 -1.794 0.000) 6.699 8.602 ( 8.461 0.002 0.000) 8.461 8.645 ( 6.571 4.290 0.000) 7.847 8.858 ( -3.537 -2.975 0.000) 4.621 9.307 ( 6.374 0.015 0.000) 6.374 9.330 ( -0.632 -3.614 0.000) 3.669 9.360 ( 8.931 4.076 0.000) 9.817 9.386 ( 1.003 -7.568 0.000) 7.634 10.231 ( -0.817 0.426 0.000) 0.922 10.369 ( 13.358 10.873 0.000) 17.224 11.017 ( 3.484 -2.647 0.000) 4.376 11.237 ( -20.904 -18.456 0.000) 27.885 11.338 ( -6.895 3.590 0.000) 7.774 11.519 ( -7.215 -1.448 0.000) 7.358 11.601 ( 9.205 5.914 0.000) 10.941 11.872 ( 5.850 -1.804 0.000) 6.122 12.122 ( -10.358 0.871 0.000) 10.394 12.135 ( 7.788 1.258 0.000) 7.889 12.298 ( 3.385 3.316 0.000) 4.739 12.327 ( 0.920 -2.881 0.000) 3.024 12.561 ( -5.397 14.013 0.000) 15.016 12.842 ( 4.663 -5.442 0.000) 7.166 13.058 ( -9.425 -5.237 0.000) 10.782 13.490 ( -2.634 -3.073 0.000) 4.047 13.657 ( -11.772 -7.739 0.000) 14.088 13.892 ( 1.870 5.945 0.000) 6.232 13.900 ( -9.622 -7.363 0.000) 12.116 14.051 ( 8.372 2.783 0.000) 8.823 14.230 ( -1.866 3.881 0.000) 4.306 14.732 ( -11.443 -6.125 0.000) 12.979 14.989 ( -1.074 11.228 0.000) 11.279 15.246 ( -7.544 3.659 0.000) 8.385 15.402 ( 19.642 -4.046 0.000) 20.054 15.556 ( 9.502 -5.708 0.000) 11.085 15.592 ( 0.308 -2.762 0.000) 2.779 15.812 ( 3.810 4.319 0.000) 5.760 16.906 ( -5.992 -7.182 0.000) 9.354 17.219 ( -12.794 -9.174 0.000) 15.743 17.342 ( 6.316 2.023 0.000) 6.632 17.549 ( 6.311 7.011 0.000) 9.434 17.662 ( 6.693 0.860 0.000) 6.748 17.867 ( 1.206 3.713 0.000) 3.904 19.507 ( -1.250 -0.537 0.000) 1.360 19.591 ( 2.170 -4.458 0.000) 4.958 19.761 ( 3.817 -3.455 0.000) 5.149 20.166 ( 5.993 10.323 0.000) 11.936 20.368 ( -6.572 -3.220 0.000) 7.318 20.599 ( -5.595 6.326 0.000) 8.445 20.814 ( 8.416 2.380 0.000) 8.746 21.598 ( -7.667 -3.293 0.000) 8.344======================= Grid point 12 (8/90) =======================q-point: ( 0.38 0.12 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 192Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.408 ( 37.836 -6.945 0.000) 38.468 2.611 ( 32.196 8.592 0.000) 33.323 3.563 ( -7.103 11.439 0.000) 13.465 3.721 ( -26.734 3.464 0.000) 26.957 4.352 ( 34.700 5.052 0.000) 35.066 4.814 ( 3.097 -10.965 0.000) 11.393 5.634 ( -12.558 -16.302 0.000) 20.579 5.791 ( -2.484 1.247 0.000) 2.779 6.062 ( -7.589 0.563 0.000) 7.610 6.069 ( -11.521 -15.619 0.000) 19.409 6.899 ( -0.249 -2.260 0.000) 2.274 7.019 ( -8.317 -8.213 0.000) 11.689 7.199 ( 13.562 14.101 0.000) 19.565 7.643 ( 12.031 4.912 0.000) 12.995 7.996 ( -21.044 24.214 0.000) 32.080 8.101 ( -11.520 5.543 0.000) 12.784 8.512 ( 6.849 -7.006 0.000) 9.798 8.688 ( -0.217 -5.235 0.000) 5.239 8.736 ( 3.176 -0.259 0.000) 3.187 8.805 ( -1.614 -2.484 0.000) 2.962 9.355 ( 2.977 -1.282 0.000) 3.242 9.400 ( 2.825 -1.002 0.000) 2.997 9.458 ( 6.041 -10.285 0.000) 11.928 9.512 ( 5.742 4.507 0.000) 7.300 10.244 ( 3.543 -6.203 0.000) 7.143 10.690 ( 19.070 16.232 0.000) 25.043 10.787 ( -21.826 -22.159 0.000) 31.102 11.116 ( 3.133 -1.218 0.000) 3.361 11.228 ( -3.847 4.075 0.000) 5.604 11.358 ( -10.674 4.925 0.000) 11.756 11.830 ( 12.782 5.719 0.000) 14.003 11.925 ( 0.438 2.334 0.000) 2.375 11.933 ( -6.850 3.750 0.000) 7.809 12.275 ( -6.203 1.707 0.000) 6.434 12.283 ( 4.191 2.117 0.000) 4.695 12.402 ( 10.240 0.360 0.000) 10.246 12.448 ( -6.521 17.296 0.000) 18.484 12.840 ( -9.288 -6.287 0.000) 11.216 12.995 ( 7.440 -6.076 0.000) 9.606 13.414 ( -12.802 -8.255 0.000) 15.233 13.477 ( 1.517 -5.145 0.000) 5.364 13.711 ( -9.498 -7.132 0.000) 11.878 13.948 ( 4.122 6.068 0.000) 7.336 14.163 ( -5.081 5.811 0.000) 7.719 14.214 ( 8.324 2.511 0.000) 8.694 14.528 ( -9.347 -3.327 0.000) 9.921 14.984 ( 0.855 4.453 0.000) 4.535 15.114 ( -5.796 2.096 0.000) 6.163 15.585 ( 1.467 -3.902 0.000) 4.169 15.645 ( 0.003 -1.187 0.000) 1.187 15.788 ( 16.637 -1.540 0.000) 16.708 15.949 ( 8.723 -0.100 0.000) 8.723 16.790 ( -5.274 -10.261 0.000) 11.536 16.962 ( -12.999 -10.529 0.000) 16.729 17.469 ( 6.428 0.308 0.000) 6.435 17.615 ( 0.362 2.849 0.000) 2.872 17.780 ( 5.343 1.020 0.000) 5.439 17.879 ( -0.108 3.671 0.000) 3.673 19.522 ( 2.500 -1.198 0.000) 2.773 19.614 ( -0.176 -4.938 0.000) 4.941 19.873 ( 7.658 -2.803 0.000) 8.155 20.220 ( -8.631 -2.824 0.000) 9.081 20.266 ( 4.650 11.492 0.000) 12.397 20.475 ( -6.655 10.111 0.000) 12.104 21.002 ( 10.768 0.809 0.000) 10.799 21.424 ( -10.114 -1.998 0.000) 10.309======================= Grid point 13 (9/90) =======================q-point: (-0.50 0.12 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 120Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.984 ( -10.994 -5.173 0.000) 12.150 2.984 ( 10.994 -5.173 0.000) 12.150 3.339 ( -3.057 11.306 0.000) 11.712 3.339 ( 3.057 11.306 0.000) 11.712 4.811 ( -8.332 -4.394 0.000) 9.420 4.811 ( 8.332 -4.394 0.000) 9.420 5.587 ( -10.633 -12.689 0.000) 16.555 5.587 ( 10.633 -12.689 0.000) 16.555 5.984 ( -1.224 -7.058 0.000) 7.163 5.984 ( 1.224 -7.058 0.000) 7.163 6.920 ( -2.622 -3.708 0.000) 4.541 6.920 ( 2.622 -3.708 0.000) 4.541 7.554 ( -22.489 23.970 0.000) 32.868 7.554 ( 22.489 23.970 0.000) 32.868 7.875 ( -11.913 6.697 0.000) 13.666 7.875 ( 11.913 6.697 0.000) 13.666 8.628 ( -4.995 -7.982 0.000) 9.416 8.628 ( 4.995 -7.982 0.000) 9.416 8.779 ( -1.535 -2.913 0.000) 3.292 8.779 ( 1.535 -2.913 0.000) 3.292 9.409 ( -1.709 -0.051 0.000) 1.710 9.409 ( 1.709 -0.051 0.000) 1.710 9.553 ( -1.954 -2.258 0.000) 2.987 9.553 ( 1.954 -2.258 0.000) 2.987 10.417 ( -14.930 -16.833 0.000) 22.500 10.417 ( 14.930 -16.833 0.000) 22.500 11.056 ( -16.862 11.672 0.000) 20.508 11.056 ( 16.862 11.672 0.000) 20.508 11.182 ( -0.662 3.587 0.000) 3.647 11.182 ( 0.662 3.587 0.000) 3.647 11.891 ( -1.229 2.232 0.000) 2.548 11.891 ( 1.229 2.232 0.000) 2.548 12.091 ( -12.167 8.476 0.000) 14.828 12.091 ( 12.167 8.476 0.000) 14.828 12.344 ( -3.820 6.850 0.000) 7.844 12.344 ( 3.820 6.850 0.000) 7.844 12.632 ( -11.913 -2.380 0.000) 12.148 12.632 ( 11.913 -2.380 0.000) 12.148 13.181 ( -11.141 -7.944 0.000) 13.683 13.181 ( 11.141 -7.944 0.000) 13.683 13.554 ( -6.346 -6.758 0.000) 9.271 13.554 ( 6.346 -6.758 0.000) 9.271 14.049 ( -6.078 6.074 0.000) 8.593 14.049 ( 6.078 6.074 0.000) 8.593 14.368 ( -7.737 0.127 0.000) 7.738 14.368 ( 7.737 0.127 0.000) 7.738 15.025 ( -3.408 2.420 0.000) 4.180 15.025 ( 3.408 2.420 0.000) 4.180 15.617 ( -1.969 -1.367 0.000) 2.397 15.617 ( 1.969 -1.367 0.000) 2.397 16.013 ( -4.560 -1.600 0.000) 4.832 16.013 ( 4.560 -1.600 0.000) 4.832 16.770 ( -5.001 -11.778 0.000) 12.796 16.770 ( 5.001 -11.778 0.000) 12.796 17.574 ( -4.156 0.087 0.000) 4.156 17.574 ( 4.156 0.087 0.000) 4.156 17.856 ( -2.457 2.717 0.000) 3.663 17.856 ( 2.457 2.717 0.000) 3.663 19.581 ( -2.949 -3.353 0.000) 4.465 19.581 ( 2.949 -3.353 0.000) 4.465 20.043 ( -9.464 -2.517 0.000) 9.794 20.043 ( 9.464 -2.517 0.000) 9.794 20.359 ( -5.264 11.643 0.000) 12.778 20.359 ( 5.264 11.643 0.000) 12.778 21.217 ( -11.203 -0.571 0.000) 11.218 21.217 ( 11.203 -0.571 0.000) 11.218======================= Grid point 20 (10/90) =======================q-point: ( 0.25 0.25 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 126Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.804 ( 23.047 23.047 0.000) 32.593 2.358 ( 25.173 25.173 0.000) 35.601 3.873 ( -3.274 -3.274 0.000) 4.630 3.923 ( 32.700 32.700 0.000) 46.245 4.172 ( -10.359 -10.359 0.000) 14.649 4.514 ( -7.501 -7.501 0.000) 10.608 5.605 ( -17.503 -17.503 0.000) 24.752 5.792 ( 2.499 2.499 0.000) 3.534 6.060 ( -16.469 -16.469 0.000) 23.290 6.187 ( -9.504 -9.504 0.000) 13.441 6.889 ( -1.453 -1.453 0.000) 2.055 7.052 ( -9.835 -9.835 0.000) 13.909 7.198 ( 14.628 14.628 0.000) 20.687 7.526 ( 11.932 11.932 0.000) 16.874 8.330 ( -1.572 -1.572 0.000) 2.224 8.358 ( -0.775 -0.775 0.000) 1.097 8.514 ( 1.693 1.693 0.000) 2.394 8.643 ( 3.521 3.521 0.000) 4.980 8.659 ( 0.238 0.238 0.000) 0.337 8.800 ( -2.501 -2.501 0.000) 3.536 9.237 ( -4.233 -4.233 0.000) 5.987 9.281 ( -1.388 -1.388 0.000) 1.963 9.301 ( 0.284 0.284 0.000) 0.401 9.545 ( 11.484 11.484 0.000) 16.241 10.190 ( -3.875 -3.875 0.000) 5.480 10.661 ( 17.755 17.755 0.000) 25.109 10.773 ( -22.310 -22.310 0.000) 31.551 11.043 ( 0.208 0.208 0.000) 0.294 11.379 ( -2.091 -2.091 0.000) 2.957 11.488 ( -1.724 -1.724 0.000) 2.438 11.683 ( 7.346 7.346 0.000) 10.389 11.943 ( 4.979 4.979 0.000) 7.041 12.139 ( -2.649 -2.649 0.000) 3.747 12.228 ( 10.009 10.009 0.000) 14.155 12.275 ( -0.787 -0.787 0.000) 1.113 12.345 ( 1.584 1.584 0.000) 2.240 12.754 ( 5.782 5.782 0.000) 8.177 12.761 ( -2.352 -2.352 0.000) 3.326 12.927 ( -7.730 -7.730 0.000) 10.932 13.435 ( -2.658 -2.658 0.000) 3.759 13.456 ( -12.466 -12.466 0.000) 17.629 13.730 ( -9.831 -9.831 0.000) 13.903 13.995 ( 4.105 4.105 0.000) 5.806 14.154 ( 7.856 7.856 0.000) 11.110 14.294 ( 2.288 2.288 0.000) 3.236 14.583 ( -8.640 -8.640 0.000) 12.219 15.149 ( 0.359 0.359 0.000) 0.507 15.244 ( -4.227 -4.227 0.000) 5.978 15.350 ( 3.964 3.964 0.000) 5.606 15.558 ( 5.656 5.656 0.000) 7.999 15.603 ( 4.027 4.027 0.000) 5.695 15.872 ( 2.486 2.486 0.000) 3.516 16.725 ( -11.083 -11.083 0.000) 15.673 16.983 ( -14.465 -14.465 0.000) 20.456 17.402 ( 4.037 4.037 0.000) 5.709 17.662 ( 0.126 0.126 0.000) 0.179 17.710 ( 7.638 7.638 0.000) 10.802 17.930 ( 2.365 2.365 0.000) 3.344 19.495 ( -0.301 -0.301 0.000) 0.426 19.547 ( -0.326 -0.326 0.000) 0.461 19.761 ( 3.304 3.304 0.000) 4.672 20.284 ( -5.393 -5.393 0.000) 7.626 20.350 ( 8.108 8.108 0.000) 11.466 20.666 ( 0.507 0.507 0.000) 0.717 20.892 ( 5.829 5.829 0.000) 8.243 21.507 ( -5.989 -5.989 0.000) 8.470======================= Grid point 21 (11/90) =======================q-point: ( 0.38 0.25 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 192Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.384 ( 33.574 6.175 0.000) 34.137 2.830 ( 21.446 13.156 0.000) 25.160 3.733 ( -9.626 5.045 0.000) 10.868 3.813 ( -22.580 5.743 0.000) 23.299 4.494 ( 23.325 9.058 0.000) 25.022 4.527 ( 6.051 -17.794 0.000) 18.795 5.265 ( -15.179 -21.432 0.000) 26.263 5.652 ( -23.491 -22.600 0.000) 32.598 5.848 ( 2.841 1.877 0.000) 3.405 6.013 ( -7.402 -4.098 0.000) 8.460 6.876 ( 0.167 -0.718 0.000) 0.737 6.935 ( -3.292 -1.810 0.000) 3.757 7.575 ( 23.128 24.131 0.000) 33.425 7.758 ( 11.301 5.996 0.000) 12.793 8.196 ( -9.343 1.896 0.000) 9.534 8.398 ( 3.694 -3.722 0.000) 5.244 8.430 ( -10.795 17.428 0.000) 20.500 8.609 ( -5.731 -2.273 0.000) 6.166 8.688 ( 1.693 -2.522 0.000) 3.037 8.750 ( -3.019 -1.153 0.000) 3.232 9.193 ( 1.329 -10.398 0.000) 10.483 9.307 ( -0.257 -6.766 0.000) 6.771 9.401 ( 11.414 1.353 0.000) 11.494 9.697 ( 2.582 10.974 0.000) 11.273 10.120 ( -2.450 -6.929 0.000) 7.349 10.368 ( -17.980 -19.896 0.000) 26.816 10.994 ( 15.095 13.574 0.000) 20.301 11.086 ( 3.427 -1.722 0.000) 3.835 11.307 ( -2.995 3.448 0.000) 4.567 11.446 ( -3.147 4.255 0.000) 5.293 11.891 ( 10.502 4.373 0.000) 11.376 11.995 ( 3.095 1.642 0.000) 3.503 12.035 ( -5.957 5.542 0.000) 8.137 12.265 ( -1.923 -1.102 0.000) 2.216 12.369 ( 1.908 0.904 0.000) 2.112 12.498 ( 15.349 15.537 0.000) 21.840 12.657 ( -10.833 -5.909 0.000) 12.340 12.813 ( 1.893 9.289 0.000) 9.480 12.862 ( 2.102 -5.455 0.000) 5.846 13.205 ( -12.849 -12.725 0.000) 18.084 13.384 ( -2.234 -3.654 0.000) 4.282 13.538 ( -9.547 -10.331 0.000) 14.067 14.070 ( 4.336 5.399 0.000) 6.925 14.290 ( -3.845 6.739 0.000) 7.759 14.307 ( 6.825 7.925 0.000) 10.458 14.443 ( -4.356 -4.933 0.000) 6.581 15.086 ( -2.858 5.585 0.000) 6.274 15.149 ( -4.722 0.886 0.000) 4.805 15.490 ( 7.083 -5.738 0.000) 9.116 15.647 ( 1.101 1.937 0.000) 2.228 15.750 ( 10.802 -1.757 0.000) 10.944 15.946 ( 5.310 -0.005 0.000) 5.310 16.507 ( -10.119 -18.577 0.000) 21.154 16.692 ( -14.925 -16.241 0.000) 22.057 17.488 ( 4.663 1.760 0.000) 4.984 17.636 ( -2.416 -0.529 0.000) 2.473 17.846 ( 5.805 5.140 0.000) 7.754 17.953 ( 0.008 3.370 0.000) 3.370 19.506 ( 1.388 -0.164 0.000) 1.397 19.550 ( 0.005 -1.515 0.000) 1.515 19.867 ( 7.082 1.802 0.000) 7.308 20.163 ( -7.098 -3.264 0.000) 7.813 20.475 ( 5.192 9.419 0.000) 10.756 20.635 ( -3.123 5.861 0.000) 6.641 21.034 ( 8.555 2.670 0.000) 8.962 21.371 ( -7.960 -3.378 0.000) 8.648======================= Grid point 22 (12/90) =======================q-point: (-0.50 0.25 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 126Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.946 ( -17.713 1.403 0.000) 17.769 2.946 ( 17.713 1.403 0.000) 17.769 3.553 ( -3.536 10.510 0.000) 11.089 3.553 ( 3.536 10.510 0.000) 11.089 4.673 ( -5.684 -10.194 0.000) 11.672 4.673 ( 5.684 -10.194 0.000) 11.672 5.240 ( -15.534 -20.333 0.000) 25.588 5.240 ( 15.534 -20.333 0.000) 25.588 5.909 ( -3.789 -0.695 0.000) 3.852 5.909 ( 3.789 -0.695 0.000) 3.852 6.893 ( -1.489 -0.486 0.000) 1.567 6.893 ( 1.489 -0.486 0.000) 1.567 7.927 ( -0.786 7.606 0.000) 7.647 7.927 ( 0.786 7.606 0.000) 7.647 8.119 ( -13.938 22.598 0.000) 26.550 8.119 ( 13.938 22.598 0.000) 26.550 8.491 ( -5.825 -4.692 0.000) 7.480 8.491 ( 5.825 -4.692 0.000) 7.480 8.710 ( -1.055 -2.588 0.000) 2.795 8.710 ( 1.055 -2.588 0.000) 2.795 9.267 ( -4.112 -11.886 0.000) 12.578 9.267 ( 4.112 -11.886 0.000) 12.578 9.622 ( -9.564 6.412 0.000) 11.515 9.622 ( 9.564 6.412 0.000) 11.515 10.137 ( -5.519 -12.182 0.000) 13.374 10.137 ( 5.519 -12.182 0.000) 13.374 11.140 ( -0.576 -0.774 0.000) 0.965 11.140 ( 0.576 -0.774 0.000) 0.965 11.345 ( -6.723 10.598 0.000) 12.550 11.345 ( 6.723 10.598 0.000) 12.550 11.959 ( -1.627 4.556 0.000) 4.838 11.959 ( 1.627 4.556 0.000) 4.838 12.167 ( -9.004 1.779 0.000) 9.178 12.167 ( 9.004 1.779 0.000) 9.178 12.452 ( -7.913 -1.869 0.000) 8.131 12.452 ( 7.913 -1.869 0.000) 8.131 12.749 ( -9.089 17.263 0.000) 19.509 12.749 ( 9.089 17.263 0.000) 19.509 12.984 ( -9.582 -11.633 0.000) 15.071 12.984 ( 9.582 -11.633 0.000) 15.071 13.395 ( -4.339 -9.095 0.000) 10.077 13.395 ( 4.339 -9.095 0.000) 10.077 14.174 ( -6.416 5.314 0.000) 8.331 14.174 ( 6.416 5.314 0.000) 8.331 14.395 ( -2.513 4.174 0.000) 4.872 14.395 ( 2.513 4.174 0.000) 4.872 15.080 ( -2.035 2.899 0.000) 3.542 15.080 ( 2.035 2.899 0.000) 3.542 15.603 ( -4.640 0.190 0.000) 4.644 15.603 ( 4.640 0.190 0.000) 4.644 15.954 ( -7.364 -4.989 0.000) 8.895 15.954 ( 7.364 -4.989 0.000) 8.895 16.456 ( -7.109 -19.401 0.000) 20.662 16.456 ( 7.109 -19.401 0.000) 20.662 17.573 ( -3.965 0.039 0.000) 3.965 17.573 ( 3.965 0.039 0.000) 3.965 17.928 ( -2.677 4.052 0.000) 4.857 17.928 ( 2.677 4.052 0.000) 4.857 19.536 ( -1.400 -1.009 0.000) 1.725 19.536 ( 1.400 -1.009 0.000) 1.725 20.016 ( -7.997 -0.618 0.000) 8.021 20.016 ( 7.997 -0.618 0.000) 8.021 20.563 ( -4.140 8.770 0.000) 9.698 20.563 ( 4.140 8.770 0.000) 9.698 21.206 ( -9.004 -0.363 0.000) 9.012 21.206 ( 9.004 -0.363 0.000) 9.012======================= Grid point 30 (13/90) =======================q-point: ( 0.38 0.38 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 120Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.648 ( 19.768 19.768 0.000) 27.956 3.063 ( 8.781 8.781 0.000) 12.418 3.756 ( -1.961 -1.961 0.000) 2.773 3.871 ( -5.055 -5.055 0.000) 7.149 4.248 ( -3.618 -3.618 0.000) 5.116 4.673 ( 8.188 8.188 0.000) 11.580 4.842 ( -20.344 -20.344 0.000) 28.771 5.227 ( -19.763 -19.763 0.000) 27.949 5.898 ( 2.416 2.416 0.000) 3.417 5.951 ( -1.888 -1.888 0.000) 2.669 6.867 ( -0.016 -0.016 0.000) 0.022 6.908 ( -1.466 -1.466 0.000) 2.073 7.852 ( 4.015 4.015 0.000) 5.678 8.006 ( 8.358 8.358 0.000) 11.821 8.194 ( 10.863 10.863 0.000) 15.363 8.405 ( 2.888 2.888 0.000) 4.084 8.566 ( -3.557 -3.557 0.000) 5.031 8.586 ( 2.044 2.044 0.000) 2.891 8.681 ( 1.241 1.241 0.000) 1.755 8.796 ( 2.212 2.212 0.000) 3.128 9.064 ( -4.469 -4.469 0.000) 6.319 9.167 ( -7.368 -7.368 0.000) 10.420 9.486 ( 9.233 9.233 0.000) 13.057 9.832 ( 1.104 1.104 0.000) 1.562 9.992 ( -5.525 -5.525 0.000) 7.814 10.056 ( -11.690 -11.690 0.000) 16.533 11.068 ( 0.362 0.362 0.000) 0.512 11.130 ( 0.497 0.497 0.000) 0.703 11.406 ( 7.158 7.158 0.000) 10.124 11.510 ( 1.925 1.925 0.000) 2.722 12.005 ( 1.243 1.243 0.000) 1.758 12.045 ( 9.998 9.998 0.000) 14.139 12.099 ( -0.063 -0.063 0.000) 0.089 12.257 ( 0.712 0.712 0.000) 1.007 12.366 ( -0.068 -0.068 0.000) 0.096 12.511 ( -7.534 -7.534 0.000) 10.654 12.748 ( -3.445 -3.445 0.000) 4.871 12.858 ( 18.129 18.129 0.000) 25.638 12.955 ( -12.271 -12.271 0.000) 17.354 12.965 ( 4.731 4.731 0.000) 6.691 13.333 ( -10.176 -10.176 0.000) 14.391 13.339 ( -2.444 -2.444 0.000) 3.457 14.147 ( 3.208 3.208 0.000) 4.537 14.311 ( -5.084 -5.084 0.000) 7.189 14.455 ( 6.915 6.915 0.000) 9.779 14.498 ( 9.419 9.419 0.000) 13.320 15.143 ( -1.108 -1.108 0.000) 1.567 15.162 ( 0.254 0.254 0.000) 0.360 15.418 ( 2.116 2.116 0.000) 2.993 15.701 ( 1.827 1.827 0.000) 2.584 15.743 ( 1.140 1.140 0.000) 1.613 15.965 ( 2.249 2.249 0.000) 3.181 16.114 ( -19.893 -19.893 0.000) 28.132 16.380 ( -15.304 -15.304 0.000) 21.644 17.532 ( 2.513 2.513 0.000) 3.553 17.614 ( -1.517 -1.517 0.000) 2.145 17.939 ( 3.943 3.943 0.000) 5.576 17.996 ( 1.012 1.012 0.000) 1.431 19.516 ( 1.008 1.008 0.000) 1.425 19.541 ( -0.036 -0.036 0.000) 0.050 19.927 ( 4.043 4.043 0.000) 5.717 20.093 ( -3.997 -3.997 0.000) 5.652 20.615 ( 5.179 5.179 0.000) 7.324 20.698 ( 0.938 0.938 0.000) 1.327 21.107 ( 4.753 4.753 0.000) 6.722 21.297 ( -4.346 -4.346 0.000) 6.147======================= Grid point 31 (14/90) =======================q-point: (-0.50 0.38 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 120Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.029 ( -14.690 6.276 0.000) 15.975 3.029 ( 14.690 6.276 0.000) 15.975 3.723 ( -1.983 6.292 0.000) 6.597 3.723 ( 1.983 6.292 0.000) 6.597 4.434 ( -17.310 -12.708 0.000) 21.474 4.434 ( 17.310 -12.708 0.000) 21.474 4.910 ( -13.342 -12.456 0.000) 18.252 4.910 ( 13.342 -12.456 0.000) 18.252 5.929 ( -0.970 1.954 0.000) 2.181 5.929 ( 0.970 1.954 0.000) 2.181 6.880 ( -1.244 -0.858 0.000) 1.511 6.880 ( 1.244 -0.858 0.000) 1.511 7.938 ( -5.405 -3.175 0.000) 6.268 7.938 ( 5.405 -3.175 0.000) 6.268 8.478 ( -4.672 2.265 0.000) 5.192 8.478 ( 4.672 2.265 0.000) 5.192 8.544 ( -11.183 15.031 0.000) 18.735 8.544 ( 11.183 15.031 0.000) 18.735 8.731 ( -5.950 7.096 0.000) 9.261 8.731 ( 5.950 7.096 0.000) 9.261 9.044 ( -4.304 -9.836 0.000) 10.736 9.044 ( 4.304 -9.836 0.000) 10.736 9.714 ( -11.508 2.220 0.000) 11.720 9.714 ( 11.508 2.220 0.000) 11.720 9.942 ( -0.966 -7.957 0.000) 8.015 9.942 ( 0.966 -7.957 0.000) 8.015 11.099 ( -2.345 -2.437 0.000) 3.382 11.099 ( 2.345 -2.437 0.000) 3.382 11.508 ( -2.507 5.427 0.000) 5.978 11.508 ( 2.507 5.427 0.000) 5.978 12.049 ( -3.478 4.407 0.000) 5.614 12.049 ( 3.478 4.407 0.000) 5.614 12.230 ( -6.358 4.820 0.000) 7.979 12.230 ( 6.358 4.820 0.000) 7.979 12.390 ( -3.604 -2.858 0.000) 4.600 12.390 ( 3.604 -2.858 0.000) 4.600 12.765 ( -6.032 -10.212 0.000) 11.860 12.765 ( 6.032 -10.212 0.000) 11.860 13.054 ( -2.195 9.166 0.000) 9.425 13.054 ( 2.195 9.166 0.000) 9.425 13.247 ( -5.032 -3.532 0.000) 6.148 13.247 ( 5.032 -3.532 0.000) 6.148 14.216 ( -4.299 -0.038 0.000) 4.299 14.216 ( 4.299 -0.038 0.000) 4.299 14.569 ( -2.785 12.520 0.000) 12.826 14.569 ( 2.785 12.520 0.000) 12.826 15.130 ( -0.640 2.353 0.000) 2.439 15.130 ( 0.640 2.353 0.000) 2.439 15.608 ( -13.063 -1.988 0.000) 13.214 15.608 ( 13.063 -1.988 0.000) 13.214 15.800 ( -6.262 -9.883 0.000) 11.700 15.800 ( 6.262 -9.883 0.000) 11.700 16.124 ( -10.863 -12.016 0.000) 16.198 16.124 ( 10.863 -12.016 0.000) 16.198 17.578 ( -2.212 0.373 0.000) 2.243 17.578 ( 2.212 0.373 0.000) 2.243 17.991 ( -1.473 2.291 0.000) 2.724 17.991 ( 1.473 2.291 0.000) 2.724 19.535 ( -0.698 0.442 0.000) 0.826 19.535 ( 0.698 0.442 0.000) 0.826 20.011 ( -4.467 -0.038 0.000) 4.467 20.011 ( 4.467 -0.038 0.000) 4.467 20.684 ( -2.150 3.851 0.000) 4.411 20.684 ( 2.150 3.851 0.000) 4.411 21.205 ( -5.105 0.175 0.000) 5.108 21.205 ( 5.105 0.175 0.000) 5.108======================= Grid point 44 (15/90) =======================q-point: (-0.50 -0.50 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 54Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.112 ( -0.000 -0.000 0.000) 0.000 3.112 ( 0.000 0.000 0.000) 0.000 3.777 ( -0.000 -0.000 0.000) 0.000 3.777 ( 0.000 0.000 0.000) 0.000 4.294 ( -0.000 -0.000 0.000) 0.000 4.294 ( 0.000 0.000 0.000) 0.000 4.786 ( 0.000 0.000 0.000) 0.000 4.786 ( 0.000 0.000 0.000) 0.000 5.953 ( 0.000 0.000 0.000) 0.000 5.953 ( 0.000 0.000 0.000) 0.000 6.869 ( 0.000 0.000 0.000) 0.000 6.869 ( 0.000 0.000 0.000) 0.000 7.896 ( 0.000 0.000 0.000) 0.000 7.896 ( 0.000 0.000 0.000) 0.000 8.509 ( 0.000 0.000 0.000) 0.000 8.509 ( 0.000 0.000 0.000) 0.000 8.647 ( 0.000 0.000 0.000) 0.000 8.647 ( 0.000 0.000 0.000) 0.000 8.889 ( -0.000 -0.000 0.000) 0.000 8.889 ( 0.000 0.000 0.000) 0.000 8.932 ( -0.000 -0.000 0.000) 0.000 8.932 ( -0.000 -0.000 0.000) 0.000 9.717 ( 0.000 0.000 0.000) 0.000 9.717 ( 0.000 0.000 0.000) 0.000 9.860 ( 0.000 0.000 0.000) 0.000 9.860 ( 0.000 0.000 0.000) 0.000 11.073 ( 0.000 0.000 0.000) 0.000 11.073 ( 0.000 0.000 0.000) 0.000 11.555 ( 0.000 0.000 0.000) 0.000 11.555 ( 0.000 0.000 0.000) 0.000 12.102 ( 0.000 0.000 0.000) 0.000 12.102 ( 0.000 0.000 0.000) 0.000 12.297 ( 0.000 0.000 0.000) 0.000 12.297 ( 0.000 0.000 0.000) 0.000 12.362 ( 0.000 0.000 0.000) 0.000 12.362 ( 0.000 0.000 0.000) 0.000 12.646 ( -0.000 -0.000 0.000) 0.000 12.646 ( 0.000 0.000 0.000) 0.000 13.078 ( 0.000 0.000 0.000) 0.000 13.078 ( 0.000 0.000 0.000) 0.000 13.271 ( -0.000 -0.000 0.000) 0.000 13.271 ( 0.000 0.000 0.000) 0.000 14.211 ( 0.000 0.000 0.000) 0.000 14.211 ( 0.000 0.000 0.000) 0.000 14.738 ( 0.000 0.000 0.000) 0.000 14.738 ( 0.000 0.000 0.000) 0.000 15.167 ( 0.000 0.000 0.000) 0.000 15.167 ( 0.000 0.000 0.000) 0.000 15.493 ( -0.000 -0.000 0.000) 0.000 15.493 ( 0.000 0.000 0.000) 0.000 15.730 ( 0.000 0.000 0.000) 0.000 15.730 ( 0.000 0.000 0.000) 0.000 16.015 ( 0.000 0.000 0.000) 0.000 16.015 ( 0.000 0.000 0.000) 0.000 17.583 ( 0.000 0.000 0.000) 0.000 17.583 ( 0.000 0.000 0.000) 0.000 18.013 ( 0.000 0.000 0.000) 0.000 18.013 ( 0.000 0.000 0.000) 0.000 19.541 ( 0.000 0.000 0.000) 0.000 19.541 ( 0.000 0.000 0.000) 0.000 20.011 ( 0.000 0.000 0.000) 0.000 20.011 ( 0.000 0.000 0.000) 0.000 20.719 ( 0.000 0.000 0.000) 0.000 20.719 ( 0.000 0.000 0.000) 0.000 21.208 ( 0.000 0.000 0.000) 0.000 21.208 ( 0.000 0.000 0.000) 0.000======================= Grid point 81 (16/90) =======================q-point: ( 0.00 0.00 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.904 ( 0.000 0.000 45.279) 45.279 0.904 ( 0.000 0.000 45.279) 45.279 1.482 ( 0.000 0.000 71.677) 71.677 3.993 ( -0.000 0.000 -2.101) 2.101 4.826 ( 0.000 0.000 -2.900) 2.900 4.826 ( -0.000 0.000 -2.900) 2.900 5.786 ( -0.000 0.000 1.215) 1.215 6.261 ( 0.000 0.000 4.081) 4.081 6.261 ( 0.000 0.000 4.081) 4.081 6.403 ( 0.000 0.000 14.866) 14.866 6.837 ( -0.000 0.000 -4.467) 4.467 7.089 ( 0.000 0.000 0.742) 0.742 7.089 ( 0.000 0.000 0.742) 0.742 7.920 ( 0.000 0.000 -5.456) 5.456 7.920 ( -0.000 0.000 -5.456) 5.456 8.004 ( 0.000 0.000 -16.303) 16.303 8.055 ( -0.000 -0.000 10.356) 10.356 8.763 ( 0.000 0.000 8.381) 8.381 8.893 ( -0.000 0.000 21.089) 21.089 9.040 ( 0.000 0.000 3.215) 3.215 9.040 ( 0.000 0.000 3.215) 3.215 9.494 ( -0.000 0.000 10.945) 10.945 9.494 ( 0.000 0.000 10.945) 10.945 9.596 ( -0.000 0.000 13.330) 13.330 10.217 ( 0.000 0.000 3.778) 3.778 10.217 ( 0.000 0.000 3.778) 3.778 10.825 ( 0.000 0.000 -10.527) 10.527 11.202 ( -0.000 0.000 -5.584) 5.584 11.568 ( -0.000 -0.000 -19.680) 19.680 11.568 ( 0.000 0.000 -19.680) 19.680 11.818 ( 0.000 0.000 -6.300) 6.300 11.894 ( -0.000 -0.000 5.495) 5.495 12.083 ( -0.000 -0.000 4.098) 4.098 12.125 ( -0.000 -0.000 5.452) 5.452 12.125 ( 0.000 0.000 5.452) 5.452 12.462 ( -0.000 0.000 12.432) 12.432 12.900 ( -0.000 -0.000 9.980) 9.980 13.028 ( -0.000 0.000 2.248) 2.248 13.288 ( 0.000 0.000 -3.816) 3.816 13.691 ( -0.000 -0.000 -7.904) 7.904 13.691 ( 0.000 0.000 -7.904) 7.904 13.836 ( -0.000 0.000 0.691) 0.691 13.836 ( 0.000 0.000 0.691) 0.691 13.864 ( -0.000 0.000 -9.545) 9.545 14.429 ( 0.000 0.000 16.527) 16.527 14.429 ( 0.000 0.000 16.527) 16.527 14.459 ( -0.000 -0.000 8.927) 8.927 15.184 ( 0.000 0.000 0.545) 0.545 15.500 ( 0.000 0.000 -6.088) 6.088 15.500 ( -0.000 0.000 -6.088) 6.088 15.798 ( 0.000 0.000 7.514) 7.514 15.798 ( -0.000 0.000 7.514) 7.514 17.082 ( -0.000 0.000 -7.284) 7.284 17.122 ( 0.000 0.000 -7.338) 7.338 17.214 ( 0.000 0.000 -5.485) 5.485 17.214 ( 0.000 0.000 -5.485) 5.485 17.533 ( 0.000 0.000 -5.117) 5.117 17.745 ( -0.000 0.000 -4.780) 4.780 19.623 ( 0.000 0.000 -7.904) 7.904 19.754 ( -0.000 0.000 -3.445) 3.445 19.754 ( -0.000 0.000 -3.445) 3.445 20.159 ( -0.000 0.000 -24.417) 24.417 20.612 ( 0.000 0.000 -5.635) 5.635 20.612 ( 0.000 0.000 -5.635) 5.635 20.858 ( 0.000 0.000 11.910) 11.910 21.176 ( 0.000 0.000 0.856) 0.856======================= Grid point 82 (17/90) =======================q-point: ( 0.12 0.00 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.197 ( 29.195 0.000 30.412) 42.158 1.270 ( 31.838 0.000 30.715) 44.239 2.086 ( 50.360 0.000 49.333) 70.497 3.976 ( -1.492 0.000 -2.290) 2.733 4.640 ( -17.846 0.000 -2.130) 17.973 4.854 ( 2.375 0.000 -1.445) 2.780 5.729 ( 0.125 0.000 4.873) 4.874 6.214 ( -4.634 0.000 3.888) 6.049 6.401 ( -1.812 0.000 -10.644) 10.797 6.404 ( -0.317 0.000 12.765) 12.769 6.926 ( 8.298 0.000 -3.971) 9.199 7.060 ( -2.107 0.000 3.846) 4.385 7.091 ( -2.413 0.000 -2.405) 3.407 7.933 ( -1.763 0.000 -4.905) 5.212 8.007 ( 5.542 0.000 -1.709) 5.799 8.043 ( 4.805 0.000 -17.445) 18.095 8.177 ( 13.114 0.000 7.613) 15.163 8.610 ( -11.441 0.000 6.334) 13.077 8.828 ( -4.027 0.000 17.416) 17.876 9.068 ( 2.014 0.000 1.668) 2.615 9.182 ( 9.587 0.000 6.639) 11.661 9.381 ( -12.577 0.000 17.064) 21.198 9.513 ( 1.678 0.000 12.289) 12.403 9.542 ( 4.093 0.000 11.280) 12.000 10.231 ( 0.717 0.000 4.473) 4.530 10.238 ( 2.099 0.000 3.573) 4.144 10.862 ( 3.866 0.000 -9.682) 10.426 11.266 ( 6.496 0.000 -5.899) 8.774 11.468 ( -8.961 0.000 -10.510) 13.811 11.590 ( -0.224 0.000 -16.531) 16.532 11.713 ( -12.136 0.000 1.428) 12.220 11.820 ( -1.242 0.000 -8.422) 8.513 11.902 ( -7.619 0.000 1.639) 7.793 12.261 ( 5.714 0.000 4.783) 7.451 12.278 ( 6.896 0.000 5.124) 8.592 12.373 ( -0.450 0.000 14.481) 14.488 12.836 ( -14.266 0.000 7.469) 16.103 12.922 ( -1.586 0.000 5.992) 6.199 13.229 ( -5.889 0.000 -3.713) 6.961 13.583 ( -6.386 0.000 -3.474) 7.270 13.729 ( 3.429 0.000 -6.195) 7.081 13.858 ( 2.654 0.000 -0.345) 2.677 13.898 ( -1.340 0.000 -3.257) 3.521 14.176 ( -3.837 0.000 2.966) 4.850 14.415 ( -1.503 0.000 15.890) 15.961 14.420 ( 25.465 0.000 -14.726) 29.416 14.916 ( 30.033 0.000 6.533) 30.735 15.045 ( -11.821 0.000 0.018) 11.821 15.376 ( -9.343 0.000 -1.174) 9.417 15.549 ( 3.073 0.000 -4.714) 5.627 15.714 ( -5.640 0.000 7.032) 9.014 15.787 ( -1.204 0.000 6.556) 6.666 17.025 ( -4.990 0.000 -5.174) 7.188 17.132 ( 5.011 0.000 -6.984) 8.596 17.279 ( 6.237 0.000 -5.433) 8.272 17.375 ( 10.008 0.000 -6.958) 12.189 17.490 ( -5.128 0.000 -3.677) 6.310 17.765 ( 1.607 0.000 -4.147) 4.448 19.517 ( -6.929 0.000 -6.053) 9.200 19.762 ( 0.969 0.000 -3.535) 3.665 19.817 ( 1.584 0.000 -4.018) 4.319 20.025 ( -19.390 0.000 17.485) 26.109 20.182 ( 1.760 0.000 -21.625) 21.696 20.568 ( -4.466 0.000 -5.587) 7.153 20.854 ( -0.006 0.000 10.635) 10.635 21.498 ( 7.523 0.000 -16.506) 18.140======================= Grid point 83 (18/90) =======================q-point: ( 0.25 0.00 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 225Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.868 ( 37.364 0.000 13.205) 39.629 1.949 ( 36.167 0.000 17.119) 40.014 3.084 ( 45.612 0.000 25.699) 52.354 3.968 ( 3.761 0.000 -0.442) 3.787 4.209 ( -25.326 0.000 -0.448) 25.330 4.906 ( 2.855 0.000 1.251) 3.117 5.774 ( 2.970 0.000 4.239) 5.176 6.105 ( -5.637 0.000 3.630) 6.704 6.193 ( -15.398 0.000 -3.158) 15.718 6.376 ( -2.863 0.000 8.405) 8.879 7.041 ( 0.470 0.000 9.295) 9.307 7.042 ( -1.088 0.000 0.991) 1.471 7.110 ( 9.613 0.000 -2.069) 9.834 7.789 ( -11.425 0.000 -2.347) 11.663 8.016 ( -6.455 0.000 7.352) 9.783 8.133 ( -0.346 0.000 -14.081) 14.085 8.448 ( -1.593 0.000 1.189) 1.988 8.463 ( 13.988 0.000 4.830) 14.798 8.791 ( 0.015 0.000 9.377) 9.377 9.070 ( -4.016 0.000 12.261) 12.902 9.259 ( 2.716 0.000 -2.711) 3.837 9.344 ( 7.072 0.000 8.702) 11.213 9.551 ( 2.137 0.000 14.717) 14.871 9.634 ( 4.548 0.000 10.954) 11.861 10.260 ( 3.271 0.000 5.271) 6.203 10.307 ( 5.625 0.000 3.023) 6.386 10.957 ( 5.166 0.000 -8.450) 9.905 11.271 ( -9.650 0.000 -4.495) 10.646 11.384 ( -5.474 0.000 -5.277) 7.603 11.492 ( 2.098 0.000 -3.409) 4.003 11.494 ( -10.854 0.000 -2.640) 11.170 11.786 ( -2.531 0.000 -12.684) 12.934 11.902 ( 5.070 0.000 -12.568) 13.552 12.281 ( -4.566 0.000 6.049) 7.579 12.336 ( -7.737 0.000 6.723) 10.250 12.377 ( 3.967 0.000 6.107) 7.283 12.545 ( -7.823 0.000 11.707) 14.081 12.961 ( 4.912 0.000 5.492) 7.368 13.073 ( -9.873 0.000 -4.175) 10.719 13.522 ( -0.841 0.000 -0.908) 1.238 13.785 ( -8.950 0.000 5.191) 10.347 13.800 ( 3.820 0.000 -1.746) 4.200 13.951 ( 6.704 0.000 -2.576) 7.181 14.038 ( -8.100 0.000 4.926) 9.480 14.367 ( -3.470 0.000 13.837) 14.265 14.798 ( -12.820 0.000 0.361) 12.825 14.806 ( 12.454 0.000 -5.293) 13.532 15.187 ( -5.388 0.000 -1.010) 5.482 15.486 ( 22.447 0.000 5.435) 23.096 15.589 ( 1.230 0.000 -2.760) 3.022 15.687 ( 5.679 0.000 -2.070) 6.045 15.751 ( -2.462 0.000 4.423) 5.063 16.941 ( -4.259 0.000 -3.528) 5.531 17.260 ( 7.749 0.000 -6.361) 10.025 17.284 ( -12.757 0.000 -3.717) 13.288 17.419 ( 7.216 0.000 -5.365) 8.992 17.588 ( 8.824 0.000 -5.768) 10.542 17.794 ( 1.301 0.000 -3.070) 3.334 19.434 ( -1.018 0.000 -6.352) 6.433 19.746 ( -3.867 0.000 4.334) 5.808 19.801 ( 3.297 0.000 -3.813) 5.041 19.962 ( 2.974 0.000 -5.710) 6.438 20.204 ( -0.341 0.000 -16.397) 16.400 20.445 ( -8.191 0.000 -5.436) 9.831 20.882 ( 3.514 0.000 5.955) 6.915 21.499 ( -4.878 0.000 -11.506) 12.497======================= Grid point 84 (19/90) =======================q-point: ( 0.38 0.00 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.567 ( 33.977 0.000 5.048) 34.350 2.612 ( 32.133 0.000 9.463) 33.497 3.452 ( -5.955 0.000 2.838) 6.596 3.704 ( -26.538 0.000 1.727) 26.594 4.358 ( 31.450 0.000 4.377) 31.753 4.947 ( -0.071 0.000 1.878) 1.880 5.781 ( -1.488 0.000 6.752) 6.914 5.974 ( -5.659 0.000 8.101) 9.882 6.046 ( 0.447 0.000 3.634) 3.661 6.282 ( -7.051 0.000 5.237) 8.783 7.074 ( 2.873 0.000 11.901) 12.243 7.077 ( 5.619 0.000 4.612) 7.270 7.226 ( 0.041 0.000 4.754) 4.755 7.633 ( -0.608 0.000 -2.721) 2.788 7.730 ( -21.719 0.000 12.514) 25.066 7.985 ( -11.504 0.000 -6.100) 13.021 8.554 ( 8.579 0.000 -6.705) 10.889 8.685 ( 9.239 0.000 5.904) 10.964 8.783 ( -1.944 0.000 -0.023) 1.944 8.954 ( -6.413 0.000 11.965) 13.575 9.427 ( 11.318 0.000 -5.018) 12.380 9.463 ( 5.485 0.000 12.063) 13.252 9.580 ( 0.264 0.000 15.242) 15.245 9.682 ( -0.277 0.000 7.103) 7.109 10.408 ( 13.220 0.000 3.805) 13.756 10.474 ( 11.897 0.000 2.287) 12.115 11.028 ( 1.990 0.000 -8.779) 9.002 11.096 ( -17.624 0.000 0.124) 17.625 11.135 ( -5.103 0.000 -5.213) 7.295 11.219 ( -19.247 0.000 -3.836) 19.625 11.685 ( 11.457 0.000 -5.491) 12.705 11.758 ( 1.976 0.000 -10.133) 10.324 11.968 ( -0.167 0.000 -12.799) 12.800 12.057 ( -10.506 0.000 7.652) 12.997 12.303 ( 0.736 0.000 5.476) 5.525 12.450 ( -4.953 0.000 8.534) 9.867 12.470 ( 6.794 0.000 3.583) 7.681 12.864 ( -11.504 0.000 -4.617) 12.397 13.102 ( 9.087 0.000 3.859) 9.872 13.481 ( -6.705 0.000 -0.746) 6.746 13.649 ( -1.223 0.000 10.264) 10.337 13.875 ( -8.619 0.000 7.813) 11.633 13.887 ( 5.507 0.000 0.958) 5.589 14.066 ( 2.728 0.000 -0.774) 2.836 14.307 ( -0.685 0.000 8.869) 8.895 14.573 ( -10.364 0.000 1.467) 10.468 14.937 ( 3.396 0.000 -0.329) 3.412 15.081 ( -5.177 0.000 -0.815) 5.240 15.610 ( 1.243 0.000 -0.858) 1.510 15.697 ( -2.995 0.000 2.463) 3.877 15.828 ( 14.797 0.000 0.854) 14.822 15.931 ( 13.626 0.000 -0.398) 13.632 16.852 ( -4.453 0.000 -3.303) 5.545 17.024 ( -13.057 0.000 -4.595) 13.841 17.410 ( 7.186 0.000 -5.803) 9.237 17.521 ( 2.756 0.000 -5.358) 6.025 17.721 ( 5.020 0.000 -5.389) 7.365 17.809 ( -0.004 0.000 -3.180) 3.180 19.475 ( 4.695 0.000 -5.802) 7.464 19.683 ( -3.685 0.000 -0.944) 3.804 19.898 ( 6.960 0.000 -4.259) 8.159 20.024 ( 3.342 0.000 -8.666) 9.288 20.163 ( -3.454 0.000 -11.106) 11.630 20.263 ( -10.303 0.000 -5.163) 11.524 20.996 ( 8.082 0.000 -0.250) 8.086 21.360 ( -8.933 0.000 -7.955) 11.962======================= Grid point 85 (20/90) =======================q-point: (-0.50 0.00 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 140Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.137 ( -24.218 0.000 1.260) 24.251 3.137 ( 24.218 0.000 1.260) 24.251 3.185 ( -27.771 0.000 4.754) 28.175 3.185 ( 27.771 0.000 4.754) 28.175 4.817 ( -14.675 0.000 -2.395) 14.870 4.817 ( 14.675 0.000 -2.395) 14.870 5.857 ( -7.813 0.000 13.684) 15.758 5.857 ( 7.813 0.000 13.684) 15.758 6.129 ( -7.455 0.000 3.942) 8.433 6.129 ( 7.455 0.000 3.942) 8.433 7.150 ( -4.995 0.000 10.895) 11.986 7.150 ( 4.995 0.000 10.895) 11.986 7.305 ( -18.681 0.000 10.241) 21.304 7.305 ( 18.681 0.000 10.241) 21.304 7.761 ( -10.814 0.000 -4.919) 11.880 7.761 ( 10.814 0.000 -4.919) 11.880 8.703 ( -6.259 0.000 -5.370) 8.247 8.703 ( 6.259 0.000 -5.370) 8.247 8.833 ( -6.503 0.000 8.434) 10.650 8.833 ( 6.503 0.000 8.434) 10.650 9.550 ( -3.261 0.000 14.243) 14.611 9.550 ( 3.261 0.000 14.243) 14.611 9.613 ( -6.960 0.000 1.505) 7.120 9.613 ( 6.960 0.000 1.505) 7.120 10.757 ( -16.868 0.000 1.425) 16.929 10.757 ( 16.868 0.000 1.425) 16.929 10.769 ( -22.935 0.000 -1.298) 22.971 10.769 ( 22.935 0.000 -1.298) 22.971 11.073 ( -2.573 0.000 -7.370) 7.806 11.073 ( 2.573 0.000 -7.370) 7.806 11.876 ( -8.757 0.000 -0.493) 8.770 11.876 ( 8.757 0.000 -0.493) 8.770 11.881 ( -8.125 0.000 -7.591) 11.119 11.881 ( 8.125 0.000 -7.591) 11.119 12.354 ( -4.354 0.000 6.332) 7.684 12.354 ( 4.354 0.000 6.332) 7.684 12.645 ( -10.762 0.000 -2.412) 11.029 12.645 ( 10.762 0.000 -2.412) 11.029 13.294 ( -10.563 0.000 2.528) 10.861 13.294 ( 10.563 0.000 2.528) 10.861 13.722 ( -6.717 0.000 9.398) 11.552 13.722 ( 6.717 0.000 9.398) 11.552 14.008 ( -6.403 0.000 2.479) 6.866 14.008 ( 6.403 0.000 2.479) 6.866 14.395 ( -8.052 0.000 2.897) 8.557 14.395 ( 8.052 0.000 2.897) 8.557 14.997 ( -3.516 0.000 -0.412) 3.540 14.997 ( 3.516 0.000 -0.412) 3.540 15.644 ( -2.328 0.000 0.827) 2.471 15.644 ( 2.328 0.000 0.827) 2.471 16.038 ( -4.168 0.000 0.770) 4.238 16.038 ( 4.168 0.000 0.770) 4.238 16.836 ( -4.776 0.000 -4.650) 6.666 16.836 ( 4.776 0.000 -4.650) 6.666 17.515 ( -3.254 0.000 -5.472) 6.366 17.515 ( 3.254 0.000 -5.472) 6.366 17.788 ( -2.193 0.000 -4.249) 4.781 17.788 ( 2.193 0.000 -4.249) 4.781 19.587 ( -6.094 0.000 -4.070) 7.328 19.587 ( 6.094 0.000 -4.070) 7.328 20.064 ( -9.906 0.000 -4.755) 10.988 20.064 ( 9.906 0.000 -4.755) 10.988 20.091 ( -3.659 0.000 -9.230) 9.929 20.091 ( 3.659 0.000 -9.230) 9.929 21.174 ( -9.876 0.000 -4.689) 10.932 21.174 ( 9.876 0.000 -4.689) 10.932======================= Grid point 91 (21/90) =======================q-point: ( 0.12 0.12 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.279 ( 16.597 16.597 32.004) 39.688 1.541 ( 24.672 24.672 25.365) 43.137 2.589 ( 41.867 41.867 33.838) 68.196 3.950 ( -2.182 -2.182 -2.581) 4.023 4.602 ( -9.857 -9.857 -0.787) 13.962 4.752 ( -3.769 -3.769 -0.556) 5.359 5.736 ( 1.504 1.504 4.472) 4.952 6.134 ( -7.291 -7.291 3.912) 11.029 6.373 ( -5.159 -5.159 1.232) 7.399 6.430 ( 0.383 0.383 0.067) 0.545 7.021 ( 4.745 4.745 -0.989) 6.784 7.051 ( 2.785 2.785 1.150) 4.104 7.057 ( -1.817 -1.817 1.181) 2.828 7.764 ( -12.117 -12.117 5.724) 18.067 8.075 ( 2.736 2.736 -15.777) 16.245 8.157 ( 8.822 8.822 -10.037) 16.012 8.290 ( 10.501 10.501 3.725) 15.311 8.563 ( -4.947 -4.947 6.689) 9.680 8.820 ( 0.343 0.343 14.154) 14.163 9.043 ( -2.244 -2.244 4.038) 5.135 9.251 ( 6.063 6.063 4.437) 9.655 9.279 ( -7.746 -7.746 14.857) 18.459 9.506 ( -0.714 -0.714 11.620) 11.664 9.574 ( 3.515 3.515 15.341) 16.126 10.219 ( 3.411 3.411 2.440) 5.406 10.306 ( 2.120 2.120 6.009) 6.715 10.885 ( 2.774 2.774 -7.799) 8.731 11.290 ( 2.248 2.248 -7.318) 7.979 11.507 ( -1.460 -1.460 -8.596) 8.841 11.523 ( -5.431 -5.431 -9.682) 12.358 11.655 ( -6.161 -6.161 1.112) 8.783 11.740 ( -7.558 -7.558 -4.587) 11.632 11.818 ( -0.413 -0.413 -9.082) 9.101 12.269 ( 1.051 1.051 6.705) 6.867 12.347 ( 4.385 4.385 4.185) 7.482 12.422 ( 3.536 3.536 11.614) 12.645 12.774 ( -7.535 -7.535 6.159) 12.308 12.882 ( -0.715 -0.715 9.551) 9.604 13.177 ( -5.485 -5.485 -3.478) 8.501 13.574 ( -1.826 -1.826 0.191) 2.590 13.702 ( -1.289 -1.289 -8.150) 8.351 13.756 ( -3.004 -3.004 -4.767) 6.386 13.956 ( -1.001 -1.001 4.900) 5.101 14.207 ( -0.747 -0.747 -1.426) 1.775 14.312 ( 2.988 2.988 11.469) 12.223 14.806 ( 11.335 11.335 -12.588) 20.382 14.956 ( -3.750 -3.750 0.223) 5.309 15.013 ( 14.954 14.954 9.577) 23.216 15.400 ( -4.414 -4.414 -4.373) 7.622 15.436 ( -1.879 -1.879 3.082) 4.069 15.666 ( -4.899 -4.899 3.811) 7.907 15.804 ( 1.566 1.566 4.726) 5.219 16.972 ( -4.343 -4.343 -4.111) 7.391 17.172 ( 4.053 4.053 -6.834) 8.919 17.337 ( 3.873 3.873 -6.384) 8.412 17.433 ( -4.687 -4.687 -1.916) 6.899 17.460 ( 6.873 6.873 -6.358) 11.615 17.794 ( 2.334 2.334 -4.398) 5.499 19.484 ( -3.319 -3.319 -5.686) 7.373 19.685 ( -2.179 -2.179 -5.129) 5.983 19.774 ( -9.130 -9.130 11.570) 17.338 19.999 ( 5.545 5.545 -1.686) 8.022 20.184 ( 0.382 0.382 -21.668) 21.674 20.598 ( -0.883 -0.883 -5.491) 5.631 20.861 ( 0.775 0.775 9.361) 9.425 21.523 ( 0.288 0.288 -14.809) 14.815======================= Grid point 92 (22/90) =======================q-point: ( 0.25 0.12 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.811 ( 34.376 0.557 18.982) 39.272 2.114 ( 32.467 15.260 16.408) 39.449 3.403 ( 34.200 27.536 16.056) 46.751 3.934 ( 4.857 -3.110 -0.971) 5.849 4.239 ( -23.285 2.320 1.232) 23.433 4.783 ( 3.882 -11.532 2.298) 12.383 5.788 ( 2.680 1.519 4.380) 5.355 5.939 ( -12.505 -12.109 3.566) 17.768 6.184 ( -11.538 -8.309 -3.044) 14.540 6.405 ( -3.477 3.946 8.059) 9.623 6.996 ( -1.368 -2.039 5.956) 6.442 7.078 ( 4.670 3.367 6.323) 8.551 7.223 ( 5.495 9.618 -0.133) 11.078 7.537 ( -7.206 -16.404 7.649) 19.481 8.116 ( -0.182 2.914 -12.665) 12.997 8.236 ( -2.782 8.493 -7.196) 11.474 8.455 ( 1.858 4.256 5.035) 6.850 8.528 ( 6.383 2.509 2.089) 7.170 8.824 ( -0.425 2.344 10.601) 10.866 8.997 ( -3.112 -6.054 7.066) 9.812 9.175 ( -1.176 -5.522 0.977) 5.729 9.374 ( 6.062 -1.162 4.201) 7.466 9.501 ( 0.596 -3.216 13.523) 13.913 9.662 ( 5.208 4.276 17.082) 18.363 10.305 ( -0.670 1.558 6.858) 7.065 10.381 ( 12.180 9.206 1.016) 15.302 10.965 ( 4.792 0.403 -5.222) 7.099 11.197 ( -17.349 -14.862 -4.960) 23.377 11.301 ( -8.877 -1.009 -3.657) 9.654 11.458 ( -5.704 -1.835 -5.588) 8.193 11.587 ( 6.919 7.952 -1.595) 10.661 11.786 ( -1.262 1.741 -16.568) 16.707 11.836 ( 8.284 -2.191 -4.737) 9.791 12.289 ( 0.427 0.319 6.574) 6.595 12.372 ( -2.354 1.502 6.346) 6.933 12.472 ( 1.217 1.828 6.455) 6.818 12.605 ( -8.278 9.707 5.291) 13.810 12.908 ( 2.766 -4.472 6.601) 8.440 13.029 ( -8.809 -4.389 -2.820) 10.238 13.522 ( -2.196 0.397 1.486) 2.681 13.651 ( -8.082 -9.179 1.237) 12.292 13.734 ( 1.909 -8.337 -4.264) 9.557 13.935 ( 0.400 1.586 2.038) 2.613 14.181 ( -0.699 8.003 0.216) 8.036 14.357 ( -0.422 0.440 16.038) 16.050 14.705 ( -9.520 -6.686 -2.728) 11.949 14.988 ( 1.125 13.317 -0.115) 13.365 15.220 ( -6.346 2.196 -2.468) 7.154 15.459 ( 17.994 -3.592 5.341) 19.111 15.529 ( 9.936 -3.710 -1.455) 10.705 15.607 ( 0.118 -3.539 0.805) 3.631 15.820 ( 0.777 3.396 0.896) 3.597 16.879 ( -5.273 -6.023 -2.402) 8.358 17.199 ( -13.145 -8.386 -2.776) 15.837 17.280 ( 6.551 1.992 -6.193) 9.233 17.495 ( 5.977 6.844 -5.284) 10.511 17.600 ( 7.011 1.056 -5.758) 9.134 17.832 ( 1.384 3.288 -3.711) 5.147 19.435 ( -0.666 -0.101 -5.943) 5.981 19.656 ( -2.852 -6.017 3.350) 7.454 19.707 ( 3.318 -4.992 -4.448) 7.464 20.095 ( 3.000 9.149 -8.819) 13.057 20.194 ( 0.554 -0.642 -14.139) 14.165 20.522 ( -6.186 4.546 -6.220) 9.880 20.898 ( 3.577 1.807 5.423) 6.742 21.474 ( -5.122 -2.566 -11.086) 12.479======================= Grid point 93 (23/90) =======================q-point: ( 0.38 0.12 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.483 ( 33.556 -3.241 8.476) 34.762 2.724 ( 29.329 8.280 9.990) 32.071 3.544 ( -10.982 7.575 -1.126) 13.389 3.774 ( -23.553 6.510 4.225) 24.798 4.373 ( 28.818 1.632 1.727) 28.915 4.859 ( 2.609 -8.554 3.629) 9.651 5.655 ( -9.519 -14.305 3.554) 17.547 5.835 ( -4.096 -6.422 4.797) 9.001 6.043 ( -1.013 -9.426 4.375) 10.441 6.278 ( -9.187 2.638 12.875) 16.035 6.995 ( 1.179 -2.111 9.447) 9.752 7.141 ( -6.924 -5.580 11.769) 14.751 7.255 ( 12.987 12.636 6.212) 19.155 7.619 ( 10.623 4.101 -2.541) 11.667 7.988 ( -14.075 13.202 -1.096) 19.329 8.069 ( -12.503 11.387 -2.612) 17.111 8.509 ( 4.852 -3.367 -2.433) 6.387 8.629 ( 2.078 -3.667 2.214) 4.761 8.817 ( 0.140 0.726 3.833) 3.903 8.915 ( -4.505 -3.873 11.047) 12.543 9.249 ( 7.100 -10.155 -5.010) 13.366 9.440 ( -0.433 -10.868 3.400) 11.396 9.574 ( 7.870 3.739 13.147) 15.772 9.748 ( 2.733 5.636 15.707) 16.910 10.303 ( 1.996 -4.757 5.758) 7.731 10.675 ( 16.125 12.260 -1.737) 20.331 10.787 ( -19.466 -20.458 -0.332) 28.241 11.067 ( 3.536 3.019 -4.571) 6.520 11.178 ( -4.725 3.221 -5.172) 7.711 11.310 ( -10.112 4.705 -4.159) 11.903 11.773 ( 2.143 2.416 -10.472) 10.958 11.806 ( 13.201 9.431 -3.196) 16.535 11.949 ( 0.913 1.125 -2.950) 3.286 12.274 ( -6.476 10.389 -2.663) 12.529 12.301 ( -0.151 2.680 5.888) 6.471 12.440 ( -3.808 -0.210 5.714) 6.870 12.516 ( 0.538 6.675 3.750) 7.675 12.812 ( -10.239 -4.801 -3.075) 11.719 13.039 ( 7.591 -5.881 4.371) 10.551 13.423 ( -10.470 -6.883 0.316) 12.534 13.555 ( 1.570 -6.650 8.185) 10.662 13.726 ( -3.218 -8.988 3.214) 10.073 13.970 ( 3.407 3.358 0.761) 4.844 14.183 ( -1.946 7.952 2.037) 8.436 14.321 ( 0.249 1.953 9.380) 9.584 14.543 ( -7.271 -1.915 2.288) 7.859 14.991 ( 0.296 4.819 0.253) 4.835 15.102 ( -5.373 1.763 -1.102) 5.761 15.577 ( 2.069 -3.119 -0.513) 3.778 15.654 ( 0.469 -2.619 0.459) 2.700 15.835 ( 14.126 -0.765 4.041) 14.712 15.925 ( 10.716 -0.195 -1.956) 10.895 16.769 ( -5.645 -8.685 -1.733) 10.503 16.929 ( -13.610 -9.561 -3.473) 16.991 17.412 ( 6.691 0.399 -5.653) 8.768 17.560 ( 0.460 2.849 -5.384) 6.108 17.725 ( 5.713 1.200 -5.256) 7.855 17.842 ( -0.511 3.168 -3.769) 4.950 19.466 ( 3.478 -0.792 -5.312) 6.399 19.612 ( -2.514 -5.304 -0.876) 5.934 19.811 ( 7.130 -3.976 -6.128) 10.208 20.088 ( -3.941 -0.151 -12.574) 13.178 20.216 ( 2.162 8.760 -5.995) 10.832 20.389 ( -6.832 8.653 -7.694) 13.444 21.006 ( 7.493 1.164 -0.008) 7.583 21.341 ( -8.249 -1.796 -7.792) 11.489======================= Grid point 94 (24/90) =======================q-point: (-0.50 0.12 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.020 ( -14.936 -3.986 3.783) 15.915 3.020 ( 14.936 -3.986 3.783) 15.915 3.381 ( -12.203 11.944 3.979) 17.532 3.381 ( 12.203 11.944 3.979) 17.532 4.776 ( -12.667 -4.041 -2.371) 13.505 4.776 ( 12.667 -4.041 -2.371) 13.505 5.670 ( -9.469 -17.693 6.773) 21.180 5.670 ( 9.469 -17.693 6.773) 21.180 6.113 ( -6.647 -1.575 12.238) 14.016 6.113 ( 6.647 -1.575 12.238) 14.016 7.039 ( -3.472 -3.636 11.867) 12.888 7.039 ( 3.472 -3.636 11.867) 12.888 7.603 ( -21.551 20.323 5.445) 30.119 7.603 ( 21.551 20.323 5.445) 30.119 7.841 ( -11.406 8.560 -3.479) 14.679 7.841 ( 11.406 8.560 -3.479) 14.679 8.604 ( -3.988 -7.647 -2.613) 9.012 8.604 ( 3.988 -7.647 -2.613) 9.012 8.844 ( -2.674 -0.746 7.561) 8.054 8.844 ( 2.674 -0.746 7.561) 8.054 9.379 ( -5.415 -10.812 -0.117) 12.092 9.379 ( 5.415 -10.812 -0.117) 12.092 9.727 ( -5.526 5.327 13.643) 15.654 9.727 ( 5.526 5.327 13.643) 15.654 10.438 ( -12.965 -15.740 2.078) 20.498 10.438 ( 12.965 -15.740 2.078) 20.498 11.017 ( -15.428 8.404 -4.509) 18.138 11.017 ( 15.428 8.404 -4.509) 18.138 11.134 ( -3.841 7.135 -3.938) 9.009 11.134 ( 3.841 7.135 -3.938) 9.009 11.872 ( -6.737 1.092 -2.654) 7.323 11.872 ( 6.737 1.092 -2.654) 7.323 12.066 ( -12.941 14.141 -3.761) 19.534 12.066 ( 12.941 14.141 -3.761) 19.534 12.356 ( -4.310 1.487 3.591) 5.804 12.356 ( 4.310 1.487 3.591) 5.804 12.622 ( -8.863 -1.623 -1.077) 9.074 12.622 ( 8.863 -1.623 -1.077) 9.074 13.215 ( -10.293 -7.841 2.928) 13.267 13.215 ( 10.293 -7.841 2.928) 13.267 13.632 ( -5.408 -7.255 7.596) 11.814 13.632 ( 5.408 -7.255 7.596) 11.814 14.073 ( -6.832 3.858 1.926) 8.079 14.073 ( 6.832 3.858 1.926) 8.079 14.410 ( -6.643 2.535 4.641) 8.491 14.410 ( 6.643 2.535 4.641) 8.491 15.021 ( -2.931 2.212 -0.596) 3.720 15.021 ( 2.931 2.212 -0.596) 3.720 15.622 ( -2.514 -1.724 0.335) 3.066 15.622 ( 2.514 -1.724 0.335) 3.066 16.028 ( -3.410 -1.213 1.239) 3.825 16.028 ( 3.410 -1.213 1.239) 3.825 16.735 ( -4.526 -10.450 -3.235) 11.838 16.735 ( 4.526 -10.450 -3.235) 11.838 17.521 ( -4.207 0.218 -5.319) 6.785 17.521 ( 4.207 0.218 -5.319) 6.785 17.809 ( -2.953 2.480 -4.546) 5.961 17.809 ( 2.953 2.480 -4.546) 5.961 19.546 ( -4.224 -3.222 -3.614) 6.425 19.546 ( 4.224 -3.222 -3.614) 6.425 19.964 ( -8.079 -3.202 -7.990) 11.805 19.964 ( 8.079 -3.202 -7.990) 11.805 20.279 ( -4.449 10.890 -7.810) 14.120 20.279 ( 4.449 10.890 -7.810) 14.120 21.171 ( -9.092 -0.268 -4.402) 10.105 21.171 ( 9.092 -0.268 -4.402) 10.105======================= Grid point 101 (25/90) =======================q-point: ( 0.25 0.25 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 201Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.016 ( 20.515 20.515 20.108) 35.300 2.492 ( 22.633 22.633 12.288) 34.286 3.836 ( -3.404 -3.404 -3.231) 5.798 3.978 ( 25.009 25.009 4.825) 35.695 4.214 ( -9.054 -9.054 3.619) 13.305 4.583 ( -3.653 -3.653 6.341) 8.179 5.654 ( -17.203 -17.203 4.752) 24.788 5.823 ( -2.137 -2.137 -0.090) 3.023 5.932 ( -11.408 -11.408 0.265) 16.135 6.430 ( -3.607 -3.607 15.546) 16.361 6.964 ( -1.078 -1.078 6.819) 6.987 7.187 ( -4.495 -4.495 12.629) 14.138 7.260 ( 8.099 8.099 7.219) 13.538 7.501 ( 12.403 12.403 -2.493) 17.717 8.151 ( 0.419 0.419 -12.746) 12.759 8.334 ( 1.273 1.273 -4.761) 5.090 8.526 ( 0.852 0.852 -4.716) 4.867 8.592 ( 4.990 4.990 5.772) 9.117 8.822 ( -2.790 -2.790 16.775) 17.233 8.899 ( -3.651 -3.651 1.465) 5.367 9.101 ( -2.299 -2.299 -1.893) 3.762 9.265 ( -5.849 -5.849 0.205) 8.274 9.532 ( 4.488 4.488 17.146) 18.283 9.771 ( 5.715 5.715 15.874) 17.813 10.288 ( -2.242 -2.242 9.512) 10.027 10.636 ( 14.952 14.952 -2.682) 21.315 10.766 ( -21.193 -21.193 -0.975) 29.987 11.033 ( 2.706 2.706 -1.382) 4.069 11.309 ( -1.983 -1.983 -6.857) 7.408 11.430 ( -1.127 -1.127 -5.126) 5.368 11.706 ( 7.563 7.563 1.378) 10.784 11.810 ( 0.419 0.419 -13.359) 13.373 11.956 ( 11.148 11.148 -7.611) 17.507 12.314 ( 1.165 1.165 6.877) 7.072 12.360 ( -0.541 -0.541 3.481) 3.564 12.460 ( -1.637 -1.637 6.654) 7.046 12.776 ( 5.307 5.307 1.472) 7.648 12.825 ( -4.601 -4.601 5.200) 8.330 12.927 ( -4.677 -4.677 1.615) 6.809 13.445 ( -11.918 -11.918 1.028) 16.886 13.530 ( -1.654 -1.654 7.298) 7.663 13.586 ( -4.749 -4.749 -6.712) 9.494 13.962 ( 1.480 1.480 -2.997) 3.655 14.300 ( 4.960 4.960 0.857) 7.066 14.373 ( -1.766 -1.766 13.601) 13.828 14.584 ( -3.371 -3.371 1.726) 5.070 15.184 ( 1.427 1.427 3.538) 4.074 15.197 ( -3.617 -3.617 -4.364) 6.724 15.400 ( 1.188 1.188 3.969) 4.310 15.543 ( 6.303 6.303 -1.432) 9.028 15.621 ( 4.727 4.727 2.080) 7.002 15.863 ( 1.604 1.604 -0.909) 2.444 16.723 ( -9.832 -9.832 -0.140) 13.906 16.972 ( -14.392 -14.392 -1.266) 20.393 17.342 ( 4.276 4.276 -6.042) 8.549 17.605 ( 0.472 0.472 -5.480) 5.520 17.655 ( 7.559 7.559 -5.457) 12.002 17.890 ( 2.161 2.161 -4.069) 5.088 19.433 ( 0.283 0.283 -5.380) 5.395 19.569 ( -2.755 -2.755 1.183) 4.072 19.689 ( 2.845 2.845 -7.197) 8.245 20.138 ( -2.838 -2.838 -14.658) 15.197 20.284 ( 7.366 7.366 -6.686) 12.378 20.556 ( -0.738 -0.738 -8.653) 8.716 20.952 ( 3.810 3.810 3.695) 6.533 21.403 ( -4.685 -4.685 -9.573) 11.642======================= Grid point 102 (26/90) =======================q-point: ( 0.38 0.25 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.521 ( 29.154 8.080 13.425) 33.098 2.921 ( 19.395 11.584 8.140) 24.013 3.686 ( -10.495 6.227 -2.261) 12.411 3.900 ( -19.019 5.359 6.125) 20.687 4.400 ( 16.890 -1.582 -3.019) 17.231 4.676 ( 8.559 -6.733 7.930) 13.471 5.311 ( -15.290 -20.269 4.394) 25.767 5.552 ( -16.996 -20.955 -4.647) 27.379 5.958 ( 5.562 1.306 11.589) 12.921 6.273 ( -10.574 -3.622 20.002) 22.913 6.965 ( 1.143 -1.401 8.312) 8.507 7.065 ( -4.219 -2.386 12.626) 13.524 7.606 ( 21.427 22.943 3.810) 31.623 7.741 ( 11.930 7.128 -1.582) 13.987 8.105 ( -4.964 1.871 -7.509) 9.194 8.333 ( -0.944 7.714 -3.258) 8.427 8.491 ( -3.973 1.685 -4.022) 5.899 8.610 ( -6.545 4.809 7.752) 11.227 8.784 ( 0.946 -3.306 10.648) 11.189 8.835 ( -2.699 -2.730 5.347) 6.582 9.083 ( 1.684 -6.881 -5.602) 9.031 9.215 ( -0.856 -11.319 -2.145) 11.552 9.640 ( 6.670 3.461 15.474) 17.202 9.845 ( 1.383 2.063 11.526) 11.790 10.240 ( -2.703 -1.198 11.567) 11.939 10.378 ( -16.323 -18.508 1.033) 24.700 10.914 ( 12.215 8.634 -6.376) 16.261 11.122 ( 4.457 2.758 1.588) 5.477 11.248 ( -1.817 3.825 -5.534) 6.968 11.398 ( -2.797 4.340 -4.664) 6.958 11.825 ( 2.114 2.668 -10.982) 11.497 11.916 ( 11.583 4.904 0.369) 12.584 12.061 ( -0.651 5.145 -1.069) 5.295 12.334 ( -0.420 -0.997 6.846) 6.931 12.399 ( 0.912 5.747 -1.149) 5.931 12.460 ( 6.927 6.739 -0.456) 9.675 12.674 ( -9.633 -3.167 1.751) 10.290 12.809 ( -1.797 12.455 -0.920) 12.617 12.913 ( 2.676 -6.004 5.745) 8.730 13.213 ( -11.570 -13.522 1.690) 17.876 13.456 ( -2.179 -4.120 5.146) 6.943 13.551 ( -2.425 -9.003 3.996) 10.144 14.003 ( 3.059 0.410 -5.805) 6.574 14.242 ( -8.690 -3.169 -1.048) 9.309 14.414 ( 6.314 7.857 6.351) 11.914 14.578 ( -0.090 6.582 11.775) 13.490 15.093 ( -3.928 4.652 -0.682) 6.127 15.131 ( -4.571 1.681 -0.268) 4.878 15.499 ( 6.050 -4.847 0.648) 7.779 15.645 ( 1.406 1.979 -0.320) 2.449 15.787 ( 11.259 -3.232 3.751) 12.299 15.929 ( 6.142 0.513 -1.849) 6.435 16.521 ( -10.032 -16.626 1.595) 19.484 16.680 ( -15.066 -15.310 -1.191) 21.513 17.434 ( 4.940 1.911 -5.491) 7.630 17.584 ( -2.245 -0.311 -5.082) 5.565 17.792 ( 5.922 5.056 -5.413) 9.483 17.908 ( -0.330 3.062 -4.463) 5.422 19.456 ( 2.000 0.043 -4.820) 5.218 19.534 ( -1.474 -2.450 -1.898) 3.432 19.789 ( 6.849 1.391 -7.763) 10.445 20.058 ( -5.460 -2.350 -10.870) 12.389 20.393 ( 4.144 8.114 -8.367) 12.370 20.517 ( -2.805 4.150 -10.797) 11.903 21.046 ( 5.849 2.892 0.477) 6.543 21.297 ( -6.202 -2.594 -6.889) 9.625======================= Grid point 103 (27/90) =======================q-point: (-0.50 0.25 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 221Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.012 ( -16.085 3.078 6.478) 17.612 3.012 ( 16.085 3.078 6.478) 17.612 3.601 ( -8.662 10.310 4.455) 14.184 3.601 ( 8.662 10.310 4.455) 14.184 4.670 ( -10.644 -7.047 0.064) 12.766 4.670 ( 10.644 -7.047 0.064) 12.766 5.261 ( -10.722 -22.339 2.597) 24.915 5.261 ( 10.722 -22.339 2.597) 24.915 6.088 ( -8.085 -0.586 16.348) 18.248 6.088 ( 8.085 -0.586 16.348) 18.248 7.003 ( -2.623 -1.328 10.578) 10.979 7.003 ( 2.623 -1.328 10.578) 10.979 7.887 ( -5.691 6.832 -3.185) 9.445 7.887 ( 5.691 6.832 -3.185) 9.445 8.152 ( -16.341 22.991 2.651) 28.331 8.152 ( 16.341 22.991 2.651) 28.331 8.477 ( -4.035 -3.814 -0.790) 5.608 8.477 ( 4.035 -3.814 -0.790) 5.608 8.805 ( -0.795 -2.167 9.130) 9.417 8.805 ( 0.795 -2.167 9.130) 9.417 9.164 ( -4.762 -11.447 -5.428) 13.534 9.164 ( 4.762 -11.447 -5.428) 13.534 9.785 ( -7.391 -0.068 11.525) 13.691 9.785 ( 7.391 -0.068 11.525) 13.691 10.208 ( -1.670 -7.072 7.388) 10.363 10.208 ( 1.670 -7.072 7.388) 10.363 11.093 ( -6.217 0.532 -4.521) 7.705 11.093 ( 6.217 0.532 -4.521) 7.705 11.312 ( -5.735 9.477 -3.518) 11.623 11.312 ( 5.735 9.477 -3.518) 11.623 11.913 ( -6.313 3.035 -4.659) 8.412 11.913 ( 6.313 3.035 -4.659) 8.412 12.211 ( -11.017 0.774 2.865) 11.409 12.211 ( 11.017 0.774 2.865) 11.409 12.464 ( -5.819 4.093 1.625) 7.298 12.464 ( 5.819 4.093 1.625) 7.298 12.694 ( -9.228 13.851 -3.751) 17.061 12.694 ( 9.228 13.851 -3.751) 17.061 13.019 ( -8.101 -11.537 3.744) 14.586 13.019 ( 8.101 -11.537 3.744) 14.586 13.480 ( -3.855 -8.281 7.455) 11.790 13.480 ( 3.855 -8.281 7.455) 11.790 14.091 ( -6.303 -1.790 -5.306) 8.431 14.091 ( 6.303 -1.790 -5.306) 8.431 14.529 ( -4.896 9.769 10.537) 15.180 14.529 ( 4.896 9.769 10.537) 15.180 15.069 ( -1.395 2.565 -1.097) 3.119 15.069 ( 1.395 2.565 -1.097) 3.119 15.603 ( -4.478 0.189 -0.172) 4.485 15.603 ( 4.478 0.189 -0.172) 4.485 15.978 ( -5.339 -4.456 2.166) 7.284 15.978 ( 5.339 -4.456 2.166) 7.284 16.450 ( -5.894 -18.072 -0.330) 19.012 16.450 ( 5.894 -18.072 -0.330) 19.012 17.522 ( -4.063 0.184 -5.078) 6.506 17.522 ( 4.063 0.184 -5.078) 6.506 17.877 ( -2.957 3.850 -5.032) 6.991 17.877 ( 2.957 3.850 -5.032) 6.991 19.499 ( -2.201 -1.278 -3.753) 4.535 19.499 ( 2.201 -1.278 -3.753) 4.535 19.931 ( -7.398 -0.649 -8.561) 11.334 19.931 ( 7.398 -0.649 -8.561) 11.334 20.459 ( -3.070 7.227 -10.336) 12.980 20.459 ( 3.070 7.227 -10.336) 12.980 21.170 ( -6.786 0.358 -3.398) 7.597 21.170 ( 6.786 0.358 -3.398) 7.597======================= Grid point 111 (28/90) =======================q-point: ( 0.38 0.38 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.787 ( 18.206 18.206 13.373) 29.013 3.130 ( 8.258 8.258 6.013) 13.136 3.743 ( -0.390 -0.390 -0.529) 0.764 3.938 ( -5.189 -5.189 5.747) 9.321 4.294 ( -0.376 -0.376 4.751) 4.780 4.706 ( 5.683 5.683 2.975) 8.570 4.904 ( -20.110 -20.110 6.120) 29.090 5.173 ( -16.916 -16.916 -3.618) 24.195 6.017 ( 3.945 3.945 12.835) 13.995 6.181 ( -4.960 -4.960 19.607) 20.824 6.948 ( -0.044 -0.044 7.108) 7.109 7.021 ( -2.609 -2.609 10.684) 11.303 7.840 ( 4.042 4.042 -0.872) 5.782 7.979 ( 2.241 2.241 -2.425) 3.990 8.194 ( 19.410 19.410 1.310) 27.481 8.416 ( 3.050 3.050 1.002) 4.428 8.499 ( -0.528 -0.528 -6.010) 6.056 8.723 ( 1.730 1.730 10.965) 11.235 8.746 ( 0.809 0.809 5.529) 5.646 8.836 ( 0.525 0.525 4.256) 4.321 8.999 ( -3.114 -3.114 -1.901) 4.796 9.025 ( -6.880 -6.880 -7.609) 12.352 9.690 ( 0.704 0.704 12.988) 13.026 9.803 ( -4.418 -4.418 1.550) 6.437 10.123 ( -6.172 -6.172 7.177) 11.300 10.237 ( -1.461 -1.461 18.149) 18.266 11.003 ( 2.820 2.820 -5.550) 6.835 11.130 ( -2.328 -2.328 -1.317) 3.546 11.361 ( 7.007 7.007 -4.316) 10.808 11.461 ( 1.690 1.690 -4.667) 5.243 11.883 ( 3.697 3.697 -10.211) 11.472 12.059 ( 8.685 8.685 1.053) 12.328 12.078 ( -2.399 -2.399 -3.681) 5.006 12.283 ( -2.925 -2.925 0.906) 4.235 12.431 ( 1.480 1.480 6.421) 6.753 12.597 ( -3.162 -3.162 9.589) 10.580 12.758 ( 16.117 16.117 -7.814) 24.096 12.818 ( -3.468 -3.468 7.326) 8.816 12.952 ( -10.735 -10.735 1.735) 15.281 13.017 ( 5.950 5.950 0.801) 8.453 13.357 ( -6.617 -6.617 2.510) 9.689 13.416 ( -4.272 -4.272 7.427) 9.573 14.005 ( 0.334 0.334 -10.536) 10.547 14.133 ( -6.404 -6.404 -8.817) 12.639 14.593 ( 10.125 10.125 10.302) 17.640 14.728 ( 6.554 6.554 12.879) 15.867 15.108 ( -0.625 -0.625 -3.335) 3.451 15.199 ( 0.296 0.296 4.958) 4.975 15.433 ( 2.160 2.160 1.023) 3.222 15.700 ( 1.672 1.672 -0.109) 2.368 15.751 ( 0.283 0.283 0.808) 0.902 15.959 ( 2.968 2.968 -0.689) 4.254 16.163 ( -18.635 -18.635 4.882) 26.802 16.381 ( -14.816 -14.816 0.310) 20.955 17.481 ( 2.728 2.728 -5.120) 6.411 17.566 ( -1.404 -1.404 -4.806) 5.199 17.883 ( 3.942 3.942 -5.518) 7.844 17.946 ( 0.745 0.745 -4.967) 5.078 19.469 ( 1.182 1.182 -4.645) 4.936 19.508 ( -0.728 -0.728 -3.345) 3.500 19.845 ( 3.994 3.994 -8.129) 9.899 20.002 ( -3.385 -3.385 -9.254) 10.419 20.508 ( 3.789 3.789 -11.051) 12.281 20.558 ( 0.607 0.607 -13.205) 13.233 21.112 ( 3.772 3.772 -0.076) 5.336 21.245 ( -2.888 -2.888 -4.761) 6.274======================= Grid point 112 (29/90) =======================q-point: (-0.50 0.38 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.118 ( -11.756 6.771 8.303) 15.906 3.118 ( 11.756 6.771 8.303) 15.906 3.765 ( -6.081 6.418 4.121) 9.755 3.765 ( 6.081 6.418 4.121) 9.755 4.494 ( -17.036 -10.939 5.947) 21.101 4.494 ( 17.036 -10.939 5.947) 21.101 4.908 ( -10.907 -12.164 0.271) 16.340 4.908 ( 10.907 -12.164 0.271) 16.340 6.095 ( -4.085 1.022 15.750) 16.303 6.095 ( 4.085 1.022 15.750) 16.303 6.970 ( -2.239 -1.884 8.167) 8.675 6.970 ( 2.239 -1.884 8.167) 8.675 7.913 ( -4.254 -2.181 -1.652) 5.058 7.913 ( 4.254 -2.181 -1.652) 5.058 8.466 ( -2.378 4.271 -1.324) 5.064 8.466 ( 2.378 4.271 -1.324) 5.064 8.608 ( -16.335 18.434 4.742) 25.082 8.608 ( 16.335 18.434 4.742) 25.082 8.791 ( -2.427 1.017 6.234) 6.766 8.791 ( 2.427 1.017 6.234) 6.766 8.961 ( -2.790 -8.453 -4.096) 9.799 8.961 ( 2.790 -8.453 -4.096) 9.799 9.714 ( -3.739 -6.127 1.806) 7.401 9.714 ( 3.739 -6.127 1.806) 7.401 10.151 ( -6.072 -0.653 16.690) 17.772 10.151 ( 6.072 -0.653 16.690) 17.772 11.067 ( -3.660 -2.112 -3.221) 5.313 11.067 ( 3.660 -2.112 -3.221) 5.313 11.455 ( -2.413 4.684 -5.234) 7.427 11.455 ( 2.413 4.684 -5.234) 7.427 11.980 ( -6.071 3.593 -6.747) 9.762 11.980 ( 6.071 3.593 -6.747) 9.762 12.211 ( -5.482 0.082 -1.081) 5.588 12.211 ( 5.482 0.082 -1.080) 5.588 12.509 ( -6.160 3.182 10.249) 12.374 12.509 ( 6.160 3.182 10.249) 12.374 12.794 ( -2.420 -10.477 4.144) 11.524 12.794 ( 2.420 -10.477 4.144) 11.524 13.019 ( -7.459 14.458 -3.644) 16.672 13.019 ( 7.459 14.458 -3.644) 16.672 13.326 ( -4.404 -7.176 7.078) 11.000 13.326 ( 4.404 -7.176 7.078) 11.000 14.035 ( -3.215 -3.175 -12.032) 12.853 14.035 ( 3.215 -3.175 -12.032) 12.853 14.756 ( -4.675 12.295 11.946) 17.769 14.756 ( 4.675 12.295 11.946) 17.769 15.124 ( -3.429 3.868 0.395) 5.184 15.124 ( 3.429 3.868 0.395) 5.184 15.618 ( -11.015 -0.321 0.527) 11.032 15.618 ( 11.015 -0.321 0.527) 11.032 15.828 ( -8.918 -11.015 3.195) 14.529 15.828 ( 8.918 -11.015 3.195) 14.529 16.131 ( -10.572 -11.783 0.964) 15.860 16.131 ( 10.572 -11.783 0.964) 15.860 17.530 ( -2.292 0.527 -4.797) 5.343 17.530 ( 2.292 0.527 -4.797) 5.343 17.937 ( -1.625 2.141 -5.377) 6.011 17.937 ( 1.625 2.141 -5.377) 6.011 19.492 ( -1.037 0.235 -4.250) 4.381 19.492 ( 1.037 0.235 -4.250) 4.381 19.928 ( -4.272 0.106 -8.337) 9.368 19.928 ( 4.272 0.106 -8.337) 9.368 20.552 ( -1.167 2.639 -13.160) 13.473 20.552 ( 1.167 2.639 -13.160) 13.473 21.183 ( -3.499 0.825 -2.098) 4.163 21.183 ( 3.499 0.825 -2.098) 4.163======================= Grid point 125 (30/90) =======================q-point: (-0.50 -0.50 0.09)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 84Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.202 ( -0.000 -0.000 8.107) 8.107 3.202 ( 0.000 0.000 8.107) 8.107 3.832 ( -0.000 -0.000 5.477) 5.477 3.832 ( 0.000 0.000 5.477) 5.477 4.353 ( -0.000 -0.000 6.100) 6.100 4.353 ( 0.000 0.000 6.100) 6.100 4.799 ( 0.000 0.000 1.385) 1.385 4.799 ( 0.000 0.000 1.385) 1.385 6.109 ( 0.000 0.000 15.081) 15.081 6.109 ( 0.000 0.000 15.081) 15.081 6.948 ( 0.000 0.000 6.830) 6.830 6.948 ( 0.000 0.000 6.830) 6.830 7.881 ( 0.000 0.000 -0.506) 0.506 7.881 ( 0.000 0.000 -0.506) 0.506 8.518 ( 0.000 0.000 0.888) 0.888 8.518 ( 0.000 0.000 0.888) 0.888 8.768 ( 0.000 0.000 11.789) 11.789 8.768 ( -0.000 -0.000 11.789) 11.789 8.810 ( -0.000 -0.000 -10.451) 10.451 8.810 ( 0.000 0.000 -10.451) 10.451 8.920 ( 0.000 0.000 3.609) 3.609 8.920 ( 0.000 0.000 3.609) 3.609 9.630 ( 0.000 0.000 -1.425) 1.425 9.630 ( 0.000 0.000 -1.425) 1.425 10.144 ( 0.000 0.000 19.372) 19.372 10.144 ( 0.000 0.000 19.372) 19.372 11.044 ( 0.000 0.000 -3.023) 3.023 11.044 ( 0.000 0.000 -3.023) 3.023 11.496 ( 0.000 0.000 -5.872) 5.872 11.496 ( 0.000 0.000 -5.872) 5.872 12.023 ( 0.000 0.000 -7.753) 7.753 12.023 ( 0.000 0.000 -7.753) 7.753 12.213 ( 0.000 0.000 -2.757) 2.757 12.213 ( 0.000 0.000 -2.757) 2.757 12.588 ( -0.000 -0.000 16.964) 16.964 12.588 ( 0.000 0.000 16.964) 16.964 12.642 ( 0.000 0.000 0.854) 0.854 12.642 ( 0.000 0.000 0.854) 0.854 13.185 ( 0.000 0.000 8.803) 8.803 13.185 ( 0.000 0.000 8.803) 8.803 13.232 ( -0.000 -0.000 -3.950) 3.950 13.232 ( 0.000 0.000 -3.950) 3.950 13.999 ( -0.000 -0.000 -15.154) 15.154 13.999 ( 0.000 0.000 -15.154) 15.154 14.898 ( 0.000 0.000 6.902) 6.902 14.898 ( 0.000 0.000 6.902) 6.902 15.216 ( 0.000 0.000 8.188) 8.188 15.216 ( 0.000 0.000 8.188) 8.188 15.518 ( -0.000 -0.000 2.407) 2.407 15.518 ( 0.000 0.000 2.407) 2.407 15.730 ( 0.000 0.000 0.241) 0.241 15.730 ( 0.000 0.000 0.241) 0.241 16.025 ( 0.000 0.000 1.067) 1.067 16.025 ( 0.000 0.000 1.067) 1.067 17.537 ( 0.000 0.000 -4.632) 4.632 17.537 ( 0.000 0.000 -4.632) 4.632 17.957 ( 0.000 0.000 -5.539) 5.539 17.957 ( 0.000 0.000 -5.539) 5.539 19.496 ( 0.000 0.000 -4.454) 4.454 19.496 ( 0.000 0.000 -4.454) 4.454 19.930 ( 0.000 0.000 -8.130) 8.130 19.930 ( 0.000 0.000 -8.130) 8.130 20.575 ( 0.000 0.000 -14.348) 14.348 20.575 ( 0.000 0.000 -14.348) 14.348 21.193 ( 0.000 0.000 -1.547) 1.547 21.193 ( 0.000 0.000 -1.547) 1.547======================= Grid point 162 (31/90) =======================q-point: ( 0.00 0.00 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.765 ( 0.000 0.000 42.155) 42.155 1.765 ( 0.000 0.000 42.155) 42.155 2.715 ( 0.000 0.000 50.815) 50.815 3.933 ( -0.000 -0.000 -3.910) 3.910 4.751 ( 0.000 0.000 -4.578) 4.578 4.751 ( -0.000 0.000 -4.578) 4.578 5.933 ( 0.000 -0.000 16.871) 16.871 6.336 ( 0.000 0.000 2.648) 2.648 6.336 ( 0.000 0.000 2.648) 2.648 6.726 ( -0.000 -0.000 -6.278) 6.278 6.749 ( 0.000 0.000 16.415) 16.415 7.025 ( 0.000 0.000 -8.276) 8.276 7.025 ( 0.000 0.000 -8.276) 8.276 7.770 ( 0.000 0.000 -4.220) 4.220 7.930 ( -0.000 -0.000 8.713) 8.713 7.930 ( 0.000 0.000 8.713) 8.713 8.310 ( 0.000 0.000 14.791) 14.791 8.986 ( 0.000 0.000 13.650) 13.650 9.109 ( -0.000 0.000 3.556) 3.556 9.109 ( 0.000 0.000 3.556) 3.556 9.315 ( 0.000 0.000 21.197) 21.197 9.760 ( 0.000 0.000 14.995) 14.995 9.760 ( 0.000 0.000 14.995) 14.995 9.961 ( -0.000 -0.000 22.954) 22.954 10.316 ( -0.000 0.000 5.798) 5.798 10.316 ( -0.000 0.000 5.798) 5.798 10.503 ( 0.000 0.000 -21.848) 21.848 11.043 ( 0.000 0.000 -10.467) 10.467 11.147 ( 0.000 0.000 -22.025) 22.025 11.147 ( 0.000 0.000 -22.025) 22.025 11.702 ( -0.000 -0.000 -5.064) 5.064 12.040 ( 0.000 0.000 9.094) 9.094 12.162 ( -0.000 -0.000 -1.675) 1.675 12.162 ( 0.000 0.000 -1.675) 1.675 12.191 ( 0.000 0.000 6.677) 6.677 12.841 ( 0.000 0.000 25.712) 25.712 13.006 ( -0.000 -0.000 -6.446) 6.446 13.181 ( 0.000 0.000 -6.825) 6.825 13.195 ( 0.000 0.000 20.588) 20.588 13.561 ( 0.000 0.000 -4.963) 4.963 13.561 ( -0.000 -0.000 -4.963) 4.963 13.661 ( 0.000 0.000 -10.737) 10.737 13.861 ( 0.000 0.000 1.613) 1.613 13.861 ( 0.000 0.000 1.613) 1.613 14.645 ( -0.000 -0.000 10.006) 10.006 14.783 ( 0.000 0.000 18.536) 18.536 14.783 ( 0.000 0.000 18.536) 18.536 15.204 ( 0.000 0.000 1.533) 1.533 15.402 ( 0.000 0.000 -3.505) 3.505 15.402 ( 0.000 0.000 -3.505) 3.505 15.941 ( -0.000 0.000 6.777) 6.777 15.941 ( -0.000 0.000 6.777) 6.777 16.875 ( -0.000 -0.000 -13.595) 13.595 16.948 ( 0.000 0.000 -9.708) 9.708 17.060 ( 0.000 0.000 -9.915) 9.915 17.060 ( 0.000 0.000 -9.915) 9.915 17.384 ( 0.000 0.000 -10.003) 10.003 17.605 ( 0.000 0.000 -8.863) 8.863 19.400 ( -0.000 0.000 -14.554) 14.554 19.603 ( -0.000 -0.000 -32.121) 32.121 19.663 ( -0.000 -0.000 -5.462) 5.462 19.663 ( 0.000 0.000 -5.462) 5.462 20.453 ( -0.000 0.000 -10.354) 10.354 20.453 ( 0.000 0.000 -10.354) 10.354 21.050 ( 0.000 0.000 7.835) 7.835 21.199 ( 0.000 0.000 1.454) 1.454======================= Grid point 163 (32/90) =======================q-point: ( 0.12 0.00 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.903 ( 13.825 0.000 38.106) 40.536 1.949 ( 17.779 0.000 36.248) 40.374 3.019 ( 28.046 0.000 40.169) 48.991 3.912 ( -1.450 0.000 -4.066) 4.317 4.585 ( -15.998 0.000 -3.377) 16.351 4.815 ( 5.832 0.000 -2.544) 6.362 5.929 ( 1.209 0.000 18.596) 18.636 6.287 ( -4.735 0.000 2.635) 5.419 6.315 ( -4.311 0.000 -0.638) 4.358 6.648 ( -7.420 0.000 7.029) 10.221 6.835 ( 9.905 0.000 -4.393) 10.836 7.028 ( 0.698 0.000 -5.153) 5.200 7.143 ( 9.262 0.000 3.519) 9.908 7.758 ( -0.913 0.000 -6.255) 6.321 7.950 ( 0.937 0.000 7.313) 7.372 8.039 ( 9.275 0.000 6.726) 11.457 8.409 ( 10.055 0.000 14.674) 17.789 8.771 ( -14.238 0.000 9.476) 17.104 9.103 ( -6.132 0.000 10.649) 12.288 9.107 ( -0.027 0.000 3.224) 3.224 9.413 ( 9.557 0.000 16.253) 18.855 9.748 ( -11.649 0.000 16.434) 20.144 9.800 ( 3.486 0.000 15.719) 16.101 9.823 ( -0.050 0.000 18.212) 18.212 10.330 ( 1.438 0.000 5.322) 5.512 10.336 ( 0.959 0.000 5.310) 5.396 10.583 ( 7.554 0.000 -17.394) 18.964 11.101 ( 6.257 0.000 -10.878) 12.549 11.168 ( 0.292 0.000 -18.366) 18.368 11.211 ( 5.200 0.000 -20.092) 20.754 11.648 ( -5.472 0.000 -7.188) 9.034 11.776 ( -17.280 0.000 3.533) 17.638 11.958 ( -11.770 0.000 2.886) 12.118 12.338 ( 6.454 0.000 1.170) 6.559 12.363 ( 10.960 0.000 4.172) 11.728 12.706 ( -9.898 0.000 21.309) 23.496 12.896 ( -10.602 0.000 -2.845) 10.977 13.117 ( -6.460 0.000 -7.525) 9.917 13.172 ( -1.496 0.000 18.700) 18.760 13.515 ( -4.401 0.000 -4.244) 6.115 13.632 ( 6.760 0.000 -3.084) 7.431 13.819 ( 10.710 0.000 -2.950) 11.109 13.874 ( 1.582 0.000 1.404) 2.115 14.139 ( 24.420 0.000 -4.615) 24.852 14.408 ( -11.540 0.000 9.724) 15.091 14.753 ( -3.192 0.000 17.636) 17.923 15.052 ( -11.784 0.000 0.921) 11.820 15.121 ( 19.544 0.000 10.692) 22.277 15.346 ( -2.530 0.000 0.400) 2.561 15.481 ( 4.745 0.000 -2.078) 5.181 15.823 ( -10.221 0.000 4.184) 11.044 15.907 ( -3.233 0.000 5.413) 6.305 16.898 ( -2.362 0.000 -7.477) 7.841 16.936 ( 6.031 0.000 -12.625) 13.992 17.127 ( 6.383 0.000 -9.790) 11.687 17.193 ( 7.681 0.000 -11.222) 13.599 17.366 ( -1.308 0.000 -8.347) 8.449 17.635 ( 2.874 0.000 -8.660) 9.124 19.339 ( -4.818 0.000 -12.095) 13.020 19.577 ( -0.211 0.000 -25.623) 25.624 19.669 ( 0.670 0.000 -5.667) 5.707 19.755 ( 5.444 0.000 -13.193) 14.272 20.227 ( -16.549 0.000 1.491) 16.616 20.411 ( -4.311 0.000 -10.250) 11.119 21.023 ( -2.575 0.000 6.677) 7.156 21.259 ( 2.878 0.000 -7.632) 8.156======================= Grid point 164 (33/90) =======================q-point: ( 0.25 0.00 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 225Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.270 ( 23.112 0.000 25.793) 34.633 2.379 ( 24.974 0.000 25.092) 35.402 3.527 ( 13.340 0.000 14.359) 19.599 3.984 ( 15.852 0.000 3.077) 16.147 4.198 ( -22.682 0.000 -0.657) 22.692 4.940 ( 6.136 0.000 1.832) 6.404 6.001 ( 5.376 0.000 20.660) 21.348 6.167 ( -8.556 0.000 0.172) 8.558 6.179 ( -5.393 0.000 3.383) 6.366 6.514 ( -6.582 0.000 3.420) 7.417 7.060 ( 12.652 0.000 -3.330) 13.083 7.075 ( 4.776 0.000 2.875) 5.574 7.313 ( 7.534 0.000 15.812) 17.515 7.717 ( -4.239 0.000 -6.001) 7.347 7.940 ( -2.391 0.000 1.133) 2.646 8.193 ( 3.813 0.000 10.087) 10.784 8.537 ( -8.112 0.000 7.302) 10.915 8.643 ( 12.051 0.000 12.624) 17.453 8.955 ( -7.937 0.000 7.993) 11.264 9.136 ( 4.806 0.000 1.775) 5.123 9.466 ( -13.979 0.000 15.245) 20.684 9.600 ( 9.195 0.000 15.711) 18.204 9.872 ( 3.411 0.000 16.777) 17.120 9.873 ( 1.695 0.000 12.558) 12.671 10.364 ( 2.887 0.000 3.901) 4.853 10.382 ( 4.519 0.000 4.170) 6.149 10.755 ( 8.743 0.000 -10.248) 13.470 11.116 ( -5.639 0.000 -11.307) 12.635 11.242 ( 0.702 0.000 -9.242) 9.268 11.296 ( 8.057 0.000 -15.187) 17.192 11.450 ( -15.522 0.000 -4.380) 16.128 11.519 ( -6.456 0.000 -9.165) 11.210 11.774 ( -5.390 0.000 -0.860) 5.458 12.431 ( 3.404 0.000 -0.395) 3.427 12.461 ( -9.268 0.000 5.691) 10.876 12.545 ( -0.769 0.000 18.035) 18.052 12.693 ( -6.903 0.000 3.382) 7.687 12.946 ( -10.738 0.000 -8.540) 13.720 13.153 ( 0.290 0.000 14.878) 14.880 13.483 ( 0.190 0.000 -3.188) 3.193 13.782 ( 7.739 0.000 0.390) 7.749 13.928 ( 1.288 0.000 7.647) 7.755 13.943 ( 6.150 0.000 1.073) 6.243 14.169 ( -8.985 0.000 9.115) 12.798 14.650 ( -7.808 0.000 13.766) 15.826 14.668 ( 21.561 0.000 -7.705) 22.896 14.823 ( -10.884 0.000 3.010) 11.293 15.162 ( -5.335 0.000 -1.121) 5.452 15.552 ( 2.823 0.000 -0.966) 2.984 15.621 ( 12.497 0.000 2.587) 12.762 15.666 ( 5.353 0.000 4.587) 7.050 15.830 ( -4.558 0.000 3.168) 5.551 16.858 ( -2.456 0.000 -4.937) 5.514 17.085 ( 8.787 0.000 -11.028) 14.101 17.135 ( -11.478 0.000 -11.662) 16.363 17.269 ( 7.348 0.000 -9.531) 12.035 17.460 ( 8.337 0.000 -6.210) 10.396 17.694 ( 2.680 0.000 -6.943) 7.442 19.275 ( -0.753 0.000 -9.891) 9.919 19.589 ( 0.842 0.000 -22.805) 22.820 19.698 ( 2.689 0.000 -6.297) 6.847 19.803 ( -1.182 0.000 -11.078) 11.141 20.001 ( -5.597 0.000 -0.983) 5.683 20.292 ( -7.857 0.000 -9.918) 12.653 20.972 ( -1.918 0.000 2.972) 3.537 21.258 ( -2.771 0.000 -11.436) 11.767======================= Grid point 165 (34/90) =======================q-point: ( 0.38 0.00 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.744 ( 24.867 0.000 12.671) 27.910 2.861 ( 24.415 0.000 15.120) 28.717 3.488 ( -10.972 0.000 0.543) 10.985 3.751 ( -23.104 0.000 2.899) 23.285 4.438 ( 23.108 0.000 3.612) 23.389 4.985 ( -3.488 0.000 2.329) 4.194 6.045 ( 2.024 0.000 13.189) 13.344 6.126 ( 0.753 0.000 4.184) 4.251 6.140 ( 3.207 0.000 12.783) 13.179 6.375 ( -8.196 0.000 3.487) 8.907 7.247 ( 14.272 0.000 14.117) 20.075 7.303 ( 12.042 0.000 -0.475) 12.052 7.422 ( 4.096 0.000 21.529) 21.915 7.608 ( -5.548 0.000 1.144) 5.664 7.825 ( -9.566 0.000 -5.937) 11.259 8.072 ( -16.980 0.000 21.105) 27.088 8.509 ( 4.574 0.000 2.710) 5.316 8.805 ( -7.910 0.000 3.197) 8.532 8.842 ( 9.391 0.000 8.211) 12.474 9.200 ( -8.818 0.000 10.734) 13.891 9.376 ( 13.900 0.000 1.863) 14.025 9.760 ( 7.239 0.000 16.670) 18.174 9.847 ( -5.019 0.000 9.354) 10.616 9.911 ( 0.154 0.000 17.437) 17.437 10.477 ( 9.304 0.000 1.515) 9.427 10.525 ( 10.604 0.000 2.411) 10.875 10.850 ( 0.594 0.000 -7.263) 7.288 10.991 ( -5.933 0.000 -8.438) 10.315 11.075 ( -14.007 0.000 -3.074) 14.341 11.123 ( -18.248 0.000 -6.171) 19.263 11.516 ( 11.708 0.000 -11.317) 16.284 11.544 ( 9.882 0.000 -10.026) 14.077 11.750 ( 0.308 0.000 -7.872) 7.878 12.170 ( -17.325 0.000 1.961) 17.435 12.482 ( 2.519 0.000 -2.479) 3.534 12.537 ( 0.092 0.000 18.623) 18.623 12.633 ( -2.441 0.000 9.679) 9.982 12.729 ( -10.881 0.000 -8.824) 14.009 13.210 ( 5.653 0.000 8.182) 9.945 13.467 ( -3.311 0.000 -0.679) 3.380 13.912 ( -0.665 0.000 14.896) 14.911 13.923 ( 7.478 0.000 2.598) 7.916 14.040 ( -5.023 0.000 7.986) 9.434 14.084 ( 6.052 0.000 2.405) 6.512 14.483 ( -7.109 0.000 7.901) 10.628 14.640 ( -8.742 0.000 6.175) 10.703 14.907 ( 4.957 0.000 -2.820) 5.703 15.070 ( -4.864 0.000 -0.085) 4.864 15.602 ( 2.678 0.000 -0.007) 2.678 15.741 ( -4.488 0.000 1.672) 4.790 15.747 ( 14.223 0.000 -7.717) 16.182 16.004 ( 13.154 0.000 6.193) 14.539 16.778 ( -6.087 0.000 -4.729) 7.708 16.882 ( -12.165 0.000 -9.498) 15.434 17.251 ( 7.853 0.000 -9.891) 12.629 17.373 ( 2.779 0.000 -9.326) 9.731 17.597 ( 5.758 0.000 -6.230) 8.483 17.721 ( -0.196 0.000 -5.341) 5.345 19.325 ( 5.555 0.000 -9.145) 10.700 19.571 ( -3.645 0.000 -14.142) 14.604 19.782 ( 6.152 0.000 -7.297) 9.544 19.784 ( 1.297 0.000 -13.021) 13.085 19.933 ( -3.668 0.000 -10.479) 11.102 20.119 ( -9.752 0.000 -9.314) 13.485 20.974 ( 2.359 0.000 -2.212) 3.234 21.171 ( -5.771 0.000 -10.163) 11.687======================= Grid point 166 (35/90) =======================q-point: (-0.50 0.00 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 140Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.185 ( -19.960 0.000 3.596) 20.281 3.185 ( 19.960 0.000 3.596) 20.281 3.312 ( -22.693 0.000 7.817) 24.002 3.312 ( 22.693 0.000 7.817) 24.002 4.798 ( -14.664 0.000 1.080) 14.704 4.798 ( 14.664 0.000 1.080) 14.704 6.134 ( -4.188 0.000 12.591) 13.269 6.134 ( 4.188 0.000 12.591) 13.269 6.212 ( -7.582 0.000 4.231) 8.683 6.212 ( 7.582 0.000 4.231) 8.683 7.458 ( -2.753 0.000 17.486) 17.701 7.458 ( 2.753 0.000 17.486) 17.701 7.619 ( -9.467 0.000 -7.328) 11.972 7.619 ( 9.467 0.000 -7.328) 11.972 7.636 ( -24.531 0.000 23.439) 33.929 7.636 ( 24.531 0.000 23.439) 33.929 8.646 ( -8.339 0.000 0.782) 8.375 8.646 ( 8.339 0.000 0.782) 8.375 9.020 ( -9.154 0.000 8.514) 12.501 9.020 ( 9.154 0.000 8.514) 12.501 9.669 ( -13.317 0.000 4.956) 14.209 9.669 ( 13.317 0.000 4.956) 14.209 9.871 ( -4.123 0.000 17.279) 17.764 9.871 ( 4.123 0.000 17.279) 17.764 10.721 ( -14.855 0.000 -4.097) 15.410 10.721 ( 14.855 0.000 -4.097) 15.410 10.781 ( -15.251 0.000 0.448) 15.257 10.781 ( 15.251 0.000 0.448) 15.257 10.917 ( -0.668 0.000 -7.037) 7.069 10.917 ( 0.668 0.000 -7.037) 7.069 11.700 ( -6.380 0.000 -9.846) 11.732 11.700 ( 6.380 0.000 -9.846) 11.732 11.828 ( -17.500 0.000 -4.230) 18.004 11.828 ( 17.500 0.000 -4.230) 18.004 12.560 ( -6.245 0.000 -6.395) 8.939 12.560 ( 6.245 0.000 -6.395) 8.939 12.573 ( -3.151 0.000 15.590) 15.905 12.573 ( 3.151 0.000 15.590) 15.905 13.349 ( -7.819 0.000 3.385) 8.520 13.349 ( 7.819 0.000 3.385) 8.520 13.950 ( -4.100 0.000 12.266) 12.933 13.950 ( 4.100 0.000 12.266) 12.933 14.070 ( -6.699 0.000 3.708) 7.657 14.070 ( 6.699 0.000 3.708) 7.657 14.483 ( -6.514 0.000 5.968) 8.835 14.483 ( 6.514 0.000 5.968) 8.835 14.979 ( -4.015 0.000 -1.437) 4.264 14.979 ( 4.015 0.000 -1.437) 4.264 15.662 ( -3.620 0.000 0.789) 3.705 15.662 ( 3.620 0.000 0.789) 3.705 16.035 ( -10.648 0.000 -1.774) 10.795 16.035 ( 10.648 0.000 -1.774) 10.795 16.724 ( -3.689 0.000 -6.266) 7.272 16.724 ( 3.689 0.000 -6.266) 7.272 17.366 ( -3.508 0.000 -9.363) 9.998 17.366 ( 3.508 0.000 -9.363) 9.998 17.685 ( -3.343 0.000 -5.509) 6.444 17.685 ( 3.343 0.000 -5.509) 6.444 19.458 ( -7.291 0.000 -9.454) 11.939 19.458 ( 7.291 0.000 -9.454) 11.939 19.848 ( -4.518 0.000 -14.403) 15.095 19.848 ( 4.518 0.000 -14.403) 15.095 19.932 ( -9.147 0.000 -8.405) 12.422 19.932 ( 9.147 0.000 -8.405) 12.422 21.056 ( -5.663 0.000 -6.884) 8.914 21.056 ( 5.663 0.000 -6.884) 8.914======================= Grid point 172 (36/90) =======================q-point: ( 0.12 0.12 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.983 ( 10.657 10.657 37.479) 40.396 2.120 ( 15.356 15.356 31.539) 38.293 3.283 ( 23.950 23.950 30.932) 45.870 3.880 ( -2.624 -2.624 -4.472) 5.811 4.582 ( -7.367 -7.367 -1.165) 10.483 4.732 ( -1.032 -1.032 -1.664) 2.213 5.942 ( 1.937 1.937 18.811) 19.009 6.212 ( -6.701 -6.701 3.308) 10.037 6.302 ( -4.740 -4.740 -1.758) 6.930 6.588 ( -3.329 -3.329 6.148) 7.744 6.934 ( 10.117 10.117 -5.651) 15.383 7.077 ( 1.247 1.247 -2.600) 3.141 7.179 ( 6.082 6.082 9.841) 13.070 7.758 ( -1.008 -1.008 -6.579) 6.732 7.970 ( -1.844 -1.844 10.279) 10.604 8.050 ( 4.993 4.993 1.930) 7.320 8.495 ( 8.540 8.540 14.401) 18.795 8.733 ( -5.973 -5.973 10.572) 13.532 8.906 ( -5.678 -5.678 1.184) 8.117 9.322 ( -1.794 -1.794 18.965) 19.134 9.332 ( 4.224 4.224 4.072) 7.229 9.637 ( -10.489 -10.489 19.447) 24.459 9.789 ( 0.858 0.858 14.970) 15.019 9.899 ( 5.390 5.390 16.887) 18.528 10.267 ( 1.076 1.076 1.403) 2.069 10.459 ( 4.328 4.328 9.614) 11.397 10.650 ( 6.827 6.827 -15.229) 18.032 11.064 ( -1.156 -1.156 -15.618) 15.703 11.247 ( 5.001 5.001 -15.487) 17.025 11.256 ( 3.058 3.058 -15.880) 16.458 11.554 ( -8.939 -8.939 -7.490) 14.695 11.698 ( -7.740 -7.740 2.958) 11.339 11.847 ( -7.002 -7.002 4.140) 10.733 12.377 ( 2.921 2.921 -1.023) 4.256 12.433 ( 5.188 5.188 5.767) 9.332 12.664 ( -4.141 -4.141 17.129) 18.103 12.827 ( -6.415 -6.415 -2.695) 9.464 13.074 ( -4.830 -4.830 -5.343) 8.672 13.165 ( -0.939 -0.939 18.089) 18.137 13.535 ( -0.189 -0.189 -5.302) 5.309 13.662 ( -0.645 -0.645 2.799) 2.943 13.692 ( 2.273 2.273 -0.929) 3.346 14.017 ( 5.013 5.013 1.082) 7.171 14.263 ( -9.910 -9.910 7.991) 16.132 14.336 ( 17.100 17.100 -5.266) 24.749 14.842 ( -1.254 -1.254 11.531) 11.667 14.992 ( -1.368 -1.368 4.120) 4.552 15.184 ( 5.196 5.196 3.856) 8.298 15.361 ( 2.859 2.859 3.914) 5.628 15.463 ( 0.264 0.264 1.011) 1.078 15.731 ( -7.762 -7.762 2.341) 11.223 15.897 ( -1.692 -1.692 4.264) 4.889 16.863 ( -2.269 -2.269 -7.248) 7.927 16.984 ( 4.543 4.543 -11.550) 13.217 17.160 ( 3.086 3.086 -11.567) 12.363 17.304 ( 7.566 7.566 -8.764) 13.831 17.340 ( -1.821 -1.821 -6.964) 7.425 17.660 ( 2.647 2.647 -8.898) 9.653 19.319 ( -2.208 -2.208 -11.135) 11.565 19.507 ( -2.572 -2.572 -16.521) 16.917 19.721 ( 1.174 1.174 -21.125) 21.190 19.798 ( 3.168 3.168 -5.972) 7.466 20.042 ( -10.991 -10.991 2.328) 15.716 20.444 ( -0.741 -0.741 -9.906) 9.961 21.008 ( -1.532 -1.532 5.704) 6.102 21.263 ( -0.182 -0.182 -10.353) 10.356======================= Grid point 173 (37/90) =======================q-point: ( 0.25 0.12 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.302 ( 21.063 5.616 28.978) 36.262 2.502 ( 23.103 11.119 21.891) 33.714 3.659 ( 2.433 11.237 5.828) 12.890 3.959 ( 20.164 -1.021 4.776) 20.748 4.265 ( -20.646 5.534 1.218) 21.410 4.837 ( 7.525 -9.313 2.601) 12.252 5.973 ( -7.700 -5.892 10.396) 14.216 6.038 ( -3.109 -5.074 10.226) 11.831 6.167 ( -5.438 -8.178 1.373) 9.917 6.571 ( -0.108 8.465 8.989) 12.348 7.104 ( 3.988 0.726 4.055) 5.734 7.171 ( 12.620 10.978 -4.594) 17.346 7.329 ( 7.872 3.151 16.212) 18.296 7.678 ( -7.257 -5.278 2.007) 9.196 7.933 ( -0.602 -0.930 1.490) 1.857 8.160 ( 3.608 0.177 1.678) 3.983 8.582 ( -6.578 2.391 7.944) 10.587 8.692 ( 9.942 4.853 12.669) 16.820 8.870 ( -0.636 -7.087 -0.277) 7.121 9.165 ( -6.497 2.108 9.856) 11.992 9.414 ( -10.769 -4.826 14.737) 18.880 9.499 ( 6.282 -10.306 11.509) 16.678 9.813 ( 1.529 0.510 16.252) 16.332 9.995 ( 4.180 6.471 15.792) 17.570 10.374 ( 9.470 5.468 -2.462) 11.209 10.488 ( -0.717 4.584 11.002) 11.940 10.821 ( 9.697 6.433 -9.034) 14.732 11.013 ( -7.143 -10.560 -12.452) 17.821 11.206 ( -10.447 -5.705 -5.958) 13.311 11.287 ( -0.864 0.335 -12.037) 12.072 11.470 ( 3.217 3.634 -12.689) 13.585 11.566 ( -1.899 6.997 -1.071) 7.328 11.783 ( 0.576 -0.350 -0.868) 1.099 12.387 ( -3.326 -2.894 -3.003) 5.334 12.527 ( 3.205 0.384 4.333) 5.403 12.561 ( -4.790 2.487 14.348) 15.330 12.688 ( -7.198 1.810 0.652) 7.450 12.931 ( -9.425 -1.661 -4.167) 10.438 13.147 ( -0.284 -0.651 16.320) 16.336 13.487 ( -2.707 0.134 -4.330) 5.108 13.729 ( 3.916 -10.502 4.330) 12.016 13.771 ( 5.213 -1.264 6.135) 8.149 14.020 ( -5.839 -5.184 8.093) 11.246 14.168 ( 2.977 6.138 -0.554) 6.845 14.622 ( 7.029 -1.282 -1.675) 7.339 14.676 ( -9.312 -1.019 11.243) 14.634 15.001 ( -0.755 14.826 2.107) 14.994 15.163 ( -3.333 0.145 -2.433) 4.129 15.500 ( 3.538 -3.172 0.081) 4.753 15.573 ( 3.301 -5.453 1.034) 6.457 15.652 ( 12.637 -0.019 6.544) 14.231 15.845 ( -3.115 0.596 1.444) 3.485 16.818 ( -2.819 -3.986 -4.118) 6.387 17.070 ( -6.251 -2.129 -10.944) 12.782 17.122 ( 2.274 -0.313 -9.052) 9.339 17.354 ( 4.802 6.926 -8.541) 11.999 17.467 ( 7.409 0.705 -6.786) 10.071 17.718 ( 2.561 2.420 -7.823) 8.580 19.282 ( -0.372 0.575 -9.613) 9.637 19.510 ( 2.106 -4.277 -14.700) 15.454 19.728 ( -3.032 -2.588 -8.977) 9.822 19.742 ( -2.903 -4.443 -11.740) 12.884 19.992 ( 2.736 3.869 -8.815) 10.008 20.365 ( -6.831 3.462 -9.598) 12.279 20.977 ( -1.046 0.636 2.469) 2.756 21.235 ( -2.839 -2.198 -11.725) 12.262======================= Grid point 174 (38/90) =======================q-point: ( 0.38 0.12 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.739 ( 23.024 2.277 16.523) 28.430 2.956 ( 22.410 7.075 12.983) 26.848 3.531 ( -11.025 5.100 -0.315) 12.151 3.857 ( -20.942 9.057 3.971) 23.160 4.412 ( 21.525 -2.059 2.463) 21.763 4.924 ( -1.155 -5.841 3.023) 6.677 5.772 ( -5.376 -18.063 6.789) 20.032 5.957 ( -7.510 -16.472 6.472) 19.225 6.218 ( 7.816 1.498 12.226) 14.588 6.527 ( -5.169 11.896 12.022) 17.685 7.242 ( 8.529 -1.765 15.099) 17.431 7.365 ( 5.160 3.675 6.119) 8.807 7.500 ( 11.716 9.266 13.447) 20.098 7.566 ( -0.578 -1.155 4.090) 4.289 7.885 ( -5.706 4.987 -5.476) 9.350 8.144 ( -6.936 6.294 10.308) 13.928 8.508 ( -0.576 -0.080 4.626) 4.662 8.751 ( -8.529 -2.191 7.383) 11.491 8.866 ( 6.182 -0.221 1.832) 6.451 9.160 ( -2.288 -5.492 10.613) 12.167 9.267 ( 3.198 -6.195 8.009) 10.618 9.561 ( -1.161 -15.317 10.251) 18.467 9.873 ( 5.682 3.720 15.770) 17.170 10.052 ( 1.334 6.519 13.879) 15.392 10.459 ( -1.338 -0.438 9.761) 9.862 10.600 ( 11.919 6.049 -6.297) 14.775 10.759 ( -14.003 -17.347 -2.744) 22.462 10.967 ( 4.208 8.813 -4.621) 10.804 11.043 ( -6.242 2.465 -7.615) 10.150 11.200 ( -8.073 3.225 -7.431) 11.437 11.562 ( 8.913 1.892 -10.189) 13.669 11.691 ( 11.181 13.986 -7.899) 19.570 11.836 ( 2.637 6.129 -6.361) 9.219 12.218 ( -13.224 2.782 -4.428) 14.221 12.481 ( -1.932 3.106 5.434) 6.551 12.560 ( -5.020 -5.362 2.280) 7.690 12.589 ( 1.067 3.308 11.243) 11.769 12.748 ( -8.444 1.657 -0.645) 8.630 13.178 ( 3.789 -3.010 10.450) 11.516 13.419 ( -5.363 -5.124 -0.476) 7.432 13.770 ( 1.418 -10.245 11.736) 15.643 13.846 ( 0.948 -7.927 8.407) 11.594 13.974 ( 3.279 -2.993 0.211) 4.445 14.237 ( -0.043 8.391 3.295) 9.015 14.479 ( -4.070 -1.814 5.939) 7.425 14.674 ( -3.594 5.420 11.053) 12.825 14.968 ( -0.842 4.638 -2.950) 5.561 15.087 ( -5.259 2.132 -0.038) 5.675 15.569 ( 2.469 -2.919 -0.324) 3.837 15.643 ( 4.123 -3.806 -2.172) 6.017 15.830 ( 6.415 3.056 -4.052) 8.180 15.978 ( 13.314 -2.878 6.734) 15.195 16.736 ( -5.988 -4.976 -1.738) 7.977 16.820 ( -13.093 -5.998 -7.763) 16.360 17.259 ( 7.385 0.614 -9.470) 12.025 17.416 ( 0.638 3.306 -8.845) 9.464 17.598 ( 6.111 0.592 -6.867) 9.211 17.738 ( -0.644 1.939 -6.414) 6.732 19.325 ( 4.620 0.017 -8.735) 9.882 19.530 ( -2.360 -3.070 -10.369) 11.068 19.668 ( 1.569 -7.933 -6.301) 10.251 19.754 ( 0.731 -1.493 -19.761) 19.831 20.031 ( 1.190 7.279 -12.254) 14.303 20.208 ( -8.617 5.542 -10.320) 14.542 20.988 ( 2.346 1.586 -2.016) 3.476 21.158 ( -4.842 -1.131 -9.772) 10.964======================= Grid point 175 (39/90) =======================q-point: (-0.50 0.12 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.129 ( -13.863 -1.118 6.890) 15.520 3.129 ( 13.863 -1.118 6.890) 15.520 3.481 ( -15.710 12.287 5.980) 20.821 3.481 ( 15.710 12.287 5.980) 20.821 4.759 ( -14.450 -3.567 1.157) 14.929 4.759 ( 14.450 -3.567 1.157) 14.929 5.808 ( -6.868 -21.931 7.032) 24.033 5.808 ( 6.868 -21.931 7.032) 24.033 6.384 ( -8.746 6.620 12.942) 16.965 6.384 ( 8.746 6.620 12.942) 16.965 7.354 ( -3.571 -5.766 18.081) 19.311 7.354 ( 3.571 -5.766 18.081) 19.311 7.679 ( -6.047 6.303 -4.832) 9.982 7.679 ( 6.047 6.303 -4.832) 9.982 7.871 ( -16.150 17.867 15.568) 28.678 7.871 ( 16.150 17.867 15.568) 28.678 8.582 ( -7.212 -5.426 1.852) 9.213 8.582 ( 7.212 -5.426 1.852) 9.213 9.015 ( -8.472 -1.305 6.815) 10.951 9.015 ( 8.472 -1.305 6.815) 10.951 9.452 ( -9.423 -14.199 8.949) 19.248 9.452 ( 9.423 -14.199 8.949) 19.248 10.010 ( -6.239 6.021 13.759) 16.263 10.010 ( 6.239 6.021 13.759) 16.263 10.497 ( -7.057 -12.001 3.975) 14.479 10.497 ( 7.057 -12.001 3.975) 14.479 10.885 ( -11.843 5.862 -7.861) 15.376 10.885 ( 11.843 5.862 -7.861) 15.376 11.044 ( -5.491 8.829 -5.685) 11.849 11.044 ( 5.491 8.829 -5.685) 11.849 11.774 ( -8.695 1.787 -7.144) 11.394 11.774 ( 8.695 1.787 -7.144) 11.394 11.942 ( -13.510 14.596 -7.262) 21.173 11.942 ( 13.510 14.596 -7.262) 21.173 12.482 ( -2.356 -3.978 2.301) 5.164 12.482 ( 2.356 -3.978 2.301) 5.164 12.630 ( -3.743 3.027 7.571) 8.971 12.630 ( 3.743 3.027 7.571) 8.971 13.288 ( -7.136 -6.005 4.772) 10.476 13.288 ( 7.136 -6.005 4.772) 10.476 13.816 ( -2.927 -9.520 9.987) 14.105 13.816 ( 2.927 -9.520 9.987) 14.105 14.110 ( -9.173 -0.427 2.002) 9.398 14.110 ( 9.173 -0.427 2.002) 9.398 14.554 ( -7.519 7.472 9.583) 14.290 14.554 ( 7.519 7.472 9.583) 14.290 14.995 ( -3.493 1.535 -2.223) 4.416 14.995 ( 3.493 1.535 -2.223) 4.416 15.624 ( -3.012 -2.944 -0.354) 4.226 15.624 ( 3.012 -2.944 -0.354) 4.226 16.041 ( -8.202 0.084 -0.571) 8.222 16.041 ( 8.202 0.084 -0.571) 8.222 16.664 ( -2.511 -6.513 -3.637) 7.871 16.664 ( 2.511 -6.513 -3.637) 7.871 17.377 ( -4.444 0.661 -8.895) 9.966 17.377 ( 4.444 0.661 -8.895) 9.966 17.694 ( -3.760 1.418 -6.495) 7.638 17.694 ( 3.760 1.418 -6.495) 7.638 19.436 ( -6.088 -2.124 -7.897) 10.195 19.436 ( 6.088 -2.124 -7.897) 10.195 19.737 ( -3.114 -5.049 -14.498) 15.665 19.737 ( 3.114 -5.049 -14.498) 15.665 20.074 ( -4.428 7.830 -12.394) 15.314 20.074 ( 4.428 7.830 -12.394) 15.314 21.061 ( -4.838 0.685 -6.283) 7.959 21.061 ( 4.838 0.685 -6.283) 7.959======================= Grid point 182 (40/90) =======================q-point: ( 0.25 0.25 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 201Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.515 ( 15.942 15.942 28.776) 36.556 2.776 ( 16.627 16.627 15.240) 28.021 3.764 ( -2.661 -2.661 -3.888) 5.410 4.079 ( 14.129 14.129 5.027) 20.604 4.294 ( -6.852 -6.852 4.274) 10.590 4.708 ( 0.477 0.477 4.841) 4.888 5.774 ( -15.829 -15.829 7.075) 23.477 5.796 ( -15.986 -15.986 0.284) 22.610 6.129 ( 4.409 4.409 15.607) 16.807 6.759 ( 5.952 5.952 18.744) 20.547 7.081 ( -0.463 -0.463 2.575) 2.657 7.429 ( 13.629 13.629 -4.833) 19.872 7.454 ( 5.962 5.962 11.306) 14.104 7.535 ( -3.038 -3.038 20.345) 20.794 7.938 ( 1.643 1.643 -5.012) 5.524 8.214 ( 3.691 3.691 -2.972) 6.006 8.576 ( -3.184 -3.184 8.300) 9.442 8.756 ( -3.184 -3.184 -7.014) 8.335 8.807 ( 6.141 6.141 13.542) 16.088 9.172 ( -4.815 -4.815 15.868) 17.267 9.270 ( -7.136 -7.136 -0.013) 10.091 9.326 ( -5.302 -5.302 19.776) 21.150 9.875 ( 4.746 4.746 16.338) 17.663 10.075 ( 1.000 1.000 14.531) 14.600 10.537 ( 9.841 9.841 -8.103) 16.104 10.540 ( 1.313 1.313 15.500) 15.611 10.714 ( -17.411 -17.411 -5.259) 25.178 10.976 ( 9.110 9.110 -3.911) 13.463 11.134 ( -2.433 -2.433 -9.886) 10.468 11.298 ( 0.371 0.371 -8.427) 8.443 11.548 ( 2.019 2.019 -11.508) 11.857 11.712 ( 7.914 7.914 -0.602) 11.208 11.845 ( 8.969 8.969 -3.689) 13.210 12.314 ( -4.659 -4.659 -7.882) 10.273 12.475 ( -4.386 -4.386 -1.122) 6.303 12.571 ( 0.137 0.137 13.482) 13.483 12.779 ( 3.838 3.838 -1.942) 5.765 12.876 ( -3.950 -3.950 3.317) 6.497 13.130 ( -1.049 -1.049 17.791) 17.853 13.439 ( -7.143 -7.143 -2.754) 10.470 13.578 ( -3.299 -3.299 4.730) 6.644 13.733 ( -2.601 -2.601 12.455) 12.987 13.906 ( -3.585 -3.585 -1.642) 5.329 14.336 ( 9.891 9.891 3.046) 14.315 14.478 ( -10.340 -10.340 0.407) 14.628 14.747 ( 4.523 4.523 10.983) 12.710 15.084 ( -3.747 -3.747 -6.772) 8.598 15.293 ( 5.393 5.393 7.562) 10.740 15.454 ( -3.211 -3.211 0.620) 4.583 15.516 ( 5.978 5.978 -0.775) 8.490 15.697 ( 5.624 5.624 5.535) 9.690 15.838 ( -0.833 -0.833 -1.607) 1.992 16.716 ( -6.489 -6.489 -1.207) 9.256 16.926 ( -12.160 -12.160 -3.597) 17.569 17.175 ( 4.886 4.886 -10.480) 12.553 17.470 ( 0.775 0.775 -7.351) 7.432 17.511 ( 7.196 7.196 -8.658) 13.361 17.770 ( 2.253 2.253 -8.060) 8.667 19.292 ( 0.712 0.712 -8.915) 8.972 19.487 ( 1.959 1.959 -13.480) 13.761 19.580 ( -6.608 -6.608 -0.207) 9.347 19.742 ( 0.071 0.071 -24.147) 24.147 20.092 ( 4.610 4.610 -12.662) 14.242 20.362 ( -3.549 -3.549 -11.024) 12.113 20.998 ( 1.460 1.460 0.851) 2.233 21.187 ( -2.508 -2.508 -11.098) 11.651======================= Grid point 183 (41/90) =======================q-point: ( 0.38 0.25 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.868 ( 19.076 10.792 20.235) 29.830 3.101 ( 14.978 7.985 9.331) 19.370 3.662 ( -5.588 6.789 -0.363) 8.801 4.024 ( -17.076 6.926 6.395) 19.505 4.391 ( 16.418 0.252 1.908) 16.531 4.799 ( 3.558 -5.562 4.542) 8.014 5.418 ( -14.466 -18.001 6.175) 23.904 5.551 ( -12.221 -23.605 4.526) 26.964 6.260 ( 8.786 3.331 17.236) 19.631 6.687 ( -10.570 3.024 20.242) 23.035 7.141 ( 4.768 -6.979 7.951) 11.604 7.358 ( -6.040 -3.960 13.625) 15.421 7.671 ( 10.239 10.213 -3.650) 14.916 7.795 ( 16.976 19.418 14.460) 29.569 7.975 ( 3.737 4.816 -3.123) 6.849 8.271 ( 2.243 6.398 -0.209) 6.783 8.495 ( -4.056 -1.321 5.802) 7.201 8.745 ( -3.070 -1.807 -1.029) 3.708 8.839 ( -2.709 1.216 4.795) 5.640 9.045 ( -1.657 -3.565 12.200) 12.817 9.189 ( -3.502 -4.686 8.664) 10.454 9.281 ( -0.628 -11.606 15.312) 19.224 9.929 ( 0.240 1.648 13.374) 13.477 10.077 ( -0.491 -5.168 11.002) 12.166 10.406 ( -9.699 -12.887 1.968) 16.249 10.517 ( -4.000 6.170 14.009) 15.822 10.770 ( 12.131 6.460 -7.145) 15.490 11.080 ( -2.645 0.583 -7.696) 8.158 11.138 ( 5.391 7.185 -4.041) 9.849 11.273 ( -3.534 4.622 -7.654) 9.614 11.600 ( 6.339 1.755 -10.660) 12.526 11.890 ( 5.575 6.925 -3.799) 9.668 11.999 ( 5.924 6.326 -4.550) 9.788 12.269 ( 1.012 7.680 -9.449) 12.219 12.397 ( -1.394 -6.914 -2.618) 7.523 12.593 ( 2.195 0.562 11.518) 11.739 12.721 ( -8.198 10.777 1.051) 13.582 12.821 ( -3.567 7.079 5.709) 9.769 13.115 ( -0.126 -3.034 15.155) 15.456 13.262 ( -8.956 -11.144 2.684) 14.546 13.573 ( 1.811 -9.611 7.431) 12.283 13.685 ( -2.375 -7.950 5.961) 10.217 13.906 ( 3.405 -3.848 -1.321) 5.305 14.247 ( -11.978 -7.582 1.961) 14.311 14.554 ( 11.073 10.406 7.615) 16.997 14.797 ( 0.141 5.436 8.246) 9.877 15.019 ( -1.877 0.510 -5.493) 5.828 15.193 ( -9.081 9.254 5.542) 14.100 15.505 ( 4.315 -3.516 -0.151) 5.568 15.632 ( 1.350 2.539 -1.056) 3.063 15.869 ( 8.837 0.811 -3.523) 9.548 15.892 ( 10.236 -5.023 5.847) 12.814 16.571 ( -8.250 -11.947 3.094) 14.845 16.654 ( -14.491 -11.257 -1.164) 18.386 17.282 ( 5.771 2.104 -9.516) 11.326 17.451 ( -2.313 0.023 -7.900) 8.232 17.649 ( 6.255 4.504 -8.562) 11.520 17.786 ( -0.728 2.406 -7.675) 8.076 19.326 ( 2.862 0.221 -8.219) 8.706 19.471 ( -4.217 -3.401 -4.888) 7.297 19.576 ( 5.681 -0.455 -13.064) 14.253 19.737 ( -0.981 -0.485 -21.310) 21.338 20.148 ( 1.475 4.092 -16.395) 16.962 20.262 ( -5.759 -0.122 -14.262) 15.381 21.035 ( 2.398 3.013 -1.680) 4.201 21.140 ( -2.521 -0.537 -8.214) 8.609======================= Grid point 184 (42/90) =======================q-point: (-0.50 0.25 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 221Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.175 ( -9.757 5.397 8.985) 14.319 3.175 ( 9.757 5.397 8.985) 14.319 3.710 ( -12.871 10.596 6.590) 17.927 3.710 ( 12.871 10.596 6.590) 17.927 4.693 ( -13.543 -2.465 2.550) 13.999 4.693 ( 13.543 -2.465 2.550) 13.999 5.352 ( -6.571 -24.226 6.747) 25.992 5.352 ( 6.571 -24.226 6.747) 25.992 6.459 ( -11.689 2.035 19.089) 22.476 6.459 ( 11.689 2.035 19.089) 22.476 7.243 ( -5.846 -6.461 11.185) 14.178 7.243 ( 5.846 -6.461 11.185) 14.178 7.832 ( -6.231 8.048 -2.062) 10.385 7.832 ( 6.231 8.048 -2.062) 10.385 8.239 ( -10.796 18.123 8.516) 22.749 8.239 ( 10.796 18.123 8.516) 22.749 8.506 ( -9.994 0.200 4.783) 11.082 8.506 ( 9.994 0.200 4.783) 11.082 8.945 ( -8.337 -5.931 0.957) 10.276 8.945 ( 8.337 -5.931 0.957) 10.276 9.228 ( -4.777 -8.017 15.332) 17.949 9.228 ( 4.777 -8.017 15.332) 17.949 9.981 ( -6.319 -8.471 8.120) 13.328 9.981 ( 6.319 -8.471 8.120) 13.328 10.407 ( -6.065 2.627 11.207) 13.011 10.407 ( 6.065 2.627 11.207) 13.011 10.981 ( -8.542 2.618 -6.045) 10.787 10.981 ( 8.542 2.618 -6.045) 10.787 11.201 ( -2.684 7.323 -7.925) 11.119 11.201 ( 2.684 7.323 -7.925) 11.119 11.786 ( -10.736 0.378 -8.038) 13.417 11.786 ( 10.736 0.378 -8.038) 13.417 12.184 ( -9.264 4.487 -5.488) 11.665 12.184 ( 9.264 4.487 -5.488) 11.665 12.517 ( -9.893 11.145 0.640) 14.916 12.517 ( 9.893 11.145 0.640) 14.916 12.703 ( -6.958 5.179 7.228) 11.291 12.703 ( 6.958 5.179 7.228) 11.291 13.142 ( -3.386 -8.231 9.003) 12.660 13.142 ( 3.386 -8.231 9.003) 12.660 13.629 ( -3.397 -9.774 6.395) 12.164 13.629 ( 3.397 -9.774 6.395) 12.164 14.033 ( -9.447 -6.685 0.723) 11.596 14.033 ( 9.447 -6.685 0.723) 11.596 14.736 ( -6.764 9.638 8.837) 14.721 14.736 ( 6.764 9.638 8.837) 14.721 15.045 ( -5.015 4.523 -0.691) 6.789 15.045 ( 5.015 4.523 -0.691) 6.789 15.587 ( -4.077 -0.303 -1.627) 4.400 15.587 ( 4.077 -0.303 -1.627) 4.400 16.019 ( -2.151 -2.634 1.394) 3.675 16.019 ( 2.151 -2.634 1.394) 3.675 16.466 ( -1.487 -13.730 2.557) 14.045 16.466 ( 1.487 -13.730 2.557) 14.045 17.384 ( -4.546 0.349 -8.592) 9.727 17.384 ( 4.546 0.349 -8.592) 9.727 17.744 ( -3.577 3.162 -8.031) 9.343 17.744 ( 3.577 3.162 -8.031) 9.343 19.393 ( -3.885 -1.774 -6.883) 8.100 19.393 ( 3.885 -1.774 -6.883) 8.100 19.685 ( -4.643 -0.701 -16.244) 16.909 19.685 ( 4.643 -0.701 -16.244) 16.909 20.177 ( -2.557 2.699 -17.527) 17.917 20.177 ( 2.557 2.699 -17.527) 17.917 21.087 ( -2.869 1.996 -4.727) 5.878 21.087 ( 2.869 1.996 -4.727) 5.878======================= Grid point 192 (43/90) =======================q-point: ( 0.38 0.38 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.116 ( 13.204 13.204 18.007) 25.941 3.255 ( 7.103 7.103 5.701) 11.550 3.750 ( 3.322 3.322 1.672) 4.986 4.073 ( -4.405 -4.405 7.815) 9.994 4.429 ( 6.000 6.000 8.372) 11.921 4.772 ( 2.310 2.310 3.306) 4.647 5.074 ( -18.963 -18.963 11.059) 29.008 5.144 ( -14.954 -14.954 1.620) 21.210 6.351 ( 6.104 6.104 19.476) 21.303 6.639 ( -6.709 -6.709 25.727) 27.421 7.057 ( -0.726 -0.726 1.257) 1.623 7.244 ( -7.270 -7.270 8.615) 13.414 7.842 ( 6.516 6.516 0.865) 9.255 7.970 ( 0.177 0.177 3.482) 3.491 8.284 ( 23.038 23.038 9.000) 33.801 8.388 ( 4.946 4.946 -1.502) 7.154 8.473 ( -0.714 -0.714 4.421) 4.535 8.689 ( 1.144 1.144 -5.461) 5.696 8.924 ( 1.215 1.215 8.815) 8.981 8.927 ( -9.635 -9.635 -3.150) 13.985 9.113 ( 1.597 1.597 20.191) 20.317 9.177 ( -2.501 -2.501 18.874) 19.202 9.881 ( -8.827 -8.827 6.512) 14.079 9.901 ( -7.872 -7.872 8.008) 13.714 10.329 ( 4.466 4.466 12.297) 13.824 10.603 ( -0.476 -0.476 18.042) 18.054 10.862 ( 4.986 4.986 -8.783) 11.264 11.051 ( -2.912 -2.912 -6.974) 8.100 11.253 ( 4.510 4.510 -6.277) 8.949 11.335 ( 0.594 0.594 -8.178) 8.221 11.657 ( 5.329 5.329 -11.712) 13.927 11.942 ( -5.251 -5.251 -9.931) 12.401 12.073 ( 7.747 7.747 -0.059) 10.956 12.260 ( -4.170 -4.170 -2.289) 6.326 12.589 ( 1.801 1.801 8.426) 8.803 12.589 ( 17.410 17.410 -9.015) 26.219 12.876 ( 3.613 3.613 17.432) 18.166 12.959 ( 0.667 0.667 -4.344) 4.445 13.037 ( -6.921 -6.921 4.575) 10.805 13.066 ( -2.197 -2.197 18.502) 18.761 13.423 ( -4.561 -4.561 4.265) 7.733 13.549 ( -6.357 -6.357 1.517) 9.118 13.847 ( -1.391 -1.391 -1.260) 2.336 14.058 ( -10.521 -10.521 1.920) 15.003 14.763 ( 9.026 9.026 4.265) 13.458 14.859 ( 1.261 1.261 0.436) 1.836 15.048 ( 4.486 4.486 -0.607) 6.374 15.391 ( 2.422 2.422 12.170) 12.643 15.432 ( 2.390 2.390 -1.712) 3.789 15.705 ( 2.033 2.033 1.688) 3.333 15.773 ( -2.026 -2.026 1.246) 3.124 15.940 ( 5.339 5.339 -0.916) 7.605 16.301 ( -14.872 -14.872 8.904) 22.840 16.409 ( -13.251 -13.251 3.045) 18.985 17.337 ( 3.293 3.293 -9.204) 10.315 17.435 ( -1.408 -1.408 -8.136) 8.376 17.736 ( 3.961 3.961 -8.964) 10.570 17.812 ( 0.184 0.184 -8.209) 8.213 19.341 ( 1.399 1.399 -8.126) 8.364 19.414 ( -2.367 -2.367 -6.039) 6.905 19.619 ( 3.792 3.792 -14.396) 15.363 19.727 ( -0.830 -0.830 -18.792) 18.829 20.186 ( 0.355 0.355 -21.203) 21.208 20.227 ( -2.644 -2.644 -19.368) 19.726 21.091 ( 2.598 2.598 -2.019) 4.193 21.137 ( 0.030 0.030 -5.618) 5.618======================= Grid point 193 (44/90) =======================q-point: (-0.50 0.38 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.299 ( -4.163 6.113 8.289) 11.109 3.299 ( 4.163 6.113 8.289) 11.109 3.882 ( -11.213 7.695 8.073) 15.816 3.882 ( 11.213 7.695 8.073) 15.816 4.652 ( -15.081 -4.073 9.256) 18.158 4.652 ( 15.081 -4.073 9.256) 18.158 4.944 ( -6.609 -14.882 4.294) 16.840 4.944 ( 6.609 -14.882 4.294) 16.840 6.488 ( -7.913 1.280 22.654) 24.030 6.488 ( 7.913 1.280 22.654) 24.030 7.110 ( -5.676 -6.459 3.308) 9.213 7.110 ( 5.676 -6.459 3.308) 9.213 7.933 ( -3.394 2.102 4.467) 5.991 7.933 ( 3.394 2.102 4.467) 5.991 8.441 ( -1.587 5.880 0.623) 6.122 8.441 ( 1.587 5.880 0.623) 6.122 8.664 ( -14.786 6.159 0.993) 16.048 8.664 ( 14.786 6.159 0.993) 16.048 8.853 ( -10.255 2.200 2.806) 10.857 8.853 ( 10.255 2.200 2.806) 10.857 9.149 ( -1.023 -0.714 20.676) 20.713 9.149 ( 1.023 -0.714 20.676) 20.713 9.788 ( -2.052 -9.935 5.352) 11.469 9.788 ( 2.052 -9.935 5.352) 11.469 10.486 ( -9.435 3.530 15.754) 18.700 10.486 ( 9.435 3.530 15.754) 18.700 10.974 ( -5.298 -2.072 -6.016) 8.280 10.974 ( 5.298 -2.072 -6.016) 8.280 11.311 ( -2.141 3.543 -9.104) 10.001 11.311 ( 2.141 3.543 -9.104) 10.001 11.800 ( -8.382 1.084 -11.219) 14.046 11.800 ( 8.382 1.084 -11.219) 14.046 12.193 ( -4.038 -0.312 -0.809) 4.130 12.193 ( 4.038 -0.312 -0.809) 4.130 12.705 ( -10.800 3.400 8.168) 13.961 12.705 ( 10.800 3.400 8.168) 13.961 12.899 ( -12.121 14.424 -4.348) 19.336 12.899 ( 12.121 14.424 -4.348) 19.336 13.022 ( -3.989 -2.424 15.828) 16.502 13.022 ( 3.989 -2.424 15.828) 16.502 13.439 ( -4.721 -9.939 1.717) 11.136 13.439 ( 4.721 -9.939 1.717) 11.136 13.888 ( -6.015 -7.406 0.051) 9.541 13.888 ( 6.015 -7.406 0.051) 9.541 14.856 ( -1.638 2.606 -2.680) 4.082 14.856 ( 1.638 2.606 -2.680) 4.082 15.220 ( -11.477 13.539 8.773) 19.798 15.220 ( 11.477 13.539 8.773) 19.798 15.606 ( -7.816 1.245 -1.978) 8.157 15.606 ( 7.816 1.245 -1.978) 8.157 15.928 ( -11.147 -7.396 6.350) 14.808 15.928 ( 11.147 -7.396 6.350) 14.808 16.184 ( -7.974 -12.967 5.522) 16.193 16.184 ( 7.974 -12.967 5.522) 16.193 17.396 ( -2.630 0.822 -8.588) 9.019 17.396 ( 2.630 0.822 -8.588) 9.019 17.794 ( -2.019 1.751 -8.709) 9.110 17.794 ( 2.019 1.751 -8.709) 9.110 19.374 ( -1.869 -0.331 -7.537) 7.772 19.374 ( 1.869 -0.331 -7.537) 7.772 19.691 ( -3.071 0.897 -15.456) 15.784 19.691 ( 3.071 0.897 -15.456) 15.784 20.190 ( -0.786 -0.701 -22.842) 22.866 20.190 ( 0.786 -0.701 -22.842) 22.866 21.128 ( -1.159 1.906 -3.347) 4.022 21.128 ( 1.159 1.906 -3.347) 4.022======================= Grid point 206 (45/90) =======================q-point: (-0.50 -0.50 0.18)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 84Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.364 ( 0.000 0.000 6.546) 6.546 3.364 ( 0.000 0.000 6.546) 6.546 3.982 ( -0.000 -0.000 9.483) 9.483 3.982 ( 0.000 0.000 9.483) 9.483 4.547 ( -0.000 -0.000 14.114) 14.114 4.547 ( 0.000 0.000 14.114) 14.114 4.836 ( 0.000 0.000 2.130) 2.130 4.836 ( 0.000 0.000 2.130) 2.130 6.504 ( -0.000 -0.000 24.027) 24.027 6.504 ( 0.000 0.000 24.027) 24.027 7.039 ( 0.000 0.000 -0.381) 0.381 7.039 ( 0.000 0.000 -0.381) 0.381 7.945 ( 0.000 0.000 7.930) 7.930 7.945 ( 0.000 0.000 7.930) 7.930 8.536 ( -0.000 -0.000 0.643) 0.643 8.536 ( 0.000 0.000 0.643) 0.643 8.622 ( -0.000 -0.000 -5.983) 5.983 8.622 ( 0.000 0.000 -5.983) 5.983 8.961 ( 0.000 0.000 5.930) 5.930 8.961 ( 0.000 0.000 5.930) 5.930 9.166 ( 0.000 0.000 22.858) 22.858 9.166 ( 0.000 0.000 22.858) 22.858 9.665 ( 0.000 0.000 4.045) 4.045 9.665 ( 0.000 0.000 4.045) 4.045 10.517 ( 0.000 0.000 17.467) 17.467 10.517 ( 0.000 0.000 17.467) 17.467 10.950 ( 0.000 0.000 -6.647) 6.647 10.950 ( 0.000 0.000 -6.647) 6.647 11.340 ( 0.000 0.000 -9.482) 9.482 11.340 ( 0.000 0.000 -9.482) 9.482 11.814 ( -0.000 -0.000 -12.883) 12.883 11.814 ( 0.000 0.000 -12.883) 12.883 12.194 ( 0.000 0.000 0.314) 0.314 12.194 ( 0.000 0.000 0.314) 0.314 12.716 ( -0.000 -0.000 6.882) 6.882 12.716 ( 0.000 0.000 6.882) 6.882 13.003 ( 0.000 0.000 25.129) 25.129 13.003 ( 0.000 0.000 25.129) 25.129 13.119 ( 0.000 0.000 -7.505) 7.505 13.119 ( 0.000 0.000 -7.505) 7.505 13.290 ( -0.000 -0.000 -2.556) 2.556 13.290 ( 0.000 0.000 -2.556) 2.556 13.802 ( 0.000 0.000 -0.482) 0.482 13.802 ( 0.000 0.000 -0.482) 0.482 14.875 ( 0.000 0.000 -6.575) 6.575 14.875 ( 0.000 0.000 -6.575) 6.575 15.454 ( 0.000 0.000 8.103) 8.103 15.454 ( 0.000 0.000 8.103) 8.103 15.572 ( -0.000 -0.000 2.452) 2.452 15.572 ( 0.000 0.000 2.452) 2.452 15.803 ( -0.000 -0.000 11.649) 11.649 15.803 ( -0.000 -0.000 11.649) 11.649 16.058 ( 0.000 0.000 2.391) 2.391 16.058 ( 0.000 0.000 2.391) 2.391 17.406 ( 0.000 0.000 -8.458) 8.458 17.406 ( 0.000 0.000 -8.458) 8.458 17.810 ( -0.000 -0.000 -8.952) 8.952 17.810 ( 0.000 0.000 -8.952) 8.952 19.373 ( 0.000 0.000 -7.898) 7.898 19.373 ( 0.000 0.000 -7.898) 7.898 19.703 ( 0.000 0.000 -14.505) 14.505 19.703 ( 0.000 0.000 -14.505) 14.505 20.178 ( 0.000 0.000 -25.322) 25.322 20.178 ( 0.000 0.000 -25.322) 25.322 21.148 ( 0.000 0.000 -2.876) 2.876 21.148 ( 0.000 0.000 -2.876) 2.876======================= Grid point 243 (46/90) =======================q-point: ( 0.00 0.00 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.548 ( 0.000 0.000 37.277) 37.277 2.548 ( 0.000 0.000 37.277) 37.277 3.398 ( 0.000 0.000 19.374) 19.374 3.844 ( 0.000 0.000 -4.980) 4.980 4.645 ( 0.000 0.000 -6.378) 6.378 4.645 ( 0.000 0.000 -6.378) 6.378 6.334 ( 0.000 0.000 -3.394) 3.394 6.334 ( 0.000 0.000 -3.394) 3.394 6.525 ( -0.000 0.000 42.368) 42.368 6.609 ( 0.000 0.000 -5.306) 5.306 6.824 ( -0.000 -0.000 -9.678) 9.678 6.824 ( 0.000 0.000 -9.678) 9.678 6.877 ( 0.000 0.000 -3.501) 3.501 7.973 ( -0.000 -0.000 23.960) 23.960 8.225 ( 0.000 0.000 18.840) 18.840 8.225 ( 0.000 0.000 18.840) 18.840 8.630 ( 0.000 0.000 18.494) 18.494 9.175 ( -0.000 -0.000 3.018) 3.018 9.175 ( 0.000 0.000 3.018) 3.018 9.272 ( -0.000 -0.000 14.640) 14.640 9.705 ( 0.000 0.000 17.977) 17.977 10.003 ( -0.000 0.000 -28.081) 28.081 10.042 ( 0.000 0.000 12.556) 12.556 10.042 ( 0.000 0.000 12.556) 12.556 10.411 ( 0.000 0.000 2.505) 2.505 10.411 ( 0.000 0.000 2.505) 2.505 10.456 ( 0.000 0.000 26.425) 26.425 10.768 ( 0.000 0.000 -13.803) 13.803 10.768 ( 0.000 0.000 -13.803) 13.803 10.796 ( 0.000 0.000 -14.487) 14.487 11.604 ( 0.000 0.000 -5.889) 5.889 12.067 ( 0.000 0.000 -7.715) 7.715 12.067 ( 0.000 0.000 -7.715) 7.715 12.240 ( 0.000 0.000 11.071) 11.071 12.333 ( 0.000 0.000 7.484) 7.484 12.720 ( 0.000 0.000 -22.901) 22.901 13.030 ( 0.000 0.000 -8.291) 8.291 13.401 ( -0.000 -0.000 29.251) 29.251 13.447 ( -0.000 0.000 -11.183) 11.183 13.494 ( 0.000 0.000 -2.121) 2.121 13.494 ( 0.000 0.000 -2.121) 2.121 13.763 ( 0.000 0.000 38.489) 38.489 13.893 ( -0.000 -0.000 1.564) 1.564 13.893 ( -0.000 -0.000 1.564) 1.564 14.863 ( 0.000 -0.000 12.271) 12.271 15.126 ( -0.000 0.000 15.448) 15.448 15.126 ( 0.000 0.000 15.448) 15.448 15.251 ( 0.000 0.000 3.556) 3.556 15.381 ( -0.000 0.000 1.956) 1.956 15.381 ( 0.000 0.000 1.956) 1.956 16.055 ( -0.000 -0.000 4.544) 4.544 16.055 ( 0.000 0.000 4.544) 4.544 16.561 ( 0.000 0.000 -17.893) 17.893 16.727 ( 0.000 0.000 -13.863) 13.863 16.838 ( 0.000 0.000 -12.184) 12.184 16.838 ( 0.000 0.000 -12.184) 12.184 17.144 ( -0.000 -0.000 -14.322) 14.322 17.445 ( -0.000 0.000 -6.061) 6.061 18.906 ( -0.000 0.000 -38.191) 38.191 19.067 ( -0.000 -0.000 -18.888) 18.888 19.557 ( 0.000 -0.000 -4.904) 4.904 19.557 ( 0.000 0.000 -4.904) 4.904 20.218 ( 0.000 0.000 -13.172) 13.172 20.218 ( -0.000 -0.000 -13.172) 13.172 21.172 ( -0.000 -0.000 4.799) 4.799 21.230 ( 0.000 0.000 1.614) 1.614======================= Grid point 244 (47/90) =======================q-point: ( 0.12 0.00 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.623 ( 6.895 0.000 34.102) 34.792 2.645 ( 9.578 0.000 33.866) 35.194 3.555 ( 13.502 0.000 14.975) 20.163 3.826 ( 0.446 0.000 -4.203) 4.226 4.506 ( -13.469 0.000 -4.841) 14.312 4.749 ( 9.748 0.000 -4.483) 10.730 6.280 ( -5.034 0.000 -1.976) 5.408 6.296 ( -3.112 0.000 -2.045) 3.723 6.510 ( -1.035 0.000 32.773) 32.790 6.634 ( -7.667 0.000 -4.396) 8.838 6.744 ( 9.336 0.000 -5.673) 10.925 6.944 ( 11.555 0.000 2.438) 11.809 7.078 ( 11.761 0.000 -9.684) 15.235 7.969 ( -0.273 0.000 25.306) 25.307 8.209 ( -2.331 0.000 16.606) 16.768 8.258 ( 3.800 0.000 14.238) 14.737 8.745 ( 10.694 0.000 19.812) 22.514 8.960 ( -13.869 0.000 9.305) 16.701 9.183 ( 0.842 0.000 3.891) 3.981 9.297 ( -4.998 0.000 9.989) 11.170 9.746 ( 6.110 0.000 16.226) 17.338 9.912 ( -4.061 0.000 -10.577) 11.329 10.084 ( 3.567 0.000 11.773) 12.302 10.108 ( -14.590 0.000 8.034) 16.656 10.263 ( 10.806 0.000 -0.261) 10.809 10.423 ( 1.276 0.000 3.730) 3.942 10.534 ( 1.970 0.000 10.173) 10.362 10.824 ( 5.453 0.000 -16.094) 16.993 10.866 ( 5.608 0.000 -7.865) 9.660 10.893 ( 8.858 0.000 -11.256) 14.323 11.520 ( -8.645 0.000 -6.928) 11.078 11.826 ( -16.691 0.000 0.754) 16.708 11.971 ( -8.714 0.000 -2.519) 9.071 12.353 ( 1.562 0.000 1.365) 2.074 12.434 ( 11.927 0.000 4.087) 12.607 12.646 ( -7.733 0.000 -20.645) 22.046 12.948 ( -7.740 0.000 -9.203) 12.025 13.213 ( -8.919 0.000 25.055) 26.595 13.385 ( -3.891 0.000 -8.142) 9.023 13.603 ( 9.959 0.000 -0.172) 9.961 13.606 ( 0.256 0.000 20.531) 20.533 13.850 ( 9.818 0.000 7.964) 12.642 13.904 ( 1.450 0.000 1.553) 2.125 14.123 ( 20.437 0.000 6.873) 21.562 14.658 ( -13.403 0.000 15.104) 20.194 15.075 ( -8.697 0.000 11.781) 14.643 15.100 ( -7.326 0.000 7.002) 10.134 15.238 ( -0.953 0.000 2.744) 2.904 15.474 ( 14.703 0.000 10.870) 18.285 15.475 ( 5.208 0.000 1.717) 5.484 15.870 ( -15.285 0.000 0.227) 15.287 15.982 ( -6.181 0.000 1.556) 6.374 16.658 ( 8.673 0.000 -14.919) 17.257 16.720 ( 0.286 0.000 -11.151) 11.155 16.910 ( 6.792 0.000 -11.825) 13.637 16.933 ( 2.414 0.000 -15.490) 15.677 17.191 ( 6.923 0.000 -8.983) 11.341 17.469 ( 2.594 0.000 -6.727) 7.210 18.927 ( 2.272 0.000 -36.241) 36.312 19.055 ( -0.655 0.000 -17.297) 17.310 19.557 ( 0.110 0.000 -5.244) 5.246 19.580 ( 1.739 0.000 -6.730) 6.951 20.140 ( -7.477 0.000 -8.961) 11.670 20.178 ( -4.021 0.000 -12.993) 13.601 21.121 ( -5.436 0.000 3.408) 6.415 21.181 ( -4.074 0.000 -1.032) 4.203======================= Grid point 245 (48/90) =======================q-point: ( 0.25 0.00 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 225Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.791 ( 10.451 0.000 25.163) 27.248 2.886 ( 14.499 0.000 25.630) 29.447 3.626 ( -5.149 0.000 -1.238) 5.295 4.089 ( 23.355 0.000 6.743) 24.309 4.179 ( -19.096 0.000 -1.440) 19.150 4.960 ( 10.182 0.000 -0.130) 10.182 6.172 ( -4.775 0.000 0.013) 4.775 6.229 ( -3.240 0.000 1.637) 3.630 6.499 ( -0.454 0.000 22.904) 22.908 6.512 ( -4.532 0.000 -2.062) 4.979 6.961 ( 11.559 0.000 -6.731) 13.376 7.243 ( 19.276 0.000 18.773) 26.907 7.290 ( 9.565 0.000 -13.347) 16.420 7.964 ( -0.385 0.000 27.203) 27.206 8.111 ( -7.832 0.000 11.885) 14.234 8.377 ( 7.861 0.000 8.406) 11.509 8.733 ( -8.322 0.000 12.605) 15.104 8.956 ( 7.607 0.000 18.967) 20.435 9.130 ( -10.163 0.000 10.563) 14.658 9.232 ( 6.338 0.000 6.940) 9.399 9.692 ( -17.274 0.000 5.935) 18.265 9.909 ( 9.386 0.000 14.712) 17.451 9.974 ( 0.683 0.000 -6.418) 6.455 10.162 ( 4.277 0.000 11.066) 11.864 10.406 ( 1.485 0.000 3.542) 3.840 10.460 ( 2.702 0.000 4.238) 5.027 10.677 ( 13.163 0.000 2.064) 13.324 10.900 ( -1.961 0.000 -6.320) 6.617 10.944 ( 5.167 0.000 -17.984) 18.712 11.089 ( 10.834 0.000 -6.930) 12.861 11.288 ( -14.571 0.000 -7.883) 16.566 11.507 ( -14.524 0.000 2.830) 14.797 11.785 ( -9.153 0.000 0.511) 9.167 12.378 ( 0.777 0.000 -4.362) 4.431 12.423 ( -14.116 0.000 -13.247) 19.358 12.648 ( 9.240 0.000 2.321) 9.527 12.756 ( -11.607 0.000 -10.243) 15.481 13.073 ( -6.191 0.000 26.528) 27.240 13.357 ( 0.971 0.000 -3.313) 3.452 13.582 ( -1.627 0.000 22.530) 22.589 13.814 ( 10.307 0.000 2.651) 10.643 13.976 ( 6.982 0.000 1.982) 7.258 14.018 ( 6.931 0.000 1.833) 7.169 14.382 ( -8.491 0.000 7.375) 11.247 14.603 ( 19.307 0.000 7.526) 20.722 14.836 ( -13.033 0.000 6.179) 14.424 14.980 ( -7.497 0.000 11.807) 13.986 15.164 ( -3.953 0.000 1.648) 4.282 15.552 ( 3.022 0.000 0.949) 3.168 15.562 ( -10.854 0.000 -5.301) 12.079 15.840 ( 17.525 0.000 8.616) 19.529 15.857 ( -6.303 0.000 -0.940) 6.373 16.720 ( -1.666 0.000 -10.559) 10.689 16.844 ( -9.168 0.000 -16.760) 19.104 16.851 ( 10.639 0.000 -11.999) 16.036 17.061 ( 7.817 0.000 -11.133) 13.603 17.377 ( 9.282 0.000 -1.872) 9.469 17.544 ( 4.921 0.000 -7.548) 9.010 19.000 ( 5.442 0.000 -28.926) 29.434 19.065 ( 2.031 0.000 -16.797) 16.919 19.570 ( 1.554 0.000 -6.286) 6.475 19.590 ( -1.360 0.000 -9.922) 10.015 19.965 ( -9.815 0.000 -4.518) 10.805 20.068 ( -7.229 0.000 -12.425) 14.375 20.992 ( -6.586 0.000 -1.040) 6.668 21.095 ( -4.852 0.000 -4.541) 6.645======================= Grid point 246 (49/90) =======================q-point: ( 0.38 0.00 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.019 ( 12.805 0.000 13.748) 18.788 3.176 ( 15.290 0.000 16.242) 22.307 3.479 ( -9.560 0.000 -1.278) 9.645 3.810 ( -18.545 0.000 2.821) 18.758 4.529 ( 20.856 0.000 6.673) 21.898 5.049 ( -2.626 0.000 4.062) 4.837 6.168 ( 5.298 0.000 3.598) 6.404 6.209 ( 1.863 0.000 4.396) 4.775 6.424 ( -5.541 0.000 2.135) 5.938 6.461 ( -4.222 0.000 13.797) 14.429 7.173 ( 10.445 0.000 -10.481) 14.797 7.413 ( 2.298 0.000 -13.748) 13.939 7.680 ( 25.554 0.000 29.298) 38.876 7.929 ( -4.454 0.000 17.319) 17.882 7.957 ( -5.275 0.000 19.020) 19.738 8.466 ( -3.111 0.000 15.236) 15.550 8.671 ( 1.891 0.000 14.055) 14.181 8.941 ( -9.263 0.000 11.939) 15.111 8.995 ( 0.914 0.000 10.431) 10.471 9.326 ( -10.621 0.000 2.374) 10.883 9.520 ( 12.286 0.000 10.826) 16.376 9.977 ( -2.951 0.000 0.552) 3.002 10.078 ( 7.723 0.000 15.034) 16.901 10.226 ( 1.319 0.000 13.424) 13.489 10.443 ( 4.639 0.000 -2.241) 5.152 10.549 ( 7.441 0.000 -0.086) 7.442 10.783 ( -6.049 0.000 -2.949) 6.729 10.860 ( -1.343 0.000 -2.502) 2.840 10.940 ( -6.349 0.000 -11.157) 12.837 11.003 ( -13.472 0.000 -3.637) 13.954 11.314 ( 12.345 0.000 -7.411) 14.398 11.418 ( 8.896 0.000 -2.296) 9.187 11.654 ( -4.929 0.000 -2.688) 5.614 12.107 ( -18.372 0.000 -8.389) 20.196 12.381 ( -0.177 0.000 -7.445) 7.447 12.534 ( -10.304 0.000 -10.484) 14.700 12.798 ( 6.312 0.000 6.357) 8.958 12.973 ( -4.260 0.000 21.674) 22.088 13.398 ( 2.954 0.000 6.387) 7.038 13.545 ( -2.725 0.000 15.906) 16.138 13.986 ( 8.668 0.000 3.857) 9.487 14.116 ( 3.330 0.000 4.103) 5.284 14.150 ( 8.028 0.000 4.001) 8.970 14.223 ( -5.825 0.000 10.986) 12.435 14.614 ( -8.245 0.000 6.508) 10.504 14.809 ( -10.002 0.000 9.722) 13.948 14.859 ( 5.750 0.000 -0.130) 5.752 15.076 ( -6.849 0.000 0.299) 6.856 15.578 ( 14.821 0.000 -8.347) 17.010 15.604 ( 2.713 0.000 0.074) 2.714 15.747 ( -5.003 0.000 -1.379) 5.190 16.114 ( 6.746 0.000 3.823) 7.754 16.574 ( -9.197 0.000 -16.427) 18.826 16.716 ( -5.038 0.000 -7.830) 9.311 17.044 ( 8.769 0.000 -10.553) 13.721 17.173 ( 3.104 0.000 -10.492) 10.942 17.516 ( 5.812 0.000 -1.240) 5.942 17.623 ( 2.104 0.000 -3.924) 4.452 19.130 ( 5.764 0.000 -10.333) 11.832 19.135 ( 6.129 0.000 -26.547) 27.246 19.536 ( -2.765 0.000 -13.240) 13.526 19.627 ( 4.639 0.000 -7.952) 9.207 19.770 ( -10.634 0.000 -7.036) 12.751 19.911 ( -8.714 0.000 -11.386) 14.338 20.907 ( -1.811 0.000 -4.563) 4.909 20.999 ( -4.820 0.000 -6.632) 8.199======================= Grid point 247 (50/90) =======================q-point: (-0.50 0.00 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 140Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.266 ( -12.311 0.000 4.121) 12.983 3.266 ( 12.311 0.000 4.121) 12.983 3.476 ( -16.163 0.000 8.428) 18.229 3.476 ( 16.163 0.000 8.428) 18.229 4.872 ( -14.389 0.000 6.438) 15.764 4.872 ( 14.389 0.000 6.438) 15.764 6.298 ( -6.648 0.000 4.800) 8.200 6.298 ( 6.648 0.000 4.800) 8.200 6.328 ( -9.087 0.000 7.560) 11.821 6.328 ( 9.087 0.000 7.560) 11.821 7.355 ( -7.624 0.000 -13.495) 15.500 7.355 ( 7.624 0.000 -13.495) 15.500 7.891 ( -1.815 0.000 18.269) 18.359 7.891 ( 1.815 0.000 18.269) 18.359 8.178 ( -23.822 0.000 29.205) 37.689 8.178 ( 23.822 0.000 29.205) 37.689 8.775 ( -7.752 0.000 13.488) 15.557 8.775 ( 7.752 0.000 13.488) 15.557 9.107 ( -9.711 0.000 0.977) 9.760 9.107 ( 9.711 0.000 0.977) 9.760 9.812 ( -13.661 0.000 8.046) 15.854 9.812 ( 13.661 0.000 8.046) 15.854 10.195 ( -4.189 0.000 14.963) 15.538 10.195 ( 4.189 0.000 14.963) 15.538 10.602 ( -10.740 0.000 -7.045) 12.844 10.602 ( 10.740 0.000 -7.045) 12.844 10.746 ( -11.831 0.000 -4.613) 12.698 10.746 ( 11.831 0.000 -4.613) 12.698 10.841 ( -2.628 0.000 -0.440) 2.665 10.841 ( 2.628 0.000 -0.440) 2.665 11.531 ( -9.102 0.000 -6.698) 11.301 11.531 ( 9.102 0.000 -6.698) 11.301 11.733 ( -19.708 0.000 -5.058) 20.347 11.733 ( 19.708 0.000 -5.058) 20.347 12.400 ( -3.250 0.000 -9.429) 9.974 12.400 ( 3.250 0.000 -9.429) 9.974 12.896 ( -4.153 0.000 13.906) 14.513 12.896 ( 4.153 0.000 13.906) 14.513 13.471 ( -4.435 0.000 11.408) 12.240 13.471 ( 4.435 0.000 11.408) 12.240 14.153 ( -7.210 0.000 4.729) 8.623 14.153 ( 7.210 0.000 4.729) 8.623 14.158 ( -1.789 0.000 8.420) 8.608 14.158 ( 1.789 0.000 8.420) 8.608 14.620 ( -8.082 0.000 7.563) 11.069 14.620 ( 8.082 0.000 7.563) 11.069 14.946 ( -5.391 0.000 -1.515) 5.600 14.946 ( 5.391 0.000 -1.515) 5.600 15.664 ( -3.642 0.000 -0.802) 3.730 15.664 ( 3.642 0.000 -0.802) 3.730 15.952 ( -19.186 0.000 -6.544) 20.272 15.952 ( 19.186 0.000 -6.544) 20.272 16.589 ( -7.363 0.000 -8.170) 10.998 16.589 ( 7.363 0.000 -8.170) 10.998 17.168 ( -3.648 0.000 -10.159) 10.794 17.168 ( 3.648 0.000 -10.159) 10.794 17.608 ( -3.333 0.000 -1.460) 3.639 17.608 ( 3.333 0.000 -1.460) 3.639 19.204 ( -1.415 0.000 -15.981) 16.043 19.204 ( 1.415 0.000 -15.981) 16.043 19.575 ( -7.885 0.000 -12.679) 14.930 19.575 ( 7.885 0.000 -12.679) 14.930 19.749 ( -7.718 0.000 -9.827) 12.496 19.749 ( 7.718 0.000 -9.827) 12.496 20.921 ( -2.879 0.000 -6.481) 7.092 20.921 ( 2.879 0.000 -6.481) 7.092======================= Grid point 253 (51/90) =======================q-point: ( 0.12 0.12 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.701 ( 7.594 7.594 34.835) 36.453 2.720 ( 7.442 7.442 28.282) 30.177 3.701 ( 13.140 13.140 12.725) 22.522 3.782 ( -2.753 -2.753 -5.187) 6.486 4.552 ( -4.249 -4.249 -2.113) 6.369 4.675 ( 1.448 1.448 -4.464) 4.912 6.245 ( -4.319 -4.319 -0.180) 6.111 6.259 ( -4.322 -4.322 -2.509) 6.607 6.403 ( -5.938 -5.938 15.862) 17.948 6.776 ( 6.522 6.522 22.453) 24.273 6.820 ( 9.666 9.666 -5.600) 14.772 6.941 ( 4.341 4.341 -9.147) 11.016 7.199 ( 9.454 9.454 -5.744) 14.551 7.967 ( -0.107 -0.107 26.013) 26.013 8.220 ( -0.376 -0.376 12.396) 12.407 8.232 ( -1.040 -1.040 14.877) 14.950 8.822 ( 5.559 5.559 18.019) 19.659 8.969 ( -5.525 -5.525 6.121) 9.925 8.977 ( -4.480 -4.480 14.044) 15.407 9.408 ( 0.817 0.817 3.138) 3.344 9.671 ( -3.425 -3.425 15.816) 16.541 9.926 ( 1.512 1.512 -9.950) 10.177 10.000 ( -9.281 -9.281 16.453) 21.047 10.183 ( 4.648 4.648 10.336) 12.249 10.253 ( 0.740 0.740 3.116) 3.287 10.419 ( 6.933 6.933 -5.894) 11.441 10.686 ( 6.702 6.702 13.003) 16.091 10.765 ( 0.140 0.140 -12.317) 12.318 10.959 ( 6.699 6.699 -13.707) 16.662 10.975 ( 5.370 5.370 -9.482) 12.148 11.429 ( -8.742 -8.742 -6.406) 13.924 11.745 ( -8.125 -8.125 0.949) 11.530 11.910 ( -5.453 -5.453 1.184) 7.802 12.316 ( -3.219 -3.219 -5.204) 6.914 12.492 ( 4.623 4.623 2.360) 6.951 12.634 ( -1.927 -1.927 -16.240) 16.467 12.862 ( -6.732 -6.732 -5.465) 10.978 13.182 ( -3.023 -3.023 22.132) 22.541 13.385 ( -1.252 -1.252 -9.155) 9.325 13.596 ( -0.742 -0.742 23.043) 23.067 13.696 ( 7.420 7.420 0.485) 10.505 13.770 ( -0.282 -0.282 8.510) 8.520 14.024 ( 6.497 6.497 0.040) 9.189 14.293 ( 15.470 15.470 4.531) 22.342 14.497 ( -12.524 -12.524 14.995) 23.207 15.016 ( -6.855 -6.855 6.639) 11.750 15.177 ( 2.793 2.793 12.444) 13.056 15.178 ( -4.795 -4.795 -0.843) 6.833 15.505 ( 2.045 2.045 3.699) 4.695 15.537 ( 8.860 8.860 10.304) 16.223 15.738 ( -10.505 -10.505 -2.136) 15.009 15.961 ( -4.069 -4.069 2.285) 6.192 16.632 ( 0.784 0.784 -16.374) 16.411 16.771 ( 3.792 3.792 -10.500) 11.790 16.891 ( 1.786 1.786 -15.492) 15.697 17.136 ( 10.109 10.109 -8.406) 16.584 17.184 ( 2.056 2.056 -8.286) 8.781 17.485 ( 1.855 1.855 -7.382) 7.834 18.949 ( 2.358 2.358 -34.838) 34.997 19.051 ( -0.121 -0.121 -15.842) 15.843 19.478 ( -3.765 -3.765 -7.606) 9.285 19.666 ( 4.225 4.225 -6.426) 8.775 19.993 ( -9.989 -9.989 -6.994) 15.762 20.221 ( -0.273 -0.273 -12.452) 12.458 21.090 ( -3.553 -3.553 2.828) 5.766 21.129 ( -4.210 -4.210 -3.525) 6.919======================= Grid point 254 (52/90) =======================q-point: ( 0.25 0.12 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.861 ( 9.333 7.414 24.443) 27.194 2.945 ( 14.438 5.328 24.029) 28.535 3.662 ( -6.637 3.184 -2.834) 7.888 4.080 ( 21.576 0.470 6.653) 22.583 4.279 ( -17.932 8.782 0.000) 19.967 4.862 ( 11.282 -8.878 -0.336) 14.360 6.058 ( -11.683 -8.842 2.382) 14.844 6.181 ( -4.574 -10.415 2.072) 11.562 6.361 ( 0.901 -0.055 11.312) 11.348 6.792 ( -2.033 16.451 9.597) 19.154 7.058 ( 12.911 10.029 -6.699) 17.668 7.190 ( 17.401 -4.151 4.946) 18.560 7.384 ( 9.642 7.654 0.696) 12.330 7.967 ( 0.095 0.326 26.830) 26.833 8.123 ( -7.293 0.912 11.285) 13.467 8.292 ( 5.074 -6.557 9.937) 12.941 8.733 ( -6.287 -1.340 7.057) 9.546 8.933 ( -1.326 -5.298 14.909) 15.878 9.072 ( 6.683 2.475 19.225) 20.503 9.307 ( -5.396 2.176 3.875) 6.990 9.596 ( -9.163 -8.730 6.984) 14.455 9.851 ( -1.971 -4.904 18.387) 19.132 10.010 ( 6.241 2.777 -3.445) 7.651 10.221 ( 0.039 4.622 7.229) 8.580 10.319 ( 5.909 0.881 3.044) 6.705 10.602 ( 6.509 2.546 -8.679) 11.143 10.737 ( 3.417 6.601 8.400) 11.216 10.851 ( 4.440 -1.179 -2.546) 5.252 11.023 ( -0.072 4.649 -10.953) 11.899 11.077 ( -0.082 -2.247 -7.458) 7.789 11.266 ( -2.890 0.746 -7.889) 8.435 11.572 ( -7.030 6.082 1.114) 9.363 11.796 ( -5.196 0.397 1.338) 5.380 12.233 ( -6.028 -8.736 -12.351) 16.285 12.531 ( -3.257 -0.528 -3.820) 5.048 12.585 ( -2.022 0.321 -6.948) 7.243 12.754 ( -2.911 -0.445 -1.684) 3.392 13.106 ( -4.850 2.601 23.079) 23.726 13.350 ( -0.972 -0.798 -5.664) 5.802 13.575 ( -1.342 -0.680 23.452) 23.500 13.823 ( 4.878 -8.323 4.994) 10.863 13.855 ( 8.122 3.554 2.673) 9.259 14.164 ( 5.047 5.197 0.110) 7.245 14.257 ( -8.198 -7.104 13.681) 17.460 14.589 ( 9.781 -1.671 2.691) 10.281 14.866 ( -6.143 2.865 6.595) 9.457 15.059 ( -5.991 -1.226 2.828) 6.737 15.193 ( -0.501 9.193 6.589) 11.322 15.510 ( -5.697 -2.733 -1.525) 6.500 15.544 ( -1.533 -2.191 -0.661) 2.755 15.767 ( 5.367 -2.400 1.243) 6.008 15.899 ( 4.807 -0.695 5.771) 7.543 16.676 ( 2.072 -4.644 -11.752) 12.805 16.805 ( -5.278 3.701 -14.968) 16.298 16.924 ( 4.803 1.597 -10.846) 11.969 17.183 ( 3.198 9.302 -8.382) 12.923 17.372 ( 8.607 -0.443 -2.383) 8.942 17.546 ( 4.341 0.718 -8.720) 9.767 19.023 ( 5.329 2.398 -28.651) 29.241 19.067 ( 2.148 0.358 -15.331) 15.485 19.426 ( -1.616 -7.195 -10.874) 13.138 19.696 ( -2.779 0.818 -4.747) 5.561 19.816 ( -6.352 -6.693 -9.062) 12.933 20.154 ( -6.410 2.764 -11.548) 13.494 20.990 ( -5.326 -0.081 -1.577) 5.555 21.059 ( -3.356 -3.186 -5.121) 6.902======================= Grid point 255 (53/90) =======================q-point: ( 0.38 0.12 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.060 ( 10.962 4.703 13.879) 18.300 3.225 ( 12.961 3.809 14.203) 19.602 3.528 ( -5.981 5.978 0.376) 8.465 3.928 ( -17.793 10.656 3.178) 20.982 4.491 ( 20.107 -3.116 6.190) 21.268 4.989 ( -0.525 -5.844 3.463) 6.813 5.900 ( -2.731 -17.286 6.557) 18.688 6.077 ( -6.196 -17.177 6.111) 19.256 6.425 ( 5.866 6.881 7.862) 11.982 6.720 ( -5.730 13.697 6.552) 16.229 7.286 ( 10.096 10.524 -9.752) 17.543 7.403 ( 3.961 -2.320 -10.382) 11.352 7.652 ( 14.967 -2.507 24.357) 28.698 7.936 ( -7.349 1.221 11.228) 13.475 8.022 ( 5.097 6.500 23.535) 24.942 8.407 ( 5.135 -3.792 14.348) 15.704 8.693 ( 0.169 1.024 11.140) 11.188 8.874 ( -4.800 -5.430 11.335) 13.454 9.001 ( -7.152 0.124 11.926) 13.906 9.285 ( -9.912 -4.947 1.568) 11.188 9.498 ( 9.453 -1.219 15.117) 17.871 9.841 ( -1.860 -9.622 14.935) 17.863 10.132 ( 5.316 1.934 7.377) 9.297 10.218 ( 0.297 1.885 2.547) 3.183 10.474 ( 9.423 1.997 -2.209) 9.883 10.629 ( -1.688 -1.504 0.120) 2.264 10.732 ( -4.010 -2.317 6.291) 7.812 10.884 ( -2.677 6.549 -5.456) 8.935 10.921 ( -5.838 -0.274 -3.550) 6.838 11.015 ( -5.828 4.050 -10.546) 12.712 11.387 ( 13.032 2.947 -6.733) 14.961 11.559 ( 4.583 13.753 -4.508) 15.181 11.753 ( 0.738 8.360 -2.211) 8.678 12.064 ( -11.551 -3.845 -11.107) 16.479 12.440 ( -4.762 1.746 -7.289) 8.880 12.476 ( -7.406 -0.858 -6.982) 10.214 12.788 ( 4.754 -1.170 5.709) 7.521 13.003 ( -5.573 3.222 19.383) 20.424 13.364 ( 2.334 -3.447 4.422) 6.074 13.532 ( -3.709 -1.062 18.430) 18.830 13.930 ( 5.417 -10.846 4.426) 12.906 13.998 ( 7.031 -0.387 4.224) 8.211 14.052 ( -5.532 -12.732 9.843) 17.017 14.309 ( -0.534 6.847 4.112) 8.005 14.614 ( 1.511 0.871 8.550) 8.726 14.853 ( 1.505 0.546 0.865) 1.820 14.940 ( -6.647 4.921 5.958) 10.193 15.096 ( -9.672 5.506 0.831) 11.160 15.542 ( 5.583 -3.435 -4.449) 7.922 15.580 ( 5.431 -0.810 -1.777) 5.771 15.749 ( 2.073 0.465 -4.086) 4.605 16.104 ( 7.103 -1.855 5.136) 8.959 16.609 ( -9.800 2.138 -13.289) 16.649 16.676 ( -2.872 -2.514 -6.042) 7.147 17.066 ( 7.982 1.450 -9.547) 12.528 17.235 ( 0.733 5.204 -9.059) 10.473 17.500 ( 5.563 -1.518 -2.054) 6.121 17.614 ( 1.474 -0.466 -5.484) 5.698 19.132 ( 4.722 0.240 -11.933) 12.836 19.150 ( 6.625 1.720 -24.209) 25.158 19.411 ( -0.184 -7.727 -14.719) 16.625 19.576 ( -7.030 -9.427 -4.436) 12.569 19.761 ( -0.643 3.227 -14.488) 14.856 19.991 ( -9.850 3.067 -11.608) 15.530 20.925 ( -1.145 1.961 -4.406) 4.957 20.995 ( -3.281 -0.199 -6.203) 7.020======================= Grid point 256 (54/90) =======================q-point: (-0.50 0.12 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.260 ( -8.547 0.931 5.543) 10.230 3.260 ( 8.547 0.931 5.543) 10.230 3.613 ( -14.190 11.830 7.278) 19.857 3.613 ( 14.190 11.830 7.278) 19.857 4.830 ( -14.319 -3.757 6.014) 15.979 4.830 ( 14.319 -3.757 6.014) 15.979 5.951 ( -6.144 -21.048 7.768) 23.261 5.951 ( 6.144 -21.048 7.768) 23.261 6.574 ( -8.684 11.169 6.562) 15.595 6.574 ( 8.684 11.169 6.562) 15.595 7.417 ( -2.847 4.027 -11.228) 12.264 7.417 ( 2.847 4.027 -11.228) 12.264 7.799 ( -5.117 -5.466 16.526) 18.143 7.799 ( 5.117 -5.466 16.526) 18.143 8.312 ( -16.807 11.047 24.913) 32.018 8.312 ( 16.807 11.047 24.913) 32.019 8.729 ( -6.128 -3.393 14.681) 16.266 8.729 ( 6.128 -3.393 14.681) 16.266 9.061 ( -10.286 -5.210 -0.421) 11.538 9.061 ( 10.286 -5.210 -0.421) 11.538 9.725 ( -10.237 -6.211 16.161) 20.114 9.725 ( 10.237 -6.211 16.161) 20.114 10.208 ( -2.516 -0.536 5.090) 5.703 10.208 ( 2.516 -0.536 5.090) 5.703 10.583 ( -2.052 -6.026 3.575) 7.301 10.583 ( 2.052 -6.026 3.575) 7.301 10.771 ( -8.238 7.971 -1.338) 11.541 10.771 ( 8.238 7.971 -1.338) 11.541 10.894 ( -2.937 5.305 -9.532) 11.297 10.894 ( 2.937 5.305 -9.532) 11.297 11.613 ( -4.173 2.629 -8.515) 9.840 11.613 ( 4.173 2.629 -8.515) 9.840 11.826 ( -9.782 11.714 -4.384) 15.878 11.826 ( 9.782 11.714 -4.384) 15.878 12.388 ( -0.709 -0.391 -8.056) 8.097 12.388 ( 0.709 -0.391 -8.056) 8.097 12.894 ( -5.758 -0.099 12.544) 13.803 12.894 ( 5.758 -0.099 12.544) 13.803 13.438 ( -5.111 -3.194 12.263) 13.664 13.438 ( 5.111 -3.194 12.263) 13.664 13.993 ( -1.704 -12.132 7.845) 14.547 13.993 ( 1.704 -12.132 7.845) 14.547 14.170 ( -10.020 -0.392 4.504) 10.993 14.170 ( 10.020 -0.392 4.504) 10.993 14.759 ( -9.972 10.287 10.720) 17.894 14.759 ( 9.972 10.287 10.720) 17.894 14.932 ( -5.714 -0.331 -3.896) 6.924 14.932 ( 5.714 -0.331 -3.896) 6.924 15.597 ( -2.298 -4.829 -2.702) 5.992 15.597 ( 2.298 -4.829 -2.702) 5.992 15.994 ( -15.826 2.680 -3.988) 16.539 15.994 ( 15.826 2.680 -3.988) 16.539 16.584 ( -5.365 -0.705 -5.478) 7.700 16.584 ( 5.365 -0.705 -5.478) 7.700 17.195 ( -4.767 2.005 -9.036) 10.411 17.195 ( 4.767 2.005 -9.036) 10.411 17.591 ( -3.472 -1.246 -2.961) 4.730 17.591 ( 3.472 -1.246 -2.961) 4.730 19.210 ( -1.898 0.637 -15.526) 15.654 19.210 ( 1.898 0.637 -15.526) 15.654 19.452 ( -5.370 -8.500 -12.874) 16.335 19.452 ( 5.370 -8.500 -12.874) 16.335 19.817 ( -6.847 3.018 -13.173) 15.150 19.817 ( 6.847 3.018 -13.173) 15.150 20.939 ( -2.203 1.950 -5.838) 6.537 20.939 ( 2.203 1.950 -5.838) 6.537======================= Grid point 263 (55/90) =======================q-point: ( 0.25 0.25 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 201Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.051 ( 8.902 8.902 12.066) 17.438 3.080 ( 10.908 10.908 26.954) 31.057 3.695 ( -0.586 -0.586 -2.202) 2.353 4.179 ( 10.780 10.780 5.531) 16.218 4.376 ( -4.380 -4.380 3.916) 7.328 4.747 ( 2.054 2.054 -0.890) 3.039 5.842 ( -14.617 -14.617 4.292) 21.112 5.921 ( -12.779 -12.779 7.619) 19.613 6.425 ( 5.382 5.382 12.638) 14.752 7.028 ( -0.042 -0.042 -6.669) 6.670 7.158 ( 7.525 7.525 14.832) 18.255 7.311 ( 14.276 14.276 -6.958) 21.355 7.525 ( 5.057 5.057 5.586) 9.074 7.996 ( 3.939 3.939 25.069) 25.680 8.107 ( -2.429 -2.429 16.593) 16.944 8.235 ( 2.085 2.085 2.745) 4.029 8.666 ( -3.135 -3.135 2.338) 5.012 8.853 ( -2.933 -2.933 19.901) 20.329 9.161 ( 3.272 3.272 20.441) 20.958 9.241 ( -8.634 -8.634 -3.931) 12.828 9.456 ( -2.871 -2.871 14.153) 14.724 9.750 ( -5.079 -5.079 21.126) 22.314 10.087 ( 4.804 4.804 -0.021) 6.794 10.335 ( 0.202 0.202 11.625) 11.629 10.343 ( 5.524 5.524 -6.629) 10.246 10.562 ( -4.707 -4.707 -8.455) 10.760 10.853 ( 1.904 1.904 14.474) 14.723 10.894 ( 6.283 6.283 -7.607) 11.697 10.970 ( -3.873 -3.873 -4.321) 6.976 11.113 ( 2.434 2.434 -8.806) 9.455 11.362 ( 5.598 5.598 -7.402) 10.838 11.697 ( 6.488 6.488 -0.698) 9.202 11.817 ( 3.202 3.202 0.291) 4.538 12.077 ( -6.396 -6.396 -15.495) 17.942 12.408 ( -6.359 -6.359 -3.338) 9.593 12.674 ( 3.179 3.179 -8.945) 10.011 12.739 ( -0.836 -0.836 3.035) 3.257 13.140 ( 0.415 0.415 20.960) 20.969 13.320 ( -2.801 -2.801 -8.595) 9.464 13.554 ( -1.313 -1.313 23.936) 24.008 13.711 ( -2.385 -2.385 8.973) 9.586 13.913 ( -1.084 -1.084 1.746) 2.324 13.979 ( -9.037 -9.037 11.456) 17.163 14.426 ( 12.681 12.681 6.160) 18.962 14.514 ( -5.594 -5.594 4.525) 9.113 14.914 ( -0.237 -0.237 6.299) 6.308 14.956 ( -4.694 -4.694 -5.459) 8.594 15.417 ( -5.188 -5.188 -4.242) 8.475 15.426 ( 10.152 10.152 3.815) 14.855 15.540 ( 1.085 1.085 2.743) 3.143 15.806 ( 3.460 3.460 4.482) 6.635 15.827 ( -1.430 -1.430 2.651) 3.334 16.624 ( -1.244 -1.244 -9.641) 9.800 16.832 ( -5.536 -5.536 -5.714) 9.692 16.957 ( 5.133 5.133 -11.294) 13.426 17.345 ( 5.989 5.989 -7.300) 11.182 17.364 ( 0.603 0.603 -2.357) 2.506 17.585 ( 2.989 2.989 -10.207) 11.047 19.085 ( 1.768 1.768 -12.016) 12.273 19.094 ( 4.967 4.967 -27.731) 28.607 19.322 ( -3.264 -3.264 -15.344) 16.023 19.556 ( -9.435 -9.435 -2.439) 13.565 19.805 ( 0.009 0.009 -15.586) 15.586 20.128 ( -5.333 -5.333 -12.493) 14.593 20.991 ( -0.532 -0.532 -1.348) 1.544 21.003 ( -1.288 -1.288 -7.185) 7.412======================= Grid point 264 (56/90) =======================q-point: ( 0.38 0.25 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.195 ( 7.127 8.348 9.014) 14.204 3.300 ( 7.811 4.129 11.540) 14.534 3.690 ( 2.865 9.258 5.102) 10.952 4.147 ( -14.884 10.186 5.967) 18.997 4.464 ( 16.679 1.691 5.129) 17.532 4.861 ( 3.771 -5.986 1.834) 7.309 5.565 ( -10.639 -16.894 9.273) 22.013 5.700 ( -10.778 -20.667 9.817) 25.292 6.562 ( 8.783 7.146 12.428) 16.812 6.927 ( -7.489 6.922 1.715) 10.341 7.284 ( 3.485 -8.713 4.279) 10.314 7.480 ( -2.922 1.214 -2.561) 4.070 7.610 ( 10.235 4.016 5.155) 12.143 8.002 ( -7.659 4.540 6.552) 11.054 8.213 ( 17.142 14.343 19.431) 29.616 8.391 ( 12.434 2.241 12.543) 17.803 8.678 ( 3.706 -2.062 6.247) 7.551 8.781 ( -4.464 -3.650 18.573) 19.448 8.993 ( -12.595 -1.997 4.406) 13.492 9.157 ( -7.755 -6.201 5.823) 11.511 9.503 ( 6.635 1.961 21.527) 22.611 9.675 ( -2.223 -6.826 20.106) 21.350 10.134 ( -1.354 -4.139 3.427) 5.542 10.234 ( -7.388 -2.394 7.062) 10.497 10.452 ( 3.468 -2.234 1.941) 4.559 10.549 ( 4.117 2.688 -6.075) 7.815 10.848 ( 0.432 7.479 9.792) 12.329 10.903 ( 0.040 -0.628 -8.604) 8.627 11.027 ( 1.014 5.289 -6.393) 8.359 11.114 ( -3.217 4.356 -8.287) 9.900 11.432 ( 5.259 1.524 -6.010) 8.130 11.769 ( -4.304 4.091 -8.713) 10.545 11.907 ( 7.927 4.590 -4.410) 10.167 12.078 ( 5.998 11.845 -8.495) 15.762 12.327 ( -1.057 -5.908 -3.610) 7.004 12.647 ( -6.522 11.169 -7.676) 15.040 12.755 ( 3.740 -1.873 6.387) 7.635 13.093 ( -7.217 5.393 13.325) 16.085 13.268 ( 0.656 -6.396 2.373) 6.854 13.512 ( -5.564 -1.081 21.506) 22.240 13.714 ( 1.474 -11.033 5.504) 12.417 13.771 ( -2.920 -13.439 9.337) 16.623 14.005 ( 4.238 -0.904 7.977) 9.078 14.336 ( -10.550 -4.111 7.173) 13.404 14.683 ( 10.196 3.818 4.165) 11.657 14.868 ( -1.557 -0.253 -0.325) 1.611 14.928 ( 1.234 1.710 -1.832) 2.794 15.283 ( -8.512 7.455 1.084) 11.367 15.502 ( 0.468 -0.381 -0.542) 0.811 15.606 ( -1.664 5.535 -1.098) 5.883 15.795 ( 9.418 4.863 -2.548) 10.901 16.015 ( 9.112 -7.362 5.872) 13.104 16.586 ( -3.752 -3.529 -3.427) 6.187 16.654 ( -9.565 -2.666 1.247) 10.008 17.085 ( 7.055 1.112 -9.846) 12.163 17.311 ( -3.906 0.993 -5.317) 6.672 17.488 ( 6.425 1.629 -6.591) 9.348 17.624 ( 0.229 1.373 -8.206) 8.323 19.140 ( 3.916 0.589 -10.876) 11.575 19.202 ( 5.396 3.630 -23.792) 24.665 19.300 ( 0.375 -3.056 -18.528) 18.782 19.399 ( -6.496 -7.895 -5.944) 11.826 19.779 ( -1.536 -1.913 -19.902) 20.053 19.975 ( -9.585 -4.609 -14.713) 18.155 20.979 ( 0.309 3.358 -4.215) 5.398 21.004 ( -0.000 1.288 -4.870) 5.037======================= Grid point 265 (57/90) =======================q-point: (-0.50 0.25 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 221Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.315 ( -4.501 4.250 4.421) 7.607 3.315 ( 4.501 4.250 4.421) 7.607 3.864 ( -13.537 13.045 9.040) 20.860 3.864 ( 13.537 13.045 9.040) 20.860 4.766 ( -12.791 -1.692 4.607) 13.700 4.766 ( 12.791 -1.692 4.607) 13.700 5.526 ( -5.796 -22.248 10.888) 25.438 5.526 ( 5.796 -22.248 10.888) 25.438 6.751 ( -10.251 7.299 9.135) 15.551 6.751 ( 10.251 7.299 9.135) 15.551 7.366 ( -5.957 -9.758 1.087) 11.485 7.366 ( 5.957 -9.758 1.087) 11.485 7.822 ( -10.459 7.615 2.244) 13.131 7.822 ( 10.459 7.615 2.244) 13.131 8.524 ( -7.637 8.018 15.321) 18.904 8.524 ( 7.637 8.018 15.321) 18.904 8.702 ( -4.152 2.159 17.476) 18.092 8.702 ( 4.152 2.159 17.476) 18.092 8.936 ( -11.144 -5.571 1.443) 12.542 8.936 ( 11.144 -5.571 1.443) 12.542 9.628 ( -4.503 -3.516 21.806) 22.542 9.628 ( 4.503 -3.516 21.806) 22.542 10.117 ( -2.689 -8.585 6.032) 10.831 10.117 ( 2.689 -8.585 6.032) 10.831 10.546 ( -4.504 3.572 0.325) 5.758 10.546 ( 4.504 3.572 0.325) 5.758 10.919 ( -2.351 3.697 1.570) 4.654 10.919 ( 2.351 3.697 1.570) 4.654 11.008 ( -2.533 6.545 -11.222) 13.236 11.008 ( 2.533 6.545 -11.222) 13.236 11.604 ( -10.460 -2.166 -10.145) 14.732 11.604 ( 10.460 -2.166 -10.145) 14.732 12.070 ( -6.906 9.589 -4.824) 12.764 12.070 ( 6.906 9.589 -4.824) 12.764 12.453 ( -11.749 9.210 -5.922) 16.060 12.453 ( 11.749 9.210 -5.922) 16.060 12.899 ( -10.434 0.680 8.898) 13.729 12.899 ( 10.434 0.680 8.898) 13.729 13.361 ( -7.671 -4.470 11.998) 14.926 13.361 ( 7.671 -4.470 11.998) 14.926 13.753 ( -1.645 -11.801 9.312) 15.122 13.753 ( 1.645 -11.801 9.312) 15.122 14.134 ( -9.339 -3.682 8.292) 13.020 14.134 ( 9.339 -3.682 8.292) 13.020 14.802 ( -4.315 -3.841 -2.076) 6.139 14.802 ( 4.315 -3.841 -2.076) 6.139 15.085 ( -11.387 13.754 4.291) 18.365 15.085 ( 11.387 13.754 4.291) 18.365 15.536 ( -3.180 -1.014 -3.586) 4.899 15.536 ( 3.180 -1.014 -3.586) 4.899 16.024 ( -9.206 0.546 -0.614) 9.242 16.024 ( 9.206 0.546 -0.614) 9.242 16.541 ( -2.554 -4.610 3.679) 6.428 16.541 ( 2.554 -4.610 3.679) 6.428 17.213 ( -6.046 -0.192 -7.699) 9.791 17.213 ( 6.046 -0.192 -7.699) 9.791 17.588 ( -3.746 1.185 -6.907) 7.947 17.588 ( 3.746 1.185 -6.907) 7.947 19.224 ( -3.919 0.311 -11.814) 12.451 19.224 ( 3.919 0.311 -11.814) 12.451 19.322 ( -2.419 -3.667 -18.272) 18.792 19.322 ( 2.419 -3.667 -18.272) 18.792 19.811 ( -5.824 -3.630 -18.744) 19.961 19.811 ( 5.824 -3.630 -18.744) 19.961 20.994 ( -0.885 3.525 -4.518) 5.799 20.994 ( 0.885 3.525 -4.518) 5.799======================= Grid point 273 (58/90) =======================q-point: ( 0.38 0.38 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.329 ( 4.868 4.868 1.683) 7.087 3.380 ( 3.175 3.175 6.194) 7.650 3.867 ( 10.036 10.036 11.992) 18.581 4.238 ( -2.534 -2.534 8.754) 9.459 4.578 ( 10.047 10.047 5.752) 15.328 4.818 ( 1.625 1.625 0.908) 2.472 5.266 ( -13.705 -13.705 11.204) 22.387 5.331 ( -16.162 -16.162 14.749) 27.202 6.706 ( 7.898 7.898 14.267) 18.119 6.974 ( -2.092 -2.092 -8.076) 8.600 7.132 ( -4.982 -4.982 20.826) 21.986 7.321 ( -11.023 -11.023 4.425) 16.205 7.803 ( 10.423 10.423 -5.457) 15.717 8.068 ( 0.183 0.183 3.392) 3.402 8.396 ( 5.421 5.421 -0.255) 7.670 8.617 ( 18.014 18.014 23.252) 34.491 8.681 ( 4.373 4.373 8.541) 10.545 8.707 ( -4.992 -4.992 17.689) 19.046 8.877 ( -8.230 -8.230 -0.247) 11.641 9.107 ( -1.360 -1.360 10.484) 10.659 9.571 ( 4.044 4.044 24.973) 25.620 9.591 ( -1.222 -1.222 20.965) 21.036 9.967 ( -9.127 -9.127 2.567) 13.160 10.119 ( -9.588 -9.588 14.643) 19.957 10.514 ( 7.271 7.271 3.337) 10.811 10.660 ( 5.783 5.783 -11.563) 14.163 10.884 ( -0.542 -0.542 -7.874) 7.911 10.914 ( -0.707 -0.707 13.056) 13.095 11.114 ( 2.141 2.141 -8.082) 8.631 11.137 ( -0.819 -0.819 -11.918) 11.974 11.457 ( 2.513 2.513 -8.023) 8.774 11.704 ( -6.924 -6.924 -13.783) 16.907 12.045 ( 8.411 8.411 -2.164) 12.090 12.239 ( -1.781 -1.781 0.362) 2.544 12.418 ( 17.547 17.547 -8.163) 26.123 12.750 ( 2.851 2.851 7.916) 8.884 12.818 ( 3.590 3.590 -9.531) 10.799 13.120 ( -7.275 -7.275 0.636) 10.309 13.160 ( -0.369 -0.369 7.924) 7.941 13.477 ( -10.674 -10.674 -1.740) 15.196 13.508 ( 0.139 0.139 25.215) 25.216 13.624 ( -2.180 -2.180 19.871) 20.108 13.981 ( -0.595 -0.595 10.173) 10.207 14.197 ( -9.157 -9.157 11.294) 17.183 14.702 ( 0.100 0.100 -8.064) 8.065 14.799 ( -4.272 -4.272 -5.434) 8.125 15.128 ( 13.800 13.800 6.086) 20.443 15.352 ( 2.083 2.083 -6.472) 7.111 15.473 ( -1.792 -1.792 -4.539) 5.198 15.777 ( -4.526 -4.526 -1.698) 6.622 15.856 ( 7.901 7.901 10.823) 15.557 15.953 ( 7.202 7.202 4.290) 11.051 16.486 ( -6.877 -6.877 8.529) 12.936 16.528 ( -9.219 -9.219 9.873) 16.355 17.133 ( 3.695 3.695 -11.336) 12.482 17.277 ( -3.202 -3.202 -6.520) 7.938 17.555 ( 3.986 3.986 -8.886) 10.523 17.642 ( -0.020 -0.020 -8.572) 8.572 19.161 ( 1.763 1.763 -9.969) 10.276 19.273 ( 3.242 3.242 -26.564) 26.956 19.279 ( -4.527 -4.527 -7.555) 9.903 19.307 ( 2.990 2.990 -16.655) 17.183 19.709 ( -4.005 -4.005 -26.233) 26.837 19.840 ( -8.418 -8.418 -19.250) 22.634 21.036 ( 2.052 2.052 -4.570) 5.413 21.039 ( 2.038 2.038 -3.107) 4.238======================= Grid point 274 (59/90) =======================q-point: (-0.50 0.38 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.392 ( -1.695 2.984 0.988) 3.571 3.392 ( 1.695 2.984 0.988) 3.571 4.084 ( -11.361 9.353 11.921) 18.938 4.084 ( 11.361 9.353 11.921) 18.938 4.789 ( -8.574 3.612 3.547) 9.957 4.789 ( 8.574 3.612 3.547) 9.957 5.130 ( -3.199 -17.766 14.967) 23.450 5.130 ( 3.199 -17.766 14.967) 23.450 6.862 ( -7.951 4.489 7.541) 11.842 6.862 ( 7.951 4.489 7.541) 11.842 7.146 ( -5.880 -10.889 8.766) 15.165 7.146 ( 5.880 -10.889 8.766) 15.165 7.980 ( -7.775 6.873 -2.042) 10.576 7.980 ( 7.775 6.873 -2.042) 10.576 8.558 ( -9.624 -1.825 4.524) 10.790 8.558 ( 9.624 -1.825 4.524) 10.790 8.740 ( -4.959 -0.970 14.135) 15.011 8.740 ( 4.959 -0.970 14.135) 15.011 8.982 ( -13.116 9.329 10.425) 19.177 8.982 ( 13.116 9.329 10.425) 19.177 9.607 ( -2.263 2.022 22.531) 22.734 9.607 ( 2.263 2.022 22.531) 22.734 9.929 ( -6.909 -10.195 10.492) 16.179 9.929 ( 6.909 -10.195 10.492) 16.179 10.662 ( -6.044 6.972 -2.919) 9.678 10.662 ( 6.044 6.972 -2.919) 9.678 10.891 ( -1.082 -4.852 1.264) 5.130 10.891 ( 1.082 -4.852 1.264) 5.130 11.117 ( -1.572 3.625 -9.643) 10.421 11.117 ( 1.572 3.625 -9.643) 10.421 11.561 ( -7.376 -1.752 -12.462) 14.587 11.561 ( 7.376 -1.752 -12.462) 14.587 12.179 ( -5.035 3.250 -0.470) 6.011 12.179 ( 5.035 3.250 -0.470) 6.011 12.713 ( -11.843 15.017 -7.761) 20.640 12.713 ( 11.843 15.017 -7.761) 20.640 12.908 ( -12.207 -0.057 5.945) 13.577 12.908 ( 12.207 -0.057 5.945) 13.577 13.261 ( -9.692 -6.777 0.709) 11.847 13.261 ( 9.692 -6.777 0.709) 11.847 13.582 ( -3.760 -4.629 22.326) 23.109 13.582 ( 3.760 -4.629 22.326) 23.109 14.032 ( -6.497 -6.161 11.687) 14.723 14.032 ( 6.497 -6.161 11.687) 14.723 14.728 ( -2.752 -2.976 -8.846) 9.731 14.728 ( 2.752 -2.976 -8.846) 9.731 15.331 ( -5.635 10.195 -0.080) 11.649 15.331 ( 5.635 10.195 -0.080) 11.649 15.555 ( -11.383 2.453 -2.536) 11.917 15.555 ( 11.383 2.453 -2.536) 11.917 16.042 ( -2.953 2.393 5.122) 6.378 16.042 ( 2.953 2.393 5.122) 6.378 16.391 ( -1.335 -10.467 15.347) 18.624 16.391 ( 1.335 -10.467 15.347) 18.624 17.209 ( -3.835 0.105 -9.941) 10.656 17.209 ( 3.835 0.105 -9.941) 10.656 17.618 ( -2.393 1.290 -8.590) 9.010 17.618 ( 2.393 1.290 -8.590) 9.010 19.208 ( -3.009 -1.073 -9.109) 9.653 19.208 ( 3.009 -1.073 -9.109) 9.653 19.332 ( -1.781 3.340 -20.969) 21.308 19.332 ( 1.781 3.340 -20.969) 21.308 19.700 ( -4.358 -6.881 -25.532) 26.799 19.700 ( 4.358 -6.881 -25.532) 26.799 21.059 ( -0.168 2.696 -3.583) 4.487 21.059 ( 0.168 2.696 -3.583) 4.487======================= Grid point 287 (60/90) =======================q-point: (-0.50 -0.50 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 84Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.420 ( 0.000 0.000 -0.695) 0.695 3.420 ( 0.000 0.000 -0.695) 0.695 4.190 ( -0.000 -0.000 11.303) 11.303 4.190 ( 0.000 0.000 11.303) 11.303 4.867 ( -0.000 -0.000 0.616) 0.616 4.867 ( 0.000 0.000 0.616) 0.616 4.904 ( 0.000 0.000 21.372) 21.372 4.904 ( 0.000 0.000 21.372) 21.372 6.923 ( -0.000 -0.000 -9.645) 9.645 6.923 ( 0.000 0.000 -9.645) 9.645 7.014 ( 0.000 0.000 27.080) 27.080 7.014 ( 0.000 0.000 27.080) 27.080 8.050 ( 0.000 0.000 -1.653) 1.653 8.050 ( 0.000 0.000 -1.653) 1.653 8.530 ( -0.000 -0.000 -1.611) 1.611 8.530 ( 0.000 0.000 -1.611) 1.611 8.726 ( 0.000 0.000 18.771) 18.771 8.726 ( 0.000 0.000 18.771) 18.771 9.096 ( 0.000 0.000 8.542) 8.542 9.096 ( -0.000 -0.000 8.542) 8.542 9.695 ( -0.000 -0.000 29.378) 29.378 9.695 ( 0.000 0.000 29.378) 29.378 9.762 ( 0.000 0.000 5.283) 5.283 9.762 ( 0.000 0.000 5.283) 5.283 10.771 ( -0.000 -0.000 -11.959) 11.959 10.771 ( 0.000 0.000 -11.959) 11.959 10.798 ( -0.000 -0.000 10.168) 10.168 10.798 ( 0.000 0.000 10.168) 10.168 11.146 ( 0.000 0.000 -9.259) 9.259 11.146 ( 0.000 0.000 -9.259) 9.259 11.545 ( 0.000 0.000 -13.784) 13.784 11.545 ( 0.000 0.000 -13.784) 13.784 12.212 ( 0.000 0.000 1.401) 1.401 12.212 ( 0.000 0.000 1.401) 1.401 12.883 ( 0.000 0.000 6.501) 6.501 12.883 ( 0.000 0.000 6.501) 6.501 12.944 ( 0.000 0.000 -10.134) 10.134 12.944 ( 0.000 0.000 -10.134) 10.134 13.131 ( -0.000 -0.000 -6.365) 6.365 13.131 ( 0.000 0.000 -6.365) 6.365 13.558 ( 0.000 0.000 30.822) 30.822 13.558 ( 0.000 0.000 30.822) 30.822 13.956 ( 0.000 0.000 11.959) 11.959 13.956 ( 0.000 0.000 11.959) 11.959 14.699 ( 0.000 0.000 -10.677) 10.677 14.699 ( 0.000 0.000 -10.677) 10.677 15.433 ( 0.000 0.000 -7.125) 7.125 15.433 ( 0.000 0.000 -7.125) 7.125 15.590 ( 0.000 0.000 -1.311) 1.311 15.590 ( 0.000 0.000 -1.311) 1.311 16.124 ( -0.000 -0.000 4.450) 4.450 16.124 ( 0.000 0.000 4.450) 4.450 16.216 ( -0.000 -0.000 26.576) 26.576 16.216 ( 0.000 0.000 26.576) 26.576 17.212 ( 0.000 0.000 -11.113) 11.113 17.212 ( 0.000 0.000 -11.113) 11.113 17.630 ( -0.000 -0.000 -8.756) 8.756 17.630 ( 0.000 0.000 -8.756) 8.756 19.198 ( 0.000 0.000 -9.458) 9.458 19.198 ( 0.000 0.000 -9.458) 9.458 19.386 ( 0.000 0.000 -16.945) 16.945 19.386 ( 0.000 0.000 -16.945) 16.945 19.610 ( -0.000 -0.000 -31.830) 31.830 19.610 ( 0.000 0.000 -31.830) 31.830 21.086 ( 0.000 0.000 -3.289) 3.289 21.086 ( 0.000 0.000 -3.289) 3.289======================= Grid point 324 (61/90) =======================q-point: ( 0.00 0.00 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.216 ( -0.000 0.000 30.375) 30.375 3.216 ( 0.000 0.000 30.375) 30.375 3.590 ( -0.000 0.000 3.510) 3.510 3.746 ( -0.000 -0.000 -4.779) 4.779 4.491 ( 0.000 0.000 -9.596) 9.596 4.491 ( 0.000 0.000 -9.596) 9.596 6.217 ( 0.000 0.000 -7.103) 7.103 6.217 ( -0.000 -0.000 -7.103) 7.103 6.531 ( -0.000 0.000 -2.387) 2.387 6.694 ( 0.000 0.000 -3.851) 3.851 6.694 ( 0.000 0.000 -3.851) 3.851 6.737 ( -0.000 0.000 -8.320) 8.320 7.447 ( 0.000 0.000 46.880) 46.880 8.550 ( -0.000 0.000 31.636) 31.636 8.587 ( -0.000 0.000 16.499) 16.499 8.587 ( -0.000 0.000 16.499) 16.499 9.090 ( 0.000 0.000 30.093) 30.093 9.205 ( 0.000 0.000 -0.862) 0.862 9.205 ( 0.000 0.000 -0.862) 0.862 9.434 ( -0.000 0.000 -29.288) 29.288 9.519 ( 0.000 0.000 9.016) 9.016 10.001 ( 0.000 0.000 11.662) 11.662 10.185 ( 0.000 0.000 1.564) 1.564 10.185 ( 0.000 0.000 1.564) 1.564 10.442 ( -0.000 -0.000 4.709) 4.709 10.442 ( 0.000 0.000 4.709) 4.709 10.491 ( -0.000 -0.000 -15.722) 15.722 10.667 ( -0.000 0.000 0.344) 0.344 10.667 ( 0.000 0.000 0.344) 0.344 10.959 ( -0.000 0.000 23.963) 23.963 11.397 ( -0.000 0.000 -18.558) 18.558 11.878 ( 0.000 0.000 -10.739) 10.739 11.878 ( 0.000 0.000 -10.739) 10.739 12.172 ( 0.000 0.000 -29.100) 29.100 12.468 ( 0.000 0.000 12.056) 12.056 12.476 ( -0.000 -0.000 6.934) 6.934 12.868 ( 0.000 0.000 -7.890) 7.890 13.216 ( 0.000 0.000 -12.335) 12.335 13.468 ( -0.000 0.000 -0.688) 0.688 13.468 ( 0.000 0.000 -0.688) 0.688 13.919 ( 0.000 0.000 1.041) 1.041 13.919 ( 0.000 0.000 1.041) 1.041 13.986 ( 0.000 0.000 30.780) 30.780 14.662 ( -0.000 -0.000 50.923) 50.923 15.096 ( 0.000 0.000 9.204) 9.204 15.346 ( 0.000 0.000 7.691) 7.691 15.346 ( 0.000 0.000 7.691) 7.691 15.354 ( 0.000 0.000 7.179) 7.179 15.499 ( 0.000 0.000 8.315) 8.315 15.499 ( -0.000 0.000 8.315) 8.315 16.118 ( 0.000 0.000 2.212) 2.212 16.118 ( -0.000 -0.000 2.212) 2.212 16.192 ( 0.000 0.000 -19.167) 19.167 16.403 ( 0.000 0.000 -17.067) 17.067 16.602 ( -0.000 0.000 -11.265) 11.265 16.602 ( -0.000 0.000 -11.265) 11.265 16.831 ( -0.000 0.000 -17.201) 17.201 17.335 ( 0.000 0.000 -10.831) 10.831 18.188 ( 0.000 0.000 -29.205) 29.205 18.678 ( 0.000 0.000 -20.208) 20.208 19.490 ( 0.000 0.000 -1.481) 1.481 19.490 ( -0.000 0.000 -1.481) 1.481 19.955 ( 0.000 0.000 -13.007) 13.007 19.955 ( 0.000 -0.000 -13.007) 13.007 21.243 ( 0.000 0.000 2.518) 2.518 21.260 ( -0.000 0.000 1.274) 1.274======================= Grid point 325 (62/90) =======================q-point: ( 0.12 0.00 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.195 ( -1.266 0.000 22.521) 22.556 3.257 ( 4.014 0.000 27.974) 28.260 3.665 ( -2.889 0.000 -2.266) 3.672 3.824 ( 17.382 0.000 6.578) 18.585 4.384 ( -10.378 0.000 -7.820) 12.994 4.627 ( 12.938 0.000 -8.174) 15.304 6.196 ( -1.957 0.000 -5.180) 5.537 6.216 ( 0.487 0.000 -5.154) 5.177 6.564 ( -6.373 0.000 -2.256) 6.760 6.637 ( 8.980 0.000 -4.611) 10.095 6.731 ( 2.759 0.000 -0.532) 2.810 6.878 ( 8.361 0.000 -9.064) 12.331 7.533 ( 9.465 0.000 42.821) 43.855 8.513 ( -7.889 0.000 13.222) 15.397 8.542 ( -1.110 0.000 28.999) 29.020 8.560 ( -1.580 0.000 15.790) 15.869 9.114 ( -6.772 0.000 6.120) 9.128 9.171 ( 5.022 0.000 15.196) 16.004 9.248 ( 5.714 0.000 8.870) 10.551 9.465 ( 3.978 0.000 -24.206) 24.531 9.503 ( -3.240 0.000 10.496) 10.984 10.010 ( 3.000 0.000 9.669) 10.124 10.204 ( 1.924 0.000 1.099) 2.216 10.221 ( -7.265 0.000 0.431) 7.278 10.331 ( 1.175 0.000 7.790) 7.878 10.496 ( 0.939 0.000 -14.022) 14.054 10.521 ( 6.443 0.000 4.091) 7.632 10.661 ( 0.316 0.000 2.452) 2.472 10.780 ( 10.329 0.000 -1.293) 10.409 11.008 ( 1.605 0.000 16.973) 17.049 11.317 ( -7.928 0.000 -15.830) 17.704 11.787 ( -8.383 0.000 -4.830) 9.675 11.853 ( -2.874 0.000 -8.574) 9.043 12.123 ( -4.677 0.000 -29.288) 29.659 12.407 ( -6.038 0.000 3.842) 7.156 12.551 ( 7.453 0.000 8.008) 10.939 12.772 ( -8.665 0.000 -8.361) 12.041 13.193 ( -1.464 0.000 -10.817) 10.916 13.535 ( 5.504 0.000 6.248) 8.327 13.613 ( 12.846 0.000 0.925) 12.879 13.930 ( 1.504 0.000 1.056) 1.838 13.944 ( 2.029 0.000 2.728) 3.400 14.005 ( 2.456 0.000 23.862) 23.988 14.659 ( -2.200 0.000 40.069) 40.130 14.980 ( -5.563 0.000 17.275) 18.148 15.204 ( -10.464 0.000 7.970) 13.153 15.311 ( -4.233 0.000 5.090) 6.620 15.326 ( -4.580 0.000 9.438) 10.490 15.546 ( 2.720 0.000 4.797) 5.515 15.657 ( 11.264 0.000 5.851) 12.693 15.826 ( -19.323 0.000 -4.085) 19.750 15.933 ( -9.901 0.000 -7.428) 12.378 16.403 ( 12.841 0.000 -9.340) 15.878 16.467 ( 1.354 0.000 -13.765) 13.831 16.599 ( -2.254 0.000 -16.911) 17.061 16.685 ( 7.759 0.000 -10.449) 13.015 17.019 ( 17.070 0.000 -8.139) 18.911 17.351 ( 1.831 0.000 -10.242) 10.404 18.244 ( 5.767 0.000 -27.718) 28.312 18.696 ( 2.169 0.000 -18.896) 19.020 19.482 ( -0.705 0.000 -1.919) 2.044 19.488 ( -0.622 0.000 -2.381) 2.461 19.920 ( -3.559 0.000 -12.740) 13.228 19.926 ( -3.117 0.000 -11.632) 12.042 21.162 ( -8.762 0.000 1.219) 8.847 21.191 ( -5.716 0.000 1.162) 5.833======================= Grid point 326 (63/90) =======================q-point: ( 0.25 0.00 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 225Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.190 ( 1.006 0.000 14.577) 14.612 3.356 ( 5.820 0.000 21.618) 22.388 3.564 ( -6.107 0.000 -4.040) 7.322 4.130 ( -14.861 0.000 -3.859) 15.353 4.264 ( 25.019 0.000 11.771) 27.649 4.921 ( 15.369 0.000 -4.295) 15.958 6.163 ( -0.511 0.000 -0.727) 0.888 6.241 ( 1.989 0.000 -0.392) 2.027 6.488 ( -1.227 0.000 0.468) 1.313 6.752 ( -1.492 0.000 5.774) 5.964 6.811 ( 7.964 0.000 -8.094) 11.355 7.041 ( 8.023 0.000 -10.661) 13.342 7.821 ( 19.946 0.000 33.015) 38.572 8.301 ( -12.490 0.000 7.418) 14.527 8.482 ( -5.960 0.000 20.163) 21.025 8.564 ( 2.413 0.000 11.788) 12.032 9.025 ( -1.362 0.000 18.268) 18.319 9.208 ( -0.294 0.000 -0.852) 0.901 9.408 ( -5.547 0.000 17.809) 18.653 9.409 ( 8.640 0.000 6.030) 10.536 9.603 ( 8.452 0.000 -1.271) 8.547 9.960 ( -12.295 0.000 8.654) 15.036 10.133 ( 9.101 0.000 6.224) 11.025 10.259 ( 3.761 0.000 0.598) 3.809 10.414 ( 0.437 0.000 -3.449) 3.477 10.522 ( 1.218 0.000 -10.334) 10.406 10.642 ( 5.440 0.000 -0.880) 5.511 10.747 ( 8.757 0.000 4.145) 9.688 10.944 ( -8.443 0.000 5.830) 10.260 11.009 ( 12.393 0.000 -1.626) 12.500 11.134 ( -9.044 0.000 -7.455) 11.721 11.591 ( -11.008 0.000 4.818) 12.017 11.757 ( -6.876 0.000 -3.726) 7.820 12.009 ( -6.975 0.000 -26.193) 27.106 12.293 ( -5.148 0.000 -3.488) 6.218 12.569 ( -11.836 0.000 -8.223) 14.412 12.712 ( 8.576 0.000 3.802) 9.381 13.175 ( -0.948 0.000 -8.078) 8.134 13.631 ( 4.236 0.000 21.034) 21.456 13.878 ( 12.401 0.000 3.622) 12.919 13.981 ( 1.208 0.000 7.056) 7.159 14.009 ( 8.107 0.000 1.090) 8.180 14.088 ( 5.813 0.000 13.120) 14.351 14.521 ( -10.040 0.000 14.640) 17.752 14.979 ( -12.335 0.000 8.860) 15.187 14.988 ( 3.084 0.000 26.411) 26.590 15.192 ( -9.194 0.000 8.933) 12.819 15.217 ( -5.463 0.000 2.087) 5.848 15.439 ( -12.818 0.000 -5.035) 13.771 15.580 ( 0.988 0.000 1.499) 1.795 15.775 ( -6.516 0.000 -7.514) 9.946 15.935 ( 12.804 0.000 -0.926) 12.838 16.388 ( -9.766 0.000 -20.855) 23.028 16.565 ( -0.869 0.000 -11.634) 11.666 16.650 ( 12.454 0.000 -7.690) 14.637 16.856 ( 8.769 0.000 -9.206) 12.714 17.353 ( 15.510 0.000 -2.012) 15.640 17.417 ( 5.388 0.000 -6.558) 8.487 18.403 ( 10.485 0.000 -25.102) 27.204 18.774 ( 6.281 0.000 -15.091) 16.346 19.439 ( -5.141 0.000 -4.972) 7.152 19.471 ( -0.107 0.000 -3.269) 3.270 19.823 ( -6.228 0.000 -11.891) 13.423 19.825 ( -7.678 0.000 -8.831) 11.702 20.963 ( -10.155 0.000 -0.867) 10.192 21.052 ( -8.094 0.000 -1.097) 8.168======================= Grid point 327 (64/90) =======================q-point: ( 0.38 0.00 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.237 ( 3.772 0.000 8.005) 8.850 3.444 ( -6.226 0.000 -2.078) 6.563 3.475 ( 6.674 0.000 13.635) 15.181 3.849 ( -13.518 0.000 0.870) 13.546 4.715 ( 20.698 0.000 11.803) 23.827 5.121 ( 3.295 0.000 2.391) 4.071 6.228 ( 8.226 0.000 2.763) 8.678 6.302 ( 4.762 0.000 5.162) 7.023 6.481 ( -1.109 0.000 4.059) 4.208 6.659 ( -8.152 0.000 7.247) 10.908 6.945 ( 6.676 0.000 -11.924) 13.665 7.142 ( 1.189 0.000 -12.915) 12.970 8.114 ( -4.939 0.000 5.940) 7.725 8.252 ( 23.021 0.000 22.794) 32.396 8.316 ( -10.234 0.000 11.101) 15.099 8.637 ( 3.840 0.000 6.523) 7.570 9.066 ( 4.932 0.000 25.878) 26.344 9.178 ( -2.092 0.000 0.068) 2.093 9.301 ( -5.723 0.000 23.431) 24.120 9.432 ( -11.472 0.000 15.023) 18.902 9.698 ( 8.696 0.000 2.700) 9.106 9.947 ( 6.065 0.000 4.964) 7.838 10.326 ( 8.826 0.000 9.412) 12.903 10.346 ( 5.867 0.000 -2.683) 6.451 10.376 ( -1.586 0.000 -7.332) 7.502 10.532 ( 0.175 0.000 -6.970) 6.972 10.698 ( -0.692 0.000 -6.154) 6.193 10.708 ( -13.046 0.000 -4.288) 13.733 10.860 ( 0.295 0.000 2.940) 2.955 11.042 ( -3.037 0.000 5.114) 5.948 11.236 ( 11.150 0.000 -1.368) 11.234 11.455 ( 1.142 0.000 5.540) 5.657 11.612 ( -7.869 0.000 -2.300) 8.199 11.848 ( -9.979 0.000 -17.378) 20.039 12.214 ( -2.757 0.000 -8.555) 8.988 12.348 ( -10.002 0.000 -7.745) 12.650 12.872 ( 7.975 0.000 1.392) 8.096 13.129 ( -4.185 0.000 -3.450) 5.424 13.720 ( 5.422 0.000 24.953) 25.535 13.958 ( -4.144 0.000 17.578) 18.060 14.072 ( 9.634 0.000 4.623) 10.686 14.199 ( 5.103 0.000 9.540) 10.819 14.224 ( 10.211 0.000 3.067) 10.662 14.364 ( -5.278 0.000 4.087) 6.676 14.761 ( -8.519 0.000 8.442) 11.993 14.973 ( -3.504 0.000 10.339) 10.916 14.984 ( -11.895 0.000 7.550) 14.088 15.039 ( -9.402 0.000 -4.260) 10.322 15.490 ( 13.553 0.000 1.570) 13.644 15.596 ( 0.922 0.000 -1.086) 1.425 15.677 ( -3.762 0.000 -5.609) 6.754 16.104 ( -8.503 0.000 -7.292) 11.201 16.197 ( 4.063 0.000 -19.199) 19.624 16.514 ( -5.088 0.000 -12.851) 13.821 16.865 ( 9.379 0.000 -7.009) 11.709 16.985 ( 3.928 0.000 -8.129) 9.028 17.540 ( 7.149 0.000 2.258) 7.497 17.586 ( 7.419 0.000 0.406) 7.430 18.632 ( 12.889 0.000 -22.344) 25.795 18.933 ( 8.260 0.000 -9.410) 12.521 19.293 ( -7.863 0.000 -10.430) 13.062 19.490 ( 2.367 0.000 -5.483) 5.972 19.625 ( -12.953 0.000 -7.632) 15.034 19.692 ( -7.068 0.000 -10.350) 12.533 20.821 ( -3.906 0.000 -3.296) 5.110 20.905 ( -6.645 0.000 -3.536) 7.527======================= Grid point 328 (65/90) =======================q-point: (-0.50 0.00 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 140Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.329 ( -5.589 0.000 2.156) 5.990 3.329 ( 5.589 0.000 2.156) 5.990 3.627 ( -9.508 0.000 6.494) 11.514 3.627 ( 9.508 0.000 6.494) 11.514 5.032 ( -11.528 0.000 8.897) 14.562 5.032 ( 11.528 0.000 8.897) 14.562 6.412 ( -5.650 0.000 6.991) 8.988 6.412 ( 5.650 0.000 6.991) 8.988 6.449 ( -12.773 0.000 5.096) 13.752 6.449 ( 12.773 0.000 5.096) 13.752 7.079 ( -6.521 0.000 -14.144) 15.575 7.079 ( 6.521 0.000 -14.144) 15.575 8.139 ( -6.682 0.000 7.316) 9.908 8.139 ( 6.682 0.000 7.316) 9.908 8.608 ( -10.385 0.000 9.048) 13.774 8.608 ( 10.385 0.000 9.048) 13.774 9.183 ( -6.460 0.000 26.297) 27.079 9.183 ( 6.460 0.000 26.297) 27.079 9.200 ( -7.171 0.000 13.533) 15.315 9.200 ( 7.171 0.000 13.533) 15.315 9.907 ( -9.776 0.000 1.323) 9.865 9.907 ( 9.776 0.000 1.323) 9.865 10.415 ( -2.151 0.000 4.329) 4.834 10.415 ( 2.151 0.000 4.329) 4.834 10.468 ( -10.626 0.000 -7.251) 12.864 10.468 ( 10.626 0.000 -7.251) 12.864 10.607 ( -7.434 0.000 -6.943) 10.172 10.607 ( 7.434 0.000 -6.943) 10.172 10.917 ( -6.674 0.000 8.630) 10.909 10.917 ( 6.674 0.000 8.630) 10.909 11.442 ( -10.010 0.000 -2.719) 10.373 11.442 ( 10.010 0.000 -2.719) 10.373 11.626 ( -12.418 0.000 -6.140) 13.853 11.626 ( 12.418 0.000 -6.140) 13.853 12.215 ( -3.441 0.000 -8.644) 9.304 12.215 ( 3.441 0.000 -8.644) 9.304 13.018 ( -6.986 0.000 -0.424) 6.999 13.018 ( 6.986 0.000 -0.424) 6.999 13.841 ( -6.902 0.000 23.314) 24.315 13.841 ( 6.902 0.000 23.314) 24.315 14.252 ( -7.214 0.000 5.094) 8.831 14.252 ( 7.214 0.000 5.094) 8.831 14.286 ( -4.027 0.000 5.259) 6.624 14.286 ( 4.027 0.000 5.259) 6.624 14.765 ( -8.935 0.000 6.903) 11.291 14.765 ( 8.935 0.000 6.903) 11.291 14.937 ( -1.286 0.000 0.821) 1.525 14.937 ( 1.286 0.000 0.821) 1.525 15.623 ( -2.005 0.000 -3.349) 3.903 15.623 ( 2.005 0.000 -3.349) 3.903 15.802 ( -17.248 0.000 -7.680) 18.880 15.802 ( 17.248 0.000 -7.680) 18.880 16.374 ( -9.037 0.000 -13.941) 16.614 16.374 ( 9.037 0.000 -13.941) 16.614 16.992 ( -3.315 0.000 -7.246) 7.968 16.992 ( 3.315 0.000 -7.246) 7.968 17.638 ( -1.827 0.000 3.893) 4.300 17.638 ( 1.827 0.000 3.893) 4.300 18.885 ( -12.136 0.000 -14.797) 19.138 18.885 ( 12.136 0.000 -14.797) 19.138 19.355 ( -13.250 0.000 -9.683) 16.411 19.355 ( 13.250 0.000 -9.683) 16.411 19.567 ( -5.497 0.000 -8.090) 9.781 19.567 ( 5.497 0.000 -8.090) 9.781 20.813 ( -2.579 0.000 -4.367) 5.071 20.813 ( 2.579 0.000 -4.367) 5.071======================= Grid point 334 (66/90) =======================q-point: ( 0.12 0.12 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.184 ( -0.140 -0.140 17.851) 17.852 3.316 ( 4.455 4.455 25.954) 26.708 3.698 ( -1.311 -1.311 -1.781) 2.571 3.887 ( 11.605 11.605 8.852) 18.647 4.488 ( -0.648 -0.648 -4.727) 4.815 4.546 ( 2.718 2.718 -8.833) 9.633 6.189 ( -2.018 -2.018 -3.690) 4.665 6.206 ( -0.456 -0.456 -3.232) 3.295 6.522 ( -2.689 -2.689 2.332) 4.461 6.719 ( 8.316 8.316 -4.867) 12.728 6.793 ( 4.355 4.355 -4.847) 7.837 6.931 ( 5.161 5.161 -7.544) 10.497 7.608 ( 8.242 8.242 39.629) 41.308 8.441 ( -6.179 -6.179 9.130) 12.638 8.513 ( -3.751 -3.751 18.861) 19.593 8.557 ( -0.441 -0.441 24.314) 24.322 9.040 ( -5.768 -5.768 8.999) 12.145 9.203 ( -0.178 -0.178 1.464) 1.485 9.313 ( 9.403 9.403 25.399) 28.669 9.387 ( -3.072 -3.072 -8.326) 9.391 9.621 ( 5.725 5.725 -5.712) 9.909 9.930 ( -5.604 -5.604 10.662) 13.285 10.203 ( -2.143 -2.143 3.594) 4.701 10.280 ( 2.548 2.548 -4.862) 6.051 10.350 ( 2.690 2.690 9.583) 10.311 10.425 ( -1.507 -1.507 4.584) 5.055 10.527 ( 2.897 2.897 -13.336) 13.951 10.796 ( 7.794 7.794 -1.265) 11.095 10.830 ( 6.285 6.285 1.901) 9.089 11.048 ( 2.294 2.294 13.905) 14.278 11.253 ( -6.320 -6.320 -13.097) 15.856 11.717 ( -5.258 -5.258 -3.454) 8.199 11.860 ( -1.253 -1.253 -6.336) 6.579 12.034 ( -7.668 -7.668 -25.540) 27.746 12.405 ( -0.761 -0.761 -1.903) 2.186 12.558 ( -0.487 -0.487 3.447) 3.515 12.734 ( -2.069 -2.069 -4.593) 5.446 13.193 ( -0.573 -0.573 -10.162) 10.195 13.536 ( 0.629 0.629 10.279) 10.317 13.699 ( 8.131 8.131 -0.212) 11.501 13.933 ( 0.873 0.873 4.616) 4.778 14.009 ( 1.208 1.208 23.481) 23.543 14.020 ( 5.971 5.971 -0.482) 8.458 14.699 ( 1.974 1.974 35.221) 35.331 14.816 ( -10.987 -10.987 15.999) 22.303 15.175 ( -4.252 -4.252 10.235) 11.870 15.192 ( -7.798 -7.798 1.803) 11.175 15.381 ( 0.095 0.095 8.184) 8.185 15.592 ( 0.871 0.871 3.360) 3.579 15.630 ( -9.738 -9.738 -7.484) 15.674 15.707 ( 4.356 4.356 5.169) 8.042 16.014 ( -3.696 -3.696 4.599) 6.962 16.267 ( 0.630 0.630 -19.930) 19.950 16.541 ( 4.072 4.072 -12.572) 13.829 16.571 ( 2.001 2.001 -16.155) 16.401 16.969 ( 12.800 12.800 -7.794) 19.708 17.035 ( 6.584 6.584 -6.565) 11.392 17.361 ( 1.134 1.134 -9.802) 9.932 18.295 ( 5.307 5.307 -26.455) 27.499 18.714 ( 1.976 1.976 -18.001) 18.217 19.376 ( -5.757 -5.757 -2.641) 8.559 19.565 ( 2.504 2.504 -3.720) 5.136 19.810 ( -7.003 -7.003 -10.159) 14.187 19.974 ( 0.428 0.428 -12.157) 12.172 21.102 ( -6.750 -6.750 0.096) 9.547 21.125 ( -5.297 -5.297 0.855) 7.540======================= Grid point 335 (67/90) =======================q-point: ( 0.25 0.12 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.199 ( 1.773 1.116 11.670) 11.857 3.398 ( 3.291 2.563 15.386) 15.942 3.630 ( -3.444 7.582 4.024) 9.249 4.240 ( 20.907 -0.712 9.545) 22.994 4.254 ( -13.730 10.981 -2.341) 17.736 4.817 ( 15.795 -9.606 -4.421) 19.008 6.100 ( -5.637 -5.353 2.055) 8.041 6.213 ( 0.413 -5.479 1.071) 5.598 6.502 ( 0.743 3.910 5.142) 6.502 6.837 ( 0.424 6.159 -0.894) 6.238 6.911 ( 9.199 9.885 -7.960) 15.674 7.062 ( 7.800 2.196 -9.350) 12.373 7.854 ( 16.314 3.605 30.929) 35.153 8.267 ( -11.563 -2.473 4.794) 12.760 8.443 ( -2.512 -5.626 9.862) 11.629 8.538 ( -0.897 -1.540 21.907) 21.979 8.980 ( 0.696 -2.845 20.459) 20.668 9.179 ( -2.661 -3.675 -6.155) 7.646 9.340 ( -2.134 -3.059 12.843) 13.374 9.512 ( 7.314 7.427 19.991) 22.545 9.673 ( 0.217 5.043 1.702) 5.327 9.873 ( 1.202 -6.049 1.269) 6.297 10.155 ( 0.178 0.288 11.151) 11.156 10.277 ( -1.545 -1.971 -5.326) 5.886 10.384 ( 2.232 4.985 1.581) 5.686 10.533 ( 6.978 -3.195 3.617) 8.484 10.607 ( 4.442 1.025 -16.054) 16.688 10.883 ( 0.907 5.852 2.667) 6.495 10.954 ( 2.159 4.564 -1.703) 5.329 11.056 ( -4.912 0.832 3.691) 6.200 11.158 ( 4.204 4.534 -1.936) 6.479 11.599 ( -6.635 2.095 1.545) 7.128 11.792 ( -5.196 2.199 -2.999) 6.389 11.895 ( -5.716 -9.444 -21.744) 24.386 12.362 ( -3.902 5.158 -7.983) 10.275 12.482 ( -6.952 -6.366 -5.046) 10.692 12.759 ( 4.422 2.888 2.859) 6.006 13.172 ( -1.615 -0.578 -8.100) 8.279 13.564 ( 2.489 -5.465 15.668) 16.779 13.882 ( 9.678 0.981 0.026) 9.728 13.958 ( 1.874 -0.918 9.307) 9.538 14.034 ( 1.146 0.702 20.033) 20.078 14.169 ( 7.943 5.918 0.778) 9.935 14.515 ( -12.390 -0.408 15.655) 19.969 14.824 ( 3.027 -9.046 19.116) 21.364 14.969 ( -11.077 -2.815 4.073) 12.133 15.143 ( -3.197 -5.209 5.642) 8.318 15.341 ( -1.628 7.024 6.448) 9.673 15.417 ( -9.756 -3.921 -3.710) 11.150 15.576 ( -1.882 -0.741 0.639) 2.122 15.715 ( -5.896 1.711 -4.141) 7.405 16.020 ( 8.733 3.222 3.699) 10.017 16.360 ( 1.749 -7.171 -18.302) 19.735 16.522 ( -2.190 8.209 -13.019) 15.546 16.714 ( 9.538 2.555 -9.718) 13.854 17.034 ( 2.533 13.559 -6.751) 15.357 17.336 ( 15.063 -1.449 -2.812) 15.392 17.406 ( 4.008 -0.920 -6.559) 7.742 18.442 ( 9.633 3.996 -24.268) 26.414 18.784 ( 5.711 1.131 -15.017) 16.106 19.268 ( -5.421 -9.851 -4.949) 12.285 19.562 ( -3.102 -0.161 -9.214) 9.724 19.661 ( -8.194 -6.892 -5.045) 11.836 19.927 ( -5.522 2.139 -11.140) 12.616 20.944 ( -7.843 -1.779 -1.526) 8.186 21.012 ( -6.136 -3.490 -1.412) 7.199======================= Grid point 336 (68/90) =======================q-point: ( 0.38 0.12 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.252 ( 3.623 1.516 6.307) 7.429 3.406 ( -2.645 -0.972 1.506) 3.195 3.627 ( 3.640 12.356 11.025) 16.954 3.973 ( -13.528 11.789 1.086) 17.977 4.660 ( 20.210 -4.888 10.566) 23.323 5.043 ( 5.117 -7.622 1.350) 9.279 6.036 ( 0.459 -13.268 7.085) 15.048 6.201 ( -2.278 -13.215 6.367) 14.845 6.549 ( 4.324 9.222 5.556) 11.603 6.796 ( -4.648 8.155 2.213) 9.644 7.057 ( 6.337 9.842 -12.344) 17.012 7.187 ( 3.499 4.501 -10.438) 11.893 8.068 ( -5.641 -6.066 6.314) 10.416 8.104 ( 2.499 -6.334 14.924) 16.404 8.465 ( 8.977 7.987 10.864) 16.199 8.581 ( 5.265 -4.494 12.061) 13.906 9.034 ( 2.441 -3.365 18.091) 18.562 9.129 ( -0.163 -4.080 5.870) 7.151 9.270 ( -5.423 -2.063 23.549) 24.253 9.428 ( -12.255 -0.523 16.361) 20.449 9.781 ( 9.557 7.657 9.087) 15.249 9.971 ( 5.745 1.771 1.604) 6.222 10.213 ( 3.572 -9.561 7.073) 12.418 10.233 ( -2.725 -3.148 -4.861) 6.400 10.454 ( 5.296 5.717 -3.805) 8.672 10.616 ( 2.139 -3.631 2.494) 4.897 10.663 ( 1.247 1.732 -15.994) 16.135 10.810 ( -4.941 4.969 -1.593) 7.186 10.902 ( -7.580 4.115 1.608) 8.774 10.965 ( -3.286 0.746 5.268) 6.253 11.330 ( 9.017 4.187 -0.590) 9.959 11.511 ( -1.882 5.771 -0.383) 6.082 11.722 ( -0.471 9.309 -1.869) 9.507 11.809 ( -3.595 -2.224 -13.765) 14.399 12.262 ( -5.526 3.262 -9.314) 11.311 12.333 ( -7.691 0.505 -6.704) 10.216 12.872 ( 6.839 -0.088 2.549) 7.299 13.118 ( -4.257 -1.120 -4.019) 5.960 13.642 ( 5.693 -7.738 18.912) 21.212 13.952 ( -5.958 -1.082 17.851) 18.850 14.054 ( 6.818 -2.972 10.237) 12.654 14.069 ( 6.197 -5.595 5.237) 9.855 14.215 ( -2.655 -7.380 6.268) 10.040 14.405 ( -1.565 7.080 6.057) 9.448 14.778 ( -2.048 3.026 4.967) 6.166 14.889 ( 1.106 -5.610 8.141) 9.948 15.004 ( -8.912 -3.799 -2.475) 9.999 15.184 ( -11.719 11.613 8.859) 18.726 15.455 ( 6.144 -2.831 -2.727) 7.294 15.544 ( -1.608 -3.972 -3.503) 5.535 15.671 ( 4.849 2.587 -2.854) 6.193 16.146 ( -4.018 1.322 -1.873) 4.626 16.290 ( 0.738 7.558 -18.110) 19.637 16.503 ( -2.098 1.955 -11.112) 11.476 16.904 ( 9.294 3.171 -6.319) 11.677 17.074 ( 0.778 7.901 -7.185) 10.707 17.511 ( 6.301 -3.049 1.227) 7.107 17.555 ( 7.016 -2.760 0.545) 7.559 18.649 ( 11.560 1.762 -22.325) 25.202 18.934 ( 8.241 0.129 -9.703) 12.731 19.157 ( -5.618 -10.175 -10.642) 15.758 19.444 ( -9.219 -10.835 -11.010) 17.989 19.535 ( -2.789 -0.106 -5.306) 5.995 19.767 ( -10.375 1.148 -10.711) 14.956 20.842 ( -2.451 2.125 -3.228) 4.576 20.906 ( -4.606 0.433 -3.420) 5.753======================= Grid point 337 (69/90) =======================q-point: (-0.50 0.12 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.331 ( -4.369 0.548 1.893) 4.793 3.331 ( 4.369 0.548 1.893) 4.793 3.752 ( -9.134 12.037 6.386) 16.405 3.752 ( 9.134 12.037 6.386) 16.405 4.975 ( -11.269 -5.416 7.819) 14.747 4.975 ( 11.269 -5.416 7.819) 14.747 6.115 ( -5.980 -18.008 8.659) 20.857 6.115 ( 5.980 -18.008 8.659) 20.857 6.670 ( -7.502 10.812 3.914) 13.730 6.670 ( 7.502 10.812 3.914) 13.730 7.168 ( -4.630 7.551 -12.892) 15.641 7.168 ( 4.630 7.551 -12.892) 15.641 8.050 ( -3.594 -7.408 8.447) 11.796 8.050 ( 3.594 -7.408 8.447) 11.796 8.646 ( -2.764 2.295 4.499) 5.757 8.646 ( 2.764 2.295 4.499) 5.757 9.101 ( -8.591 -5.439 17.097) 19.892 9.101 ( 8.591 -5.439 17.097) 19.892 9.223 ( -6.916 1.352 25.383) 26.343 9.223 ( 6.916 1.352 25.383) 26.343 9.960 ( -7.271 4.285 4.522) 9.575 9.960 ( 7.271 4.285 4.522) 9.575 10.224 ( -1.712 -8.666 -1.063) 8.897 10.224 ( 1.712 -8.666 -1.063) 8.897 10.584 ( -6.225 3.634 -6.988) 10.040 10.584 ( 6.225 3.634 -6.988) 10.040 10.714 ( -4.733 0.323 -2.824) 5.520 10.714 ( 4.733 0.323 -2.824) 5.520 10.861 ( -4.343 4.473 7.057) 9.416 10.861 ( 4.343 4.473 7.057) 9.416 11.464 ( -4.655 -0.849 -6.143) 7.754 11.464 ( 4.655 -0.849 -6.143) 7.754 11.756 ( -2.367 12.728 -3.294) 13.359 11.756 ( 2.367 12.728 -3.294) 13.359 12.220 ( -2.547 1.357 -8.127) 8.625 12.220 ( 2.547 1.357 -8.127) 8.625 13.008 ( -6.844 -1.007 -0.032) 6.918 13.008 ( 6.844 -1.007 -0.032) 6.918 13.785 ( -8.991 -6.434 20.288) 23.105 13.785 ( 8.991 -6.434 20.288) 23.105 14.141 ( -3.187 -9.104 7.629) 12.298 14.141 ( 3.187 -9.104 7.629) 12.298 14.273 ( -9.914 1.090 5.129) 11.215 14.273 ( 9.914 1.090 5.129) 11.215 14.858 ( -6.578 0.804 -2.489) 7.079 14.858 ( 6.578 0.804 -2.489) 7.079 14.971 ( -8.720 7.277 10.460) 15.440 14.971 ( 8.720 7.277 10.460) 15.440 15.511 ( -1.584 -6.510 -5.776) 8.846 15.511 ( 1.584 -6.510 -5.776) 8.846 15.902 ( -15.312 6.178 -5.053) 17.267 15.902 ( 15.312 6.178 -5.053) 17.267 16.412 ( -6.827 4.235 -12.040) 14.474 16.412 ( 6.827 4.235 -12.040) 14.474 17.041 ( -4.513 4.546 -6.265) 8.960 17.041 ( 4.513 4.546 -6.265) 8.960 17.602 ( -1.926 -3.598 3.725) 5.525 17.602 ( 1.926 -3.598 3.725) 5.525 18.879 ( -11.461 -0.650 -15.990) 19.684 18.879 ( 11.461 -0.650 -15.990) 19.684 19.237 ( -11.321 -9.032 -9.378) 17.254 19.237 ( 11.321 -9.032 -9.378) 17.254 19.581 ( -7.195 -1.160 -10.161) 12.505 19.581 ( 7.195 -1.160 -10.161) 12.505 20.841 ( -1.974 2.930 -3.965) 5.310 20.841 ( 1.974 2.930 -3.965) 5.310======================= Grid point 344 (70/90) =======================q-point: ( 0.25 0.25 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 201Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.235 ( 2.508 2.508 6.724) 7.602 3.421 ( -0.012 -0.012 3.962) 3.962 3.804 ( 7.736 7.736 16.819) 20.064 4.297 ( 9.286 9.286 6.095) 14.478 4.439 ( -1.456 -1.456 2.267) 3.063 4.676 ( 3.549 3.549 -6.400) 8.133 5.959 ( -9.570 -9.570 7.177) 15.319 6.060 ( -8.170 -8.170 6.034) 13.035 6.625 ( 7.048 7.048 8.575) 13.148 6.893 ( -0.066 -0.066 -5.594) 5.595 7.123 ( 4.469 4.469 -8.932) 10.942 7.163 ( 13.565 13.565 -8.107) 20.826 7.928 ( 1.282 1.282 24.309) 24.377 8.266 ( -1.236 -1.236 0.278) 1.770 8.274 ( -4.674 -4.674 0.894) 6.670 8.527 ( 1.830 1.830 30.081) 30.192 8.990 ( 4.128 4.128 27.558) 28.169 9.063 ( -7.521 -7.521 -13.719) 17.359 9.303 ( -1.476 -1.476 22.319) 22.416 9.553 ( -6.587 -6.587 16.780) 19.192 9.767 ( 8.563 8.563 18.531) 22.137 9.892 ( 7.191 7.191 -11.764) 15.550 10.111 ( -4.674 -4.674 15.707) 17.041 10.257 ( 0.450 0.450 -9.754) 9.775 10.478 ( -0.450 -0.450 1.157) 1.321 10.502 ( 2.903 2.903 4.794) 6.312 10.644 ( 2.763 2.763 -16.914) 17.359 10.921 ( -0.621 -0.621 -2.807) 2.941 10.937 ( -2.420 -2.420 -0.711) 3.495 11.159 ( 1.252 1.252 9.492) 9.656 11.269 ( 8.203 8.203 -2.718) 11.914 11.686 ( 5.429 5.429 -0.392) 7.688 11.694 ( -8.309 -8.309 -19.526) 22.789 11.843 ( 3.257 3.257 -2.557) 5.268 12.358 ( -5.152 -5.152 -1.945) 7.541 12.457 ( 2.892 2.892 -11.034) 11.768 12.804 ( 2.123 2.123 4.358) 5.292 13.146 ( -2.157 -2.157 -8.405) 8.941 13.467 ( -3.773 -3.773 10.581) 11.850 13.920 ( 2.192 2.192 -2.035) 3.708 13.950 ( 0.476 0.476 18.235) 18.247 14.046 ( 0.393 0.393 20.956) 20.963 14.160 ( -6.895 -6.895 6.710) 11.836 14.577 ( 5.657 5.657 8.767) 11.868 14.696 ( -3.479 -3.479 14.628) 15.433 14.891 ( -4.595 -4.595 -1.548) 6.680 15.025 ( -6.498 -6.498 5.767) 10.849 15.300 ( -5.696 -5.696 -6.841) 10.568 15.438 ( 0.918 0.918 -3.906) 4.116 15.559 ( 3.851 3.851 2.924) 6.181 15.832 ( -0.859 -0.859 -2.840) 3.089 15.998 ( 2.903 2.903 12.542) 13.197 16.345 ( 4.066 4.066 -17.321) 18.251 16.722 ( 4.948 4.948 -12.842) 14.624 16.731 ( 4.500 4.500 -2.910) 6.998 17.246 ( 4.467 4.467 -2.795) 6.908 17.348 ( 4.839 4.839 -2.607) 7.323 17.399 ( 1.689 1.689 -7.972) 8.322 18.550 ( 6.833 6.833 -23.084) 25.025 18.826 ( 3.570 3.570 -14.171) 15.044 19.101 ( -6.944 -6.944 -7.476) 12.343 19.419 ( -10.025 -10.025 -13.320) 19.453 19.586 ( -5.220 -5.220 -3.631) 8.227 19.887 ( -6.376 -6.376 -11.568) 14.666 20.908 ( -1.538 -1.538 -2.690) 3.459 20.954 ( -1.964 -1.964 -2.221) 3.557======================= Grid point 345 (71/90) =======================q-point: ( 0.38 0.25 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.290 ( 3.125 2.284 2.572) 4.647 3.400 ( -2.044 -0.046 -0.551) 2.117 3.913 ( 5.099 15.958 14.795) 22.351 4.244 ( -12.138 14.291 3.450) 19.065 4.579 ( 17.210 -1.940 6.300) 18.429 4.869 ( 8.173 -8.841 -1.143) 12.093 5.781 ( -6.728 -12.868 11.942) 18.800 5.906 ( -8.180 -15.871 10.348) 20.637 6.740 ( 4.807 8.732 5.849) 11.557 6.873 ( -1.579 -0.840 -3.860) 4.254 7.198 ( 4.179 4.433 -8.441) 10.410 7.371 ( 4.912 14.151 -7.034) 16.548 7.869 ( -3.101 -11.280 14.339) 18.506 8.098 ( -8.312 3.063 4.092) 9.758 8.419 ( 9.919 -7.536 -0.765) 12.481 8.677 ( 11.085 10.434 20.376) 25.435 8.904 ( -5.882 -9.022 -4.086) 11.519 9.120 ( 7.103 3.471 29.645) 30.681 9.248 ( -5.003 -0.211 22.968) 23.508 9.401 ( -7.598 -2.604 16.877) 18.690 9.933 ( 5.545 6.653 18.482) 20.410 9.990 ( -2.513 -2.264 5.452) 6.416 10.051 ( 5.288 -3.342 0.729) 6.298 10.266 ( -0.722 5.018 -9.502) 10.770 10.477 ( 1.055 -6.006 0.781) 6.148 10.530 ( 0.923 -0.609 4.571) 4.703 10.705 ( 3.221 1.751 -14.935) 15.379 10.835 ( -6.647 2.169 -3.421) 7.784 10.959 ( 2.909 3.060 -2.049) 4.693 11.103 ( -5.000 4.486 5.692) 8.805 11.362 ( 1.177 -0.089 -2.612) 2.866 11.533 ( -7.196 -4.549 -14.225) 16.578 11.845 ( 9.290 7.898 -1.476) 12.283 11.971 ( 8.940 14.799 -3.228) 17.589 12.266 ( -3.954 -0.388 -2.376) 4.629 12.453 ( -4.045 9.122 -10.779) 14.689 12.865 ( 4.634 -0.658 4.082) 6.211 13.083 ( -4.505 -2.616 -6.320) 8.190 13.454 ( 3.106 -10.534 10.333) 15.079 13.832 ( -12.442 -11.520 10.793) 20.100 13.987 ( 3.016 -0.927 18.615) 18.881 14.031 ( 0.997 1.185 13.477) 13.565 14.143 ( 5.129 -1.317 7.556) 9.227 14.494 ( -9.970 1.929 6.557) 12.088 14.726 ( 0.516 -10.216 4.477) 11.166 14.864 ( -5.844 -5.358 0.460) 7.942 14.951 ( 8.201 8.730 3.526) 12.486 15.225 ( -2.851 -3.217 -5.147) 6.705 15.415 ( -0.937 -5.969 -7.790) 9.858 15.613 ( -8.008 11.867 -0.050) 14.316 15.787 ( 9.317 7.692 1.299) 12.152 16.117 ( 2.150 -2.017 4.761) 5.600 16.427 ( 4.419 6.662 -11.922) 14.354 16.642 ( -5.682 10.478 -4.611) 12.780 16.942 ( 10.685 -0.572 -2.311) 10.947 17.232 ( -3.690 7.177 -3.818) 8.928 17.433 ( 4.885 -4.658 -0.588) 6.775 17.504 ( 4.558 -1.547 -1.880) 5.167 18.690 ( 7.726 1.976 -23.380) 24.703 18.935 ( 7.568 -0.316 -11.179) 13.503 19.000 ( -4.758 -3.850 -12.326) 13.762 19.236 ( -8.461 -9.984 -12.432) 18.051 19.458 ( -5.583 -8.048 -9.427) 13.594 19.700 ( -12.076 -7.837 -12.767) 19.242 20.899 ( 0.553 3.494 -3.074) 4.687 20.932 ( -0.682 2.268 -3.064) 3.873======================= Grid point 346 (72/90) =======================q-point: (-0.50 0.25 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 221Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.350 ( -2.983 1.152 -0.128) 3.200 3.350 ( 2.983 1.152 -0.128) 3.200 4.041 ( -8.555 16.432 8.014) 20.185 4.041 ( 8.555 16.432 8.014) 20.185 4.859 ( -9.425 -5.464 4.415) 11.754 4.859 ( 9.425 -5.464 4.415) 11.754 5.765 ( -4.948 -17.483 12.636) 22.132 5.765 ( 4.948 -17.483 12.636) 22.132 6.822 ( -3.747 3.370 -0.592) 5.074 6.822 ( 3.747 3.370 -0.592) 5.074 7.315 ( -7.378 7.415 -4.778) 11.500 7.315 ( 7.378 7.415 -4.778) 11.500 7.934 ( -7.995 -3.175 7.830) 11.632 7.934 ( 7.995 -3.175 7.830) 11.632 8.628 ( -10.734 -4.654 -3.344) 12.168 8.628 ( 10.734 -4.654 -3.344) 12.168 9.053 ( -13.392 1.659 17.434) 22.046 9.053 ( 13.392 1.659 17.434) 22.046 9.266 ( -6.501 3.001 29.174) 30.040 9.266 ( 6.501 3.001 29.174) 30.040 9.958 ( -1.221 -5.021 8.220) 9.709 9.958 ( 1.221 -5.021 8.220) 9.709 10.194 ( -6.704 5.235 -0.764) 8.540 10.194 ( 6.704 5.235 -0.764) 8.540 10.523 ( -2.706 -6.637 4.351) 8.384 10.523 ( 2.706 -6.637 4.351) 8.384 10.750 ( -1.754 5.044 -13.867) 14.860 10.750 ( 1.754 5.044 -13.867) 14.860 11.012 ( -3.539 5.552 4.082) 7.747 11.012 ( 3.539 5.552 4.082) 7.747 11.411 ( -5.004 -3.905 -8.721) 10.787 11.411 ( 5.004 -3.905 -8.721) 10.787 12.010 ( -6.330 11.609 -1.447) 13.301 12.010 ( 6.330 11.609 -1.447) 13.301 12.313 ( -8.736 9.128 -7.662) 14.776 12.313 ( 8.736 9.128 -7.662) 14.776 12.976 ( -6.245 -2.507 -0.811) 6.778 12.976 ( 6.245 -2.507 -0.811) 6.778 13.591 ( -10.753 -12.231 12.361) 20.445 13.591 ( 10.753 -12.231 12.361) 20.445 14.036 ( -1.273 -1.618 15.791) 15.924 14.036 ( 1.273 -1.618 15.791) 15.924 14.293 ( -9.859 0.588 6.258) 11.692 14.293 ( 9.859 0.588 6.258) 11.692 14.754 ( -3.605 -9.058 0.595) 9.767 14.754 ( 3.605 -9.058 0.595) 9.767 15.138 ( -7.515 6.891 0.273) 10.200 15.138 ( 7.515 6.891 0.273) 10.200 15.450 ( -5.607 0.229 -5.114) 7.593 15.450 ( 5.607 0.229 -5.114) 7.593 16.014 ( -10.919 6.289 0.248) 12.603 16.014 ( 10.919 6.289 0.248) 12.603 16.531 ( -5.881 7.521 -5.864) 11.204 16.531 ( 5.881 7.521 -5.864) 11.204 17.123 ( -7.668 2.291 -1.536) 8.149 17.123 ( 7.668 2.291 -1.536) 8.149 17.517 ( -2.791 -4.154 0.821) 5.072 17.517 ( 2.791 -4.154 0.821) 5.072 18.859 ( -9.384 -1.192 -20.397) 22.484 18.859 ( 9.384 -1.192 -20.397) 22.484 19.088 ( -7.713 -5.401 -8.966) 13.002 19.088 ( 7.713 -5.401 -8.966) 13.002 19.481 ( -8.403 -9.007 -13.841) 18.529 19.481 ( 8.403 -9.007 -13.841) 18.529 20.917 ( -1.005 4.493 -3.223) 5.620 20.917 ( 1.005 4.493 -3.223) 5.620======================= Grid point 354 (73/90) =======================q-point: ( 0.38 0.38 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.332 ( 1.943 1.943 -0.835) 2.872 3.391 ( -0.978 -0.978 -2.543) 2.895 4.172 ( 9.778 9.778 16.583) 21.592 4.406 ( -0.108 -0.108 8.059) 8.060 4.641 ( 8.599 8.599 0.928) 12.196 4.794 ( 2.458 2.458 -3.500) 4.933 5.553 ( -9.920 -9.920 16.148) 21.391 5.629 ( -12.203 -12.203 14.685) 22.660 6.806 ( -3.408 -3.408 -7.765) 9.139 6.830 ( -0.483 -0.483 -1.410) 1.566 7.292 ( 6.538 6.538 4.463) 10.267 7.658 ( 11.249 11.249 -8.531) 18.052 7.660 ( -7.021 -7.021 20.827) 23.072 8.116 ( -5.454 -5.454 3.500) 8.470 8.351 ( 4.239 4.239 -4.294) 7.374 8.710 ( -9.618 -9.618 -8.661) 16.125 8.922 ( 12.862 12.862 18.982) 26.291 9.216 ( 4.896 4.896 30.901) 31.667 9.244 ( -1.326 -1.326 25.666) 25.734 9.347 ( -1.496 -1.496 14.154) 14.312 9.884 ( -4.683 -4.683 11.111) 12.935 9.975 ( -3.819 -3.819 -2.401) 5.911 10.110 ( 7.223 7.223 26.711) 28.598 10.369 ( 4.165 4.165 -15.541) 16.620 10.437 ( 1.055 1.055 -10.395) 10.501 10.451 ( -5.658 -5.658 16.329) 18.184 10.747 ( 2.965 2.965 -11.390) 12.137 10.888 ( -0.987 -0.987 -11.142) 11.229 10.993 ( 3.503 3.503 -1.266) 5.114 11.109 ( -2.325 -2.325 6.511) 7.294 11.336 ( -2.014 -2.014 -5.636) 6.315 11.424 ( -5.670 -5.670 -13.947) 16.088 12.023 ( 9.474 9.474 0.433) 13.405 12.259 ( -0.608 -0.608 1.528) 1.754 12.275 ( 14.997 14.997 -6.387) 22.149 12.603 ( 4.377 4.377 -11.628) 13.173 12.850 ( -0.400 -0.400 0.986) 1.136 13.014 ( -4.822 -4.822 -8.515) 10.909 13.303 ( -2.867 -2.867 10.768) 11.506 13.595 ( -12.376 -12.376 10.958) 20.649 14.005 ( 2.469 2.469 22.956) 23.221 14.089 ( 2.451 2.451 21.765) 22.039 14.133 ( 2.234 2.234 2.990) 4.350 14.478 ( -7.351 -7.351 17.000) 19.926 14.545 ( -3.458 -3.458 -5.578) 7.417 14.699 ( -8.633 -8.633 -1.528) 12.304 15.191 ( 0.291 0.291 -7.968) 7.979 15.199 ( 12.594 12.594 -1.184) 17.850 15.311 ( -3.475 -3.475 -10.434) 11.534 15.673 ( -6.157 -6.157 -9.509) 12.893 15.980 ( 11.608 11.608 5.818) 17.416 16.150 ( 4.018 4.018 11.357) 12.699 16.549 ( 6.106 6.106 -3.740) 9.411 16.813 ( -0.451 -0.451 18.752) 18.763 16.894 ( 3.672 3.672 -13.031) 14.027 17.254 ( -6.689 -6.689 4.305) 10.393 17.407 ( 3.768 3.768 -5.830) 7.898 17.505 ( 0.381 0.381 -4.184) 4.218 18.731 ( 3.709 3.709 -26.756) 27.265 18.954 ( 2.504 2.504 -12.261) 12.762 19.010 ( 2.215 2.215 -12.598) 12.981 19.070 ( -6.506 -6.506 -16.820) 19.172 19.266 ( -9.552 -9.552 -12.747) 18.573 19.494 ( -12.542 -12.542 -15.410) 23.496 20.962 ( 2.765 2.765 -2.825) 4.824 20.978 ( 1.989 1.989 -2.826) 3.987======================= Grid point 355 (74/90) =======================q-point: (-0.50 0.38 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.366 ( -1.578 0.348 -2.648) 3.102 3.366 ( 1.578 0.348 -2.648) 3.102 4.318 ( -6.466 10.396 11.103) 16.528 4.318 ( 6.466 10.396 11.103) 16.528 4.809 ( -4.970 1.037 -0.863) 5.149 4.809 ( 4.970 1.037 -0.863) 5.149 5.469 ( -2.821 -12.500 17.592) 21.764 5.469 ( 2.821 -12.500 17.592) 21.764 6.787 ( -1.814 -5.028 -7.758) 9.421 6.787 ( 1.814 -5.028 -7.758) 9.421 7.458 ( -10.075 6.854 14.342) 18.820 7.458 ( 10.075 6.854 14.342) 18.820 7.925 ( -12.513 0.905 -0.270) 12.549 7.925 ( 12.513 0.905 -0.270) 12.549 8.515 ( -10.216 -5.446 -5.889) 12.989 8.515 ( 10.216 -5.446 -5.889) 12.989 9.140 ( -8.467 5.907 19.361) 21.941 9.140 ( 8.467 5.907 19.361) 21.941 9.313 ( -3.847 1.180 24.179) 24.512 9.313 ( 3.847 1.180 24.179) 24.512 9.874 ( -3.993 -2.588 5.593) 7.343 9.874 ( 3.993 -2.588 5.593) 7.343 10.277 ( -9.151 0.962 19.088) 21.190 10.277 ( 9.151 0.962 19.088) 21.190 10.450 ( -1.543 0.083 -11.822) 11.923 10.450 ( 1.543 0.083 -11.822) 11.923 10.820 ( -4.266 1.471 -11.342) 12.207 10.820 ( 4.266 1.471 -11.342) 12.207 11.062 ( -2.492 1.057 3.227) 4.212 11.062 ( 2.492 1.057 3.227) 4.212 11.335 ( -2.814 -3.568 -10.168) 11.137 11.335 ( 2.814 -3.568 -10.168) 11.137 12.184 ( -6.610 6.576 1.208) 9.401 12.184 ( 6.610 6.576 1.208) 9.401 12.539 ( -10.452 12.518 -9.186) 18.718 12.539 ( 10.452 12.518 -9.186) 18.718 12.903 ( -5.694 -5.364 -5.917) 9.808 12.903 ( 5.694 -5.364 -5.917) 9.808 13.377 ( -9.206 -8.722 12.732) 17.970 13.377 ( 9.206 -8.722 12.732) 17.970 14.063 ( -2.974 4.116 19.527) 20.176 14.063 ( 2.974 4.116 19.527) 20.176 14.278 ( -10.225 -2.687 12.395) 16.291 14.278 ( 10.225 -2.687 12.395) 16.291 14.571 ( -4.221 -8.303 -2.892) 9.754 14.571 ( 4.221 -8.303 -2.892) 9.754 15.220 ( -2.704 2.161 -9.284) 9.908 15.220 ( 2.704 2.161 -9.284) 9.908 15.479 ( -12.482 1.616 -6.803) 14.307 15.479 ( 12.482 1.616 -6.803) 14.307 16.154 ( -5.020 7.470 6.975) 11.387 16.154 ( 5.020 7.470 6.975) 11.387 16.678 ( -7.679 7.297 7.257) 12.841 16.678 ( 7.679 7.297 7.257) 12.841 17.078 ( -10.401 -6.524 1.701) 12.395 17.078 ( 10.401 -6.524 1.701) 12.395 17.481 ( -2.933 0.201 -4.579) 5.441 17.481 ( 2.933 0.201 -4.579) 5.441 18.866 ( -9.492 3.008 -26.010) 27.851 18.866 ( 9.492 3.008 -26.010) 27.851 19.032 ( -3.579 -1.054 -8.442) 9.230 19.032 ( 3.579 -1.054 -8.442) 9.230 19.263 ( -9.685 -12.635 -17.297) 23.508 19.263 ( 9.685 -12.635 -17.297) 23.508 20.995 ( -0.441 3.155 -2.735) 4.199 20.995 ( 0.441 3.155 -2.735) 4.199======================= Grid point 368 (75/90) =======================q-point: (-0.50 -0.50 0.36)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 84Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.367 ( 0.000 0.000 -3.650) 3.650 3.367 ( 0.000 0.000 -3.650) 3.650 4.412 ( -0.000 -0.000 11.022) 11.022 4.412 ( 0.000 0.000 11.022) 11.022 4.849 ( -0.000 -0.000 -2.592) 2.592 4.849 ( 0.000 0.000 -2.592) 2.592 5.332 ( -0.000 -0.000 20.561) 20.561 5.332 ( 0.000 0.000 20.561) 20.561 6.723 ( 0.000 0.000 -9.675) 9.675 6.723 ( 0.000 0.000 -9.675) 9.675 7.534 ( 0.000 0.000 25.138) 25.138 7.534 ( 0.000 0.000 25.138) 25.138 7.934 ( 0.000 0.000 -7.644) 7.644 7.934 ( 0.000 0.000 -7.644) 7.644 8.458 ( 0.000 0.000 -6.057) 6.057 8.458 ( 0.000 0.000 -6.057) 6.057 9.217 ( 0.000 0.000 26.956) 26.956 9.217 ( 0.000 0.000 26.956) 26.956 9.313 ( -0.000 -0.000 13.952) 13.952 9.313 ( 0.000 0.000 13.952) 13.952 9.854 ( 0.000 0.000 3.597) 3.597 9.854 ( 0.000 0.000 3.597) 3.597 10.267 ( 0.000 0.000 27.639) 27.639 10.267 ( 0.000 0.000 27.639) 27.639 10.471 ( 0.000 0.000 -18.561) 18.561 10.471 ( 0.000 0.000 -18.561) 18.561 10.823 ( 0.000 0.000 -7.890) 7.890 10.823 ( 0.000 0.000 -7.890) 7.890 11.077 ( 0.000 0.000 2.905) 2.905 11.077 ( 0.000 0.000 2.905) 2.905 11.294 ( -0.000 -0.000 -11.735) 11.735 11.294 ( 0.000 0.000 -11.735) 11.735 12.252 ( 0.000 0.000 2.904) 2.904 12.252 ( 0.000 0.000 2.904) 2.904 12.729 ( 0.000 0.000 -11.414) 11.414 12.729 ( 0.000 0.000 -11.414) 11.414 12.786 ( -0.000 -0.000 -9.617) 9.617 12.786 ( 0.000 0.000 -9.617) 9.617 13.288 ( -0.000 -0.000 15.871) 15.871 13.288 ( 0.000 0.000 15.871) 15.871 14.172 ( -0.000 -0.000 7.504) 7.504 14.172 ( 0.000 0.000 7.504) 7.504 14.184 ( -0.000 -0.000 31.946) 31.946 14.184 ( 0.000 0.000 31.946) 31.946 14.487 ( 0.000 0.000 -8.792) 8.792 14.487 ( 0.000 0.000 -8.792) 8.792 15.239 ( -0.000 -0.000 -11.631) 11.631 15.239 ( 0.000 0.000 -11.631) 11.631 15.495 ( 0.000 0.000 -8.839) 8.839 15.495 ( 0.000 0.000 -8.839) 8.839 16.241 ( 0.000 0.000 7.787) 7.787 16.241 ( 0.000 0.000 7.787) 7.787 16.775 ( -0.000 -0.000 29.426) 29.426 16.775 ( -0.000 -0.000 29.426) 29.426 16.973 ( 0.000 0.000 -13.198) 13.198 16.973 ( 0.000 0.000 -13.198) 13.198 17.488 ( -0.000 -0.000 -5.131) 5.131 17.488 ( 0.000 0.000 -5.131) 5.131 18.957 ( 0.000 0.000 -33.831) 33.831 18.957 ( 0.000 0.000 -33.831) 33.831 19.019 ( -0.000 -0.000 -8.343) 8.343 19.019 ( 0.000 0.000 -8.343) 8.343 19.078 ( -0.000 -0.000 -13.293) 13.293 19.078 ( 0.000 0.000 -13.293) 13.293 21.027 ( 0.000 0.000 -2.583) 2.583 21.027 ( 0.000 0.000 -2.583) 2.583======================= Grid point 405 (76/90) =======================q-point: ( 0.00 0.00 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.625 ( 0.000 0.000 1.298) 1.298 3.666 ( 0.000 0.000 -3.145) 3.145 3.711 ( -0.000 0.000 18.092) 18.092 3.711 ( 0.000 0.000 18.092) 18.092 4.275 ( 0.000 0.000 -10.760) 10.760 4.275 ( 0.000 0.000 -10.760) 10.760 6.110 ( 0.000 0.000 -3.016) 3.016 6.110 ( 0.000 0.000 -3.016) 3.016 6.522 ( 0.000 0.000 1.605) 1.605 6.594 ( 0.000 0.000 -5.705) 5.705 6.649 ( 0.000 0.000 -1.057) 1.057 6.649 ( 0.000 0.000 -1.057) 1.057 8.250 ( 0.000 0.000 34.604) 34.604 8.845 ( 0.000 0.000 9.151) 9.151 8.845 ( 0.000 0.000 9.151) 9.151 8.861 ( 0.000 0.000 -29.255) 29.255 9.129 ( 0.000 0.000 -5.522) 5.522 9.129 ( -0.000 0.000 -5.522) 5.522 9.139 ( 0.000 -0.000 26.888) 26.888 9.530 ( 0.000 0.000 -10.334) 10.334 9.847 ( -0.000 0.000 45.809) 45.809 10.157 ( -0.000 -0.000 4.682) 4.682 10.221 ( 0.000 0.000 2.413) 2.413 10.221 ( 0.000 0.000 2.413) 2.413 10.247 ( -0.000 -0.000 -7.346) 7.346 10.557 ( 0.000 0.000 4.574) 4.574 10.557 ( 0.000 0.000 4.574) 4.574 10.671 ( -0.000 -0.000 -0.581) 0.581 10.671 ( 0.000 0.000 -0.581) 0.581 10.767 ( -0.000 0.000 -43.767) 43.767 11.379 ( 0.000 0.000 18.753) 18.753 11.696 ( 0.000 0.000 -6.010) 6.010 11.696 ( 0.000 0.000 -6.010) 6.010 11.720 ( 0.000 0.000 -17.606) 17.606 12.604 ( 0.000 0.000 6.158) 6.158 12.712 ( 0.000 0.000 12.730) 12.730 12.726 ( 0.000 0.000 -6.558) 6.558 12.966 ( -0.000 -0.000 -12.994) 12.994 13.461 ( 0.000 0.000 -0.128) 0.128 13.461 ( 0.000 0.000 -0.128) 0.128 13.933 ( -0.000 -0.000 0.355) 0.355 13.933 ( 0.000 0.000 0.355) 0.355 14.596 ( -0.000 0.000 30.129) 30.129 15.073 ( 0.000 0.000 -14.609) 14.609 15.490 ( 0.000 0.000 6.938) 6.938 15.490 ( 0.000 0.000 6.938) 6.938 15.543 ( -0.000 -0.000 12.208) 12.208 15.586 ( 0.000 0.000 -0.779) 0.779 15.586 ( -0.000 0.000 -0.779) 0.779 15.691 ( -0.000 0.000 51.691) 51.691 15.832 ( 0.000 0.000 -16.951) 16.951 16.168 ( 0.000 0.000 2.984) 2.984 16.168 ( -0.000 0.000 2.984) 2.984 16.211 ( 0.000 0.000 -0.503) 0.503 16.419 ( 0.000 0.000 -6.517) 6.517 16.419 ( -0.000 -0.000 -6.517) 6.517 16.500 ( 0.000 0.000 -14.614) 14.614 16.759 ( -0.000 -0.000 -42.746) 42.746 18.018 ( 0.000 0.000 8.112) 8.112 18.296 ( -0.000 -0.000 -17.935) 17.935 19.503 ( 0.000 0.000 2.175) 2.175 19.503 ( 0.000 0.000 2.175) 2.175 19.738 ( 0.000 0.000 -7.740) 7.740 19.738 ( -0.000 -0.000 -7.740) 7.740 21.275 ( 0.000 0.000 0.798) 0.798 21.277 ( 0.000 -0.000 0.460) 0.460======================= Grid point 406 (77/90) =======================q-point: ( 0.12 0.00 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.469 ( -6.711 0.000 6.612) 9.421 3.594 ( -5.520 0.000 -3.518) 6.545 3.714 ( 0.142 0.000 16.831) 16.832 4.048 ( 23.416 0.000 13.201) 26.881 4.201 ( -7.309 0.000 -9.599) 12.065 4.430 ( 14.713 0.000 -10.782) 18.241 6.117 ( 0.848 0.000 -2.243) 2.398 6.135 ( 2.773 0.000 -2.355) 3.638 6.545 ( -2.010 0.000 0.193) 2.019 6.570 ( 4.213 0.000 -2.204) 4.755 6.719 ( 6.119 0.000 -0.357) 6.129 6.750 ( 7.503 0.000 -3.581) 8.314 8.267 ( 1.951 0.000 30.931) 30.992 8.696 ( -13.796 0.000 5.281) 14.772 8.754 ( -3.812 0.000 -8.475) 9.293 8.927 ( -11.451 0.000 5.864) 12.865 8.974 ( 6.345 0.000 -6.762) 9.273 9.177 ( 5.065 0.000 -6.018) 7.866 9.316 ( 8.986 0.000 18.376) 20.456 9.613 ( 7.255 0.000 -4.215) 8.390 9.857 ( 1.412 0.000 35.715) 35.743 10.099 ( -4.477 0.000 -0.332) 4.489 10.155 ( -3.223 0.000 -4.979) 5.932 10.282 ( 4.144 0.000 4.360) 6.015 10.303 ( 3.528 0.000 -0.191) 3.533 10.441 ( -10.673 0.000 2.895) 11.059 10.644 ( 6.470 0.000 4.479) 7.869 10.681 ( 3.721 0.000 -2.658) 4.573 10.768 ( 9.437 0.000 -0.719) 9.464 10.820 ( 3.704 0.000 -30.228) 30.454 11.326 ( -7.008 0.000 13.556) 15.260 11.592 ( -7.775 0.000 -14.080) 16.084 11.697 ( -0.187 0.000 -5.378) 5.381 11.741 ( 0.635 0.000 -6.521) 6.551 12.487 ( -11.118 0.000 3.764) 11.738 12.633 ( -7.661 0.000 -5.232) 9.277 12.740 ( 2.803 0.000 10.759) 11.118 12.971 ( 0.997 0.000 -11.534) 11.578 13.584 ( 11.652 0.000 0.669) 11.671 13.630 ( 14.771 0.000 0.537) 14.780 13.944 ( 1.491 0.000 0.359) 1.533 13.950 ( 1.579 0.000 -0.090) 1.581 14.562 ( -3.417 0.000 28.478) 28.682 14.999 ( -7.558 0.000 -10.077) 12.596 15.397 ( -9.625 0.000 10.759) 14.436 15.417 ( -6.597 0.000 9.743) 11.766 15.468 ( -5.277 0.000 4.881) 7.188 15.549 ( -2.241 0.000 18.501) 18.636 15.607 ( 0.189 0.000 0.570) 0.600 15.697 ( -7.696 0.000 5.013) 9.185 15.714 ( -8.219 0.000 -12.431) 14.902 15.850 ( -12.112 0.000 15.619) 19.765 16.184 ( -5.768 0.000 -12.648) 13.902 16.315 ( 11.948 0.000 -0.671) 11.967 16.370 ( -0.054 0.000 -8.370) 8.370 16.523 ( 9.391 0.000 -5.204) 10.737 16.867 ( 11.940 0.000 -31.573) 33.755 16.896 ( 23.774 0.000 -3.838) 24.082 18.068 ( 4.717 0.000 6.751) 8.235 18.338 ( 4.789 0.000 -16.627) 17.303 19.486 ( -2.139 0.000 1.484) 2.604 19.487 ( -1.573 0.000 1.833) 2.415 19.709 ( -2.962 0.000 -7.475) 8.041 19.729 ( -1.279 0.000 -7.013) 7.129 21.180 ( -9.370 0.000 0.568) 9.387 21.206 ( -6.881 0.000 0.332) 6.889======================= Grid point 407 (78/90) =======================q-point: ( 0.25 0.00 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 225Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.379 ( -3.019 0.000 5.806) 6.544 3.485 ( -5.283 0.000 -3.861) 6.544 3.709 ( -0.782 0.000 13.177) 13.200 4.022 ( -10.407 0.000 -6.622) 12.335 4.531 ( 24.929 0.000 14.061) 28.622 4.781 ( 19.999 0.000 -9.929) 22.328 6.152 ( 3.277 0.000 -0.249) 3.286 6.226 ( 6.909 0.000 -0.639) 6.938 6.540 ( 1.496 0.000 4.639) 4.874 6.658 ( 4.449 0.000 -7.172) 8.440 6.817 ( 2.226 0.000 1.559) 2.717 6.895 ( 6.264 0.000 -3.851) 7.353 8.338 ( 5.654 0.000 18.899) 19.726 8.395 ( -15.266 0.000 2.348) 15.445 8.687 ( -13.363 0.000 3.173) 13.734 8.710 ( -1.079 0.000 -5.498) 5.603 9.102 ( 7.313 0.000 2.239) 7.648 9.327 ( 10.541 0.000 -6.196) 12.227 9.483 ( 8.144 0.000 25.678) 26.939 9.744 ( 4.524 0.000 11.568) 12.421 9.893 ( 0.850 0.000 19.114) 19.133 10.061 ( 2.249 0.000 -16.908) 17.057 10.131 ( 0.563 0.000 -7.748) 7.768 10.217 ( -10.208 0.000 3.258) 10.716 10.311 ( -1.686 0.000 2.154) 2.736 10.369 ( 3.563 0.000 1.397) 3.828 10.740 ( 2.753 0.000 3.748) 4.650 10.804 ( 0.676 0.000 -2.824) 2.904 10.877 ( 5.708 0.000 -5.108) 7.660 10.994 ( 12.847 0.000 -0.377) 12.852 11.130 ( -9.002 0.000 3.956) 9.833 11.457 ( -5.098 0.000 -18.668) 19.352 11.669 ( -3.310 0.000 -3.587) 4.881 11.722 ( -3.320 0.000 1.424) 3.613 12.253 ( -11.491 0.000 -0.748) 11.515 12.454 ( -10.711 0.000 -3.102) 11.151 12.806 ( 3.727 0.000 5.533) 6.671 13.010 ( 2.520 0.000 -7.640) 8.045 13.858 ( 15.436 0.000 4.091) 15.969 13.943 ( 15.719 0.000 2.490) 15.915 13.993 ( 3.306 0.000 -1.098) 3.484 14.014 ( 6.972 0.000 -0.464) 6.988 14.477 ( -4.861 0.000 21.937) 22.469 14.802 ( -11.921 0.000 0.807) 11.949 15.168 ( -13.371 0.000 8.731) 15.969 15.199 ( -18.333 0.000 4.928) 18.984 15.314 ( -10.560 0.000 2.888) 10.948 15.374 ( -8.189 0.000 4.177) 9.193 15.595 ( -1.473 0.000 -0.018) 1.473 15.598 ( -3.292 0.000 -8.073) 8.718 15.607 ( 1.370 0.000 14.652) 14.716 15.803 ( -0.445 0.000 -1.094) 1.181 16.050 ( -6.954 0.000 -10.284) 12.414 16.329 ( -4.098 0.000 -14.764) 15.322 16.561 ( 12.750 0.000 -1.674) 12.860 16.721 ( 9.916 0.000 -3.968) 10.681 17.198 ( 20.575 0.000 -11.430) 23.537 17.315 ( 18.985 0.000 -1.395) 19.036 18.175 ( 6.210 0.000 0.184) 6.213 18.501 ( 12.257 0.000 -10.757) 16.307 19.394 ( -8.249 0.000 -0.276) 8.253 19.450 ( -1.898 0.000 0.779) 2.052 19.630 ( -4.947 0.000 -6.648) 8.287 19.670 ( -5.419 0.000 -5.351) 7.616 20.961 ( -11.770 0.000 0.246) 11.773 21.035 ( -10.070 0.000 -0.612) 10.088======================= Grid point 408 (79/90) =======================q-point: ( 0.38 0.00 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.344 ( -0.650 0.000 3.587) 3.645 3.401 ( -3.402 0.000 -2.359) 4.140 3.693 ( -0.403 0.000 7.941) 7.951 3.833 ( -8.399 0.000 -2.499) 8.763 4.948 ( 17.383 0.000 10.396) 20.255 5.112 ( 11.652 0.000 -3.705) 12.227 6.273 ( 10.038 0.000 1.478) 10.147 6.400 ( 10.578 0.000 3.847) 11.256 6.586 ( 2.365 0.000 6.384) 6.808 6.733 ( 3.328 0.000 -9.143) 9.730 6.760 ( -8.337 0.000 2.810) 8.797 6.935 ( -2.998 0.000 -6.957) 7.575 8.186 ( -4.876 0.000 1.696) 5.162 8.427 ( -12.997 0.000 1.984) 13.148 8.476 ( 7.991 0.000 4.785) 9.314 8.688 ( -1.958 0.000 -3.980) 4.436 9.276 ( 11.177 0.000 10.453) 15.304 9.584 ( 15.903 0.000 -4.229) 16.456 9.620 ( 5.934 0.000 28.403) 29.016 9.766 ( -1.394 0.000 21.170) 21.216 9.789 ( -11.497 0.000 13.693) 17.880 10.146 ( 1.244 0.000 -12.058) 12.122 10.158 ( 4.810 0.000 -22.325) 22.837 10.179 ( 4.372 0.000 -14.183) 14.842 10.222 ( -6.734 0.000 14.066) 15.595 10.459 ( 6.486 0.000 3.181) 7.224 10.570 ( -17.121 0.000 -9.547) 19.603 10.738 ( -3.195 0.000 2.744) 4.212 11.025 ( 6.122 0.000 13.084) 14.446 11.123 ( 4.407 0.000 3.458) 5.602 11.228 ( 10.834 0.000 0.006) 10.834 11.417 ( 0.932 0.000 -19.275) 19.297 11.563 ( -7.283 0.000 -1.935) 7.535 11.614 ( -7.136 0.000 2.636) 7.608 12.088 ( -4.750 0.000 -3.500) 5.900 12.244 ( -10.232 0.000 -2.661) 10.573 12.882 ( 4.289 0.000 0.445) 4.312 13.032 ( -0.984 0.000 -4.218) 4.332 14.053 ( 5.960 0.000 3.158) 6.745 14.150 ( 10.070 0.000 2.668) 10.418 14.168 ( 12.090 0.000 10.025) 15.706 14.261 ( 12.400 0.000 0.686) 12.419 14.383 ( -4.960 0.000 7.547) 9.031 14.580 ( -10.333 0.000 8.286) 13.245 14.910 ( -7.579 0.000 0.320) 7.586 14.919 ( -10.718 0.000 6.098) 12.332 15.086 ( -12.529 0.000 2.367) 12.751 15.203 ( -11.353 0.000 5.637) 12.675 15.557 ( -0.914 0.000 -3.842) 3.949 15.572 ( -1.196 0.000 -1.984) 2.317 15.652 ( 2.677 0.000 10.983) 11.305 15.767 ( -3.374 0.000 -13.518) 13.932 15.990 ( 1.921 0.000 -6.743) 7.011 16.224 ( -6.566 0.000 -15.019) 16.391 16.779 ( 9.223 0.000 -1.915) 9.419 16.871 ( 4.970 0.000 -3.170) 5.895 17.569 ( 15.128 0.000 1.014) 15.162 17.608 ( 11.057 0.000 0.342) 11.062 18.339 ( 12.446 0.000 -6.742) 14.154 18.781 ( 14.264 0.000 -4.919) 15.088 19.156 ( -14.605 0.000 -3.329) 14.979 19.427 ( -0.184 0.000 -0.985) 1.002 19.501 ( -12.361 0.000 -3.958) 12.979 19.531 ( -5.014 0.000 -5.195) 7.220 20.785 ( -5.570 0.000 -0.681) 5.611 20.854 ( -7.847 0.000 -1.487) 7.987======================= Grid point 409 (80/90) =======================q-point: (-0.50 0.00 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 140Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.353 ( -1.505 0.000 0.489) 1.582 3.353 ( 1.505 0.000 0.489) 1.582 3.717 ( -3.461 0.000 2.452) 4.242 3.717 ( 3.461 0.000 2.452) 4.242 5.173 ( -5.108 0.000 4.235) 6.635 5.173 ( 5.108 0.000 4.235) 6.635 6.526 ( -14.496 0.000 2.280) 14.674 6.526 ( 14.496 0.000 2.280) 14.674 6.575 ( -5.223 0.000 9.254) 10.626 6.575 ( 5.223 0.000 9.254) 10.626 6.817 ( -6.541 0.000 -11.941) 13.616 6.817 ( 6.541 0.000 -11.941) 13.616 8.220 ( -7.475 0.000 1.707) 7.668 8.220 ( 7.475 0.000 1.707) 7.668 8.614 ( -5.790 0.000 -2.476) 6.297 8.614 ( 5.790 0.000 -2.476) 6.297 9.526 ( -14.088 0.000 12.171) 18.618 9.526 ( 14.088 0.000 12.171) 18.618 9.713 ( -3.855 0.000 25.229) 25.521 9.713 ( 3.855 0.000 25.229) 25.521 9.926 ( -17.918 0.000 2.327) 18.068 9.926 ( 17.918 0.000 2.327) 18.068 10.219 ( -1.137 0.000 -18.084) 18.120 10.219 ( 1.137 0.000 -18.084) 18.120 10.302 ( -9.972 0.000 -8.210) 12.917 10.302 ( 9.972 0.000 -8.210) 12.917 10.618 ( -8.642 0.000 2.529) 9.005 10.618 ( 8.642 0.000 2.529) 9.005 11.132 ( -3.950 0.000 10.386) 11.112 11.132 ( 3.950 0.000 10.386) 11.112 11.409 ( -8.431 0.000 -0.830) 8.472 11.409 ( 8.431 0.000 -0.830) 8.472 11.485 ( -5.606 0.000 -7.431) 9.308 11.485 ( 5.606 0.000 -7.431) 9.308 12.091 ( -4.814 0.000 -3.399) 5.893 12.091 ( 4.814 0.000 -3.399) 5.893 12.972 ( -4.605 0.000 -2.287) 5.141 12.972 ( 4.605 0.000 -2.287) 5.141 14.191 ( -7.670 0.000 8.054) 11.122 14.191 ( 7.670 0.000 8.054) 11.122 14.332 ( -6.074 0.000 2.434) 6.544 14.332 ( 6.074 0.000 2.434) 6.544 14.411 ( -7.504 0.000 7.445) 10.571 14.411 ( 7.504 0.000 7.445) 10.571 14.872 ( -7.200 0.000 3.291) 7.917 14.872 ( 7.200 0.000 3.291) 7.917 14.964 ( -10.971 0.000 1.115) 11.028 14.964 ( 10.971 0.000 1.115) 11.028 15.554 ( -0.496 0.000 -2.633) 2.679 15.554 ( 0.496 0.000 -2.633) 2.679 15.704 ( -2.855 0.000 -1.327) 3.148 15.704 ( 2.855 0.000 -1.327) 3.148 16.089 ( -6.942 0.000 -11.858) 13.740 16.089 ( 6.942 0.000 -11.858) 13.740 16.896 ( -2.519 0.000 -2.424) 3.496 16.896 ( 2.519 0.000 -2.424) 3.496 17.717 ( -0.709 0.000 2.853) 2.940 17.717 ( 0.709 0.000 2.853) 2.940 18.675 ( -20.185 0.000 -5.743) 20.986 18.675 ( 20.185 0.000 -5.743) 20.986 19.211 ( -16.212 0.000 -4.183) 16.743 19.211 ( 16.212 0.000 -4.183) 16.743 19.452 ( -2.852 0.000 -3.172) 4.265 19.452 ( 2.852 0.000 -3.172) 4.265 20.754 ( -2.140 0.000 -1.507) 2.617 20.754 ( 2.140 0.000 -1.507) 2.617======================= Grid point 415 (81/90) =======================q-point: ( 0.12 0.12 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.417 ( -3.936 -3.936 7.108) 9.028 3.511 ( -3.831 -3.831 -2.518) 5.974 3.909 ( 6.364 6.364 18.918) 20.949 4.075 ( 10.506 10.506 7.451) 16.622 4.336 ( 2.970 2.970 -10.611) 11.412 4.361 ( 3.125 3.125 -7.856) 9.014 6.138 ( 1.159 1.159 -1.134) 1.994 6.148 ( 1.841 1.841 -2.053) 3.316 6.567 ( 1.775 1.775 2.608) 3.619 6.631 ( 5.803 5.803 -3.939) 9.103 6.753 ( 4.133 4.133 0.411) 5.860 6.803 ( 4.761 4.761 -4.672) 8.195 8.280 ( 1.567 1.567 27.668) 27.757 8.564 ( -9.408 -9.408 2.117) 13.472 8.692 ( -10.365 -10.365 2.126) 14.812 8.870 ( -2.750 -2.750 -21.959) 22.300 9.008 ( 3.054 3.054 17.844) 18.360 9.260 ( 7.072 7.072 -8.483) 13.115 9.364 ( 4.591 4.591 21.999) 22.937 9.664 ( 4.448 4.448 -2.470) 6.757 9.839 ( 0.444 0.444 24.499) 24.507 10.099 ( -4.144 -4.144 7.062) 9.177 10.106 ( -3.476 -3.476 -11.095) 12.135 10.281 ( -0.860 -0.860 -8.522) 8.609 10.333 ( 4.961 4.961 14.234) 15.869 10.500 ( 0.390 0.390 4.819) 4.850 10.513 ( -1.078 -1.078 1.182) 1.929 10.824 ( 8.668 8.668 -4.179) 12.952 10.843 ( 2.433 2.433 -22.266) 22.530 10.855 ( 6.602 6.602 0.082) 9.337 11.301 ( -3.606 -3.606 11.007) 12.131 11.546 ( -6.022 -6.022 -17.449) 19.417 11.660 ( -1.275 -1.275 -0.400) 1.847 11.734 ( -0.664 -0.664 -6.956) 7.019 12.442 ( -5.432 -5.432 3.829) 8.584 12.530 ( -6.965 -6.965 -4.713) 10.920 12.793 ( 3.374 3.374 8.720) 9.940 12.989 ( 1.312 1.312 -10.527) 10.690 13.646 ( 4.387 4.387 2.943) 6.867 13.685 ( 6.695 6.695 -1.282) 9.555 13.978 ( 4.097 4.097 1.452) 5.973 14.004 ( 5.190 5.190 -1.132) 7.427 14.537 ( -2.493 -2.493 27.427) 27.653 14.958 ( -4.677 -4.677 -9.675) 11.720 15.241 ( -13.379 -13.379 5.955) 19.836 15.269 ( -10.201 -10.201 10.448) 17.813 15.457 ( -2.014 -2.014 12.580) 12.899 15.520 ( -9.296 -9.296 -0.889) 13.176 15.559 ( -1.602 -1.602 9.318) 9.589 15.635 ( -5.508 -5.508 12.482) 14.714 15.722 ( 4.650 4.650 -5.968) 8.881 15.913 ( -4.892 -4.892 -12.903) 14.641 16.138 ( -0.959 -0.959 3.669) 3.911 16.291 ( 3.336 3.336 -12.622) 13.475 16.386 ( 9.306 9.306 6.399) 14.634 16.823 ( 9.363 9.363 -18.203) 22.509 16.933 ( 10.543 10.543 -3.691) 15.360 16.952 ( 9.610 9.610 -16.530) 21.400 18.121 ( 4.990 4.990 6.445) 9.557 18.369 ( 3.585 3.585 -16.364) 17.131 19.384 ( -6.454 -6.454 3.453) 9.758 19.488 ( -3.796 -3.796 -5.564) 7.732 19.679 ( -0.990 -0.990 -0.810) 1.618 19.766 ( 1.054 1.054 -8.354) 8.486 21.115 ( -7.249 -7.249 0.905) 10.292 21.129 ( -6.603 -6.603 -0.398) 9.347======================= Grid point 416 (82/90) =======================q-point: ( 0.25 0.12 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.358 ( -2.049 -1.690 5.436) 6.051 3.442 ( -3.388 -2.585 -3.255) 5.363 3.889 ( -3.321 15.568 13.850) 21.100 4.153 ( -10.703 12.922 -7.100) 18.219 4.466 ( 22.835 -5.831 11.868) 26.387 4.685 ( 19.463 -9.121 -8.956) 23.285 6.134 ( -0.550 -1.376 1.147) 1.874 6.222 ( 5.028 -2.416 0.078) 5.579 6.608 ( 2.564 7.597 6.048) 10.044 6.750 ( 5.457 9.283 -7.612) 13.187 6.839 ( 2.714 1.427 0.715) 3.148 6.923 ( 7.351 2.484 -4.361) 8.901 8.311 ( -9.473 -4.529 4.793) 11.542 8.348 ( -0.470 -0.896 14.029) 14.065 8.525 ( -6.658 -12.014 3.163) 14.095 8.766 ( -6.097 0.646 -14.027) 15.308 9.110 ( 6.680 0.913 17.019) 18.305 9.402 ( 7.574 6.602 -1.098) 10.107 9.499 ( 9.436 1.861 19.722) 21.942 9.732 ( 0.946 -0.485 7.479) 7.554 9.903 ( 4.382 2.425 11.648) 12.679 10.000 ( -2.517 -7.931 3.464) 9.013 10.051 ( -2.500 -4.084 -12.924) 13.782 10.220 ( -3.651 1.343 -12.512) 13.103 10.388 ( -2.654 8.221 1.415) 8.754 10.469 ( 3.912 4.236 13.572) 14.746 10.639 ( 5.084 -4.290 2.968) 7.284 10.857 ( -0.535 1.348 -4.517) 4.744 10.968 ( 5.668 2.762 0.971) 6.379 11.020 ( 8.178 3.498 -6.358) 10.933 11.151 ( -9.910 5.417 -2.009) 11.471 11.476 ( 1.708 -0.997 -12.958) 13.108 11.637 ( -2.476 -2.367 2.447) 4.209 11.709 ( -1.899 1.110 -4.903) 5.374 12.286 ( -9.215 2.642 -0.816) 9.621 12.403 ( -7.244 -4.067 -2.414) 8.651 12.852 ( 2.729 3.367 6.021) 7.419 13.013 ( 1.170 0.127 -7.588) 7.679 13.744 ( 6.492 -7.233 5.111) 10.981 13.849 ( 8.994 -4.439 -2.912) 10.444 14.096 ( 7.365 6.523 3.893) 10.580 14.145 ( 8.872 7.907 -1.181) 11.943 14.472 ( -4.088 -0.695 21.937) 22.325 14.813 ( -10.255 1.197 2.573) 10.641 14.942 ( -14.263 -13.781 -0.594) 19.842 15.092 ( -9.983 -10.175 2.515) 14.474 15.298 ( -11.105 -2.931 9.406) 14.845 15.441 ( -0.598 -7.759 3.043) 8.355 15.478 ( -5.013 -7.410 3.727) 9.692 15.553 ( -4.024 6.390 4.260) 8.670 15.706 ( -4.782 4.176 4.319) 7.679 15.867 ( 2.638 5.189 -16.991) 17.961 16.151 ( -1.830 4.932 -2.260) 5.725 16.319 ( -0.203 5.340 -8.303) 9.874 16.624 ( 12.799 6.479 3.193) 14.697 16.890 ( 3.269 13.783 -9.629) 17.128 17.192 ( 17.228 -0.124 -10.693) 20.277 17.288 ( 17.807 -2.540 -1.477) 18.048 18.229 ( 5.669 5.316 1.199) 7.863 18.505 ( 11.023 0.565 -11.692) 16.079 19.242 ( -8.646 -10.548 2.149) 13.807 19.373 ( -6.951 -9.458 -8.359) 14.410 19.633 ( -4.856 1.235 1.738) 5.303 19.738 ( -4.503 1.876 -7.508) 8.954 20.936 ( -9.307 -2.297 0.261) 9.590 20.987 ( -7.764 -4.278 -0.985) 8.919======================= Grid point 417 (83/90) =======================q-point: ( 0.38 0.12 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.337 ( -0.182 -0.635 2.946) 3.019 3.385 ( -2.445 -1.091 -2.082) 3.392 3.834 ( -1.763 13.423 8.217) 15.837 3.959 ( -8.641 12.357 -2.691) 15.317 4.868 ( 17.531 -7.479 9.426) 21.263 5.019 ( 12.609 -8.892 -3.974) 15.932 6.152 ( 3.304 -9.072 3.705) 10.342 6.308 ( 2.241 -10.665 3.549) 11.461 6.667 ( 3.690 9.410 6.890) 12.233 6.820 ( -1.854 4.467 -3.459) 5.946 6.843 ( 2.714 8.119 -5.328) 10.083 7.021 ( 0.682 8.441 -5.401) 10.045 8.115 ( -4.708 -5.821 0.841) 7.533 8.336 ( -8.980 -6.166 7.616) 13.292 8.483 ( 5.881 -2.083 -0.022) 6.239 8.682 ( -3.131 -1.033 -6.990) 7.729 9.268 ( 10.118 -0.958 19.401) 21.902 9.569 ( 9.522 1.448 8.064) 12.562 9.658 ( -2.523 -4.579 14.222) 15.153 9.715 ( 6.262 3.906 17.393) 18.894 9.868 ( -5.314 3.165 9.115) 11.016 9.997 ( -2.976 -5.385 -9.739) 11.520 10.085 ( 7.191 -4.341 -2.517) 8.769 10.230 ( 3.544 3.259 -17.671) 18.315 10.324 ( -2.822 5.927 -9.301) 11.384 10.436 ( -9.717 -2.281 8.010) 12.798 10.691 ( 3.110 6.916 0.693) 7.614 10.848 ( -1.098 2.686 7.098) 7.669 10.951 ( -3.418 -0.241 2.674) 4.346 11.030 ( -0.235 -1.775 0.093) 1.793 11.227 ( 8.624 -2.244 -10.129) 13.491 11.540 ( -6.010 -6.751 1.809) 9.218 11.590 ( 6.530 13.860 -5.579) 16.306 11.683 ( 0.023 9.895 -1.845) 10.066 12.130 ( -5.988 4.250 -3.291) 8.047 12.243 ( -8.801 0.455 -2.220) 9.088 12.904 ( 2.976 1.687 1.322) 3.668 13.020 ( -1.011 -1.407 -4.312) 4.647 13.904 ( 9.807 -12.762 8.697) 18.295 14.030 ( 10.418 -6.494 -4.108) 12.945 14.221 ( 3.910 -0.059 8.672) 9.513 14.275 ( 1.925 -1.030 2.175) 3.081 14.377 ( -5.330 -0.001 9.938) 11.277 14.572 ( -13.165 -1.686 8.664) 15.851 14.784 ( -1.673 -2.717 -4.590) 5.590 14.929 ( -4.653 -0.386 0.867) 4.749 15.123 ( -5.946 1.597 8.056) 10.139 15.379 ( -8.185 -1.373 7.995) 11.524 15.424 ( -3.335 0.069 1.389) 3.613 15.440 ( -2.767 -8.342 -5.273) 10.250 15.701 ( 4.105 4.820 5.254) 8.227 15.888 ( -1.746 9.500 -17.039) 19.586 16.113 ( 0.151 9.282 -2.486) 9.611 16.270 ( -4.509 6.287 -10.732) 13.229 16.839 ( 9.033 6.099 -0.453) 10.909 16.957 ( 2.563 8.197 -4.260) 9.587 17.529 ( 14.827 -4.095 1.242) 15.432 17.578 ( 11.616 -3.053 -0.268) 12.013 18.362 ( 9.787 2.263 -6.223) 11.816 18.773 ( 14.951 -1.074 -5.489) 15.963 19.020 ( -14.297 -11.310 -3.135) 18.497 19.254 ( -5.467 -12.618 -6.052) 15.024 19.499 ( -7.392 -1.400 0.774) 7.563 19.592 ( -9.837 0.065 -6.440) 11.758 20.806 ( -3.719 2.193 -0.649) 4.366 20.855 ( -5.384 0.492 -1.534) 5.620======================= Grid point 418 (84/90) =======================q-point: (-0.50 0.12 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.349 ( -1.325 -0.389 0.238) 1.401 3.349 ( 1.325 -0.389 0.238) 1.401 3.843 ( -3.137 12.343 2.464) 12.971 3.843 ( 3.137 12.343 2.464) 12.971 5.096 ( -4.853 -7.360 3.597) 9.521 5.096 ( 4.853 -7.360 3.597) 9.521 6.261 ( -6.296 -15.791 4.919) 17.698 6.261 ( 6.296 -15.791 4.919) 17.698 6.746 ( -4.174 7.009 3.904) 9.043 6.746 ( 4.174 7.009 3.904) 9.043 6.945 ( -6.508 11.625 -8.624) 15.870 6.945 ( 6.508 11.625 -8.624) 15.870 8.156 ( -7.576 -5.321 2.769) 9.663 8.156 ( 7.576 -5.321 2.769) 9.663 8.604 ( -5.474 -1.783 -3.558) 6.767 8.604 ( 5.474 -1.783 -3.558) 6.767 9.488 ( -11.605 -3.342 19.053) 22.558 9.488 ( 11.605 -3.342 19.053) 22.558 9.733 ( -6.516 1.076 15.424) 16.778 9.733 ( 6.516 1.076 15.424) 16.778 9.908 ( -7.272 0.637 -0.212) 7.303 9.908 ( 7.272 0.637 -0.212) 7.303 10.211 ( -8.115 -4.619 -2.134) 9.578 10.211 ( 8.115 -4.619 -2.134) 9.578 10.299 ( -2.877 5.436 -17.109) 18.181 10.299 ( 2.877 5.436 -17.109) 18.181 10.776 ( -5.016 9.021 3.600) 10.932 10.776 ( 5.016 9.021 3.600) 10.932 10.980 ( -3.817 -7.118 4.059) 9.039 10.980 ( 3.817 -7.118 4.059) 9.039 11.387 ( -8.418 -4.042 -1.654) 9.483 11.387 ( 8.418 -4.042 -1.654) 9.483 11.687 ( -1.677 16.274 -3.033) 16.639 11.687 ( 1.677 16.274 -3.033) 16.639 12.104 ( -4.014 1.880 -3.107) 5.413 12.104 ( 4.014 1.880 -3.107) 5.413 12.971 ( -3.619 -0.433 -1.987) 4.151 12.971 ( 3.619 -0.433 -1.987) 4.151 14.107 ( -10.879 -10.999 10.650) 18.782 14.107 ( 10.879 -10.999 10.650) 18.782 14.248 ( -10.002 -8.621 0.882) 13.234 14.248 ( 10.002 -8.621 0.882) 13.234 14.358 ( -6.765 2.019 3.475) 7.869 14.358 ( 6.765 2.019 3.475) 7.869 14.846 ( -5.822 1.112 0.874) 5.991 14.846 ( 5.822 1.112 0.874) 5.991 15.165 ( -10.030 9.250 7.317) 15.482 15.165 ( 10.030 9.250 7.317) 15.482 15.410 ( -0.819 -9.299 -2.829) 9.754 15.410 ( 0.819 -9.299 -2.829) 9.754 15.806 ( -5.731 8.421 -4.121) 10.988 15.806 ( 5.731 8.421 -4.121) 10.988 16.172 ( -4.942 7.931 -9.200) 13.113 16.172 ( 4.942 7.931 -9.200) 13.113 16.957 ( -2.958 6.051 -2.184) 7.080 16.957 ( 2.958 6.051 -2.184) 7.080 17.688 ( -1.330 -3.027 3.363) 4.716 17.688 ( 1.330 -3.027 3.363) 4.716 18.647 ( -18.581 -3.267 -6.561) 19.975 18.647 ( 18.581 -3.267 -6.561) 19.975 19.095 ( -12.684 -9.183 -4.291) 16.237 19.095 ( 12.684 -9.183 -4.291) 16.237 19.441 ( -3.146 -3.231 -3.752) 5.867 19.441 ( 3.146 -3.231 -3.752) 5.867 20.788 ( -1.524 3.389 -1.385) 3.966 20.788 ( 1.524 3.389 -1.385) 3.966======================= Grid point 425 (85/90) =======================q-point: ( 0.25 0.25 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 201Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.332 ( -0.833 -0.833 3.749) 3.930 3.398 ( -2.048 -2.048 -3.096) 4.240 4.184 ( 7.681 7.681 18.427) 21.391 4.400 ( 6.301 6.301 3.768) 9.675 4.455 ( 1.952 1.952 -0.798) 2.874 4.493 ( 5.057 5.057 -11.971) 13.945 6.091 ( -4.694 -4.694 5.225) 8.448 6.135 ( -4.075 -4.075 1.038) 5.856 6.784 ( 6.885 6.885 7.451) 12.261 6.840 ( -0.466 -0.466 0.072) 0.663 6.964 ( 4.852 4.852 -5.831) 9.004 6.999 ( 12.315 12.315 -8.018) 19.173 8.251 ( -9.318 -9.318 0.740) 13.198 8.258 ( -4.741 -4.741 -0.672) 6.738 8.352 ( -0.166 -0.166 17.536) 17.538 8.720 ( -4.813 -4.813 -19.202) 20.373 9.146 ( 3.535 3.535 30.225) 30.635 9.534 ( 5.439 5.439 23.011) 24.263 9.573 ( 6.481 6.481 -6.404) 11.181 9.735 ( 0.135 0.135 -0.330) 0.381 9.827 ( -6.869 -6.869 15.215) 18.051 10.009 ( 7.343 7.343 1.123) 10.445 10.019 ( 0.203 0.203 -8.988) 8.993 10.242 ( 1.175 1.175 -23.284) 23.344 10.470 ( -4.041 -4.041 17.003) 17.938 10.520 ( -2.547 -2.547 1.863) 4.055 10.584 ( 4.382 4.382 11.332) 12.916 10.920 ( -0.484 -0.484 1.601) 1.741 10.924 ( 1.914 1.914 -1.851) 3.278 11.090 ( 1.970 1.970 -21.583) 21.763 11.294 ( -0.025 -0.025 4.306) 4.306 11.370 ( -1.300 -1.300 -6.596) 6.847 11.692 ( 5.979 5.979 1.561) 8.598 11.762 ( 5.180 5.180 -5.178) 8.971 12.325 ( -0.327 -0.327 -2.211) 2.259 12.326 ( -2.973 -2.973 -1.297) 4.400 12.899 ( 1.269 1.269 4.932) 5.248 13.003 ( -1.259 -1.259 -6.078) 6.334 13.642 ( -2.517 -2.517 9.025) 9.702 13.818 ( 1.585 1.585 -7.949) 8.259 14.207 ( 4.561 4.561 6.106) 8.882 14.242 ( 0.909 0.909 1.574) 2.032 14.438 ( -3.253 -3.253 19.351) 19.891 14.701 ( -10.416 -10.416 -1.961) 14.861 14.854 ( 2.153 2.153 0.247) 3.055 14.913 ( -6.090 -6.090 0.791) 8.649 15.224 ( -6.317 -6.317 0.955) 8.984 15.247 ( -7.498 -7.498 16.136) 19.308 15.327 ( -6.753 -6.753 -1.938) 9.745 15.655 ( -6.504 -6.504 -15.749) 18.238 15.719 ( 7.858 7.858 12.426) 16.670 16.004 ( 7.795 7.795 -16.169) 19.569 16.233 ( 3.906 3.906 10.935) 12.251 16.463 ( 4.855 4.855 -12.928) 14.638 16.807 ( 11.704 11.704 12.189) 20.556 17.151 ( 8.421 8.421 -18.505) 22.006 17.226 ( 4.566 4.566 0.482) 6.475 17.265 ( 5.360 5.360 -3.887) 8.519 18.350 ( 5.519 5.519 3.035) 8.375 18.544 ( 4.826 4.826 -13.770) 15.368 19.041 ( -9.981 -9.981 1.635) 14.210 19.164 ( -11.057 -11.057 -10.564) 18.871 19.586 ( -6.876 -6.876 2.807) 10.121 19.692 ( -6.863 -6.863 -7.932) 12.535 20.887 ( -2.339 -2.339 0.347) 3.326 20.912 ( -2.600 -2.600 -1.888) 4.133======================= Grid point 426 (86/90) =======================q-point: ( 0.38 0.25 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 352Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.326 ( 0.175 -0.467 1.503) 1.584 3.363 ( -1.560 -1.236 -2.193) 2.961 4.160 ( -2.958 19.068 9.153) 21.356 4.266 ( -8.813 18.041 -1.652) 20.146 4.703 ( 17.015 -8.439 6.154) 19.965 4.814 ( 13.898 -11.108 -4.324) 18.309 5.981 ( -4.487 -8.542 6.609) 11.695 6.066 ( -4.601 -12.862 4.696) 14.445 6.791 ( -1.794 -0.572 1.038) 2.150 6.832 ( -2.369 -2.148 -1.767) 3.654 7.078 ( 8.059 15.998 -2.114) 18.038 7.236 ( 7.785 13.025 -5.405) 16.108 8.035 ( -5.918 -1.399 2.859) 6.720 8.233 ( -5.832 -4.029 7.537) 10.347 8.392 ( 5.820 -6.535 1.203) 8.833 8.623 ( -4.732 -5.507 -12.082) 14.096 9.264 ( 8.572 1.906 27.371) 28.745 9.582 ( -5.117 -1.181 10.595) 11.825 9.650 ( 6.170 4.836 7.134) 10.599 9.761 ( 2.721 0.156 19.475) 19.665 9.823 ( 4.693 -4.986 -5.030) 8.496 9.996 ( -3.375 4.379 -6.114) 8.243 10.132 ( 3.592 5.638 2.289) 7.066 10.302 ( 2.930 4.245 -17.268) 18.022 10.339 ( -7.074 -5.204 2.028) 9.013 10.415 ( -3.320 -0.472 -7.268) 8.004 10.679 ( 3.704 -1.510 15.384) 15.895 10.894 ( -3.722 0.352 5.666) 6.788 10.958 ( 2.736 3.794 -0.282) 4.686 11.126 ( -2.397 1.092 -13.527) 13.781 11.189 ( -0.113 1.079 -3.213) 3.391 11.384 ( -2.917 -8.442 -1.603) 9.075 11.847 ( 9.479 12.105 1.533) 15.451 11.909 ( 8.789 13.301 -3.321) 16.285 12.236 ( -5.234 5.386 -0.748) 7.547 12.292 ( -4.260 5.307 -4.282) 8.041 12.911 ( 0.480 -1.885 1.571) 2.500 12.969 ( -2.075 -3.973 -4.491) 6.345 13.673 ( 5.811 -9.461 12.030) 16.370 13.891 ( 4.158 -7.201 -6.544) 10.581 14.157 ( -6.931 -4.508 7.759) 11.338 14.267 ( -0.607 -1.317 0.216) 1.466 14.357 ( -2.849 -0.951 13.608) 13.935 14.532 ( -7.746 -1.262 -2.293) 8.177 14.827 ( 0.126 2.100 2.453) 3.232 14.942 ( 0.650 3.587 2.665) 4.516 15.093 ( -1.310 -3.778 11.110) 11.808 15.179 ( -2.434 -10.335 5.479) 11.948 15.249 ( -0.964 -8.741 -7.801) 11.755 15.494 ( -9.315 -2.698 -12.465) 15.793 15.884 ( 9.004 13.360 9.235) 18.570 16.119 ( 2.404 13.596 -11.561) 18.008 16.275 ( 1.668 7.322 5.254) 9.165 16.465 ( -3.790 11.655 -11.085) 16.525 17.005 ( 7.778 10.813 5.854) 14.550 17.155 ( -1.751 11.436 -3.980) 12.234 17.421 ( 12.657 -6.506 1.383) 14.299 17.501 ( 12.350 -4.299 -2.497) 13.313 18.407 ( 2.255 1.163 -3.998) 4.735 18.699 ( 6.344 -7.731 -10.573) 14.554 18.849 ( -7.608 -3.362 -3.418) 8.993 19.008 ( -3.908 -11.978 -7.194) 14.509 19.394 ( -10.936 -9.472 1.001) 14.502 19.494 ( -12.503 -9.803 -7.616) 17.619 20.864 ( -0.049 3.564 -0.550) 3.607 20.884 ( -0.695 2.467 -1.603) 3.023======================= Grid point 427 (87/90) =======================q-point: (-0.50 0.25 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 221Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.338 ( -1.036 -0.763 -0.583) 1.413 3.338 ( 1.036 -0.763 -0.583) 1.413 4.152 ( -2.668 18.492 2.983) 18.920 4.152 ( 2.668 18.492 2.983) 18.920 4.924 ( -3.741 -9.483 1.846) 10.360 4.924 ( 3.741 -9.483 1.846) 10.360 5.970 ( -3.601 -13.796 6.539) 15.686 5.970 ( 3.601 -13.796 6.539) 15.686 6.785 ( -1.451 -3.388 -1.857) 4.127 6.785 ( 1.451 -3.388 -1.857) 4.127 7.233 ( -6.478 17.440 -2.631) 18.789 7.233 ( 6.478 17.440 -2.631) 18.789 8.074 ( -8.059 -2.250 5.065) 9.781 8.074 ( 8.059 -2.250 5.065) 9.781 8.522 ( -6.273 -6.910 -4.833) 10.510 8.522 ( 6.273 -6.910 -4.833) 10.510 9.443 ( -8.831 0.015 20.230) 22.074 9.443 ( 8.831 0.015 20.230) 22.074 9.765 ( -3.606 2.349 7.385) 8.548 9.765 ( 3.606 2.349 7.385) 8.548 9.914 ( -4.508 -1.986 1.291) 5.093 9.914 ( 4.508 -1.986 1.291) 5.093 10.172 ( -4.009 0.264 1.727) 4.373 10.172 ( 4.009 0.264 1.727) 4.373 10.395 ( -2.202 4.352 -18.291) 18.930 10.395 ( 2.202 4.352 -18.291) 18.930 10.777 ( -6.979 -2.073 11.771) 13.840 10.777 ( 6.979 -2.073 11.771) 13.840 11.029 ( -4.476 5.012 -2.289) 7.099 11.029 ( 4.476 5.012 -2.289) 7.099 11.284 ( -6.278 -6.016 -3.894) 9.527 11.284 ( 6.278 -6.016 -3.894) 9.527 11.997 ( -3.474 14.771 -0.242) 15.176 11.997 ( 3.474 14.771 -0.242) 15.176 12.191 ( -3.663 7.590 -3.701) 9.205 12.191 ( 3.663 7.590 -3.701) 9.205 12.931 ( -1.666 -4.405 -2.066) 5.143 12.931 ( 1.666 -4.405 -2.066) 5.143 13.835 ( -9.260 -13.216 10.566) 19.289 13.835 ( 9.260 -13.216 10.566) 19.289 14.156 ( -6.897 -2.874 -3.742) 8.356 14.156 ( 6.897 -2.874 -3.742) 8.356 14.402 ( -5.369 2.472 5.242) 7.900 14.402 ( 5.369 2.472 5.242) 7.900 14.876 ( -4.233 0.762 7.222) 8.405 14.876 ( 4.233 0.762 7.222) 8.405 15.141 ( -2.171 -7.344 3.396) 8.378 15.141 ( 2.171 -7.344 3.396) 8.378 15.317 ( -7.985 -2.717 -8.885) 12.251 15.317 ( 7.985 -2.717 -8.885) 12.251 16.052 ( -7.640 15.857 3.233) 17.896 16.052 ( 7.640 15.857 3.233) 17.896 16.360 ( -6.130 10.944 -8.456) 15.128 16.360 ( 6.130 10.944 -8.456) 15.128 17.110 ( -3.445 9.107 -0.353) 9.743 17.110 ( 3.445 9.107 -0.353) 9.743 17.602 ( -3.376 -5.677 5.028) 8.301 17.602 ( 3.376 -5.677 5.028) 8.301 18.535 ( -11.738 -8.147 -10.414) 17.680 18.535 ( 11.738 -8.147 -10.414) 17.680 18.948 ( -6.009 -4.869 -4.279) 8.838 18.948 ( 6.009 -4.869 -4.279) 8.838 19.296 ( -4.217 -11.429 -4.776) 13.085 19.296 ( 4.217 -11.429 -4.776) 13.085 20.873 ( -0.623 4.918 -1.166) 5.093 20.873 ( 0.623 4.918 -1.166) 5.093======================= Grid point 435 (88/90) =======================q-point: ( 0.38 0.38 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 200Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.318 ( -0.279 -0.279 -0.121) 0.413 3.338 ( -1.265 -1.265 -2.175) 2.816 4.468 ( 6.447 6.447 13.061) 15.929 4.543 ( 2.678 2.678 5.694) 6.838 4.624 ( 5.675 5.675 -2.548) 8.421 4.678 ( 3.958 3.958 -8.282) 9.996 5.820 ( -7.702 -7.702 9.095) 14.190 5.852 ( -8.762 -8.762 6.127) 13.824 6.705 ( -5.235 -5.235 -1.766) 7.611 6.745 ( -6.110 -6.110 -4.892) 9.930 7.378 ( 13.516 13.516 4.518) 19.642 7.494 ( 12.291 12.291 -7.498) 18.931 8.009 ( -2.677 -2.677 14.244) 14.738 8.226 ( 1.841 1.841 -8.444) 8.836 8.252 ( -5.841 -5.841 10.437) 13.310 8.492 ( -6.971 -6.971 -12.722) 16.095 9.362 ( 7.595 7.595 24.253) 26.526 9.605 ( -0.625 -0.625 12.215) 12.247 9.645 ( 0.751 0.751 9.914) 9.971 9.794 ( 2.560 2.560 23.842) 24.115 9.815 ( 2.221 2.221 -15.606) 15.919 10.066 ( 0.182 0.182 -10.342) 10.345 10.066 ( -8.207 -8.207 8.527) 14.402 10.269 ( -8.133 -8.133 -7.050) 13.491 10.403 ( 7.053 7.053 -5.148) 11.225 10.434 ( 8.014 8.014 -16.128) 19.712 10.705 ( 1.815 1.815 19.326) 19.495 10.895 ( -2.628 -2.628 9.956) 10.627 10.991 ( 1.955 1.955 -3.070) 4.132 11.116 ( -0.086 -0.086 -15.177) 15.178 11.187 ( -3.009 -3.009 2.125) 4.756 11.247 ( -4.805 -4.805 -5.177) 8.543 12.067 ( 10.503 10.503 3.884) 15.352 12.162 ( 12.076 12.076 -5.348) 17.896 12.302 ( 1.121 1.121 3.078) 3.463 12.402 ( 3.752 3.752 -7.795) 9.429 12.832 ( -5.014 -5.014 -0.737) 7.129 12.871 ( -5.558 -5.558 -5.030) 9.332 13.581 ( 0.081 0.081 15.331) 15.332 13.770 ( -5.783 -5.783 1.421) 8.301 14.094 ( -1.306 -1.306 -0.954) 2.079 14.202 ( -4.495 -4.495 -5.674) 8.521 14.380 ( 2.980 2.980 12.162) 12.871 14.511 ( -1.647 -1.647 -1.202) 2.621 14.811 ( -1.292 -1.292 17.467) 17.563 14.958 ( -7.010 -7.010 23.028) 25.071 15.049 ( -2.342 -2.342 -3.397) 4.744 15.099 ( 6.533 6.533 -10.227) 13.782 15.113 ( -4.205 -4.205 -8.045) 10.004 15.394 ( -6.586 -6.586 -18.814) 20.994 16.140 ( 12.202 12.202 10.553) 20.228 16.373 ( 11.235 11.235 -11.995) 19.908 16.373 ( 3.006 3.006 11.862) 12.601 16.628 ( 3.396 3.396 -13.676) 14.495 17.216 ( 6.960 6.960 20.366) 22.620 17.312 ( -0.131 -0.131 0.398) 0.439 17.330 ( 3.120 3.120 -2.091) 4.882 17.486 ( 4.631 4.631 -3.382) 7.370 18.357 ( -4.406 -4.406 -5.656) 8.415 18.564 ( -7.476 -7.476 -21.342) 23.817 18.845 ( 1.126 1.126 -3.816) 4.135 18.859 ( -0.411 -0.411 -4.892) 4.926 19.171 ( -11.932 -11.932 0.202) 16.876 19.256 ( -13.550 -13.550 -8.407) 20.925 20.928 ( 2.664 2.664 -0.674) 3.828 20.935 ( 2.277 2.277 -1.404) 3.512======================= Grid point 436 (89/90) =======================q-point: (-0.50 0.38 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 220Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.320 ( -0.537 -0.997 -1.458) 1.846 3.320 ( 0.537 -0.997 -1.458) 1.846 4.491 ( -1.819 14.294 5.592) 15.456 4.491 ( 1.819 14.294 5.592) 15.456 4.774 ( -1.971 -4.764 -1.972) 5.520 4.774 ( 1.971 -4.764 -1.972) 5.520 5.745 ( -1.204 -9.270 8.477) 12.619 5.745 ( 1.204 -9.270 8.477) 12.619 6.660 ( -1.353 -7.474 -4.061) 8.613 6.660 ( 1.353 -7.474 -4.061) 8.613 7.575 ( -5.415 17.052 0.135) 17.892 7.575 ( 5.415 17.052 0.135) 17.892 8.053 ( -8.889 -1.731 10.214) 13.651 8.053 ( 8.889 -1.731 10.214) 13.651 8.363 ( -6.968 -8.044 -8.508) 13.625 8.363 ( 6.968 -8.044 -8.508) 13.625 9.509 ( -6.609 6.560 18.244) 20.483 9.509 ( 6.609 6.560 18.244) 20.483 9.772 ( -6.518 -3.153 17.044) 18.518 9.772 ( 6.518 -3.153 17.044) 18.518 9.876 ( -5.891 -0.187 -6.556) 8.816 9.876 ( 5.891 -0.187 -6.556) 8.816 10.128 ( -4.817 -4.979 -9.780) 11.985 10.128 ( 4.817 -4.979 -9.780) 11.985 10.517 ( -2.262 8.536 -8.977) 12.593 10.517 ( 2.262 8.536 -8.977) 12.593 10.776 ( -7.155 0.046 15.166) 16.770 10.776 ( 7.155 0.046 15.166) 16.770 11.067 ( -4.625 -0.270 -5.738) 7.375 11.067 ( 4.625 -0.270 -5.738) 7.375 11.179 ( -2.652 -4.288 -3.715) 6.263 11.179 ( 2.652 -4.288 -3.715) 6.263 12.233 ( -5.953 9.683 3.625) 11.931 12.233 ( 5.953 9.683 3.625) 11.931 12.374 ( -6.730 9.856 -6.888) 13.780 12.374 ( 6.730 9.856 -6.888) 13.780 12.792 ( -1.760 -9.456 -3.632) 10.282 12.792 ( 1.760 -9.456 -3.632) 10.282 13.651 ( -6.055 -5.898 11.961) 14.646 13.651 ( 6.055 -5.898 11.961) 14.646 14.119 ( -3.529 -1.011 -7.549) 8.394 14.119 ( 3.529 -1.011 -7.549) 8.394 14.454 ( -4.056 2.822 6.126) 7.870 14.454 ( 4.056 2.822 6.126) 7.870 14.837 ( -4.309 -4.490 21.646) 22.522 14.837 ( 4.309 -4.490 21.646) 22.522 15.045 ( -1.593 -2.205 -5.950) 6.543 15.045 ( 1.593 -2.205 -5.950) 6.543 15.256 ( -7.712 -2.755 -15.937) 17.918 15.256 ( 7.712 -2.755 -15.937) 17.918 16.328 ( -6.613 10.901 10.467) 16.496 16.328 ( 6.613 10.901 10.467) 16.496 16.575 ( -7.861 10.642 -11.428) 17.482 16.575 ( 7.861 10.642 -11.428) 17.482 17.260 ( -2.205 4.327 6.133) 7.823 17.260 ( 2.205 4.327 6.133) 7.823 17.499 ( -6.330 -3.337 7.806) 10.590 17.499 ( 6.330 -3.337 7.806) 10.590 18.384 ( -8.070 -5.793 -18.961) 21.406 18.384 ( 8.070 -5.793 -18.961) 21.406 18.901 ( -1.227 -0.830 -4.038) 4.301 18.901 ( 1.227 -0.830 -4.038) 4.301 19.045 ( -4.179 -12.843 -5.202) 14.473 19.045 ( 4.179 -12.843 -5.202) 14.473 20.957 ( -0.214 3.356 -1.022) 3.515 20.957 ( 0.214 3.356 -1.022) 3.515======================= Grid point 449 (90/90) =======================q-point: (-0.50 -0.50 0.45)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 Number of triplets: 84Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.308 ( 0.000 0.000 -1.802) 1.802 3.308 ( 0.000 0.000 -1.802) 1.802 4.612 ( -0.000 -0.000 9.121) 9.121 4.612 ( 0.000 0.000 9.121) 9.121 4.763 ( 0.000 0.000 -6.128) 6.128 4.763 ( 0.000 0.000 -6.128) 6.128 5.644 ( -0.000 -0.000 9.401) 9.401 5.644 ( 0.000 0.000 9.401) 9.401 6.575 ( 0.000 0.000 -4.518) 4.518 6.575 ( 0.000 0.000 -4.518) 4.518 7.811 ( 0.000 0.000 -3.804) 3.804 7.811 ( 0.000 0.000 -3.804) 3.804 7.974 ( -0.000 -0.000 19.195) 19.195 7.974 ( 0.000 0.000 19.195) 19.195 8.282 ( 0.000 0.000 -12.163) 12.163 8.282 ( 0.000 0.000 -12.163) 12.163 9.647 ( 0.000 0.000 19.730) 19.730 9.647 ( 0.000 0.000 19.730) 19.730 9.677 ( -0.000 -0.000 17.812) 17.812 9.677 ( 0.000 0.000 17.812) 17.812 9.875 ( 0.000 0.000 -2.658) 2.658 9.875 ( 0.000 0.000 -2.658) 2.658 10.064 ( -0.000 -0.000 -21.938) 21.938 10.064 ( 0.000 0.000 -21.938) 21.938 10.649 ( 0.000 0.000 -6.821) 6.821 10.649 ( 0.000 0.000 -6.821) 6.821 10.742 ( -0.000 -0.000 20.170) 20.170 10.742 ( 0.000 0.000 20.170) 20.170 11.061 ( -0.000 -0.000 -13.034) 13.034 11.061 ( 0.000 0.000 -13.034) 13.034 11.135 ( 0.000 0.000 1.724) 1.724 11.135 ( 0.000 0.000 1.724) 1.724 12.341 ( 0.000 0.000 6.544) 6.544 12.341 ( 0.000 0.000 6.544) 6.544 12.510 ( 0.000 0.000 -10.377) 10.377 12.510 ( 0.000 0.000 -10.377) 10.377 12.644 ( -0.000 -0.000 -3.970) 3.970 12.644 ( 0.000 0.000 -3.970) 3.970 13.596 ( 0.000 0.000 12.753) 12.753 13.596 ( 0.000 0.000 12.753) 12.753 14.111 ( 0.000 0.000 -9.177) 9.177 14.111 ( 0.000 0.000 -9.177) 9.177 14.490 ( -0.000 -0.000 5.137) 5.137 14.490 ( 0.000 0.000 5.137) 5.137 14.775 ( 0.000 0.000 27.346) 27.346 14.775 ( 0.000 0.000 27.346) 27.346 15.027 ( -0.000 -0.000 -7.847) 7.847 15.027 ( 0.000 0.000 -7.847) 7.847 15.229 ( 0.000 0.000 -18.435) 18.435 15.229 ( 0.000 0.000 -18.435) 18.435 16.436 ( 0.000 0.000 11.979) 11.979 16.436 ( 0.000 0.000 11.979) 11.979 16.700 ( 0.000 0.000 -14.296) 14.296 16.700 ( 0.000 0.000 -14.296) 14.296 17.269 ( -0.000 -0.000 12.780) 12.780 17.269 ( -0.000 -0.000 12.780) 12.780 17.489 ( -0.000 -0.000 9.983) 9.983 17.489 ( 0.000 0.000 9.983) 9.983 18.335 ( 0.000 0.000 -26.081) 26.081 18.335 ( 0.000 0.000 -26.081) 26.081 18.894 ( 0.000 0.000 -3.701) 3.701 18.894 ( 0.000 0.000 -3.701) 3.701 18.898 ( 0.000 0.000 -4.608) 4.608 18.898 ( 0.000 0.000 -4.608) 4.608 20.991 ( 0.000 0.000 -0.977) 0.977 20.991 ( 0.000 0.000 -0.977) 0.977=================== 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 3/46464 10.0 877.980 877.980 642.949 0.000 0.000 0.000 3/46464 20.0 1349.665 1349.665 1261.451 0.000 0.000 0.000 3/46464 30.0 735.403 735.403 700.071 0.000 0.000 0.000 3/46464 40.0 372.868 372.868 369.426 0.000 0.000 0.000 3/46464 50.0 199.556 199.556 200.238 0.000 0.000 0.000 3/46464 60.0 116.382 116.382 116.774 0.000 0.000 0.000 3/46464 70.0 74.157 74.157 74.080 0.000 0.000 0.000 3/46464 80.0 50.984 50.984 50.715 0.000 0.000 0.000 3/46464 90.0 37.262 37.262 36.988 0.000 0.000 0.000 3/46464 100.0 28.586 28.586 28.387 0.000 0.000 0.000 3/46464 110.0 22.790 22.790 22.692 0.000 0.000 0.000 3/46464 120.0 18.737 18.737 18.739 0.000 0.000 0.000 3/46464 130.0 15.794 15.794 15.885 0.000 0.000 0.000 3/46464 140.0 13.588 13.588 13.754 0.000 0.000 0.000 3/46464 150.0 11.889 11.889 12.116 0.000 0.000 0.000 3/46464 160.0 10.550 10.550 10.826 0.000 0.000 0.000 3/46464 170.0 9.473 9.473 9.788 0.000 0.000 0.000 3/46464 180.0 8.591 8.591 8.937 0.000 0.000 0.000 3/46464 190.0 7.859 7.859 8.229 0.000 0.000 0.000 3/46464 200.0 7.242 7.242 7.631 0.000 0.000 0.000 3/46464 210.0 6.716 6.716 7.119 0.000 0.000 0.000 3/46464 220.0 6.263 6.263 6.676 0.000 0.000 0.000 3/46464 230.0 5.869 5.869 6.290 0.000 0.000 0.000 3/46464 240.0 5.523 5.523 5.949 0.000 0.000 0.000 3/46464 250.0 5.217 5.217 5.646 0.000 0.000 0.000 3/46464 260.0 4.945 4.945 5.375 0.000 0.000 0.000 3/46464 270.0 4.701 4.701 5.132 0.000 0.000 0.000 3/46464 280.0 4.481 4.481 4.911 0.000 0.000 0.000 3/46464 290.0 4.282 4.282 4.710 0.000 0.000 0.000 3/46464 300.0 4.101 4.101 4.526 0.000 0.000 0.000 3/46464 310.0 3.935 3.935 4.357 0.000 0.000 0.000 3/46464 320.0 3.783 3.783 4.202 0.000 0.000 0.000 3/46464 330.0 3.643 3.643 4.058 0.000 0.000 0.000 3/46464 340.0 3.514 3.514 3.924 0.000 0.000 0.000 3/46464 350.0 3.393 3.393 3.799 0.000 0.000 0.000 3/46464 360.0 3.282 3.282 3.683 0.000 0.000 0.000 3/46464 370.0 3.177 3.177 3.574 0.000 0.000 0.000 3/46464 380.0 3.080 3.080 3.471 0.000 0.000 0.000 3/46464 390.0 2.988 2.988 3.375 0.000 0.000 0.000 3/46464 400.0 2.903 2.903 3.284 0.000 0.000 0.000 3/46464 410.0 2.822 2.822 3.198 0.000 0.000 0.000 3/46464 420.0 2.746 2.746 3.117 0.000 0.000 0.000 3/46464 430.0 2.674 2.674 3.040 0.000 0.000 0.000 3/46464 440.0 2.606 2.606 2.967 0.000 0.000 0.000 3/46464 450.0 2.541 2.541 2.898 0.000 0.000 0.000 3/46464 460.0 2.480 2.480 2.832 0.000 0.000 0.000 3/46464 470.0 2.421 2.421 2.769 0.000 0.000 0.000 3/46464 480.0 2.366 2.366 2.708 0.000 0.000 0.000 3/46464 490.0 2.313 2.313 2.651 0.000 0.000 0.000 3/46464 500.0 2.262 2.262 2.596 0.000 0.000 0.000 3/46464 510.0 2.214 2.214 2.543 0.000 0.000 0.000 3/46464 520.0 2.168 2.168 2.492 0.000 0.000 0.000 3/46464 530.0 2.124 2.124 2.444 0.000 0.000 0.000 3/46464 540.0 2.081 2.081 2.397 0.000 0.000 0.000 3/46464 550.0 2.041 2.041 2.353 0.000 0.000 0.000 3/46464 560.0 2.002 2.002 2.309 0.000 0.000 0.000 3/46464 570.0 1.964 1.964 2.268 0.000 0.000 0.000 3/46464 580.0 1.928 1.928 2.228 0.000 0.000 0.000 3/46464 590.0 1.893 1.893 2.189 0.000 0.000 0.000 3/46464 600.0 1.860 1.860 2.152 0.000 0.000 0.000 3/46464 610.0 1.827 1.827 2.116 0.000 0.000 0.000 3/46464 620.0 1.796 1.796 2.081 0.000 0.000 0.000 3/46464 630.0 1.766 1.766 2.048 0.000 0.000 0.000 3/46464 640.0 1.737 1.737 2.015 0.000 0.000 0.000 3/46464 650.0 1.709 1.709 1.984 0.000 0.000 0.000 3/46464 660.0 1.682 1.682 1.953 0.000 0.000 0.000 3/46464 670.0 1.656 1.656 1.923 0.000 0.000 0.000 3/46464 680.0 1.630 1.630 1.895 0.000 0.000 0.000 3/46464 690.0 1.605 1.605 1.867 0.000 0.000 0.000 3/46464 700.0 1.581 1.581 1.840 0.000 0.000 0.000 3/46464 710.0 1.558 1.558 1.814 0.000 0.000 0.000 3/46464 720.0 1.536 1.536 1.788 0.000 0.000 0.000 3/46464 730.0 1.514 1.514 1.764 0.000 0.000 0.000 3/46464 740.0 1.493 1.493 1.740 0.000 0.000 0.000 3/46464 750.0 1.472 1.472 1.716 0.000 0.000 0.000 3/46464 760.0 1.452 1.452 1.693 0.000 0.000 0.000 3/46464 770.0 1.432 1.432 1.671 0.000 0.000 0.000 3/46464 780.0 1.413 1.413 1.650 0.000 0.000 0.000 3/46464 790.0 1.395 1.395 1.629 0.000 0.000 0.000 3/46464 800.0 1.377 1.377 1.608 0.000 0.000 0.000 3/46464 810.0 1.359 1.359 1.588 0.000 0.000 0.000 3/46464 820.0 1.342 1.342 1.569 0.000 0.000 0.000 3/46464 830.0 1.326 1.326 1.550 0.000 0.000 0.000 3/46464 840.0 1.309 1.309 1.531 0.000 0.000 0.000 3/46464 850.0 1.294 1.294 1.513 0.000 0.000 0.000 3/46464 860.0 1.278 1.278 1.495 0.000 0.000 0.000 3/46464 870.0 1.263 1.263 1.478 0.000 0.000 0.000 3/46464 880.0 1.248 1.248 1.461 0.000 0.000 0.000 3/46464 890.0 1.234 1.234 1.445 0.000 0.000 0.000 3/46464 900.0 1.220 1.220 1.429 0.000 0.000 0.000 3/46464 910.0 1.206 1.206 1.413 0.000 0.000 0.000 3/46464 920.0 1.193 1.193 1.397 0.000 0.000 0.000 3/46464 930.0 1.180 1.180 1.382 0.000 0.000 0.000 3/46464 940.0 1.167 1.167 1.368 0.000 0.000 0.000 3/46464 950.0 1.154 1.154 1.353 0.000 0.000 0.000 3/46464 960.0 1.142 1.142 1.339 0.000 0.000 0.000 3/46464 970.0 1.130 1.130 1.325 0.000 0.000 0.000 3/46464 980.0 1.118 1.118 1.312 0.000 0.000 0.000 3/46464 990.0 1.107 1.107 1.298 0.000 0.000 0.000 3/46464 1000.0 1.095 1.095 1.285 0.000 0.000 0.000 3/46464Thermal conductivity related properties were written into "kappa-m8811.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 00:42:55]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|