----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 00:03:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.552223825027812 -4.720614960000000 0.000000000000000 b 2.552223825027812 4.720614960000000 0.000000000000000 c -1.259811026026961 0.000000000000000 4.930089578654051 Atomic positions (fractional): *1 Li 0.65288747543086 0.34711252456914 0.00000000000000 6.941 2 Li 0.34711252456914 0.65288747543086 0.00000000000000 6.941 *3 Sb 0.83962319385961 0.16037680614039 0.50000000000000 121.760 4 Sb 0.16037680614039 0.83962319385961 0.50000000000000 121.760 *5 O 0.20166314637727 0.20166314637727 0.71776315303563 15.999 6 O 0.79833685362273 0.79833685362273 0.28223684696437 15.999 *7 O 0.94980650089977 0.54919291298417 0.73820880595561 15.999 8 O 0.45080708701583 0.05019349910023 0.26179119404439 15.999 9 O 0.05019349910023 0.45080708701583 0.26179119404439 15.999 10 O 0.54919291298417 0.94980650089977 0.73820880595561 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.104447650055625 0.000000000000000 0.000000000000000 b 0.000000000000000 9.441229920000000 0.000000000000000 c -1.259811026026961 0.000000000000000 4.930089578654051 Atomic positions (fractional): *1 Li 0.00000000000000 0.34711252456914 0.00000000000000 6.941 > 1 2 Li 0.50000000000000 0.15288747543086 0.00000000000000 6.941 > 2 3 Li 0.50000000000000 0.84711252456914 0.00000000000000 6.941 > 1 4 Li 0.00000000000000 0.65288747543086 0.00000000000000 6.941 > 2 *5 Sb 0.00000000000000 0.16037680614039 0.50000000000000 121.760 > 3 6 Sb 0.50000000000000 0.33962319385961 0.50000000000000 121.760 > 4 7 Sb 0.50000000000000 0.66037680614039 0.50000000000000 121.760 > 3 8 Sb 0.00000000000000 0.83962319385961 0.50000000000000 121.760 > 4 *9 O 0.20166314637727 0.00000000000000 0.71776315303563 15.999 > 5 10 O 0.79833685362273 0.00000000000000 0.28223684696437 15.999 > 6 *11 O 0.24949970694197 0.29969320604220 0.73820880595561 15.999 > 7 12 O 0.75050029305803 0.29969320604220 0.26179119404439 15.999 > 8 13 O 0.25050029305803 0.20030679395780 0.26179119404439 15.999 > 9 14 O 0.74949970694197 0.20030679395780 0.73820880595561 15.999 > 10 15 O 0.70166314637727 0.50000000000000 0.71776315303563 15.999 > 5 16 O 0.29833685362273 0.50000000000000 0.28223684696437 15.999 > 6 17 O 0.74949970694197 0.79969320604220 0.73820880595561 15.999 > 7 18 O 0.25050029305803 0.79969320604220 0.26179119404439 15.999 > 8 19 O 0.75050029305803 0.70030679395780 0.26179119404439 15.999 > 9 20 O 0.24949970694197 0.70030679395780 0.73820880595561 15.999 > 10 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.208895300111250 0.000000000000000 0.000000000000000 b 0.000000000000000 9.441229920000000 0.000000000000000 c -2.519622052053922 0.000000000000000 9.860179157308101 Atomic positions (fractional): *1 Li 0.00000000000000 0.34711252456914 0.00000000000000 6.941 > 1 2 Li 0.50000000000000 0.34711252456914 0.00000000000000 6.941 > 1 3 Li 0.00000000000000 0.34711252456914 0.50000000000000 6.941 > 1 4 Li 0.50000000000000 0.34711252456914 0.50000000000000 6.941 > 1 5 Li 0.25000000000000 0.15288747543086 0.00000000000000 6.941 > 2 6 Li 0.75000000000000 0.15288747543086 0.00000000000000 6.941 > 2 7 Li 0.25000000000000 0.15288747543086 0.50000000000000 6.941 > 2 8 Li 0.75000000000000 0.15288747543086 0.50000000000000 6.941 > 2 9 Li 0.25000000000000 0.84711252456914 0.00000000000000 6.941 > 1 10 Li 0.75000000000000 0.84711252456914 0.00000000000000 6.941 > 1 11 Li 0.25000000000000 0.84711252456914 0.50000000000000 6.941 > 1 12 Li 0.75000000000000 0.84711252456914 0.50000000000000 6.941 > 1 13 Li 0.00000000000000 0.65288747543086 0.00000000000000 6.941 > 2 14 Li 0.50000000000000 0.65288747543086 0.00000000000000 6.941 > 2 15 Li 0.00000000000000 0.65288747543086 0.50000000000000 6.941 > 2 16 Li 0.50000000000000 0.65288747543086 0.50000000000000 6.941 > 2 *17 Sb 0.00000000000000 0.16037680614039 0.25000000000000 121.760 > 3 18 Sb 0.50000000000000 0.16037680614039 0.25000000000000 121.760 > 3 19 Sb 0.00000000000000 0.16037680614039 0.75000000000000 121.760 > 3 20 Sb 0.50000000000000 0.16037680614039 0.75000000000000 121.760 > 3 21 Sb 0.25000000000000 0.33962319385961 0.25000000000000 121.760 > 4 22 Sb 0.75000000000000 0.33962319385961 0.25000000000000 121.760 > 4 23 Sb 0.25000000000000 0.33962319385961 0.75000000000000 121.760 > 4 24 Sb 0.75000000000000 0.33962319385961 0.75000000000000 121.760 > 4 25 Sb 0.25000000000000 0.66037680614039 0.25000000000000 121.760 > 3 26 Sb 0.75000000000000 0.66037680614039 0.25000000000000 121.760 > 3 27 Sb 0.25000000000000 0.66037680614039 0.75000000000000 121.760 > 3 28 Sb 0.75000000000000 0.66037680614039 0.75000000000000 121.760 > 3 29 Sb 0.00000000000000 0.83962319385961 0.25000000000000 121.760 > 4 30 Sb 0.50000000000000 0.83962319385961 0.25000000000000 121.760 > 4 31 Sb 0.00000000000000 0.83962319385961 0.75000000000000 121.760 > 4 32 Sb 0.50000000000000 0.83962319385961 0.75000000000000 121.760 > 4 *33 O 0.10083157318863 0.00000000000000 0.35888157651781 15.999 > 5 34 O 0.60083157318863 0.00000000000000 0.35888157651781 15.999 > 5 35 O 0.10083157318863 0.00000000000000 0.85888157651781 15.999 > 5 36 O 0.60083157318863 0.00000000000000 0.85888157651781 15.999 > 5 37 O 0.39916842681137 0.00000000000000 0.14111842348219 15.999 > 6 38 O 0.89916842681137 0.00000000000000 0.14111842348219 15.999 > 6 39 O 0.39916842681137 0.00000000000000 0.64111842348219 15.999 > 6 40 O 0.89916842681137 0.00000000000000 0.64111842348219 15.999 > 6 *41 O 0.12474985347099 0.29969320604220 0.36910440297780 15.999 > 7 42 O 0.62474985347099 0.29969320604220 0.36910440297780 15.999 > 7 43 O 0.12474985347099 0.29969320604220 0.86910440297780 15.999 > 7 44 O 0.62474985347099 0.29969320604220 0.86910440297780 15.999 > 7 45 O 0.37525014652901 0.29969320604220 0.13089559702220 15.999 > 8 46 O 0.87525014652901 0.29969320604220 0.13089559702220 15.999 > 8 47 O 0.37525014652901 0.29969320604220 0.63089559702220 15.999 > 8 48 O 0.87525014652901 0.29969320604220 0.63089559702220 15.999 > 8 49 O 0.12525014652901 0.20030679395780 0.13089559702220 15.999 > 9 50 O 0.62525014652901 0.20030679395780 0.13089559702220 15.999 > 9 51 O 0.12525014652901 0.20030679395780 0.63089559702220 15.999 > 9 52 O 0.62525014652901 0.20030679395780 0.63089559702220 15.999 > 9 53 O 0.37474985347099 0.20030679395780 0.36910440297780 15.999 > 10 54 O 0.87474985347099 0.20030679395780 0.36910440297780 15.999 > 10 55 O 0.37474985347099 0.20030679395780 0.86910440297780 15.999 > 10 56 O 0.87474985347099 0.20030679395780 0.86910440297780 15.999 > 10 57 O 0.35083157318863 0.50000000000000 0.35888157651781 15.999 > 5 58 O 0.85083157318863 0.50000000000000 0.35888157651781 15.999 > 5 59 O 0.35083157318863 0.50000000000000 0.85888157651781 15.999 > 5 60 O 0.85083157318863 0.50000000000000 0.85888157651781 15.999 > 5 61 O 0.14916842681137 0.50000000000000 0.14111842348219 15.999 > 6 62 O 0.64916842681137 0.50000000000000 0.14111842348219 15.999 > 6 63 O 0.14916842681137 0.50000000000000 0.64111842348219 15.999 > 6 64 O 0.64916842681137 0.50000000000000 0.64111842348219 15.999 > 6 65 O 0.37474985347099 0.79969320604220 0.36910440297780 15.999 > 7 66 O 0.87474985347099 0.79969320604220 0.36910440297780 15.999 > 7 67 O 0.37474985347099 0.79969320604220 0.86910440297780 15.999 > 7 68 O 0.87474985347099 0.79969320604220 0.86910440297780 15.999 > 7 69 O 0.12525014652901 0.79969320604220 0.13089559702220 15.999 > 8 70 O 0.62525014652901 0.79969320604220 0.13089559702220 15.999 > 8 71 O 0.12525014652901 0.79969320604220 0.63089559702220 15.999 > 8 72 O 0.62525014652901 0.79969320604220 0.63089559702220 15.999 > 8 73 O 0.37525014652901 0.70030679395780 0.13089559702220 15.999 > 9 74 O 0.87525014652901 0.70030679395780 0.13089559702220 15.999 > 9 75 O 0.37525014652901 0.70030679395780 0.63089559702220 15.999 > 9 76 O 0.87525014652901 0.70030679395780 0.63089559702220 15.999 > 9 77 O 0.12474985347099 0.70030679395780 0.36910440297780 15.999 > 10 78 O 0.62474985347099 0.70030679395780 0.36910440297780 15.999 > 10 79 O 0.12474985347099 0.70030679395780 0.86910440297780 15.999 > 10 80 O 0.62474985347099 0.70030679395780 0.86910440297780 15.999 > 10 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6659993 0.0000000 0.0091908 0.0000000 3.7401317 0.0000000 0.0091893 0.0000000 3.0818680 -------------------------- Born effective charges -------------------------- 1 Li 1.1692050 0.0000000 0.0042689 0.0000000 0.9812295 0.0000000 0.0325162 0.0000000 1.4964988 2 Li 1.1692050 0.0000000 0.0042689 0.0000000 0.9812295 0.0000000 0.0325162 0.0000000 1.4964988 3 Sb 4.7416588 0.0000000 0.0570186 0.0000000 4.9223252 0.0000000 0.0110635 0.0000000 2.8688777 4 Sb 4.7416588 0.0000000 0.0570186 0.0000000 4.9223252 0.0000000 0.0110635 0.0000000 2.8688777 5 O -1.3772162 0.0000000 -0.2928163 0.0000000 -2.6387896 0.0000000 -0.3366060 0.0000000 -1.3433769 6 O -1.3772162 0.0000000 -0.2928163 0.0000000 -2.6387896 0.0000000 -0.3366060 0.0000000 -1.3433769 7 O -2.2668238 -0.4808053 0.1157644 -0.3996751 -1.6323826 -0.0481273 0.1465132 -0.0984467 -1.5109998 8 O -2.2668238 0.4808053 0.1157644 0.3996751 -1.6323826 0.0481273 0.1465132 0.0984467 -1.5109998 9 O -2.2668238 -0.4808053 0.1157644 -0.3996751 -1.6323826 -0.0481273 0.1465132 -0.0984467 -1.5109998 10 O -2.2668238 0.4808053 0.1157644 0.3996751 -1.6323826 0.0481273 0.1465132 0.0984467 -1.5109998 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 4512/4512 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 998 Number of blocks in projector: 998 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 216 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 184 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 184 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 138 Use standard eigh solver. Tree of FC basis block matrices: - (998, 975), data: False |-- (138, 134), data: True |-- (138, 134), data: True |-- (138, 134), data: True |-- (184, 182), data: True |-- (184, 182), data: True |-- (216, 209), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 320 - Time: 0.751 Solver_block: 200 / 320 - Time: 0.770 Solver_block: 300 / 320 - Time: 0.769 Solver_block: 320 / 320 - Time: 0.194 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.502 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 240/240 Permutation basis: 4512/4512 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 998 Number of blocks in projector: 998 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 216 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 184 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 184 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 138 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 138 Use standard eigh solver. Tree of FC basis block matrices: - (998, 975), data: False |-- (138, 134), data: True |-- (138, 134), data: True |-- (138, 134), data: True |-- (184, 182), data: True |-- (184, 182), data: True |-- (216, 209), data: True Max drift after symmetrization by symfc projector: 0.00000000 (zz) 0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 00:03:46]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:03:46]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.552223825027812 -4.720614960000000 0.000000000000000 b 2.552223825027812 4.720614960000000 0.000000000000000 c -1.259811026026961 0.000000000000000 4.930089578654051 Atomic positions (fractional): 1 Li 0.65288747543086 0.34711252456914 0.00000000000000 6.941 2 Li 0.34711252456914 0.65288747543086 0.00000000000000 6.941 3 Sb 0.83962319385961 0.16037680614039 0.50000000000000 121.760 4 Sb 0.16037680614039 0.83962319385961 0.50000000000000 121.760 5 O 0.20166314637727 0.20166314637727 0.71776315303563 15.999 6 O 0.79833685362273 0.79833685362273 0.28223684696437 15.999 7 O 0.94980650089977 0.54919291298417 0.73820880595561 15.999 8 O 0.45080708701583 0.05019349910023 0.26179119404439 15.999 9 O 0.05019349910023 0.45080708701583 0.26179119404439 15.999 10 O 0.54919291298417 0.94980650089977 0.73820880595561 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.208895300111250 0.000000000000000 0.000000000000000 b 0.000000000000000 9.441229920000000 0.000000000000000 c -2.519622052053922 0.000000000000000 9.860179157308101 Atomic positions (fractional): 1 Li 0.00000000000000 0.34711252456914 0.00000000000000 6.941 > 1 2 Li 0.50000000000000 0.34711252456914 0.00000000000000 6.941 > 1 3 Li 0.00000000000000 0.34711252456914 0.50000000000000 6.941 > 1 4 Li 0.50000000000000 0.34711252456914 0.50000000000000 6.941 > 1 5 Li 0.25000000000000 0.15288747543086 0.00000000000000 6.941 > 5 6 Li 0.75000000000000 0.15288747543086 0.00000000000000 6.941 > 5 7 Li 0.25000000000000 0.15288747543086 0.50000000000000 6.941 > 5 8 Li 0.75000000000000 0.15288747543086 0.50000000000000 6.941 > 5 9 Li 0.25000000000000 0.84711252456914 0.00000000000000 6.941 > 1 10 Li 0.75000000000000 0.84711252456914 0.00000000000000 6.941 > 1 11 Li 0.25000000000000 0.84711252456914 0.50000000000000 6.941 > 1 12 Li 0.75000000000000 0.84711252456914 0.50000000000000 6.941 > 1 13 Li 0.00000000000000 0.65288747543086 0.00000000000000 6.941 > 5 14 Li 0.50000000000000 0.65288747543086 0.00000000000000 6.941 > 5 15 Li 0.00000000000000 0.65288747543086 0.50000000000000 6.941 > 5 16 Li 0.50000000000000 0.65288747543086 0.50000000000000 6.941 > 5 17 Sb 0.00000000000000 0.16037680614039 0.25000000000000 121.760 > 17 18 Sb 0.50000000000000 0.16037680614039 0.25000000000000 121.760 > 17 19 Sb 0.00000000000000 0.16037680614039 0.75000000000000 121.760 > 17 20 Sb 0.50000000000000 0.16037680614039 0.75000000000000 121.760 > 17 21 Sb 0.25000000000000 0.33962319385961 0.25000000000000 121.760 > 21 22 Sb 0.75000000000000 0.33962319385961 0.25000000000000 121.760 > 21 23 Sb 0.25000000000000 0.33962319385961 0.75000000000000 121.760 > 21 24 Sb 0.75000000000000 0.33962319385961 0.75000000000000 121.760 > 21 25 Sb 0.25000000000000 0.66037680614039 0.25000000000000 121.760 > 17 26 Sb 0.75000000000000 0.66037680614039 0.25000000000000 121.760 > 17 27 Sb 0.25000000000000 0.66037680614039 0.75000000000000 121.760 > 17 28 Sb 0.75000000000000 0.66037680614039 0.75000000000000 121.760 > 17 29 Sb 0.00000000000000 0.83962319385961 0.25000000000000 121.760 > 21 30 Sb 0.50000000000000 0.83962319385961 0.25000000000000 121.760 > 21 31 Sb 0.00000000000000 0.83962319385961 0.75000000000000 121.760 > 21 32 Sb 0.50000000000000 0.83962319385961 0.75000000000000 121.760 > 21 33 O 0.10083157318863 0.00000000000000 0.35888157651781 15.999 > 33 34 O 0.60083157318863 0.00000000000000 0.35888157651781 15.999 > 33 35 O 0.10083157318863 0.00000000000000 0.85888157651781 15.999 > 33 36 O 0.60083157318863 0.00000000000000 0.85888157651781 15.999 > 33 37 O 0.39916842681137 0.00000000000000 0.14111842348219 15.999 > 37 38 O 0.89916842681137 0.00000000000000 0.14111842348219 15.999 > 37 39 O 0.39916842681137 0.00000000000000 0.64111842348219 15.999 > 37 40 O 0.89916842681137 0.00000000000000 0.64111842348219 15.999 > 37 41 O 0.12474985347099 0.29969320604220 0.36910440297780 15.999 > 41 42 O 0.62474985347099 0.29969320604220 0.36910440297780 15.999 > 41 43 O 0.12474985347099 0.29969320604220 0.86910440297780 15.999 > 41 44 O 0.62474985347099 0.29969320604220 0.86910440297780 15.999 > 41 45 O 0.37525014652901 0.29969320604220 0.13089559702220 15.999 > 45 46 O 0.87525014652901 0.29969320604220 0.13089559702220 15.999 > 45 47 O 0.37525014652901 0.29969320604220 0.63089559702220 15.999 > 45 48 O 0.87525014652901 0.29969320604220 0.63089559702220 15.999 > 45 49 O 0.12525014652901 0.20030679395780 0.13089559702220 15.999 > 49 50 O 0.62525014652901 0.20030679395780 0.13089559702220 15.999 > 49 51 O 0.12525014652901 0.20030679395780 0.63089559702220 15.999 > 49 52 O 0.62525014652901 0.20030679395780 0.63089559702220 15.999 > 49 53 O 0.37474985347099 0.20030679395780 0.36910440297780 15.999 > 53 54 O 0.87474985347099 0.20030679395780 0.36910440297780 15.999 > 53 55 O 0.37474985347099 0.20030679395780 0.86910440297780 15.999 > 53 56 O 0.87474985347099 0.20030679395780 0.86910440297780 15.999 > 53 57 O 0.35083157318863 0.50000000000000 0.35888157651781 15.999 > 33 58 O 0.85083157318863 0.50000000000000 0.35888157651781 15.999 > 33 59 O 0.35083157318863 0.50000000000000 0.85888157651781 15.999 > 33 60 O 0.85083157318863 0.50000000000000 0.85888157651781 15.999 > 33 61 O 0.14916842681137 0.50000000000000 0.14111842348219 15.999 > 37 62 O 0.64916842681137 0.50000000000000 0.14111842348219 15.999 > 37 63 O 0.14916842681137 0.50000000000000 0.64111842348219 15.999 > 37 64 O 0.64916842681137 0.50000000000000 0.64111842348219 15.999 > 37 65 O 0.37474985347099 0.79969320604220 0.36910440297780 15.999 > 41 66 O 0.87474985347099 0.79969320604220 0.36910440297780 15.999 > 41 67 O 0.37474985347099 0.79969320604220 0.86910440297780 15.999 > 41 68 O 0.87474985347099 0.79969320604220 0.86910440297780 15.999 > 41 69 O 0.12525014652901 0.79969320604220 0.13089559702220 15.999 > 45 70 O 0.62525014652901 0.79969320604220 0.13089559702220 15.999 > 45 71 O 0.12525014652901 0.79969320604220 0.63089559702220 15.999 > 45 72 O 0.62525014652901 0.79969320604220 0.63089559702220 15.999 > 45 73 O 0.37525014652901 0.70030679395780 0.13089559702220 15.999 > 49 74 O 0.87525014652901 0.70030679395780 0.13089559702220 15.999 > 49 75 O 0.37525014652901 0.70030679395780 0.63089559702220 15.999 > 49 76 O 0.87525014652901 0.70030679395780 0.63089559702220 15.999 > 49 77 O 0.12474985347099 0.70030679395780 0.36910440297780 15.999 > 53 78 O 0.62474985347099 0.70030679395780 0.36910440297780 15.999 > 53 79 O 0.12474985347099 0.70030679395780 0.86910440297780 15.999 > 53 80 O 0.62474985347099 0.70030679395780 0.86910440297780 15.999 > 53 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6659993 0.0000000 0.0091908 0.0000000 3.7401317 0.0000000 0.0091893 0.0000000 3.0818680 -------------------------- Born effective charges -------------------------- 1 Li 1.1692050 0.0000000 0.0042689 0.0000000 0.9812295 0.0000000 0.0325162 0.0000000 1.4964988 2 Li 1.1692050 0.0000000 0.0042689 0.0000000 0.9812295 0.0000000 0.0325162 0.0000000 1.4964988 3 Sb 4.7416588 0.0000000 0.0570186 0.0000000 4.9223252 0.0000000 0.0110635 0.0000000 2.8688777 4 Sb 4.7416588 0.0000000 0.0570186 0.0000000 4.9223252 0.0000000 0.0110635 0.0000000 2.8688777 5 O -1.3772162 0.0000000 -0.2928163 0.0000000 -2.6387896 0.0000000 -0.3366060 0.0000000 -1.3433769 6 O -1.3772162 0.0000000 -0.2928163 0.0000000 -2.6387896 0.0000000 -0.3366060 0.0000000 -1.3433769 7 O -2.2668238 -0.4808053 0.1157644 -0.3996751 -1.6323826 -0.0481273 0.1465132 -0.0984467 -1.5109998 8 O -2.2668238 0.4808053 0.1157644 0.3996751 -1.6323826 0.0481273 0.1465132 0.0984467 -1.5109998 9 O -2.2668238 -0.4808053 0.1157644 -0.3996751 -1.6323826 -0.0481273 0.1465132 -0.0984467 -1.5109998 10 O -2.2668238 0.4808053 0.1157644 0.3996751 -1.6323826 0.0481273 0.1465132 0.0984467 -1.5109998 ---------------------------------------------------------------------------- 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000007 (yyy) 0.00000007 (yyy) 0.00000007 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000003 (zx) 0.00000003 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 00:03:55]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:03:55]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.552223825027812 -4.720614960000000 0.000000000000000 b 2.552223825027812 4.720614960000000 0.000000000000000 c -1.259811026026961 0.000000000000000 4.930089578654051 Atomic positions (fractional): 1 Li 0.65288747543086 0.34711252456914 0.00000000000000 6.941 2 Li 0.34711252456914 0.65288747543086 0.00000000000000 6.941 3 Sb 0.83962319385961 0.16037680614039 0.50000000000000 121.760 4 Sb 0.16037680614039 0.83962319385961 0.50000000000000 121.760 5 O 0.20166314637727 0.20166314637727 0.71776315303563 15.999 6 O 0.79833685362273 0.79833685362273 0.28223684696437 15.999 7 O 0.94980650089977 0.54919291298417 0.73820880595561 15.999 8 O 0.45080708701583 0.05019349910023 0.26179119404439 15.999 9 O 0.05019349910023 0.45080708701583 0.26179119404439 15.999 10 O 0.54919291298417 0.94980650089977 0.73820880595561 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.208895300111250 0.000000000000000 0.000000000000000 b 0.000000000000000 9.441229920000000 0.000000000000000 c -2.519622052053922 0.000000000000000 9.860179157308101 Atomic positions (fractional): 1 Li 0.00000000000000 0.34711252456914 0.00000000000000 6.941 > 1 2 Li 0.50000000000000 0.34711252456914 0.00000000000000 6.941 > 1 3 Li 0.00000000000000 0.34711252456914 0.50000000000000 6.941 > 1 4 Li 0.50000000000000 0.34711252456914 0.50000000000000 6.941 > 1 5 Li 0.25000000000000 0.15288747543086 0.00000000000000 6.941 > 5 6 Li 0.75000000000000 0.15288747543086 0.00000000000000 6.941 > 5 7 Li 0.25000000000000 0.15288747543086 0.50000000000000 6.941 > 5 8 Li 0.75000000000000 0.15288747543086 0.50000000000000 6.941 > 5 9 Li 0.25000000000000 0.84711252456914 0.00000000000000 6.941 > 1 10 Li 0.75000000000000 0.84711252456914 0.00000000000000 6.941 > 1 11 Li 0.25000000000000 0.84711252456914 0.50000000000000 6.941 > 1 12 Li 0.75000000000000 0.84711252456914 0.50000000000000 6.941 > 1 13 Li 0.00000000000000 0.65288747543086 0.00000000000000 6.941 > 5 14 Li 0.50000000000000 0.65288747543086 0.00000000000000 6.941 > 5 15 Li 0.00000000000000 0.65288747543086 0.50000000000000 6.941 > 5 16 Li 0.50000000000000 0.65288747543086 0.50000000000000 6.941 > 5 17 Sb 0.00000000000000 0.16037680614039 0.25000000000000 121.760 > 17 18 Sb 0.50000000000000 0.16037680614039 0.25000000000000 121.760 > 17 19 Sb 0.00000000000000 0.16037680614039 0.75000000000000 121.760 > 17 20 Sb 0.50000000000000 0.16037680614039 0.75000000000000 121.760 > 17 21 Sb 0.25000000000000 0.33962319385961 0.25000000000000 121.760 > 21 22 Sb 0.75000000000000 0.33962319385961 0.25000000000000 121.760 > 21 23 Sb 0.25000000000000 0.33962319385961 0.75000000000000 121.760 > 21 24 Sb 0.75000000000000 0.33962319385961 0.75000000000000 121.760 > 21 25 Sb 0.25000000000000 0.66037680614039 0.25000000000000 121.760 > 17 26 Sb 0.75000000000000 0.66037680614039 0.25000000000000 121.760 > 17 27 Sb 0.25000000000000 0.66037680614039 0.75000000000000 121.760 > 17 28 Sb 0.75000000000000 0.66037680614039 0.75000000000000 121.760 > 17 29 Sb 0.00000000000000 0.83962319385961 0.25000000000000 121.760 > 21 30 Sb 0.50000000000000 0.83962319385961 0.25000000000000 121.760 > 21 31 Sb 0.00000000000000 0.83962319385961 0.75000000000000 121.760 > 21 32 Sb 0.50000000000000 0.83962319385961 0.75000000000000 121.760 > 21 33 O 0.10083157318863 0.00000000000000 0.35888157651781 15.999 > 33 34 O 0.60083157318863 0.00000000000000 0.35888157651781 15.999 > 33 35 O 0.10083157318863 0.00000000000000 0.85888157651781 15.999 > 33 36 O 0.60083157318863 0.00000000000000 0.85888157651781 15.999 > 33 37 O 0.39916842681137 0.00000000000000 0.14111842348219 15.999 > 37 38 O 0.89916842681137 0.00000000000000 0.14111842348219 15.999 > 37 39 O 0.39916842681137 0.00000000000000 0.64111842348219 15.999 > 37 40 O 0.89916842681137 0.00000000000000 0.64111842348219 15.999 > 37 41 O 0.12474985347099 0.29969320604220 0.36910440297780 15.999 > 41 42 O 0.62474985347099 0.29969320604220 0.36910440297780 15.999 > 41 43 O 0.12474985347099 0.29969320604220 0.86910440297780 15.999 > 41 44 O 0.62474985347099 0.29969320604220 0.86910440297780 15.999 > 41 45 O 0.37525014652901 0.29969320604220 0.13089559702220 15.999 > 45 46 O 0.87525014652901 0.29969320604220 0.13089559702220 15.999 > 45 47 O 0.37525014652901 0.29969320604220 0.63089559702220 15.999 > 45 48 O 0.87525014652901 0.29969320604220 0.63089559702220 15.999 > 45 49 O 0.12525014652901 0.20030679395780 0.13089559702220 15.999 > 49 50 O 0.62525014652901 0.20030679395780 0.13089559702220 15.999 > 49 51 O 0.12525014652901 0.20030679395780 0.63089559702220 15.999 > 49 52 O 0.62525014652901 0.20030679395780 0.63089559702220 15.999 > 49 53 O 0.37474985347099 0.20030679395780 0.36910440297780 15.999 > 53 54 O 0.87474985347099 0.20030679395780 0.36910440297780 15.999 > 53 55 O 0.37474985347099 0.20030679395780 0.86910440297780 15.999 > 53 56 O 0.87474985347099 0.20030679395780 0.86910440297780 15.999 > 53 57 O 0.35083157318863 0.50000000000000 0.35888157651781 15.999 > 33 58 O 0.85083157318863 0.50000000000000 0.35888157651781 15.999 > 33 59 O 0.35083157318863 0.50000000000000 0.85888157651781 15.999 > 33 60 O 0.85083157318863 0.50000000000000 0.85888157651781 15.999 > 33 61 O 0.14916842681137 0.50000000000000 0.14111842348219 15.999 > 37 62 O 0.64916842681137 0.50000000000000 0.14111842348219 15.999 > 37 63 O 0.14916842681137 0.50000000000000 0.64111842348219 15.999 > 37 64 O 0.64916842681137 0.50000000000000 0.64111842348219 15.999 > 37 65 O 0.37474985347099 0.79969320604220 0.36910440297780 15.999 > 41 66 O 0.87474985347099 0.79969320604220 0.36910440297780 15.999 > 41 67 O 0.37474985347099 0.79969320604220 0.86910440297780 15.999 > 41 68 O 0.87474985347099 0.79969320604220 0.86910440297780 15.999 > 41 69 O 0.12525014652901 0.79969320604220 0.13089559702220 15.999 > 45 70 O 0.62525014652901 0.79969320604220 0.13089559702220 15.999 > 45 71 O 0.12525014652901 0.79969320604220 0.63089559702220 15.999 > 45 72 O 0.62525014652901 0.79969320604220 0.63089559702220 15.999 > 45 73 O 0.37525014652901 0.70030679395780 0.13089559702220 15.999 > 49 74 O 0.87525014652901 0.70030679395780 0.13089559702220 15.999 > 49 75 O 0.37525014652901 0.70030679395780 0.63089559702220 15.999 > 49 76 O 0.87525014652901 0.70030679395780 0.63089559702220 15.999 > 49 77 O 0.12474985347099 0.70030679395780 0.36910440297780 15.999 > 53 78 O 0.62474985347099 0.70030679395780 0.36910440297780 15.999 > 53 79 O 0.12474985347099 0.70030679395780 0.86910440297780 15.999 > 53 80 O 0.62474985347099 0.70030679395780 0.86910440297780 15.999 > 53 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.6659993 0.0000000 0.0091908 0.0000000 3.7401317 0.0000000 0.0091893 0.0000000 3.0818680 -------------------------- Born effective charges -------------------------- 1 Li 1.1692050 0.0000000 0.0042689 0.0000000 0.9812295 0.0000000 0.0325162 0.0000000 1.4964988 2 Li 1.1692050 0.0000000 0.0042689 0.0000000 0.9812295 0.0000000 0.0325162 0.0000000 1.4964988 3 Sb 4.7416588 0.0000000 0.0570186 0.0000000 4.9223252 0.0000000 0.0110635 0.0000000 2.8688777 4 Sb 4.7416588 0.0000000 0.0570186 0.0000000 4.9223252 0.0000000 0.0110635 0.0000000 2.8688777 5 O -1.3772162 0.0000000 -0.2928163 0.0000000 -2.6387896 0.0000000 -0.3366060 0.0000000 -1.3433769 6 O -1.3772162 0.0000000 -0.2928163 0.0000000 -2.6387896 0.0000000 -0.3366060 0.0000000 -1.3433769 7 O -2.2668238 -0.4808053 0.1157644 -0.3996751 -1.6323826 -0.0481273 0.1465132 -0.0984467 -1.5109998 8 O -2.2668238 0.4808053 0.1157644 0.3996751 -1.6323826 0.0481273 0.1465132 0.0984467 -1.5109998 9 O -2.2668238 -0.4808053 0.1157644 -0.3996751 -1.6323826 -0.0481273 0.1465132 -0.0984467 -1.5109998 10 O -2.2668238 0.4808053 0.1157644 0.3996751 -1.6323826 0.0481273 0.1465132 0.0984467 -1.5109998 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000007 (yyy) 0.00000007 (yyy) 0.00000007 (yyy) Max drift of fc2: 0.00000000 (zz) 0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 11 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.84, Number of G-points: 309, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/336) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 4.040 ( 0.000 0.000 0.000) 0.000 5.770 ( 0.000 0.000 0.000) 0.000 6.218 ( 0.000 0.000 0.000) 0.000 6.986 ( 0.000 0.000 0.000) 0.000 7.071 ( 0.000 0.000 0.000) 0.000 7.464 ( 0.000 0.000 0.000) 0.000 7.999 ( 0.000 0.000 0.000) 0.000 8.218 ( 0.000 0.000 0.000) 0.000 8.690 ( 0.000 0.000 0.000) 0.000 8.778 ( 0.000 0.000 0.000) 0.000 9.122 ( 0.000 0.000 0.000) 0.000 9.759 ( 0.000 0.000 0.000) 0.000 10.563 ( 0.000 0.000 0.000) 0.000 10.648 ( 0.000 0.000 0.000) 0.000 10.753 ( 0.000 0.000 0.000) 0.000 14.986 ( 0.000 0.000 0.000) 0.000 14.992 ( 0.000 0.000 0.000) 0.000 15.289 ( 0.000 0.000 0.000) 0.000 15.441 ( 0.000 0.000 0.000) 0.000 15.720 ( 0.000 0.000 0.000) 0.000 16.964 ( 0.000 0.000 0.000) 0.000 17.508 ( 0.000 0.000 0.000) 0.000 17.759 ( 0.000 0.000 0.000) 0.000 18.587 ( 0.000 0.000 0.000) 0.000 18.942 ( 0.000 0.000 0.000) 0.000 19.725 ( 0.000 0.000 0.000) 0.000 19.768 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/336) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.473 ( 22.938 -5.276 6.235) 24.349 0.607 ( 11.122 -39.266 4.489) 41.057 1.249 ( 59.734 -19.561 -3.805) 62.970 4.038 ( -1.144 0.031 3.040) 3.248 5.830 ( -6.832 -8.967 1.781) 11.413 6.262 ( 2.981 -2.850 0.014) 4.124 7.014 ( 1.018 9.841 -2.387) 10.177 7.139 ( 2.508 2.205 -4.942) 5.964 7.546 ( -2.462 -0.923 8.015) 8.435 8.000 ( -2.290 -4.278 0.579) 4.887 8.222 ( 0.812 0.624 -1.514) 1.828 8.650 ( -2.445 2.876 -0.193) 3.780 9.070 ( -4.129 2.351 1.223) 4.906 9.474 ( 20.641 32.440 -0.979) 38.463 10.336 ( -8.060 -23.331 -43.965) 50.420 10.548 ( 0.442 5.190 1.928) 5.554 10.762 ( 8.594 6.656 -15.480) 18.916 11.305 ( -27.417 -9.769 92.713) 97.174 14.976 ( 1.740 2.568 2.904) 4.249 15.149 ( 1.629 -14.662 -5.299) 15.675 15.463 ( 2.871 -1.414 0.248) 3.210 15.594 ( 6.604 -4.060 0.047) 7.753 16.767 ( 8.485 24.912 -2.365) 26.423 17.442 ( -4.877 2.217 -2.946) 6.114 17.761 ( -0.385 0.202 1.644) 1.700 18.575 ( -1.036 -0.177 -1.657) 1.962 18.953 ( 0.688 0.315 2.385) 2.502 19.713 ( 0.704 0.955 -4.614) 4.764 19.768 ( 0.049 -0.261 5.399) 5.406 20.834 ( 4.771 -1.147 -35.505) 35.843 ======================= Grid point 2 (3/336) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.972 ( 21.436 -9.973 4.802) 24.125 1.187 ( 13.411 -31.605 4.881) 34.678 2.454 ( 55.094 -20.439 -2.808) 58.830 4.020 ( -2.712 0.854 5.001) 5.753 5.790 ( -4.228 -0.279 4.635) 6.280 6.355 ( 3.696 -2.944 -0.975) 4.824 6.926 ( 1.297 9.393 -2.005) 9.691 7.114 ( 0.045 5.954 0.618) 5.986 7.534 ( -4.466 -3.931 2.415) 6.421 8.001 ( -3.105 -4.144 2.403) 5.709 8.211 ( -0.089 1.423 -2.975) 3.299 8.568 ( -2.528 4.411 2.647) 5.732 8.974 ( -6.953 -2.939 1.639) 7.724 9.534 ( 9.283 11.486 1.462) 14.841 10.189 ( -12.233 -12.735 -14.621) 22.926 10.504 ( 1.234 7.914 1.485) 8.146 10.784 ( 10.483 8.335 -18.165) 22.568 11.327 ( -13.223 -6.366 40.506) 43.083 15.043 ( 7.303 2.584 1.324) 7.859 15.259 ( 0.479 -7.648 -4.967) 9.132 15.622 ( 10.661 -7.617 -0.870) 13.131 15.793 ( 9.686 -2.570 5.519) 11.440 16.626 ( -1.771 13.102 -3.955) 13.800 17.289 ( -8.136 2.494 -0.023) 8.509 17.748 ( -1.775 1.010 2.672) 3.363 18.538 ( -2.024 -0.149 -3.093) 3.700 18.981 ( 1.349 0.713 4.129) 4.402 19.653 ( -4.170 -0.119 -3.434) 5.403 19.835 ( 2.488 -2.333 5.094) 6.130 20.742 ( 1.098 4.459 -20.144) 20.661 ======================= Grid point 3 (4/336) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( 12.765 -15.041 4.657) 20.270 1.751 ( 20.187 -20.259 3.420) 28.804 3.560 ( 46.827 -21.731 -1.968) 51.661 3.953 ( -5.766 3.388 5.410) 8.602 5.733 ( -2.735 3.330 5.430) 6.932 6.415 ( 1.776 -0.322 -2.516) 3.097 6.879 ( 2.992 6.086 -1.873) 7.036 7.029 ( -3.579 6.838 2.700) 8.177 7.474 ( -6.156 -1.787 0.622) 6.440 8.003 ( 0.457 -0.488 1.989) 2.099 8.141 ( -5.602 -0.351 -4.216) 7.020 8.547 ( 2.169 3.148 8.527) 9.345 8.898 ( -7.076 -5.694 0.335) 9.089 9.566 ( 1.157 4.281 -0.409) 4.454 10.053 ( -8.293 -8.460 -3.049) 12.233 10.461 ( 2.330 7.725 -1.091) 8.142 10.811 ( 9.360 6.636 -15.612) 19.374 11.316 ( -9.454 -3.427 21.843) 24.047 15.186 ( 12.097 6.193 0.679) 13.607 15.293 ( -2.433 -9.925 -4.557) 11.189 15.927 ( 13.204 -6.158 -2.357) 14.759 16.005 ( 8.569 -2.787 7.302) 11.598 16.431 ( -5.034 9.345 -4.815) 11.655 17.142 ( -6.367 0.277 2.679) 6.913 17.696 ( -3.994 2.043 3.172) 5.494 18.480 ( -2.688 0.042 -4.068) 4.876 19.025 ( 2.301 1.160 5.293) 5.887 19.548 ( -6.027 -0.656 -3.428) 6.965 19.925 ( 1.374 -3.434 5.222) 6.399 20.616 ( 0.344 6.802 -15.108) 16.573 ======================= Grid point 4 (5/336) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( 4.560 -12.206 4.298) 13.720 2.324 ( 23.713 -14.134 0.992) 27.624 3.775 ( -10.991 7.181 4.289) 13.812 4.495 ( 33.719 -22.239 -1.820) 40.433 5.701 ( 2.533 5.838 5.265) 8.260 6.402 ( -0.528 2.113 -3.616) 4.221 6.822 ( -8.640 6.858 1.337) 11.112 6.932 ( 1.580 1.172 -0.066) 1.968 7.385 ( -3.159 1.443 2.091) 4.054 7.952 ( -5.559 5.921 -3.922) 9.019 8.110 ( 1.640 -7.929 1.309) 8.202 8.633 ( 4.832 3.111 7.256) 9.256 8.828 ( -4.869 -2.454 1.452) 5.642 9.466 ( -8.434 -1.829 -5.369) 10.164 10.058 ( -0.230 -4.864 6.126) 7.825 10.428 ( 2.505 5.864 -3.420) 7.236 10.852 ( 7.685 3.207 -12.126) 14.710 11.256 ( -7.949 -0.669 12.274) 14.638 15.269 ( 4.324 6.381 -0.255) 7.712 15.416 ( 6.262 -11.346 -3.988) 13.559 16.022 ( 0.548 6.805 3.145) 7.516 16.202 ( -4.960 -0.813 -0.689) 5.073 16.348 ( 12.157 -2.916 -2.203) 12.694 17.108 ( -0.098 -1.973 3.491) 4.011 17.595 ( -6.148 2.702 3.210) 7.443 18.411 ( -2.547 0.226 -3.884) 4.650 19.091 ( 3.727 1.633 6.042) 7.284 19.427 ( -6.650 -1.505 -4.337) 8.080 19.984 ( -0.802 -2.809 4.585) 5.437 20.504 ( 0.999 6.023 -10.628) 12.256 ======================= Grid point 5 (6/336) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( 0.906 -4.358 1.780) 4.793 2.835 ( 17.776 -9.768 -0.563) 20.291 3.480 ( -12.988 8.002 2.272) 15.423 5.078 ( 10.627 -12.277 -1.482) 16.305 5.815 ( 12.673 3.113 4.261) 13.728 6.301 ( -7.170 3.160 -4.416) 8.995 6.576 ( -8.416 3.268 2.351) 9.330 6.969 ( 1.402 -0.051 -0.122) 1.408 7.382 ( 1.767 -0.099 1.220) 2.150 7.779 ( -5.242 2.985 -1.651) 6.254 8.237 ( 3.279 -4.257 0.405) 5.389 8.636 ( -1.774 2.417 -0.374) 3.021 8.849 ( 3.018 0.838 4.856) 5.778 9.316 ( -6.484 -2.678 -3.944) 8.048 10.133 ( 0.771 -1.921 4.615) 5.058 10.406 ( 1.215 2.442 -2.593) 3.764 10.905 ( 4.108 0.394 -5.943) 7.235 11.177 ( -4.404 0.518 5.188) 6.825 15.275 ( 1.001 1.558 -0.310) 1.878 15.615 ( 6.329 -6.527 -2.669) 9.475 15.924 ( -3.573 5.967 1.735) 7.168 16.092 ( -3.296 1.512 0.093) 3.628 16.577 ( 6.247 -3.549 -0.591) 7.209 17.170 ( 2.560 -1.102 1.165) 3.020 17.477 ( -4.691 1.672 1.862) 5.316 18.361 ( -1.117 0.156 -1.703) 2.042 19.179 ( 4.793 1.898 5.701) 7.686 19.307 ( -5.864 -1.963 -5.022) 7.967 19.997 ( -0.943 -0.900 1.815) 2.234 20.447 ( 0.770 2.280 -3.887) 4.571 ======================= Grid point 12 (7/336) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.691 ( 22.644 0.000 1.880) 22.722 0.946 ( 27.261 0.000 3.631) 27.501 2.263 ( 59.175 0.000 -1.724) 59.201 4.024 ( -2.118 -0.000 3.997) 4.524 5.784 ( -1.195 -0.000 6.507) 6.616 6.321 ( 4.195 0.000 0.323) 4.207 7.085 ( 0.783 0.000 -3.060) 3.159 7.110 ( -0.716 -0.000 -3.694) 3.763 7.529 ( -3.776 -0.000 9.753) 10.458 7.919 ( -2.906 -0.000 -1.104) 3.109 8.246 ( 2.124 0.000 -2.348) 3.166 8.612 ( -2.929 -0.000 1.126) 3.138 8.925 ( -12.901 -0.000 2.326) 13.109 9.749 ( 0.732 0.000 4.013) 4.079 9.972 ( -3.690 -0.000 -24.297) 24.575 10.598 ( 2.098 0.000 -5.756) 6.127 10.874 ( 9.015 0.000 -18.983) 21.015 11.247 ( -15.349 -0.000 59.941) 61.875 14.994 ( 1.710 0.000 -4.724) 5.024 15.278 ( 15.635 0.000 -1.472) 15.705 15.505 ( 2.721 0.000 1.173) 2.963 15.768 ( 12.394 0.000 3.615) 12.911 16.787 ( -8.233 -0.000 -1.907) 8.450 17.309 ( -8.606 -0.000 -4.061) 9.516 17.756 ( -1.635 -0.000 2.810) 3.251 18.537 ( -1.850 -0.000 -3.081) 3.594 18.988 ( 1.431 0.000 4.068) 4.312 19.652 ( -4.324 -0.000 -4.282) 6.086 19.814 ( 2.148 0.000 5.686) 6.078 20.791 ( 3.122 0.000 -22.651) 22.865 ======================= Grid point 13 (8/336) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( 22.332 -8.437 3.798) 24.172 1.489 ( 28.828 -6.691 1.054) 29.614 3.267 ( 49.277 -7.821 -1.595) 49.919 3.990 ( -3.901 0.732 4.210) 5.786 5.780 ( -2.077 1.408 7.222) 7.645 6.392 ( 2.597 -1.219 -0.519) 2.916 7.011 ( 0.615 7.209 -3.679) 8.117 7.118 ( -1.435 -1.091 -1.571) 2.391 7.478 ( -4.136 3.477 7.106) 8.927 7.906 ( -2.028 -5.970 0.744) 6.348 8.235 ( -0.004 6.293 -4.399) 7.678 8.591 ( 0.074 1.456 8.307) 8.434 8.705 ( -15.233 -10.188 0.639) 18.337 9.716 ( -0.367 9.094 -4.296) 10.064 9.886 ( -3.145 -8.415 -2.243) 9.259 10.571 ( 0.024 3.357 -5.245) 6.227 10.916 ( 6.628 2.898 -16.691) 18.191 11.256 ( -8.761 -1.908 31.874) 33.111 15.038 ( 1.737 -6.753 -5.242) 8.724 15.449 ( 9.805 12.712 0.020) 16.054 15.707 ( 13.131 -13.186 -1.581) 18.676 16.012 ( 11.496 0.700 5.418) 12.728 16.593 ( -8.326 5.457 -2.582) 10.285 17.137 ( -8.090 -0.533 -1.965) 8.342 17.720 ( -3.916 0.551 3.268) 5.130 18.482 ( -2.400 0.130 -3.967) 4.639 19.041 ( 2.482 0.448 5.311) 5.879 19.537 ( -6.340 -0.386 -4.352) 7.700 19.887 ( 2.183 -0.761 6.541) 6.937 20.714 ( -0.237 2.877 -15.591) 15.856 ======================= Grid point 14 (9/336) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( 19.391 -0.107 4.864) 19.992 2.089 ( 28.362 -10.359 -0.918) 30.208 3.883 ( -7.823 3.862 2.771) 9.154 4.133 ( 36.053 -13.982 -1.611) 38.702 5.767 ( -0.307 1.530 5.934) 6.135 6.418 ( -0.061 -0.428 -1.547) 1.606 6.942 ( -3.225 4.387 -2.343) 5.927 7.041 ( -1.128 8.882 0.894) 8.998 7.408 ( -2.655 1.943 2.753) 4.290 7.935 ( -4.778 -7.066 0.817) 8.569 8.098 ( -1.779 6.899 -2.498) 7.550 8.592 ( -10.208 -15.104 -0.987) 18.256 8.705 ( 5.410 0.146 12.193) 13.340 9.540 ( -5.993 6.762 -7.176) 11.538 9.973 ( 3.464 -3.533 7.265) 8.790 10.501 ( -2.143 2.014 -4.862) 5.682 10.915 ( 3.926 2.251 -12.872) 13.644 11.247 ( -5.361 0.060 15.016) 15.945 15.115 ( -0.697 -10.384 -4.312) 11.265 15.497 ( 8.660 8.621 -0.834) 12.249 16.063 ( 13.287 -7.069 -4.127) 15.606 16.153 ( 2.389 2.850 7.111) 8.025 16.400 ( -3.906 5.102 -2.827) 7.020 17.065 ( -0.050 -2.297 -0.601) 2.375 17.632 ( -6.595 1.172 3.155) 7.404 18.418 ( -2.345 0.370 -3.837) 4.512 19.118 ( 4.087 1.108 6.276) 7.571 19.402 ( -7.056 -1.024 -4.780) 8.584 19.953 ( 0.719 -0.594 7.365) 7.424 20.598 ( -1.784 3.571 -12.000) 12.646 ======================= Grid point 15 (10/336) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( 16.111 8.105 4.458) 18.578 2.656 ( 24.784 -8.848 -2.671) 26.451 3.641 ( -13.416 7.811 0.291) 15.527 4.787 ( 21.670 -15.234 -2.045) 26.568 5.819 ( 2.659 -2.376 3.729) 5.159 6.391 ( -0.804 2.324 -2.463) 3.481 6.687 ( -14.687 9.720 4.287) 18.127 7.010 ( 3.756 5.209 -2.752) 6.987 7.385 ( 0.429 0.364 0.780) 0.962 7.812 ( -9.044 -0.555 -0.322) 9.067 8.141 ( 4.698 -4.054 0.913) 6.272 8.562 ( -7.974 -12.917 -1.534) 15.257 8.846 ( 3.755 2.658 7.495) 8.795 9.377 ( 0.084 7.068 -1.407) 7.207 10.103 ( 3.869 -1.157 7.919) 8.890 10.415 ( -4.358 -1.237 -5.595) 7.199 10.905 ( 0.993 -0.435 -6.184) 6.279 11.207 ( -2.237 2.280 3.607) 4.818 15.151 ( -4.947 -10.180 -1.735) 11.451 15.602 ( 9.896 2.157 -3.475) 10.708 16.067 ( -4.767 7.578 3.101) 9.474 16.147 ( -2.525 4.248 0.073) 4.943 16.490 ( 10.027 -5.172 -1.783) 11.422 17.145 ( 5.751 -1.358 -2.439) 6.393 17.502 ( -7.409 0.851 2.120) 7.754 18.367 ( -1.150 0.404 -1.940) 2.291 19.215 ( 3.666 1.649 4.446) 5.994 19.277 ( -4.339 -1.211 -3.007) 5.417 19.990 ( -0.349 0.105 7.095) 7.105 20.487 ( -2.517 1.694 -8.095) 8.645 ======================= Grid point 16 (11/336) ======================= q-point: (-0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( 12.541 15.453 1.800) 19.983 2.999 ( 1.607 5.322 -2.188) 5.975 3.377 ( 0.195 -1.261 -4.144) 4.336 5.155 ( 8.778 -4.632 -1.099) 9.985 5.752 ( -19.810 -2.717 -2.682) 20.174 6.366 ( 5.704 9.049 6.684) 12.613 6.492 ( -0.236 -4.678 -0.623) 4.725 7.004 ( 1.446 3.654 -2.876) 4.869 7.384 ( -1.655 0.021 -1.672) 2.352 7.727 ( -0.730 -2.355 2.611) 3.591 8.249 ( 1.269 -2.748 1.320) 3.302 8.559 ( -2.795 -8.874 0.281) 9.308 8.801 ( -5.724 1.117 -2.986) 6.552 9.441 ( 11.645 7.999 6.203) 15.429 10.176 ( 2.392 2.441 -1.249) 3.639 10.325 ( -7.302 -5.625 0.200) 9.220 10.891 ( -3.300 -1.069 2.895) 4.518 11.187 ( 3.497 1.407 -5.246) 6.460 15.128 ( -7.900 -10.366 -0.399) 13.039 15.747 ( 7.986 0.996 -3.624) 8.826 15.900 ( -6.597 5.912 4.232) 9.818 16.098 ( 1.472 2.396 0.430) 2.845 16.619 ( 0.584 0.788 -1.325) 1.649 17.190 ( -0.103 1.164 -4.376) 4.530 17.440 ( 1.239 -2.243 -1.888) 3.183 18.362 ( 1.186 0.246 1.467) 1.902 19.145 ( -4.943 -1.544 -5.748) 7.737 19.351 ( 6.352 2.550 6.116) 9.179 20.018 ( 1.355 0.968 5.089) 5.354 20.406 ( -3.909 -1.772 -2.105) 4.781 ======================= Grid point 17 (12/336) ======================= q-point: (-0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( 3.495 19.989 -2.881) 20.496 2.639 ( -15.612 18.396 -2.412) 24.248 3.618 ( 13.025 -8.894 -6.207) 16.950 4.922 ( -29.307 20.064 -0.001) 35.517 5.539 ( -0.828 -10.371 -4.051) 11.165 6.379 ( -0.878 0.743 5.568) 5.685 6.699 ( 8.983 -6.276 0.156) 10.959 6.963 ( 0.064 3.747 -2.586) 4.553 7.353 ( 1.591 -1.385 -2.886) 3.575 7.829 ( 3.329 -6.272 4.000) 8.150 8.241 ( -0.031 4.101 0.082) 4.101 8.589 ( -4.204 -1.201 -1.028) 4.492 8.729 ( -0.497 -9.195 -1.904) 9.403 9.591 ( 9.592 8.427 3.423) 13.219 10.120 ( -2.437 -0.884 -11.810) 12.091 10.306 ( -3.311 -3.908 11.434) 12.529 10.822 ( -6.597 0.154 5.269) 8.444 11.260 ( 7.845 -0.352 -8.289) 11.418 15.073 ( -9.505 -11.073 -0.967) 14.626 15.690 ( -2.493 13.320 6.116) 14.868 15.897 ( 1.719 -5.568 -4.614) 7.433 16.160 ( 3.599 -2.756 2.830) 5.344 16.473 ( -10.126 7.762 -0.701) 12.779 17.140 ( 0.261 1.465 -7.130) 7.284 17.528 ( 5.094 -4.215 -4.015) 7.736 18.412 ( 3.048 0.386 4.014) 5.055 19.059 ( -3.457 -1.578 -5.761) 6.901 19.462 ( 5.996 2.269 4.235) 7.683 20.056 ( 3.115 4.119 0.252) 5.170 20.377 ( -4.288 -6.746 7.061) 10.665 ======================= Grid point 18 (13/336) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.740 ( -15.731 17.201 -7.526) 24.494 2.216 ( -6.699 26.271 -3.115) 27.290 3.854 ( 8.008 -6.568 -6.814) 12.398 4.045 ( -40.312 26.409 0.266) 48.193 5.659 ( 5.997 -4.087 -2.738) 7.757 6.393 ( -0.988 -1.993 4.309) 4.850 6.773 ( -4.429 -4.826 0.032) 6.551 6.964 ( 2.475 0.290 -2.597) 3.599 7.478 ( 10.194 -1.649 -1.713) 10.468 7.937 ( 0.322 -4.986 3.202) 5.934 8.233 ( 4.738 5.890 0.894) 7.612 8.484 ( -5.225 -2.536 -5.835) 8.233 8.857 ( 2.140 -8.582 2.232) 9.122 9.600 ( -0.319 6.511 -5.296) 8.399 10.087 ( -2.159 -9.990 -3.030) 10.660 10.368 ( 3.705 2.747 11.149) 12.065 10.721 ( -7.971 -1.888 5.341) 9.780 11.365 ( 9.024 1.428 -11.939) 15.034 14.994 ( -9.754 -10.148 -2.381) 14.276 15.572 ( 0.872 13.889 6.880) 15.524 15.910 ( -3.140 -3.583 -5.875) 7.564 16.109 ( -17.452 1.853 2.090) 17.674 16.330 ( 5.834 1.877 2.710) 6.701 17.131 ( 3.521 -0.603 -7.647) 8.440 17.636 ( 3.860 -4.318 -3.488) 6.761 18.485 ( 3.255 0.715 4.322) 5.458 19.000 ( -2.114 -1.412 -5.137) 5.732 19.563 ( 5.563 1.049 2.369) 6.137 20.017 ( -1.024 5.805 -3.536) 6.874 20.467 ( 0.147 -8.377 14.400) 16.660 ======================= Grid point 19 (14/336) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( -22.406 13.909 -10.116) 28.246 1.779 ( -13.635 26.816 -4.669) 30.443 3.038 ( -36.837 38.176 2.130) 53.094 3.976 ( 3.659 -3.874 -6.305) 8.255 5.789 ( 7.654 -0.152 -1.813) 7.867 6.400 ( -1.389 1.017 3.960) 4.318 6.754 ( -3.734 -8.225 0.415) 9.043 6.985 ( -0.511 -4.919 -4.006) 6.364 7.637 ( 7.518 4.672 0.919) 8.899 7.999 ( 2.891 -2.748 -1.398) 4.226 8.253 ( 0.497 4.533 2.807) 5.355 8.453 ( 0.316 -6.973 -4.614) 8.367 8.950 ( -1.059 -5.844 1.968) 6.256 9.448 ( -7.111 2.633 -8.033) 11.047 10.194 ( -0.075 -16.098 0.041) 16.098 10.481 ( 9.256 8.474 11.026) 16.705 10.633 ( -9.348 -5.618 8.227) 13.661 11.436 ( 10.265 4.521 -19.404) 22.412 14.915 ( -6.538 -7.657 -3.841) 10.776 15.502 ( 0.277 11.914 7.465) 14.062 15.761 ( -10.562 8.504 -0.159) 13.561 15.821 ( -8.631 -1.545 -6.542) 10.940 16.429 ( -0.383 -4.781 5.270) 7.126 17.214 ( 5.712 -4.877 -5.197) 9.134 17.710 ( 2.016 -3.086 -2.522) 4.467 18.546 ( 2.407 0.792 3.206) 4.087 18.962 ( -1.225 -1.174 -4.048) 4.389 19.658 ( 4.587 0.458 1.823) 4.957 19.901 ( -3.968 4.321 -3.694) 6.933 20.640 ( 2.849 -5.877 16.601) 17.840 ======================= Grid point 20 (15/336) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.621 ( -22.320 10.238 -13.616) 28.078 1.138 ( -30.922 19.216 -3.306) 36.556 2.077 ( -19.502 56.827 3.198) 60.165 4.019 ( 1.073 -2.056 -4.187) 4.787 5.931 ( 9.912 1.254 0.136) 9.992 6.369 ( 1.268 6.656 3.150) 7.472 6.804 ( -1.672 -11.015 0.296) 11.145 7.006 ( -3.579 -8.362 -1.645) 9.243 7.655 ( 2.248 8.214 -1.012) 8.576 8.049 ( 0.894 -0.043 -4.264) 4.357 8.219 ( -1.326 0.610 2.457) 2.858 8.548 ( 2.594 -7.230 -1.426) 7.812 8.934 ( -10.212 -7.772 1.886) 12.971 9.255 ( -7.026 2.300 -6.143) 9.612 10.368 ( 3.782 -13.819 -4.378) 14.981 10.568 ( -7.638 -8.410 5.093) 12.451 10.633 ( 6.934 7.907 21.053) 23.534 11.475 ( 12.999 6.959 -28.617) 32.192 14.899 ( 1.177 -4.607 -5.422) 7.212 15.344 ( -12.888 2.140 6.452) 14.571 15.613 ( 5.618 13.461 -0.814) 14.609 15.673 ( -2.766 3.536 -3.091) 5.450 16.403 ( -14.048 -8.663 3.778) 16.931 17.352 ( 4.352 -6.830 -2.099) 8.366 17.747 ( 0.701 -1.526 -1.376) 2.171 18.583 ( 1.211 0.684 1.653) 2.160 18.941 ( -0.621 -0.874 -2.377) 2.608 19.720 ( 0.651 1.266 3.961) 4.209 19.785 ( -2.244 1.812 -5.110) 5.868 20.817 ( 3.488 -2.937 16.445) 17.066 ======================= Grid point 21 (16/336) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.082 ( 0.000 7.359 -0.000) 7.359 0.496 ( 0.000 25.223 -0.000) 25.223 1.306 ( 0.000 67.073 -0.000) 67.073 4.030 ( -0.000 -1.101 0.000) 1.101 6.092 ( -0.000 -5.467 0.000) 5.467 6.376 ( 0.000 8.083 -0.000) 8.083 6.881 ( -0.000 -9.570 0.000) 9.570 6.997 ( -0.000 -6.163 0.000) 6.163 7.573 ( 0.000 8.938 -0.000) 8.938 8.009 ( 0.000 0.773 -0.000) 0.773 8.216 ( -0.000 -0.166 0.000) 0.166 8.638 ( -0.000 -5.152 0.000) 5.152 8.775 ( -0.000 -0.150 0.000) 0.150 9.153 ( 0.000 3.217 -0.000) 3.217 10.495 ( -0.000 -4.219 0.000) 4.219 10.603 ( -0.000 -14.667 0.000) 14.667 10.723 ( 0.000 4.893 -0.000) 4.893 11.501 ( 0.000 4.432 -0.000) 4.432 14.972 ( -0.000 -1.802 0.000) 1.802 15.214 ( -0.000 -5.181 0.000) 5.181 15.549 ( 0.000 6.839 -0.000) 6.839 15.737 ( 0.000 3.508 -0.000) 3.508 16.122 ( 0.000 4.480 -0.000) 4.480 17.452 ( -0.000 -5.663 0.000) 5.663 17.758 ( -0.000 -0.435 0.000) 0.435 18.591 ( 0.000 0.483 -0.000) 0.483 18.936 ( -0.000 -0.588 0.000) 0.588 19.681 ( 0.000 2.447 -0.000) 2.447 19.769 ( 0.000 0.117 -0.000) 0.117 20.938 ( -0.000 -2.715 0.000) 2.715 ======================= Grid point 24 (17/336) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( 28.518 0.000 5.113) 28.973 1.963 ( 28.367 0.000 -2.468) 28.474 3.921 ( -6.557 -0.000 2.389) 6.979 3.993 ( 36.736 0.000 -1.255) 36.757 5.779 ( -2.258 -0.000 6.109) 6.513 6.409 ( 0.132 0.000 -0.368) 0.391 6.993 ( -5.198 -0.000 -3.715) 6.390 7.128 ( 5.177 0.000 -2.449) 5.727 7.466 ( -4.485 -0.000 8.821) 9.896 7.838 ( -3.080 -0.000 -0.180) 3.086 8.265 ( 0.419 0.000 -6.366) 6.380 8.309 ( -17.953 -0.000 0.114) 17.954 8.717 ( 6.574 0.000 14.216) 15.662 9.622 ( -6.337 -0.000 -8.216) 10.376 9.935 ( 5.658 0.000 8.736) 10.409 10.519 ( -3.887 -0.000 -7.770) 8.688 10.932 ( 0.852 0.000 -8.647) 8.688 11.252 ( -3.207 -0.000 13.764) 14.132 15.008 ( 0.701 0.000 -4.579) 4.632 15.603 ( 2.373 0.000 -1.359) 2.735 15.961 ( 21.431 0.000 -2.585) 21.586 16.189 ( 3.157 0.000 5.235) 6.113 16.461 ( -7.439 -0.000 -1.873) 7.672 17.037 ( 0.228 0.000 -2.601) 2.611 17.643 ( -6.754 -0.000 3.240) 7.491 18.422 ( -2.299 -0.000 -3.835) 4.471 19.130 ( 4.293 0.000 6.400) 7.706 19.391 ( -7.161 -0.000 -5.026) 8.748 19.950 ( 1.181 0.000 8.199) 8.284 20.634 ( -3.016 -0.000 -12.294) 12.658 ======================= Grid point 25 (18/336) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( 26.058 10.630 5.093) 28.600 2.484 ( 26.649 -8.358 -3.961) 28.209 3.752 ( -11.621 3.152 -0.913) 12.076 4.567 ( 25.177 -6.408 -1.471) 26.021 5.766 ( -2.780 -2.011 3.186) 4.682 6.398 ( -1.197 -0.273 0.262) 1.256 6.827 ( -10.699 3.080 -1.544) 11.240 7.195 ( 6.348 10.321 -0.267) 12.120 7.403 ( -2.629 2.251 3.143) 4.675 7.740 ( -10.718 -6.103 0.185) 12.335 8.100 ( -1.928 -0.818 0.639) 2.189 8.294 ( -3.037 -9.869 -3.421) 10.878 8.901 ( 5.505 1.805 11.203) 12.612 9.505 ( 0.308 4.424 -2.120) 4.915 10.088 ( 5.837 -0.423 10.170) 11.734 10.382 ( -7.891 -1.467 -7.658) 11.093 10.893 ( -1.567 -0.524 -4.363) 4.665 11.246 ( -0.716 1.333 1.198) 1.930 14.997 ( -3.238 -4.556 -2.474) 6.112 15.634 ( 4.285 0.880 -4.068) 5.974 16.157 ( -7.319 1.883 6.657) 10.071 16.264 ( 6.685 6.694 -2.932) 9.904 16.387 ( 6.918 -5.455 -2.107) 9.058 17.125 ( 9.074 -0.628 -4.956) 10.359 17.510 ( -9.227 0.114 2.512) 9.563 18.374 ( -1.194 0.215 -2.088) 2.415 19.239 ( -2.426 0.775 -1.535) 2.974 19.260 ( 2.258 -0.535 3.362) 4.085 19.996 ( -0.415 0.293 9.438) 9.452 20.509 ( -4.515 0.608 -9.850) 10.853 ======================= Grid point 26 (19/336) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( 19.809 18.253 3.187) 27.124 2.983 ( 21.527 -6.258 -4.302) 22.827 3.445 ( -14.801 6.031 -4.883) 16.712 5.006 ( 17.416 -7.840 -1.770) 19.181 5.675 ( -16.066 -5.032 -1.580) 16.909 6.400 ( 1.092 -2.214 0.306) 2.488 6.590 ( -6.222 8.689 4.370) 11.546 7.140 ( 1.908 11.814 -0.994) 12.008 7.384 ( -0.678 0.036 -2.446) 2.538 7.662 ( -4.218 -5.690 3.624) 7.956 8.164 ( 2.111 -6.590 2.084) 7.227 8.327 ( -2.753 -10.232 -1.061) 10.649 8.890 ( -5.046 5.233 0.893) 7.324 9.583 ( 11.487 6.312 5.835) 14.347 10.205 ( -9.482 -4.434 -11.833) 15.799 10.224 ( 2.600 0.616 13.452) 13.715 10.865 ( -1.277 -1.412 -0.327) 1.931 11.220 ( 1.213 1.621 -5.734) 6.080 14.949 ( -7.374 -7.114 -0.875) 10.283 15.715 ( 6.520 -1.948 -6.047) 9.104 16.012 ( -8.922 3.337 8.644) 12.863 16.188 ( -1.483 5.814 -0.724) 6.044 16.614 ( 9.236 -1.003 -3.619) 9.970 17.225 ( 2.641 2.568 -6.720) 7.664 17.387 ( -2.977 -3.205 -1.624) 4.666 18.368 ( 1.356 0.346 1.312) 1.918 19.122 ( -4.979 -0.847 -5.621) 7.557 19.399 ( 7.153 2.093 7.014) 10.234 20.027 ( -0.210 -0.075 9.799) 9.801 20.385 ( -5.080 -0.473 -6.565) 8.314 ======================= Grid point 27 (20/336) ======================= q-point: (-0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( 3.088 20.504 -3.033) 20.956 3.005 ( -6.764 18.450 -2.481) 19.807 3.435 ( 13.289 -10.220 -7.647) 18.426 5.193 ( -27.720 6.637 -3.284) 28.692 5.348 ( 8.469 -7.942 -2.408) 11.857 6.409 ( -3.631 0.342 4.469) 5.768 6.618 ( 9.419 -0.112 2.463) 9.737 7.062 ( 0.426 6.822 -2.688) 7.345 7.339 ( -0.937 -0.224 -2.748) 2.912 7.725 ( 2.551 -4.301 4.563) 6.770 8.253 ( 1.103 -2.255 1.597) 2.975 8.417 ( -0.279 -14.589 2.026) 14.732 8.716 ( -6.587 5.842 -1.432) 8.920 9.731 ( 7.039 5.610 3.903) 9.811 10.004 ( -13.562 -7.879 -10.546) 18.900 10.323 ( 4.871 3.042 10.783) 12.217 10.841 ( -2.812 1.313 0.657) 3.173 11.246 ( 6.013 -0.975 -6.795) 9.126 14.877 ( -8.432 -8.652 -1.182) 12.139 15.814 ( 3.074 -2.992 -5.389) 6.888 15.879 ( -4.655 5.829 8.700) 11.460 16.126 ( -2.926 -0.581 2.507) 3.897 16.630 ( -1.281 8.486 -3.209) 9.163 17.164 ( -0.317 0.925 -7.691) 7.752 17.437 ( 3.436 -5.083 -6.619) 9.025 18.425 ( 3.847 0.834 4.171) 5.735 19.033 ( -3.305 -1.108 -5.483) 6.498 19.515 ( 5.605 3.131 4.619) 7.909 20.105 ( 4.051 -0.441 9.236) 10.095 20.276 ( -6.419 -2.307 -1.560) 6.997 ======================= Grid point 28 (21/336) ======================= q-point: (-0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.083 ( -17.426 17.916 -10.954) 27.288 2.710 ( -5.642 23.949 -2.121) 24.696 3.701 ( 9.303 -9.003 -7.382) 14.903 4.500 ( -29.684 18.884 -2.340) 35.259 5.594 ( 11.829 -2.186 -0.869) 12.061 6.370 ( -2.420 0.026 5.584) 6.086 6.707 ( -2.507 -1.604 -1.478) 3.323 7.006 ( -0.359 3.327 -2.425) 4.133 7.428 ( 10.893 -3.098 -1.607) 11.439 7.839 ( 2.691 -4.542 3.995) 6.620 8.286 ( 1.635 -0.774 -1.002) 2.068 8.487 ( -6.406 0.301 0.717) 6.453 8.652 ( 2.088 -9.177 3.526) 10.050 9.748 ( 0.496 7.428 -5.021) 8.979 9.797 ( -15.534 -16.007 -4.068) 22.673 10.451 ( 6.758 3.157 11.435) 13.653 10.740 ( -4.767 3.311 -2.646) 6.379 11.371 ( 9.253 -0.545 -5.788) 10.928 14.812 ( -6.976 -8.505 -2.671) 11.319 15.775 ( -3.154 7.034 9.028) 11.871 15.832 ( -4.273 -3.843 -4.857) 7.524 16.088 ( -6.924 -2.220 4.908) 8.773 16.485 ( 1.339 11.892 -2.522) 12.230 17.126 ( 1.061 0.113 -10.824) 10.876 17.527 ( 3.000 -6.890 -4.787) 8.910 18.508 ( 4.047 1.592 4.627) 6.350 18.974 ( -1.979 -1.203 -4.899) 5.419 19.593 ( 4.838 2.053 1.724) 5.531 20.129 ( -3.148 4.933 -2.638) 6.419 20.307 ( 3.012 -7.681 13.881) 16.148 ======================= Grid point 29 (22/336) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( -22.199 16.661 -14.971) 31.536 2.217 ( -25.216 19.180 -3.786) 31.907 3.812 ( -14.882 38.785 0.265) 41.543 3.871 ( 4.547 -6.383 -6.576) 10.231 5.795 ( 10.344 1.093 0.062) 10.401 6.387 ( 0.385 -1.974 5.932) 6.264 6.631 ( -5.900 -3.746 -0.764) 7.030 6.942 ( -2.806 -0.222 -5.680) 6.339 7.679 ( 12.354 -0.333 0.740) 12.380 7.941 ( 3.275 -3.288 1.338) 4.830 8.326 ( -0.150 -5.186 -3.555) 6.289 8.342 ( -5.363 3.783 1.731) 6.787 8.803 ( 0.207 -8.178 4.926) 9.549 9.554 ( -6.191 4.807 -11.687) 14.072 9.801 ( -7.034 -20.418 3.878) 21.941 10.556 ( -3.895 -1.264 8.378) 9.325 10.644 ( 4.873 5.716 -0.666) 7.540 11.502 ( 9.454 2.442 -7.776) 12.482 14.776 ( -3.005 -6.627 -4.306) 8.455 15.612 ( -16.728 -1.353 5.631) 17.702 15.772 ( -2.422 0.269 -1.308) 2.766 15.970 ( -0.427 10.888 1.523) 11.002 16.449 ( 1.682 5.776 2.147) 6.388 17.120 ( 1.847 -4.425 -9.704) 10.824 17.621 ( 2.098 -6.256 -2.733) 7.142 18.571 ( 2.703 1.745 3.411) 4.689 18.938 ( -1.117 -1.199 -3.823) 4.159 19.671 ( 4.832 0.863 0.355) 4.922 19.990 ( -5.508 4.505 -1.700) 7.316 20.523 ( 5.837 -6.032 13.659) 16.032 ======================= Grid point 30 (23/336) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.849 ( -26.042 12.719 -18.765) 34.526 1.489 ( -30.893 17.788 -1.060) 35.664 3.187 ( -4.655 56.201 1.074) 56.404 3.954 ( 1.508 -4.789 -4.249) 6.577 5.941 ( 6.943 0.876 0.301) 7.004 6.464 ( 4.804 2.414 6.387) 8.349 6.607 ( -3.118 -8.900 0.025) 9.431 6.875 ( -4.258 -4.777 -5.925) 8.721 7.800 ( 3.539 6.017 0.681) 7.014 8.022 ( 2.129 -2.078 -4.177) 5.128 8.225 ( -4.397 -0.565 3.049) 5.380 8.404 ( 2.241 -6.791 -1.446) 7.296 8.826 ( -5.779 -4.168 3.083) 7.764 9.364 ( -2.917 7.709 -7.372) 11.058 9.969 ( -1.220 -25.447 2.418) 25.591 10.471 ( -6.055 -2.163 0.968) 6.502 10.745 ( 5.909 3.298 6.550) 9.418 11.584 ( 7.835 4.630 -9.209) 12.947 14.814 ( 4.531 -4.163 -5.564) 8.296 15.313 ( -20.838 -4.277 5.218) 21.903 15.697 ( -2.972 2.911 -2.556) 4.883 15.929 ( 8.738 15.554 1.299) 17.887 16.379 ( -6.479 3.721 2.854) 7.998 17.194 ( 2.397 -9.049 -4.892) 10.563 17.692 ( 1.023 -4.364 -1.215) 4.644 18.603 ( 1.282 1.379 1.696) 2.534 18.921 ( -0.542 -1.099 -2.192) 2.512 19.740 ( 3.020 0.711 1.091) 3.289 19.847 ( -4.155 4.550 -2.103) 6.511 20.734 ( 4.872 -5.442 10.253) 12.589 ======================= Grid point 31 (24/336) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.267 ( 0.000 11.056 -0.000) 11.056 0.965 ( 0.000 23.384 -0.000) 23.384 2.567 ( 0.000 63.296 -0.000) 63.296 3.992 ( -0.000 -3.059 0.000) 3.059 6.017 ( -0.000 -2.194 0.000) 2.194 6.519 ( 0.000 6.356 -0.000) 6.356 6.677 ( -0.000 -10.691 0.000) 10.691 6.859 ( -0.000 -7.766 0.000) 7.766 7.747 ( 0.000 8.278 -0.000) 8.278 8.015 ( -0.000 -0.274 0.000) 0.274 8.214 ( -0.000 -0.129 0.000) 0.129 8.504 ( -0.000 -8.231 0.000) 8.231 8.773 ( -0.000 -0.341 0.000) 0.341 9.249 ( 0.000 6.925 -0.000) 6.925 10.221 ( -0.000 -24.374 0.000) 24.374 10.430 ( -0.000 -2.333 0.000) 2.333 10.799 ( 0.000 2.540 -0.000) 2.540 11.594 ( 0.000 4.876 -0.000) 4.876 14.937 ( -0.000 -1.585 0.000) 1.585 15.107 ( -0.000 -6.162 0.000) 6.162 15.627 ( 0.000 2.958 -0.000) 2.958 15.916 ( 0.000 13.764 -0.000) 13.764 16.226 ( 0.000 5.769 -0.000) 5.769 17.302 ( -0.000 -9.526 0.000) 9.526 17.731 ( -0.000 -2.587 0.000) 2.587 18.606 ( 0.000 1.053 -0.000) 1.053 18.921 ( -0.000 -0.965 0.000) 0.965 19.749 ( 0.000 4.650 -0.000) 4.650 19.772 ( 0.000 0.194 -0.000) 0.194 20.862 ( -0.000 -5.127 0.000) 5.127 ======================= Grid point 36 (25/336) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.678 ( 22.722 0.000 5.313) 23.335 2.842 ( 22.375 0.000 -6.677) 23.350 3.516 ( -14.442 -0.000 -5.331) 15.394 4.923 ( 19.724 0.000 -1.720) 19.798 5.614 ( -15.221 -0.000 -1.660) 15.312 6.381 ( -1.103 -0.000 2.640) 2.861 6.669 ( -5.567 -0.000 -1.343) 5.727 7.363 ( -5.112 -0.000 6.267) 8.087 7.431 ( 11.382 0.000 -1.267) 11.452 7.480 ( -10.613 -0.000 -1.118) 10.672 8.059 ( -1.364 -0.000 2.212) 2.598 8.247 ( 0.977 0.000 -1.081) 1.457 8.946 ( -4.758 -0.000 2.472) 5.362 9.654 ( 11.431 0.000 4.891) 12.433 10.142 ( -14.201 -0.000 -4.373) 14.859 10.242 ( 6.132 0.000 7.883) 9.987 10.849 ( -0.620 -0.000 -1.789) 1.893 11.237 ( 0.303 0.000 -6.135) 6.143 14.878 ( -6.734 -0.000 -1.051) 6.815 15.695 ( 5.689 0.000 -6.224) 8.433 16.040 ( -9.380 -0.000 8.809) 12.868 16.254 ( -5.399 -0.000 0.101) 5.400 16.600 ( 14.864 0.000 -4.994) 15.681 17.268 ( 9.437 0.000 -10.316) 13.981 17.337 ( -10.450 -0.000 1.304) 10.531 18.372 ( 1.457 0.000 1.260) 1.926 19.114 ( -4.991 -0.000 -5.570) 7.479 19.421 ( 7.742 0.000 7.438) 10.736 20.024 ( -1.699 -0.000 10.806) 10.939 20.382 ( -4.967 -0.000 -7.648) 9.120 ======================= Grid point 37 (26/336) ======================= q-point: (-0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.810 ( -1.930 14.342 -5.087) 15.339 3.225 ( 12.566 -9.843 -8.416) 18.045 3.286 ( 1.303 8.193 -0.531) 8.313 5.201 ( -26.713 -1.635 -4.497) 27.139 5.262 ( 16.652 -2.426 -2.267) 16.980 6.387 ( -0.780 -1.059 3.959) 4.171 6.663 ( 5.756 2.066 -1.428) 6.280 7.232 ( -4.740 9.056 2.474) 10.517 7.334 ( -3.832 -0.712 -1.046) 4.035 7.663 ( 8.647 -2.148 4.048) 9.786 8.092 ( -1.386 -10.366 3.494) 11.027 8.268 ( 0.526 -1.330 0.168) 1.440 8.817 ( -7.058 3.306 0.327) 7.801 9.807 ( -6.229 2.442 0.043) 6.691 9.883 ( -4.604 -4.060 -4.157) 7.414 10.371 ( 4.852 1.448 8.880) 10.222 10.859 ( 1.256 0.448 -1.011) 1.673 11.231 ( 3.825 -0.424 -6.988) 7.978 14.759 ( -7.376 -3.234 -1.185) 8.140 15.777 ( 5.172 -0.960 -6.563) 8.411 15.935 ( -6.299 0.926 10.833) 12.566 16.127 ( -8.757 0.250 2.147) 9.020 16.772 ( 8.087 4.883 -5.217) 10.792 17.174 ( -5.312 0.163 -2.382) 5.824 17.350 ( 3.551 -3.041 -12.741) 13.572 18.439 ( 4.526 0.455 4.253) 6.227 19.018 ( -3.240 -0.396 -5.317) 6.239 19.570 ( 5.938 1.940 5.151) 8.097 20.054 ( -1.087 -2.653 11.401) 11.756 20.280 ( -2.741 0.954 -3.978) 4.925 ======================= Grid point 38 (27/336) ======================= q-point: (-0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.399 ( -19.143 13.713 -14.754) 27.788 3.098 ( -10.971 15.514 -1.524) 19.062 3.520 ( 9.433 -9.336 -6.696) 14.866 4.742 ( -16.368 6.760 -1.855) 17.806 5.573 ( 16.568 -0.470 -1.977) 16.692 6.386 ( -2.158 0.946 5.497) 5.981 6.721 ( 1.638 2.544 -5.487) 6.266 7.088 ( -4.367 5.528 -0.148) 7.046 7.359 ( 6.165 -4.335 1.678) 7.721 7.801 ( 5.162 1.798 3.886) 6.706 8.221 ( -0.878 -9.816 3.004) 10.303 8.312 ( 1.373 -8.130 2.115) 8.512 8.673 ( -3.993 5.219 2.220) 6.936 9.524 ( -21.199 -10.715 -2.888) 23.928 9.876 ( 0.514 4.966 -6.034) 7.832 10.481 ( 4.094 0.482 8.448) 9.400 10.811 ( -2.932 3.136 -5.423) 6.917 11.354 ( 10.408 -0.937 -2.196) 10.679 14.679 ( -4.890 -4.992 -2.541) 7.435 15.772 ( -7.124 -2.012 -3.593) 8.229 15.874 ( -4.517 3.713 9.981) 11.567 16.034 ( -1.988 -3.253 4.383) 5.809 16.737 ( 2.339 13.163 -3.802) 13.900 17.124 ( -0.187 -0.827 -9.388) 9.427 17.380 ( 1.008 -7.757 -8.854) 11.815 18.540 ( 4.805 1.465 4.785) 6.937 18.955 ( -1.898 -0.680 -4.715) 5.128 19.640 ( 3.650 2.542 1.132) 4.590 20.123 ( -3.818 -5.145 7.648) 9.977 20.255 ( 4.432 2.229 3.885) 6.301 ======================= Grid point 39 (28/336) ======================= q-point: (-0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( -24.220 13.996 -19.830) 34.289 2.530 ( -32.507 13.467 -2.608) 35.283 3.710 ( 5.373 -9.098 -6.250) 12.277 4.469 ( 1.203 26.763 0.902) 26.805 5.835 ( 14.354 2.708 -0.944) 14.637 6.360 ( -2.125 0.277 7.203) 7.515 6.623 ( -4.866 2.570 -4.457) 7.082 6.956 ( -5.449 1.662 -4.758) 7.423 7.623 ( 13.646 -5.749 2.204) 14.971 7.885 ( 3.716 -1.543 1.603) 4.331 8.236 ( -3.851 -4.821 -0.900) 6.235 8.385 ( -3.874 -0.452 1.795) 4.294 8.679 ( 3.743 -3.198 7.400) 8.888 9.305 ( -17.141 -20.379 -0.929) 26.646 9.763 ( -2.512 7.029 -7.762) 10.769 10.546 ( -2.207 0.134 4.519) 5.031 10.715 ( 0.342 1.597 -3.848) 4.181 11.537 ( 10.201 1.369 -1.466) 10.396 14.663 ( -0.305 -4.940 -4.226) 6.508 15.532 ( -20.003 -4.389 2.320) 20.610 15.841 ( 0.578 5.210 3.691) 6.412 16.093 ( 3.240 1.339 6.390) 7.288 16.634 ( 1.792 12.740 -1.790) 12.989 17.057 ( -2.066 -1.934 -12.878) 13.185 17.468 ( 1.799 -9.668 -3.592) 10.469 18.609 ( 2.697 2.052 3.551) 4.909 18.918 ( -1.041 -0.871 -3.643) 3.888 19.690 ( 4.204 1.091 -0.987) 4.454 20.062 ( -4.804 2.676 1.984) 5.846 20.419 ( 6.462 -4.413 9.928) 12.641 ======================= Grid point 40 (29/336) ======================= q-point: (-0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.077 ( -32.610 10.183 -21.956) 40.610 1.824 ( -25.439 16.827 -0.135) 30.501 3.833 ( 2.154 -7.667 -4.061) 8.939 4.179 ( 3.101 44.995 0.817) 45.110 5.992 ( 7.172 4.974 -0.004) 8.728 6.413 ( 1.430 -5.857 5.115) 7.906 6.534 ( -0.538 0.737 1.978) 2.178 6.820 ( -6.347 -1.193 -7.725) 10.069 7.861 ( 6.373 -0.306 0.422) 6.394 7.982 ( 4.490 -1.891 -2.425) 5.442 8.181 ( -6.243 -4.318 2.909) 8.129 8.322 ( -0.926 -0.942 -0.608) 1.454 8.759 ( -2.571 -2.814 4.226) 5.691 9.364 ( -1.176 -22.717 1.484) 22.796 9.606 ( -4.934 3.242 -5.392) 7.996 10.461 ( -4.663 0.883 -0.783) 4.810 10.761 ( 2.829 -1.521 1.587) 3.582 11.659 ( 6.528 3.155 -2.176) 7.570 14.736 ( 6.659 -3.912 -5.462) 9.459 15.218 ( -20.985 -4.629 4.461) 21.947 15.792 ( -0.571 6.595 -0.205) 6.623 16.176 ( 8.137 8.538 5.907) 13.191 16.506 ( -4.439 9.688 -0.710) 10.681 17.025 ( -0.475 -7.755 -8.094) 11.220 17.573 ( 1.261 -8.087 -1.302) 8.288 18.634 ( 0.998 1.774 1.751) 2.685 18.901 ( -0.483 -0.979 -2.036) 2.311 19.750 ( 3.225 0.367 -0.887) 3.365 19.949 ( -3.330 5.831 0.562) 6.738 20.616 ( 4.516 -6.575 7.328) 10.831 ======================= Grid point 41 (30/336) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.472 ( 0.000 9.427 -0.000) 9.427 1.396 ( 0.000 21.423 -0.000) 21.423 3.717 ( 0.000 55.197 -0.000) 55.197 3.906 ( -0.000 -5.990 0.000) 5.990 6.016 ( 0.000 2.359 -0.000) 2.359 6.491 ( -0.000 -8.243 0.000) 8.243 6.615 ( 0.000 3.790 -0.000) 3.790 6.716 ( -0.000 -6.736 0.000) 6.736 7.871 ( 0.000 4.152 -0.000) 4.152 8.012 ( 0.000 0.572 -0.000) 0.572 8.190 ( -0.000 -3.750 0.000) 3.750 8.357 ( -0.000 -5.532 0.000) 5.532 8.751 ( -0.000 -2.046 0.000) 2.046 9.418 ( 0.000 10.244 -0.000) 10.244 9.690 ( -0.000 -29.891 0.000) 29.891 10.408 ( 0.000 0.005 -0.000) 0.005 10.812 ( -0.000 -1.276 0.000) 1.276 11.680 ( 0.000 3.920 -0.000) 3.920 14.917 ( -0.000 -0.422 0.000) 0.422 14.974 ( -0.000 -7.440 0.000) 7.440 15.716 ( 0.000 6.444 -0.000) 6.444 16.211 ( 0.000 16.032 -0.000) 16.032 16.327 ( 0.000 4.493 -0.000) 4.493 17.102 ( -0.000 -10.733 0.000) 10.733 17.649 ( -0.000 -6.052 0.000) 6.052 18.631 ( 0.000 1.488 -0.000) 1.488 18.901 ( -0.000 -1.030 0.000) 1.030 19.776 ( 0.000 0.209 -0.000) 0.209 19.857 ( 0.000 6.367 -0.000) 6.367 20.745 ( -0.000 -6.912 0.000) 6.912 ======================= Grid point 48 (31/336) ======================= q-point: (-0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.548 ( -21.194 -0.000 -17.361) 27.397 3.278 ( -16.017 -0.000 0.732) 16.034 3.390 ( 11.899 0.000 -7.464) 14.046 4.800 ( -10.026 -0.000 -0.320) 10.031 5.567 ( 18.702 0.000 -3.329) 18.996 6.394 ( -0.601 -0.000 5.247) 5.282 6.756 ( 4.480 0.000 -10.346) 11.274 7.188 ( -6.526 -0.000 0.908) 6.589 7.279 ( 0.783 0.000 6.542) 6.589 7.906 ( 12.785 0.000 5.512) 13.922 7.985 ( -4.700 -0.000 3.795) 6.041 8.270 ( 0.343 0.000 0.389) 0.519 8.733 ( -4.386 -0.000 2.573) 5.085 9.415 ( -23.808 -0.000 -3.716) 24.096 9.926 ( 1.047 0.000 -4.966) 5.075 10.484 ( 3.245 0.000 6.930) 7.652 10.842 ( -3.047 -0.000 -6.302) 7.000 11.344 ( 11.189 0.000 -0.898) 11.225 14.630 ( -4.157 -0.000 -2.426) 4.813 15.753 ( -8.867 -0.000 -3.288) 9.457 15.922 ( -1.288 -0.000 12.926) 12.990 15.986 ( -3.526 -0.000 1.356) 3.778 16.910 ( 5.568 0.000 -5.716) 7.979 17.090 ( -1.800 -0.000 -1.127) 2.123 17.288 ( -1.027 -0.000 -16.144) 16.177 18.555 ( 5.127 0.000 4.805) 7.026 18.949 ( -1.871 -0.000 -4.651) 5.013 19.670 ( 2.822 0.000 0.589) 2.883 20.061 ( -1.140 -0.000 10.236) 10.300 20.283 ( 2.313 0.000 1.719) 2.882 ======================= Grid point 50 (32/336) ======================= q-point: (-0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -27.932 5.464 -23.705) 37.040 2.729 ( -34.743 6.313 -0.910) 35.323 3.554 ( 6.504 -5.561 -6.047) 10.478 4.806 ( 8.784 8.316 4.200) 12.804 5.875 ( 17.755 1.009 -3.969) 18.221 6.395 ( -1.575 1.999 6.203) 6.705 6.695 ( -2.766 3.116 -11.600) 12.325 7.027 ( -7.716 5.494 -0.353) 9.478 7.467 ( 10.891 -8.478 6.090) 15.085 7.898 ( -1.522 2.202 2.644) 3.762 8.115 ( -0.996 -6.308 0.879) 6.446 8.352 ( 7.509 -1.325 4.440) 8.824 8.689 ( -1.028 2.426 5.507) 6.105 9.001 ( -24.265 -9.540 -1.917) 26.144 9.869 ( -1.786 3.172 -7.979) 8.770 10.554 ( 1.174 0.473 4.510) 4.685 10.721 ( -5.059 -0.343 -7.433) 8.998 11.556 ( 10.988 0.504 1.272) 11.073 14.595 ( 1.012 -1.896 -3.970) 4.514 15.474 ( -19.706 -1.497 2.093) 19.873 15.949 ( 2.246 5.674 4.282) 7.455 16.054 ( 4.066 -4.329 8.375) 10.267 16.876 ( 0.207 9.509 -4.960) 10.727 17.055 ( -1.944 2.795 -9.434) 10.030 17.260 ( 0.494 -10.965 -6.862) 12.945 18.641 ( 2.524 0.947 3.575) 4.477 18.906 ( -1.005 -0.318 -3.569) 3.722 19.708 ( 3.112 0.586 -2.096) 3.798 20.090 ( -1.071 0.452 6.981) 7.077 20.363 ( 4.106 -1.351 5.425) 6.937 ======================= Grid point 51 (33/336) ======================= q-point: (-0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( -38.986 4.726 -23.531) 45.782 2.118 ( -20.571 12.675 -0.136) 24.163 3.676 ( 2.643 -7.655 -3.609) 8.866 4.844 ( 7.915 22.538 2.657) 24.035 6.118 ( 13.383 5.575 -4.617) 15.215 6.357 ( -3.383 1.615 7.923) 8.765 6.570 ( -1.529 2.536 -3.974) 4.956 6.832 ( -7.753 3.244 -3.883) 9.259 7.792 ( 11.713 -6.564 1.486) 13.509 7.921 ( 2.258 -5.644 0.959) 6.154 8.090 ( -5.241 -2.943 0.083) 6.012 8.364 ( -5.286 4.936 0.275) 7.238 8.720 ( -3.193 -1.423 4.526) 5.719 8.870 ( -3.349 -22.733 3.968) 23.318 9.746 ( -2.449 6.655 -7.116) 10.046 10.503 ( -3.669 3.454 -1.462) 5.246 10.696 ( 0.333 -4.875 -0.551) 4.917 11.705 ( 6.196 1.665 0.473) 6.433 14.669 ( 7.125 -2.799 -5.026) 9.158 15.152 ( -19.171 -2.108 4.096) 19.717 15.929 ( 1.010 6.959 0.557) 7.054 16.241 ( 8.251 -0.714 11.295) 14.006 16.712 ( -5.993 8.162 -6.793) 12.193 16.946 ( -0.977 2.227 -7.888) 8.254 17.381 ( 1.370 -11.643 -1.680) 11.843 18.665 ( 0.486 1.297 1.777) 2.253 18.885 ( -0.452 -0.578 -1.973) 2.105 19.755 ( 3.081 0.193 -1.789) 3.568 20.060 ( -1.335 5.266 2.821) 6.121 20.492 ( 3.143 -5.774 5.046) 8.287 ======================= Grid point 52 (34/336) ======================= q-point: (-0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.609 ( 0.000 4.626 -0.000) 4.626 1.781 ( 0.000 17.987 -0.000) 17.987 3.766 ( -0.000 -8.087 0.000) 8.087 4.631 ( 0.000 37.460 -0.000) 37.460 6.130 ( 0.000 10.129 -0.000) 10.129 6.367 ( -0.000 -4.571 0.000) 4.571 6.608 ( -0.000 -4.264 0.000) 4.264 6.679 ( 0.000 3.481 -0.000) 3.481 7.912 ( 0.000 0.948 -0.000) 0.948 8.039 ( 0.000 1.560 -0.000) 1.560 8.051 ( -0.000 -9.523 0.000) 9.523 8.297 ( -0.000 -2.815 0.000) 2.815 8.701 ( -0.000 -2.715 0.000) 2.715 9.122 ( -0.000 -26.777 0.000) 26.777 9.618 ( 0.000 9.657 -0.000) 9.657 10.431 ( 0.000 2.437 -0.000) 2.437 10.752 ( -0.000 -4.767 0.000) 4.767 11.742 ( 0.000 2.498 -0.000) 2.498 14.839 ( -0.000 -6.086 0.000) 6.086 14.917 ( 0.000 0.303 -0.000) 0.303 15.862 ( 0.000 8.175 -0.000) 8.175 16.394 ( 0.000 2.468 -0.000) 2.468 16.493 ( 0.000 11.209 -0.000) 11.209 16.930 ( -0.000 -4.815 0.000) 4.815 17.495 ( -0.000 -9.931 0.000) 9.931 18.660 ( 0.000 1.375 -0.000) 1.375 18.883 ( -0.000 -0.786 0.000) 0.786 19.779 ( 0.000 0.161 -0.000) 0.161 19.989 ( 0.000 7.104 -0.000) 7.104 20.603 ( -0.000 -7.532 0.000) 7.532 ======================= Grid point 61 (35/336) ======================= q-point: (-0.55 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.265 ( -41.468 -0.000 -23.947) 47.886 2.253 ( -19.021 -0.000 -0.330) 19.024 3.590 ( 3.013 0.000 -3.435) 4.569 5.052 ( 8.828 0.000 4.608) 9.959 6.156 ( 14.823 0.000 -5.508) 15.813 6.408 ( -1.959 -0.000 6.137) 6.442 6.600 ( -3.174 -0.000 -9.002) 9.545 6.915 ( -7.830 -0.000 -0.040) 7.830 7.665 ( 12.927 0.000 5.734) 14.142 7.852 ( -1.625 -0.000 0.164) 1.633 8.073 ( -1.251 -0.000 -1.118) 1.678 8.492 ( -23.990 -0.000 -0.943) 24.009 8.557 ( 9.801 0.000 2.700) 10.166 8.717 ( -0.552 -0.000 7.034) 7.056 9.814 ( -1.934 -0.000 -6.810) 7.080 10.585 ( -4.724 -0.000 -5.221) 7.041 10.597 ( 0.878 0.000 2.307) 2.468 11.721 ( 6.116 0.000 1.135) 6.220 14.640 ( 7.023 0.000 -4.758) 8.483 15.133 ( -18.262 -0.000 3.913) 18.676 16.014 ( 0.987 0.000 -1.018) 1.418 16.213 ( 9.548 0.000 14.857) 17.660 16.763 ( -9.631 -0.000 -13.550) 16.624 17.116 ( 1.633 0.000 -0.390) 1.679 17.152 ( 1.022 0.000 -4.455) 4.571 18.678 ( 0.219 0.000 1.784) 1.797 18.879 ( -0.442 -0.000 -1.966) 2.015 19.757 ( 3.000 0.000 -2.069) 3.644 20.121 ( 0.217 0.000 4.345) 4.350 20.426 ( 1.883 0.000 3.547) 4.016 ======================= Grid point 63 (36/336) ======================= q-point: (-0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.659 ( 0.000 1.022 -0.000) 1.022 2.046 ( 0.000 8.021 -0.000) 8.021 3.631 ( -0.000 -4.573 0.000) 4.573 5.096 ( 0.000 11.038 -0.000) 11.038 6.312 ( -0.000 -1.335 0.000) 1.335 6.350 ( 0.000 8.320 -0.000) 8.320 6.553 ( -0.000 -1.426 0.000) 1.426 6.786 ( 0.000 7.297 -0.000) 7.297 7.845 ( -0.000 -10.254 0.000) 10.254 7.926 ( 0.000 0.556 -0.000) 0.556 8.056 ( 0.000 0.233 -0.000) 0.233 8.209 ( -0.000 -4.516 0.000) 4.516 8.661 ( -0.000 -1.198 0.000) 1.198 8.773 ( -0.000 -8.165 0.000) 8.165 9.757 ( 0.000 4.036 -0.000) 4.036 10.500 ( 0.000 4.259 -0.000) 4.259 10.644 ( -0.000 -5.515 0.000) 5.515 11.775 ( 0.000 0.856 -0.000) 0.856 14.755 ( -0.000 -2.324 0.000) 2.324 14.923 ( 0.000 0.223 -0.000) 0.223 15.997 ( 0.000 4.608 -0.000) 4.608 16.424 ( 0.000 0.737 -0.000) 0.737 16.559 ( -0.000 -1.840 0.000) 1.840 17.017 ( 0.000 11.946 -0.000) 11.946 17.272 ( -0.000 -12.967 0.000) 12.967 18.680 ( 0.000 0.566 -0.000) 0.566 18.872 ( -0.000 -0.297 0.000) 0.297 19.782 ( 0.000 0.060 -0.000) 0.060 20.111 ( 0.000 4.512 -0.000) 4.512 20.475 ( -0.000 -4.673 0.000) 4.673 ======================= Grid point 125 (37/336) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.168 ( -1.820 -0.000 9.724) 9.893 0.497 ( -3.812 -0.000 23.875) 24.178 0.913 ( -11.989 -0.000 43.646) 45.262 4.033 ( 2.792 0.000 -1.146) 3.018 5.773 ( 4.180 0.000 0.877) 4.271 6.141 ( 2.228 0.000 -6.969) 7.316 7.040 ( -3.348 -0.000 3.618) 4.929 7.147 ( -3.737 -0.000 7.164) 8.080 7.576 ( 7.572 0.000 -4.653) 8.887 7.999 ( -1.226 -0.000 0.146) 1.235 8.304 ( -1.092 -0.000 7.311) 7.392 8.627 ( 7.129 0.000 -4.492) 8.426 8.849 ( 6.275 0.000 3.559) 7.214 9.107 ( 3.074 0.000 -1.463) 3.405 9.799 ( 1.270 0.000 3.753) 3.962 10.508 ( -2.879 -0.000 -5.251) 5.989 10.680 ( -5.451 -0.000 -6.974) 8.851 13.961 ( 62.721 0.000 1.427) 62.738 14.892 ( -3.631 -0.000 -8.240) 9.004 15.019 ( -4.055 -0.000 3.128) 5.121 15.434 ( 1.425 0.000 -0.634) 1.560 15.533 ( -63.139 -0.000 6.852) 63.509 15.851 ( 42.153 0.000 -1.997) 42.200 16.957 ( -1.224 -0.000 -0.614) 1.369 17.799 ( 0.893 0.000 3.764) 3.868 18.584 ( -1.167 -0.000 -0.287) 1.202 18.952 ( -0.256 -0.000 0.972) 1.005 19.629 ( 0.908 0.000 -6.175) 6.241 19.827 ( 0.689 0.000 2.719) 2.805 20.151 ( -25.891 -0.000 0.423) 25.895 ======================= Grid point 126 (38/336) ======================= q-point: ( 0.09 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.708 ( 6.066 -45.316 7.311) 46.301 0.982 ( 8.456 -6.753 29.663) 31.575 1.334 ( 48.775 -9.900 12.947) 51.426 4.074 ( 0.758 -1.737 -0.211) 1.907 5.870 ( 1.449 -2.560 3.265) 4.395 6.189 ( 5.089 -1.732 -6.581) 8.497 7.029 ( -1.704 8.354 3.408) 9.182 7.125 ( 1.290 0.324 2.917) 3.206 7.616 ( -0.026 1.537 -0.908) 1.786 8.001 ( -2.129 -7.398 -0.495) 7.714 8.252 ( -3.980 1.102 4.577) 6.165 8.642 ( 0.129 2.473 0.047) 2.477 9.083 ( 1.403 5.460 0.134) 5.639 9.289 ( 22.201 3.387 -10.644) 24.853 9.908 ( -0.173 -15.433 -2.004) 15.564 10.451 ( 0.447 2.516 -8.376) 8.757 10.535 ( -2.880 2.630 -11.168) 11.830 12.867 ( -54.278 30.320 49.485) 79.461 15.015 ( 8.483 1.725 -3.813) 9.459 15.064 ( -8.970 -16.591 1.041) 18.889 15.460 ( 5.536 0.871 -0.064) 5.604 15.632 ( 11.180 -7.676 3.880) 14.105 16.600 ( 25.437 26.196 -14.569) 39.314 17.116 ( 7.234 -20.765 -15.462) 26.881 17.826 ( 0.074 0.516 4.588) 4.618 18.545 ( -2.931 -0.070 -1.325) 3.217 19.003 ( 3.258 -1.404 1.518) 3.858 19.606 ( -0.613 -0.176 -6.009) 6.042 19.855 ( 2.533 0.181 3.198) 4.084 20.171 ( 8.658 -8.877 -17.123) 21.142 ======================= Grid point 127 (39/336) ======================= q-point: ( 0.18 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.226 ( 7.579 -26.186 12.305) 29.910 1.365 ( 12.841 -15.884 17.373) 26.815 2.460 ( 52.797 -19.398 3.110) 56.334 4.082 ( -1.736 -1.004 0.523) 2.072 5.891 ( -1.187 2.413 5.399) 6.032 6.271 ( 5.117 -1.266 -6.683) 8.512 6.917 ( -1.638 7.977 0.760) 8.179 7.141 ( 0.273 3.018 2.494) 3.924 7.556 ( -3.888 1.495 -0.747) 4.232 8.034 ( -2.128 -5.203 0.756) 5.672 8.176 ( -4.621 1.156 -0.927) 4.853 8.655 ( 3.558 3.486 6.806) 8.434 9.009 ( -6.878 -1.202 1.775) 7.204 9.481 ( 8.315 2.904 -6.730) 11.084 10.002 ( -2.622 -11.359 -3.537) 12.182 10.357 ( 3.437 10.027 -12.534) 16.415 10.507 ( 3.859 -1.599 -9.049) 9.967 12.182 ( -28.291 12.798 37.202) 48.458 15.086 ( -0.430 -7.783 2.472) 8.177 15.148 ( 7.086 0.869 -5.583) 9.063 15.611 ( 9.313 -6.248 -0.205) 11.217 15.919 ( 11.303 -4.983 6.477) 13.947 16.539 ( 1.030 15.370 -4.274) 15.986 17.219 ( -2.688 -6.573 -5.753) 9.139 17.825 ( -1.766 1.297 4.762) 5.242 18.477 ( -3.514 0.073 -2.814) 4.503 19.077 ( 2.716 -0.103 4.463) 5.226 19.546 ( -3.647 -0.985 -6.419) 7.448 19.933 ( 2.957 -1.889 3.824) 5.190 20.252 ( 7.554 1.969 -23.160) 24.440 ======================= Grid point 128 (40/336) ======================= q-point: ( 0.27 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( 6.390 -16.951 11.094) 21.242 1.858 ( 17.130 -16.926 8.015) 25.381 3.553 ( 44.892 -22.700 1.122) 50.317 4.021 ( -5.559 1.598 1.125) 5.893 5.842 ( -2.465 4.752 5.005) 7.329 6.314 ( 2.831 1.058 -6.986) 7.611 6.853 ( 1.105 3.348 -0.678) 3.591 7.086 ( -2.804 7.277 3.212) 8.434 7.469 ( -4.474 -0.509 -1.321) 4.692 7.999 ( -1.654 6.518 -2.746) 7.264 8.087 ( -5.328 -6.055 -0.898) 8.115 8.743 ( 4.897 5.969 10.382) 12.938 8.906 ( -6.815 -4.201 0.730) 8.039 9.473 ( -4.492 -1.772 -7.423) 8.856 10.036 ( -0.022 -4.559 -3.305) 5.631 10.330 ( 9.265 8.368 -6.906) 14.267 10.566 ( 3.425 -3.395 -7.128) 8.606 11.820 ( -18.819 7.281 24.234) 31.535 15.181 ( -1.935 -13.355 -4.278) 14.156 15.229 ( 10.926 9.419 1.593) 14.513 15.887 ( 11.846 -9.029 -1.294) 14.951 16.163 ( 9.028 -0.308 6.754) 11.279 16.375 ( -4.081 8.305 0.024) 9.253 17.176 ( -5.825 -5.050 0.932) 7.765 17.777 ( -4.337 2.007 4.644) 6.664 18.400 ( -2.947 0.349 -3.558) 4.633 19.146 ( 2.909 0.930 6.193) 6.905 19.440 ( -5.970 -1.438 -6.576) 8.998 19.998 ( 0.987 -0.167 -0.676) 1.208 20.247 ( 7.420 4.079 -17.384) 19.336 ======================= Grid point 129 (41/336) ======================= q-point: ( 0.36 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.855 ( 1.956 -9.025 6.551) 11.322 2.363 ( 19.268 -14.499 3.061) 24.308 3.831 ( -12.186 4.516 1.236) 13.054 4.485 ( 32.162 -22.950 0.786) 39.519 5.794 ( 1.739 5.425 3.423) 6.647 6.289 ( 0.507 3.314 -6.968) 7.732 6.854 ( -3.767 4.559 1.355) 6.067 6.942 ( -3.367 2.750 1.568) 4.621 7.399 ( -2.065 1.021 -0.704) 2.409 7.856 ( -4.540 5.845 -5.371) 9.145 8.110 ( 1.505 -5.982 -1.323) 6.309 8.708 ( -3.205 5.864 -0.009) 6.683 8.921 ( 1.444 0.173 6.977) 7.127 9.345 ( -7.125 -3.051 -5.153) 9.308 10.035 ( 1.658 1.479 -10.643) 10.872 10.462 ( 8.831 1.527 8.611) 12.428 10.616 ( 2.627 -3.822 -9.267) 10.363 11.566 ( -13.907 4.160 15.726) 21.401 15.219 ( 1.535 -1.623 -4.483) 5.009 15.391 ( 8.732 -2.718 1.821) 9.325 16.050 ( -1.448 1.580 1.250) 2.481 16.262 ( 3.382 4.051 0.940) 5.360 16.379 ( 5.743 -5.693 8.056) 11.414 17.143 ( -3.870 -5.502 0.727) 6.766 17.673 ( -7.259 2.323 4.183) 8.694 18.346 ( -0.877 0.273 -2.384) 2.555 19.217 ( 2.867 1.614 5.483) 6.394 19.314 ( -5.872 -1.403 -5.581) 8.222 19.954 ( 0.762 4.711 -10.470) 11.506 20.309 ( 6.544 -0.503 -5.199) 8.373 ======================= Grid point 130 (42/336) ======================= q-point: ( 0.45 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.923 ( -0.948 0.219 2.674) 2.845 2.813 ( 14.665 -11.166 -1.520) 18.494 3.521 ( -16.140 4.789 1.617) 16.913 5.078 ( 11.162 -14.150 1.292) 18.069 5.865 ( 6.613 2.321 0.468) 7.024 6.219 ( 1.263 4.388 -3.953) 6.040 6.595 ( -10.866 7.712 0.584) 13.337 6.972 ( -0.242 -3.456 0.310) 3.478 7.387 ( 0.351 -0.337 -0.804) 0.940 7.715 ( -1.311 3.605 -4.504) 5.916 8.206 ( 3.848 -2.389 -3.444) 5.690 8.608 ( -0.721 3.426 -2.248) 4.161 8.895 ( -7.532 -1.481 -0.939) 7.733 9.307 ( 4.148 3.239 3.317) 6.221 9.985 ( 1.387 2.454 -12.864) 13.169 10.551 ( -4.524 -2.143 5.782) 7.648 10.732 ( 11.306 -1.072 -2.939) 11.731 11.391 ( -10.495 0.066 12.389) 16.237 15.240 ( 1.800 -0.163 -3.078) 3.569 15.580 ( 6.728 -5.015 -0.129) 8.393 15.953 ( -4.717 3.170 2.959) 6.408 16.254 ( -2.848 3.102 11.897) 12.620 16.577 ( 4.937 -4.633 0.777) 6.815 17.142 ( -1.744 -4.522 -2.645) 5.522 17.525 ( -7.869 1.739 2.600) 8.468 18.351 ( 1.867 -0.299 0.589) 1.981 19.164 ( -6.030 -1.905 -6.489) 9.061 19.314 ( 4.342 3.019 4.948) 7.243 19.884 ( 3.174 5.188 -11.935) 13.395 20.415 ( 4.398 -3.045 0.045) 5.349 ======================= Grid point 131 (43/336) ======================= q-point: (-0.45 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -2.357 7.373 0.560) 7.761 2.831 ( -17.923 6.189 -1.071) 18.991 3.429 ( 7.055 -9.052 -2.898) 11.837 5.137 ( -9.923 10.093 4.220) 14.770 5.708 ( -14.671 -2.147 -5.869) 15.946 6.399 ( 6.772 2.101 4.696) 8.504 6.494 ( 12.261 -3.460 -4.727) 13.588 6.970 ( -2.973 -2.921 -0.230) 4.174 7.336 ( -4.123 -0.285 -3.350) 5.321 7.781 ( 9.300 -3.025 -1.354) 9.873 8.192 ( -1.493 5.778 -3.864) 7.110 8.613 ( -0.511 -0.908 -2.722) 2.914 8.748 ( -3.784 -1.033 -4.273) 5.800 9.410 ( 8.108 4.446 3.334) 9.829 9.942 ( 2.695 2.339 -8.573) 9.286 10.474 ( -5.364 -1.412 -4.016) 6.848 10.915 ( 7.506 0.401 3.840) 8.441 11.299 ( -8.618 -3.958 11.974) 15.274 15.257 ( -0.047 -2.261 -2.025) 3.035 15.644 ( -2.823 2.395 -0.201) 3.707 15.919 ( -0.073 -3.412 3.381) 4.804 16.260 ( -0.225 0.196 13.663) 13.667 16.588 ( -5.128 2.552 -0.083) 5.729 17.102 ( -6.063 -2.916 -3.992) 7.823 17.456 ( 1.285 -1.462 -0.242) 1.961 18.414 ( 3.315 -0.600 3.177) 4.631 19.055 ( -4.696 -1.853 -6.185) 7.984 19.384 ( 5.022 2.952 1.395) 5.990 19.866 ( 5.056 4.661 -8.778) 11.150 20.523 ( 3.104 -4.816 2.112) 6.106 ======================= Grid point 132 (44/336) ======================= q-point: (-0.36 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.706 ( -4.961 12.308 1.604) 13.367 2.314 ( -27.176 10.538 -0.029) 29.147 3.658 ( 8.798 -8.167 -7.058) 13.925 4.557 ( -35.065 21.414 4.125) 41.293 5.596 ( -0.931 -3.920 -4.800) 6.267 6.424 ( 1.483 0.344 -1.391) 2.062 6.810 ( 10.987 -3.778 -0.025) 11.618 6.938 ( -4.516 -5.155 0.686) 6.888 7.317 ( 4.321 -2.969 -4.278) 6.767 8.004 ( 7.050 -7.179 0.703) 10.087 8.064 ( 0.514 9.590 -2.897) 10.031 8.490 ( -6.089 1.021 -5.402) 8.204 8.807 ( 7.007 2.386 -1.808) 7.619 9.494 ( 1.783 -2.636 -3.693) 4.875 9.993 ( 8.781 3.947 1.817) 9.797 10.373 ( -3.659 -1.747 -10.307) 11.075 11.012 ( 2.387 1.892 5.032) 5.882 11.255 ( -7.578 -5.107 11.489) 14.680 15.256 ( -5.159 -8.012 -1.462) 9.641 15.498 ( -4.715 10.806 3.252) 12.230 15.955 ( -3.508 -5.561 -1.829) 6.825 16.327 ( -5.557 7.471 8.237) 12.431 16.413 ( -3.716 -2.441 5.218) 6.855 17.016 ( -1.826 -2.937 -4.274) 5.498 17.550 ( 5.246 -3.053 -1.038) 6.158 18.494 ( 3.031 -0.320 4.048) 5.067 18.980 ( -2.783 -1.527 -4.940) 5.872 19.456 ( 5.676 1.112 -2.462) 6.286 19.872 ( 3.724 5.133 -4.792) 7.949 20.644 ( 3.486 -6.023 2.241) 7.311 ======================= Grid point 133 (45/336) ======================= q-point: (-0.27 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( -10.340 14.838 6.565) 19.240 1.710 ( -26.843 13.522 -0.068) 30.056 3.635 ( -46.092 21.067 5.267) 50.952 3.815 ( 5.838 -4.096 -7.654) 10.462 5.632 ( 4.254 -0.317 -4.324) 6.074 6.406 ( -0.949 3.561 -3.368) 4.992 6.929 ( -2.498 -7.894 1.463) 8.408 6.961 ( 1.961 -8.193 -2.820) 8.884 7.469 ( 9.121 2.270 0.846) 9.437 7.945 ( -0.624 3.212 -3.338) 4.674 8.236 ( 6.970 -2.201 4.278) 8.469 8.402 ( 0.064 -2.186 -5.434) 5.857 8.873 ( 6.826 6.665 -2.930) 9.980 9.500 ( -4.704 -9.270 -5.373) 11.701 10.176 ( 9.891 -0.274 4.271) 10.777 10.291 ( 1.287 1.404 -12.463) 12.608 11.008 ( -0.292 6.646 1.692) 6.864 11.230 ( -7.431 -6.139 14.731) 17.604 15.181 ( -14.484 -12.824 -0.238) 19.347 15.369 ( 3.576 14.638 2.901) 15.345 15.864 ( -8.175 -1.787 -5.184) 9.844 16.005 ( -16.107 10.299 3.756) 19.484 16.547 ( 3.692 -6.549 5.919) 9.568 17.083 ( 5.673 -4.728 -2.210) 7.709 17.656 ( 3.878 -2.208 -0.509) 4.492 18.558 ( 1.984 -0.006 3.589) 4.101 18.939 ( -1.157 -1.134 -3.201) 3.587 19.541 ( 5.841 -0.572 -4.884) 7.636 19.846 ( 0.627 5.009 -1.561) 5.284 20.780 ( 4.418 -5.842 0.310) 7.331 ======================= Grid point 134 (46/336) ======================= q-point: (-0.18 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( -23.053 17.116 0.796) 28.724 1.128 ( -15.135 14.930 15.247) 26.162 2.577 ( -52.916 20.645 9.058) 57.519 3.905 ( 4.807 -1.805 -5.720) 7.687 5.699 ( 6.697 3.120 -4.258) 8.527 6.300 ( -2.628 5.583 -6.168) 8.725 6.995 ( -1.678 -11.889 3.099) 12.401 7.081 ( 2.119 -10.005 -2.027) 10.426 7.517 ( 3.367 11.220 1.940) 11.874 7.951 ( 3.144 -0.179 -1.999) 3.730 8.291 ( -0.997 0.775 4.676) 4.844 8.507 ( 5.218 -6.760 -4.321) 9.571 8.926 ( 7.974 4.748 -3.845) 10.045 9.459 ( -11.157 -15.448 -5.166) 19.743 10.146 ( -2.641 0.668 -24.850) 24.999 10.469 ( 13.340 1.311 9.017) 16.155 10.884 ( -2.147 13.238 -1.204) 13.465 11.290 ( -0.141 -5.806 27.107) 27.722 15.032 ( -12.965 -9.692 -0.233) 16.189 15.335 ( 3.748 11.128 2.327) 11.971 15.647 ( -12.095 9.893 1.273) 15.678 15.704 ( -8.248 0.169 -2.901) 8.745 16.682 ( -0.765 -11.564 1.062) 11.638 17.219 ( 5.420 -2.473 -5.644) 8.207 17.725 ( 2.132 -1.042 0.586) 2.444 18.596 ( 0.742 0.194 2.448) 2.565 18.930 ( 0.137 -0.736 -0.827) 1.115 19.617 ( 4.485 -0.724 -6.884) 8.248 19.799 ( -0.970 2.887 1.570) 3.426 20.894 ( 3.240 -4.243 -5.789) 7.875 ======================= Grid point 135 (47/336) ======================= q-point: (-0.09 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.567 ( -16.261 25.212 2.035) 30.070 0.820 ( -16.421 9.944 26.210) 32.489 1.479 ( -53.862 17.317 18.769) 59.609 3.978 ( 4.336 -0.351 -2.722) 5.131 5.757 ( 7.724 8.885 -4.474) 12.595 6.184 ( -0.971 3.988 -7.328) 8.399 7.107 ( -1.917 -11.683 5.760) 13.166 7.162 ( -3.834 -7.761 -4.697) 9.848 7.469 ( 4.746 9.895 3.024) 11.383 7.993 ( 1.404 -0.158 0.380) 1.463 8.272 ( -2.030 0.741 3.648) 4.240 8.604 ( 1.967 -4.161 -5.595) 7.245 9.027 ( 7.053 0.697 -3.252) 7.798 9.253 ( -31.288 -18.619 -16.348) 39.911 9.902 ( 0.742 20.784 -16.186) 26.354 10.599 ( -3.405 -0.554 -2.173) 4.077 10.759 ( -0.390 3.862 0.615) 3.930 11.869 ( 48.582 -11.128 61.629) 79.261 14.931 ( -8.427 -10.817 -2.253) 13.896 15.242 ( -0.646 19.340 3.759) 19.712 15.446 ( -2.439 2.181 -1.303) 3.522 15.608 ( -0.267 0.651 0.957) 1.188 16.683 ( -23.240 -25.179 -12.827) 36.587 17.158 ( -2.634 16.371 -16.213) 23.191 17.765 ( 1.178 -0.373 2.186) 2.511 18.602 ( -0.530 0.431 0.841) 1.083 18.947 ( 0.774 -0.212 1.330) 1.553 19.639 ( 1.637 0.296 -7.059) 7.252 19.793 ( 0.084 -0.977 3.078) 3.231 20.816 ( -12.677 2.139 -23.763) 27.017 ======================= Grid point 137 (48/336) ======================= q-point: ( 0.09 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.813 ( 22.512 0.000 9.559) 24.458 1.254 ( 12.383 0.000 23.854) 26.877 2.288 ( 55.042 0.000 3.612) 55.161 4.065 ( -0.702 -0.000 -0.361) 0.789 5.917 ( 0.317 0.000 6.486) 6.494 6.254 ( 5.751 0.000 -6.382) 8.591 7.057 ( -3.227 -0.000 0.186) 3.232 7.094 ( -1.559 -0.000 1.620) 2.248 7.659 ( 0.378 0.000 2.857) 2.882 7.901 ( -2.617 -0.000 -0.523) 2.668 8.205 ( -2.815 -0.000 -1.768) 3.324 8.691 ( 2.944 0.000 7.405) 7.968 8.964 ( -13.170 -0.000 1.459) 13.251 9.567 ( 8.672 0.000 -15.227) 17.523 9.852 ( 2.047 0.000 5.762) 6.115 10.459 ( 2.180 0.000 -7.495) 7.806 10.489 ( 4.229 0.000 -18.333) 18.815 12.332 ( -37.937 -0.000 42.550) 57.007 14.934 ( -0.881 -0.000 -1.064) 1.381 15.227 ( 15.642 0.000 -3.822) 16.102 15.533 ( 3.101 0.000 1.643) 3.509 15.861 ( 14.313 0.000 5.549) 15.351 16.757 ( -8.428 -0.000 -0.919) 8.478 17.102 ( 5.324 0.000 -14.073) 15.046 17.837 ( -1.722 -0.000 4.929) 5.221 18.478 ( -3.389 -0.000 -2.606) 4.275 19.073 ( 3.643 0.000 3.397) 4.981 19.536 ( -3.764 -0.000 -6.683) 7.670 19.915 ( 3.212 0.000 3.858) 5.020 20.272 ( 11.244 0.000 -22.442) 25.102 ======================= Grid point 138 (49/336) ======================= q-point: ( 0.18 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( 21.831 -9.162 10.331) 25.832 1.640 ( 18.377 -5.626 13.627) 23.560 3.258 ( 47.629 -7.540 0.412) 48.224 4.032 ( -3.544 -0.059 -0.226) 3.552 5.906 ( -3.147 1.787 4.689) 5.924 6.317 ( 4.030 -0.271 -6.388) 7.558 6.951 ( -1.850 6.290 -2.210) 6.919 7.112 ( -1.719 -4.751 1.057) 5.162 7.589 ( -2.069 11.626 3.905) 12.438 7.928 ( -1.983 -9.031 1.376) 9.348 8.124 ( -2.099 4.182 -6.321) 7.864 8.716 ( -17.803 -9.466 0.301) 20.165 8.820 ( 6.597 1.923 13.774) 15.393 9.533 ( -1.575 4.114 -9.888) 10.825 9.958 ( 4.156 -2.679 4.512) 6.694 10.445 ( 2.725 2.758 -7.423) 8.374 10.520 ( 6.454 -0.971 -16.927) 18.142 11.934 ( -24.277 3.596 29.844) 38.639 14.959 ( 0.122 -6.966 -2.256) 7.323 15.441 ( 12.966 11.454 -1.289) 17.348 15.682 ( 9.342 -11.590 -0.520) 14.895 16.140 ( 12.267 -0.802 6.614) 13.959 16.558 ( -7.970 7.138 -0.748) 10.726 17.077 ( -4.670 -4.147 -3.275) 7.052 17.803 ( -4.369 0.681 4.722) 6.469 18.406 ( -2.814 0.217 -3.290) 4.334 19.158 ( 3.727 0.279 5.584) 6.719 19.418 ( -6.103 -0.705 -6.929) 9.260 19.999 ( 3.608 0.159 3.885) 5.305 20.310 ( 6.077 1.990 -21.595) 22.522 ======================= Grid point 139 (50/336) ======================= q-point: ( 0.27 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( 17.486 0.746 10.228) 20.272 2.129 ( 22.120 -9.977 4.803) 24.737 3.898 ( -7.731 2.434 -1.219) 8.196 4.118 ( 33.810 -13.991 0.095) 36.591 5.847 ( -2.347 0.832 1.569) 2.943 6.336 ( 1.784 1.467 -6.037) 6.464 6.875 ( -1.430 1.506 -3.573) 4.133 7.091 ( -3.083 5.049 3.183) 6.718 7.456 ( -2.504 8.027 2.448) 8.757 7.921 ( -6.617 -1.402 -2.909) 7.363 8.044 ( 2.101 1.414 -2.336) 3.445 8.568 ( -13.330 -17.632 -0.997) 22.126 8.966 ( 4.595 5.029 11.705) 13.542 9.404 ( -0.995 5.994 -4.952) 7.839 10.053 ( 3.481 0.446 -2.381) 4.241 10.463 ( 1.092 -1.484 4.155) 4.545 10.568 ( 7.047 -0.857 -16.870) 18.302 11.643 ( -17.509 3.346 18.983) 26.041 15.033 ( -0.123 -9.974 -3.206) 10.478 15.512 ( 7.685 8.680 1.860) 11.742 15.985 ( 11.017 -7.410 -3.195) 13.656 16.339 ( 5.961 0.743 8.832) 10.681 16.368 ( -4.614 6.072 0.920) 7.681 17.033 ( -3.287 -5.400 -1.522) 6.502 17.708 ( -7.533 1.272 4.095) 8.668 18.353 ( -1.078 0.365 -2.433) 2.686 19.243 ( 1.301 1.163 2.647) 3.170 19.288 ( -3.474 -1.251 -2.896) 4.693 20.044 ( 2.137 4.001 -1.236) 4.701 20.300 ( 4.021 -0.470 -14.035) 14.608 ======================= Grid point 140 (51/336) ======================= q-point: ( 0.36 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.041 ( 13.578 10.649 7.275) 18.727 2.620 ( 20.889 -8.745 -0.828) 22.661 3.625 ( -16.378 5.351 -1.828) 17.326 4.769 ( 21.248 -15.601 0.172) 26.361 5.848 ( -0.478 -3.635 -0.864) 3.767 6.302 ( 1.230 3.557 -5.770) 6.889 6.755 ( -11.112 4.291 1.265) 11.978 6.980 ( 1.163 8.337 0.890) 8.465 7.390 ( -1.427 1.022 -0.035) 1.756 7.782 ( -4.360 2.547 -3.066) 5.908 8.126 ( 5.316 -4.304 -2.344) 7.230 8.534 ( -7.937 -13.968 -1.044) 16.100 8.914 ( -5.328 6.964 -1.098) 8.836 9.426 ( 9.059 6.958 5.896) 12.855 10.038 ( 0.699 2.771 -10.548) 10.928 10.495 ( -3.766 -2.970 5.779) 7.510 10.686 ( 9.834 -3.486 -6.125) 12.098 11.415 ( -12.994 1.914 11.858) 17.695 15.096 ( -2.764 -10.447 -3.218) 11.275 15.594 ( 6.965 2.997 2.421) 7.960 16.052 ( -0.678 6.509 -0.749) 6.587 16.312 ( -2.926 2.276 8.833) 9.579 16.489 ( 6.968 -3.915 3.979) 8.928 17.049 ( 0.589 -4.721 -5.679) 7.408 17.554 ( -9.622 1.170 2.765) 10.080 18.349 ( 1.636 0.073 0.013) 1.638 19.132 ( -6.080 -1.340 -6.864) 9.267 19.368 ( 5.333 2.383 6.343) 8.623 20.001 ( 2.603 6.580 -8.322) 10.923 20.344 ( 2.196 -4.248 -3.464) 5.904 ======================= Grid point 141 (52/336) ======================= q-point: (-0.55 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( 9.301 18.570 3.337) 21.035 2.936 ( 2.826 3.318 -3.901) 5.849 3.301 ( -6.691 -2.842 -3.412) 8.030 5.157 ( 9.573 -6.899 1.201) 11.861 5.684 ( -22.808 -0.829 -3.729) 23.126 6.394 ( 11.444 -5.045 -4.221) 13.199 6.541 ( -2.121 9.298 5.848) 11.187 6.954 ( 0.184 2.500 -1.684) 3.020 7.334 ( -4.309 -0.061 -3.164) 5.347 7.747 ( 3.607 -0.267 -0.988) 3.749 8.236 ( 2.769 -1.667 -2.462) 4.063 8.556 ( -0.747 -9.870 -0.596) 9.916 8.722 ( -6.869 4.980 -4.433) 9.572 9.548 ( 8.351 7.879 2.088) 11.670 9.972 ( 0.053 0.531 -8.998) 9.014 10.455 ( -3.344 -0.114 0.848) 3.452 10.868 ( 5.271 -4.634 2.506) 7.453 11.262 ( -7.930 -0.227 8.729) 11.795 15.098 ( -6.918 -10.792 -2.398) 13.041 15.711 ( 6.154 0.441 0.698) 6.209 15.956 ( -1.541 8.309 2.043) 8.694 16.276 ( -3.507 1.142 14.135) 14.608 16.609 ( 0.812 -0.325 0.716) 1.130 17.046 ( -2.731 -2.487 -8.014) 8.824 17.423 ( -3.737 -1.863 0.011) 4.176 18.406 ( 3.760 -0.168 2.502) 4.519 19.022 ( -4.418 -1.563 -6.280) 7.835 19.449 ( 4.425 3.659 2.728) 6.357 19.973 ( 5.591 6.102 -7.688) 11.296 20.413 ( 0.359 -6.377 1.575) 6.578 ======================= Grid point 142 (53/336) ======================= q-point: (-0.45 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( -0.761 19.980 1.199) 20.031 2.578 ( -16.942 16.983 -3.810) 24.289 3.483 ( 11.021 -9.745 -6.906) 16.251 4.939 ( -32.668 16.525 1.608) 36.645 5.474 ( 3.124 -8.169 -2.220) 9.024 6.431 ( -0.532 0.834 -0.186) 1.006 6.738 ( 8.715 -5.561 3.514) 10.919 6.913 ( 0.571 3.742 -2.091) 4.324 7.264 ( 1.253 -1.911 -5.582) 6.032 7.872 ( 5.350 -5.937 -0.335) 7.999 8.221 ( 0.589 5.168 -1.743) 5.486 8.536 ( -5.115 4.677 -2.795) 7.473 8.716 ( 5.022 -9.984 -0.733) 11.200 9.539 ( 0.204 5.706 -9.095) 10.739 9.984 ( 0.838 -5.150 -1.409) 5.405 10.411 ( 2.200 5.233 -2.164) 6.075 10.937 ( -5.880 -6.641 7.884) 11.867 11.237 ( 1.159 1.071 5.817) 6.027 15.042 ( -10.223 -11.681 -2.077) 15.662 15.755 ( 3.262 9.983 -0.325) 10.507 15.878 ( -3.087 0.793 3.390) 4.653 16.325 ( 0.352 -2.944 11.712) 12.082 16.497 ( -10.124 6.438 3.657) 12.543 16.962 ( -2.127 -2.247 -9.046) 9.561 17.471 ( 3.769 -5.211 -1.634) 6.636 18.492 ( 3.933 0.200 3.602) 5.337 18.949 ( -2.510 -1.541 -5.063) 5.858 19.490 ( 3.983 2.481 -2.247) 5.203 19.990 ( 5.167 6.785 -4.049) 9.441 20.505 ( 1.216 -8.103 3.477) 8.901 ======================= Grid point 143 (54/336) ======================= q-point: (-0.36 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -20.729 11.672 3.770) 24.086 2.131 ( -7.156 26.846 -5.192) 28.264 3.703 ( 8.113 -6.746 -7.527) 12.961 4.086 ( -40.085 23.390 3.559) 46.547 5.618 ( 7.607 -1.140 -1.319) 7.805 6.440 ( 0.849 -0.072 0.302) 0.904 6.786 ( -5.402 -6.793 0.809) 8.717 6.890 ( -0.594 0.955 -4.318) 4.462 7.446 ( 14.454 -3.177 -0.668) 14.814 7.964 ( -1.091 -2.922 -1.065) 3.296 8.231 ( 6.774 1.864 -1.803) 7.253 8.411 ( -3.685 3.349 -0.234) 4.985 8.887 ( 5.028 -5.337 -0.010) 7.333 9.410 ( -5.064 0.671 -11.572) 12.649 10.041 ( -2.352 -10.908 -3.953) 11.839 10.428 ( 8.127 8.487 -2.606) 12.036 10.918 ( -8.843 -9.641 12.295) 17.953 11.280 ( 4.305 6.247 4.153) 8.649 14.947 ( -11.484 -11.254 -2.353) 16.250 15.682 ( 3.602 15.959 2.956) 16.625 15.820 ( -5.300 -1.754 -1.976) 5.922 16.148 ( -19.056 3.868 2.429) 19.595 16.469 ( 3.015 -0.314 8.821) 9.328 16.981 ( 3.941 -5.381 -5.401) 8.582 17.589 ( 3.936 -4.941 -1.030) 6.401 18.564 ( 2.664 0.681 3.351) 4.334 18.914 ( -0.930 -1.397 -3.360) 3.756 19.538 ( 4.917 0.357 -5.121) 7.108 19.963 ( 0.431 6.809 -1.182) 6.924 20.645 ( 3.940 -7.860 2.486) 9.137 ======================= Grid point 144 (55/336) ======================= q-point: (-0.27 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.193 ( -27.301 6.123 9.497) 29.547 1.702 ( -10.899 27.551 -2.050) 29.700 3.129 ( -36.925 34.984 6.544) 51.285 3.850 ( 5.891 -3.977 -5.504) 8.989 5.752 ( 9.064 2.283 -1.954) 9.549 6.419 ( -0.111 5.448 -2.749) 6.104 6.784 ( -4.200 -9.732 2.347) 10.856 6.892 ( 0.268 -7.994 -4.294) 9.078 7.678 ( 8.348 4.630 3.606) 10.204 7.937 ( 0.498 -0.534 -4.007) 4.073 8.337 ( -2.762 1.680 2.998) 4.409 8.364 ( 5.574 -5.456 -2.505) 8.192 8.986 ( 3.132 -0.377 0.468) 3.189 9.254 ( -8.900 -4.077 -9.630) 13.732 10.077 ( -0.216 -8.489 -10.389) 13.418 10.489 ( 4.121 0.270 -3.223) 5.239 10.929 ( -5.948 -6.479 10.642) 13.806 11.335 ( 9.060 9.316 11.893) 17.616 14.843 ( -9.220 -9.064 -3.300) 13.344 15.626 ( 6.201 16.610 3.192) 18.015 15.710 ( -5.811 0.237 -3.496) 6.785 15.778 ( -18.306 3.937 2.552) 18.897 16.516 ( -3.708 -3.977 1.951) 5.777 17.128 ( 6.519 -6.646 -1.781) 9.478 17.685 ( 2.552 -3.316 0.128) 4.186 18.604 ( 1.127 0.730 2.398) 2.748 18.911 ( 0.276 -1.193 -1.067) 1.625 19.604 ( 5.055 -0.499 -6.628) 8.350 19.878 ( -2.910 5.119 1.056) 5.982 20.792 ( 3.864 -6.100 -1.996) 7.492 ======================= Grid point 145 (56/336) ======================= q-point: (-0.18 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( -22.351 3.915 17.487) 28.648 1.212 ( -18.369 20.045 12.786) 30.045 2.185 ( -25.420 50.812 7.486) 57.307 3.957 ( 5.046 -1.962 -1.808) 5.708 5.881 ( 9.442 2.878 -4.453) 10.829 6.333 ( 1.990 9.720 -6.970) 12.125 6.851 ( -2.388 -13.062 3.428) 13.714 6.970 ( -2.027 -10.420 -1.322) 10.697 7.676 ( 1.335 10.132 3.437) 10.782 7.977 ( 2.230 -1.443 -1.569) 3.085 8.293 ( -3.189 0.774 4.231) 5.354 8.485 ( 3.133 -6.917 -4.591) 8.873 8.987 ( -11.363 -5.431 3.027) 12.953 9.112 ( 1.387 3.072 -7.054) 7.818 10.102 ( 4.779 0.501 -14.681) 15.447 10.517 ( -3.035 -7.838 -5.749) 10.183 10.851 ( -7.582 3.151 -0.330) 8.217 11.682 ( 23.501 -4.608 36.567) 43.711 14.786 ( -1.992 -5.496 -5.415) 7.969 15.462 ( -15.219 0.233 3.699) 15.663 15.597 ( 2.899 11.077 1.049) 11.498 15.644 ( 5.891 7.318 -0.567) 9.412 16.385 ( -17.756 -5.971 -5.320) 19.474 17.272 ( 5.255 -1.770 -4.155) 6.929 17.747 ( 1.400 -1.738 1.558) 2.722 18.612 ( -0.319 0.651 1.111) 1.327 18.936 ( 1.124 -0.939 1.623) 2.186 19.647 ( 2.651 0.417 -7.371) 7.845 19.799 ( -2.177 2.071 3.016) 4.257 20.825 ( -3.223 -1.753 -13.202) 13.703 ======================= Grid point 146 (57/336) ======================= q-point: (-0.09 0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.609 ( 14.321 13.015 18.596) 26.838 0.934 ( -7.861 8.289 36.649) 38.388 1.347 ( -8.782 62.930 5.308) 63.761 4.049 ( 3.740 -0.021 0.458) 3.768 5.936 ( 1.705 5.058 -8.420) 9.969 6.219 ( -0.192 8.424 -9.749) 12.886 6.948 ( -2.654 -10.598 5.681) 12.314 7.022 ( 1.649 -7.097 1.967) 7.547 7.644 ( 1.491 6.779 2.545) 7.393 8.041 ( 4.386 1.515 1.718) 4.947 8.261 ( -2.121 -2.275 5.088) 5.963 8.580 ( 4.717 -4.456 -4.239) 7.751 8.828 ( -1.589 -1.271 3.748) 4.265 9.153 ( 5.686 4.149 -0.538) 7.059 10.068 ( 4.953 13.726 -13.537) 19.904 10.483 ( -3.854 -5.481 -7.868) 10.335 10.656 ( -8.351 1.050 -3.956) 9.299 12.598 ( 14.168 -53.617 51.883) 75.943 14.861 ( 10.482 -1.046 -7.995) 13.224 15.300 ( -6.547 -5.316 5.171) 9.892 15.572 ( 5.125 9.714 2.190) 11.199 15.741 ( -14.170 7.040 0.255) 15.825 15.936 ( 7.541 10.616 -13.569) 18.807 17.270 ( 2.945 11.349 -10.651) 15.840 17.790 ( 0.897 -0.970 3.385) 3.634 18.591 ( -1.590 0.498 -0.245) 1.684 18.973 ( 1.200 0.461 2.425) 2.745 19.630 ( 0.277 0.753 -5.010) 5.074 19.796 ( 1.158 -0.021 2.522) 2.775 20.494 ( -14.866 16.037 -22.750) 31.555 ======================= Grid point 149 (58/336) ======================= q-point: ( 0.18 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( 27.616 0.000 10.566) 29.569 2.006 ( 20.514 0.000 6.729) 21.590 3.931 ( -8.126 -0.000 -1.395) 8.245 3.971 ( 36.200 0.000 -1.003) 36.213 5.851 ( -4.623 -0.000 0.609) 4.663 6.349 ( 2.657 0.000 -5.161) 5.804 6.904 ( -5.587 -0.000 -4.545) 7.203 7.105 ( 4.026 0.000 -0.182) 4.030 7.633 ( -4.741 -0.000 7.707) 9.048 7.846 ( -2.601 -0.000 0.937) 2.765 8.117 ( 1.969 0.000 -7.886) 8.128 8.307 ( -18.656 -0.000 -0.628) 18.666 9.021 ( 5.557 0.000 14.383) 15.419 9.476 ( -1.053 -0.000 -5.578) 5.676 10.056 ( 4.818 0.000 1.090) 4.939 10.440 ( -1.449 -0.000 2.135) 2.580 10.564 ( 7.525 0.000 -20.007) 21.375 11.678 ( -19.059 -0.000 20.426) 27.937 14.929 ( 0.908 0.000 -2.669) 2.819 15.628 ( 0.318 0.000 3.549) 3.563 15.875 ( 20.407 0.000 -5.608) 21.164 16.350 ( 6.291 0.000 9.289) 11.219 16.443 ( -7.441 -0.000 0.103) 7.442 16.971 ( -2.434 -0.000 -2.746) 3.670 17.720 ( -7.665 -0.000 4.148) 8.715 18.357 ( -1.168 -0.000 -2.442) 2.707 19.263 ( -6.945 -0.000 -7.219) 10.017 19.267 ( 5.212 0.000 6.837) 8.597 20.086 ( 3.208 0.000 4.865) 5.827 20.294 ( 2.279 0.000 -20.084) 20.213 ======================= Grid point 150 (59/336) ======================= q-point: ( 0.27 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( 22.654 11.434 8.358) 26.717 2.463 ( 23.082 -8.206 2.137) 24.591 3.703 ( -15.086 2.268 -3.811) 15.724 4.541 ( 24.971 -6.715 -0.973) 25.876 5.773 ( -5.294 -2.784 -2.472) 6.472 6.361 ( 1.768 2.110 -3.512) 4.462 6.749 ( -9.178 -1.492 -5.628) 10.869 7.183 ( 5.981 5.700 -1.153) 8.342 7.496 ( -6.147 11.597 5.987) 14.426 7.771 ( -8.091 -5.049 1.832) 9.712 8.079 ( 1.353 0.106 -2.726) 3.045 8.222 ( -2.700 -13.712 -3.129) 14.321 9.046 ( -4.748 4.399 1.954) 6.761 9.530 ( 8.882 3.214 4.788) 10.589 10.077 ( -0.848 0.959 -8.278) 8.377 10.457 ( -1.024 -0.817 10.862) 10.940 10.619 ( 7.502 -2.499 -14.227) 16.277 11.447 ( -14.420 1.007 11.988) 18.780 14.940 ( -1.605 -4.559 -2.636) 5.505 15.636 ( 0.774 1.159 4.015) 4.250 16.157 ( 10.946 3.119 -4.892) 12.388 16.335 ( -3.444 0.533 1.843) 3.943 16.443 ( 0.630 -0.965 13.207) 13.257 16.978 ( 3.858 -2.201 -8.279) 9.395 17.568 ( -10.810 0.344 2.970) 11.216 18.351 ( 1.476 0.096 -0.267) 1.503 19.114 ( -6.083 -0.490 -7.094) 9.358 19.401 ( 6.376 0.911 6.910) 9.446 20.121 ( 1.694 5.321 -0.954) 5.666 20.258 ( 0.805 -4.298 -10.841) 11.690 ======================= Grid point 151 (60/336) ======================= q-point: ( 0.36 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.497 ( 14.626 17.878 4.601) 23.552 2.922 ( 20.478 -4.225 -1.411) 20.957 3.334 ( -18.551 4.533 -6.018) 20.022 4.986 ( 17.086 -8.528 -0.249) 19.097 5.617 ( -19.007 -5.604 -3.761) 20.170 6.356 ( 3.990 1.726 -4.089) 5.969 6.614 ( -4.425 -2.308 -2.103) 5.416 7.149 ( 3.142 15.994 1.226) 16.346 7.341 ( -5.005 1.819 -0.743) 5.377 7.741 ( -0.663 -2.073 2.930) 3.649 8.164 ( 4.789 -5.646 -2.088) 7.693 8.305 ( -1.243 -12.265 -0.750) 12.351 8.869 ( -6.641 7.471 -2.602) 10.329 9.674 ( 7.634 4.717 0.860) 9.015 9.961 ( -6.340 -1.299 -9.772) 11.721 10.482 ( 0.813 2.838 7.363) 7.933 10.761 ( 6.055 -5.875 -2.495) 8.798 11.269 ( -8.636 0.565 7.134) 11.216 14.916 ( -6.347 -7.164 -2.222) 9.826 15.689 ( 2.911 -1.419 3.488) 4.759 16.144 ( 0.109 9.130 0.880) 9.173 16.293 ( -5.321 0.293 11.479) 12.656 16.581 ( 5.602 -2.207 2.894) 6.680 17.017 ( 2.412 -0.551 -11.901) 12.155 17.387 ( -9.336 -1.763 0.716) 9.528 18.406 ( 4.157 0.100 2.010) 4.618 18.998 ( -4.228 -0.896 -6.432) 7.749 19.515 ( 4.972 2.906 3.808) 6.904 20.087 ( 4.181 5.447 -6.381) 9.374 20.290 ( -1.031 -6.082 0.195) 6.172 ======================= Grid point 152 (61/336) ======================= q-point: (-0.55 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.409 ( -8.010 17.739 -1.182) 19.500 2.945 ( -4.761 19.188 -3.836) 20.138 3.297 ( 13.364 -8.873 -5.541) 16.971 5.136 ( -31.745 3.155 -2.233) 31.979 5.324 ( 12.891 -6.314 -0.053) 14.354 6.425 ( 1.807 -1.525 -1.876) 3.019 6.632 ( 2.718 -4.903 -1.646) 5.843 7.072 ( 2.598 12.692 3.792) 13.499 7.248 ( -0.782 -0.020 -5.770) 5.822 7.795 ( 2.948 -1.909 1.450) 3.800 8.253 ( 1.466 -0.860 -1.039) 1.992 8.456 ( 3.132 -15.093 1.376) 15.476 8.683 ( -3.730 8.075 -1.705) 9.057 9.656 ( -1.491 5.438 -12.697) 13.892 9.844 ( -7.478 -7.697 -2.305) 10.977 10.523 ( 5.240 5.333 4.515) 8.734 10.827 ( -5.083 -4.453 1.406) 6.902 11.247 ( 3.295 -0.068 6.629) 7.404 14.841 ( -9.034 -8.647 -2.281) 12.711 15.767 ( 1.456 -2.023 1.455) 2.886 16.052 ( -1.691 9.605 5.531) 11.212 16.275 ( -3.727 -2.142 12.001) 12.748 16.610 ( -2.816 5.478 2.652) 6.706 16.945 ( -1.742 0.814 -12.375) 12.523 17.351 ( 0.579 -7.146 -2.299) 7.529 18.501 ( 5.034 0.595 3.043) 5.912 18.923 ( -2.282 -1.126 -5.234) 5.820 19.549 ( 2.496 3.443 -1.970) 4.687 20.115 ( 5.740 5.644 -3.737) 8.875 20.346 ( -0.317 -7.922 4.248) 8.995 ======================= Grid point 153 (62/336) ======================= q-point: (-0.45 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( -24.332 12.559 -2.892) 27.535 2.647 ( -5.954 25.180 -4.010) 26.183 3.560 ( 9.983 -7.752 -5.998) 13.990 4.484 ( -28.225 16.920 0.528) 32.912 5.590 ( 12.360 -1.720 0.442) 12.487 6.436 ( 0.522 0.220 1.343) 1.457 6.665 ( -4.527 -5.933 -2.940) 8.021 6.961 ( -5.172 5.720 -2.001) 7.967 7.393 ( 16.126 -1.686 -1.220) 16.260 7.874 ( 1.818 -4.332 -1.095) 4.825 8.260 ( 0.396 0.417 -0.912) 1.078 8.502 ( -4.672 3.339 0.931) 5.818 8.733 ( 7.405 -7.690 3.774) 11.323 9.469 ( -5.909 3.061 -15.833) 17.175 9.798 ( -7.854 -12.397 -1.341) 14.737 10.568 ( 3.736 5.761 -5.469) 8.778 10.764 ( -6.738 -5.977 9.732) 13.261 11.376 ( 7.945 3.595 6.381) 10.806 14.753 ( -8.509 -8.664 -3.054) 12.522 15.767 ( -3.688 -1.772 -0.805) 4.170 15.958 ( -2.335 9.019 8.144) 12.374 16.200 ( -11.373 3.249 3.570) 12.355 16.529 ( 1.542 5.976 8.021) 10.120 16.895 ( 1.265 -3.025 -10.144) 10.661 17.463 ( 3.426 -8.196 -1.757) 9.055 18.585 ( 3.622 1.383 2.845) 4.809 18.888 ( -0.715 -1.229 -3.560) 3.834 19.556 ( 3.432 1.435 -5.367) 6.530 20.092 ( -0.701 6.133 -0.837) 6.230 20.489 ( 4.918 -7.945 3.754) 10.070 ======================= Grid point 154 (63/336) ======================= q-point: (-0.36 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.351 ( -27.527 9.740 2.272) 29.287 2.166 ( -21.074 20.848 -1.025) 29.661 3.748 ( 4.999 -5.679 -4.827) 8.975 3.846 ( -13.720 36.248 2.618) 38.846 5.793 ( 10.281 1.980 -0.387) 10.477 6.473 ( 2.390 0.264 2.011) 3.134 6.624 ( -4.573 -6.930 -0.000) 8.303 6.813 ( -5.040 -0.053 -6.177) 7.972 7.704 ( 14.459 -0.887 1.907) 14.612 7.912 ( -0.350 -2.839 -3.882) 4.822 8.264 ( 0.042 -1.938 -2.026) 2.804 8.403 ( -3.973 1.948 3.461) 5.618 8.913 ( 1.427 -4.899 5.853) 7.765 9.285 ( -1.885 4.111 -14.244) 14.945 9.810 ( -5.481 -17.734 -2.483) 18.727 10.486 ( -4.133 -0.061 -8.456) 9.412 10.818 ( -0.227 -4.344 10.062) 10.962 11.504 ( 9.198 7.283 8.064) 14.236 14.689 ( -4.851 -6.924 -4.186) 9.434 15.658 ( -12.719 -4.723 -0.105) 13.568 15.826 ( -9.379 5.067 5.868) 12.168 15.989 ( 2.878 16.810 0.103) 17.055 16.524 ( -2.507 3.574 2.530) 5.046 16.981 ( 5.025 -8.082 -1.270) 9.602 17.589 ( 2.944 -6.730 -0.425) 7.358 18.626 ( 1.451 1.547 1.997) 2.913 18.887 ( 0.429 -1.248 -1.373) 1.904 19.599 ( 4.949 -0.080 -6.791) 8.403 19.986 ( -4.114 5.820 0.857) 7.179 20.666 ( 4.891 -6.831 0.116) 8.402 ======================= Grid point 155 (64/336) ======================= q-point: (-0.27 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.849 ( -21.797 6.339 17.297) 28.539 1.570 ( -23.663 17.807 9.231) 31.019 3.217 ( -7.231 53.165 1.758) 53.683 3.899 ( 5.448 -4.076 -1.079) 6.889 5.916 ( 6.468 1.784 -2.370) 7.116 6.489 ( 1.821 4.765 -5.101) 7.214 6.640 ( -2.592 -7.384 2.491) 8.213 6.784 ( -0.352 -8.643 -1.257) 8.741 7.828 ( 0.794 4.824 1.581) 5.138 7.951 ( 4.748 -0.702 -1.107) 4.925 8.273 ( -2.000 -2.630 0.186) 3.309 8.374 ( -0.499 -4.459 -0.560) 4.522 8.899 ( -8.411 -3.766 3.274) 9.780 9.228 ( 6.451 8.152 -5.312) 11.675 9.923 ( -0.514 -19.137 -5.568) 19.937 10.389 ( -3.927 -3.202 -7.510) 9.060 10.862 ( -2.925 -1.494 3.314) 4.665 11.681 ( 11.301 2.831 16.931) 20.552 14.697 ( 3.088 -4.006 -5.673) 7.600 15.404 ( -19.474 -5.347 3.311) 20.465 15.685 ( -1.936 5.471 1.349) 5.958 15.948 ( 8.929 17.204 1.111) 19.415 16.377 ( -9.988 3.037 -3.403) 10.980 17.168 ( 5.452 -7.919 2.635) 9.969 17.688 ( 1.790 -4.648 0.887) 5.059 18.629 ( -0.267 1.148 0.894) 1.479 18.914 ( 1.218 -1.272 1.315) 2.198 19.652 ( 4.025 0.132 -7.422) 8.444 19.867 ( -3.380 4.717 2.059) 6.157 20.757 ( -0.330 -4.879 -7.380) 8.853 ======================= Grid point 156 (65/336) ======================= q-point: (-0.18 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.812 ( 16.202 8.221 28.757) 34.015 1.178 ( -7.765 17.111 22.136) 29.036 2.574 ( -2.365 62.220 0.809) 62.270 4.021 ( 4.041 -2.846 2.106) 5.373 5.963 ( 1.054 0.158 -4.095) 4.231 6.373 ( -3.974 6.097 -11.149) 13.314 6.716 ( -0.817 -11.887 2.567) 12.188 6.905 ( 4.498 -5.265 3.482) 7.751 7.790 ( -0.588 7.404 3.445) 8.187 8.039 ( 6.494 -0.979 2.229) 6.935 8.226 ( -4.820 -1.786 1.393) 5.325 8.462 ( 3.201 -7.574 -3.530) 8.948 8.806 ( -3.723 -1.275 2.587) 4.709 9.268 ( 7.126 7.911 1.462) 10.747 10.072 ( 1.720 -15.570 -10.793) 19.022 10.347 ( -0.407 -2.594 -6.586) 7.090 10.744 ( -7.902 5.133 -3.384) 10.013 12.011 ( 4.867 -14.888 30.785) 34.541 14.839 ( 11.947 -1.212 -7.031) 13.915 15.189 ( -10.168 -6.172 5.361) 13.047 15.663 ( 3.026 2.696 3.110) 5.108 15.927 ( -1.886 13.148 0.929) 13.315 16.130 ( -0.848 8.881 -7.845) 11.880 17.312 ( 2.802 -3.736 0.561) 4.703 17.754 ( 0.872 -3.017 2.502) 4.015 18.603 ( -1.767 0.794 -0.422) 1.983 18.963 ( 1.567 -1.114 3.760) 4.223 19.655 ( 0.996 1.576 -6.191) 6.466 19.821 ( 1.119 2.382 1.827) 3.204 20.639 ( -8.669 1.394 -17.957) 19.989 ======================= Grid point 157 (66/336) ======================= q-point: (-0.09 0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.140 ( 4.396 12.035 29.358) 32.032 1.298 ( 27.246 15.425 12.784) 33.818 2.057 ( 18.395 57.511 1.403) 60.397 4.094 ( 0.702 -0.455 2.104) 2.264 5.909 ( -3.477 0.820 -0.522) 3.611 6.248 ( 2.261 3.645 -7.829) 8.927 6.836 ( -0.530 -11.145 2.988) 11.551 7.045 ( 3.620 -5.352 2.120) 6.800 7.674 ( -4.745 6.380 0.298) 7.957 8.101 ( -2.456 0.946 0.860) 2.769 8.226 ( -0.374 -0.925 2.812) 2.984 8.555 ( 1.055 -6.244 0.137) 6.334 8.919 ( 8.846 -8.269 0.320) 12.113 9.339 ( 8.516 6.823 2.069) 11.106 10.152 ( 2.777 -1.731 -16.211) 16.538 10.328 ( -3.091 -2.433 -4.984) 6.350 10.533 ( -4.001 3.293 -5.497) 7.555 12.271 ( -18.354 -24.383 38.433) 49.077 14.959 ( 3.204 -3.547 -1.254) 4.942 15.265 ( 5.245 1.733 0.452) 5.543 15.599 ( -5.896 14.024 -2.190) 15.370 15.769 ( 7.876 3.861 5.598) 10.406 16.271 ( 16.044 -6.151 -7.528) 18.760 17.326 ( -0.654 3.060 -3.955) 5.043 17.803 ( 0.030 -2.050 4.134) 4.614 18.549 ( -3.065 0.370 -1.703) 3.526 19.018 ( 1.785 -0.165 4.399) 4.750 19.620 ( -0.497 1.299 -5.668) 5.836 19.866 ( 4.348 1.267 2.462) 5.155 20.343 ( -5.000 6.285 -22.971) 24.335 ======================= Grid point 161 (67/336) ======================= q-point: ( 0.27 0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.740 ( 18.767 0.000 -3.087) 19.019 2.817 ( 17.318 0.000 8.048) 19.096 3.392 ( -15.644 -0.000 -6.690) 17.014 4.893 ( 19.288 0.000 -1.087) 19.318 5.547 ( -17.743 -0.000 -4.513) 18.308 6.402 ( 2.047 0.000 -0.425) 2.091 6.559 ( -4.709 -0.000 -8.407) 9.637 7.290 ( 2.341 0.000 -6.028) 6.466 7.522 ( -10.521 -0.000 4.162) 11.315 7.610 ( 4.212 0.000 10.837) 11.627 8.063 ( 0.417 0.000 -1.873) 1.919 8.202 ( 4.160 0.000 -2.858) 5.047 8.949 ( -7.199 -0.000 -1.770) 7.414 9.721 ( 7.255 0.000 -0.074) 7.256 9.943 ( -9.200 -0.000 -9.449) 13.188 10.529 ( 1.060 0.000 14.611) 14.650 10.684 ( 8.427 0.000 -9.651) 12.813 11.276 ( -9.238 -0.000 6.589) 11.347 14.844 ( -5.712 -0.000 -2.042) 6.066 15.674 ( 1.937 0.000 4.140) 4.570 16.264 ( -3.161 -0.000 8.445) 9.017 16.273 ( -3.910 -0.000 1.799) 4.304 16.552 ( 8.310 0.000 4.769) 9.581 17.015 ( 5.575 0.000 -13.655) 14.750 17.367 ( -12.387 -0.000 1.337) 12.459 18.407 ( 4.325 0.000 1.835) 4.698 18.989 ( -4.156 -0.000 -6.503) 7.718 19.546 ( 5.633 0.000 4.235) 7.047 20.176 ( 1.577 0.000 -11.915) 12.019 20.193 ( 0.032 0.000 5.568) 5.568 ======================= Grid point 162 (68/336) ======================= q-point: (-0.64 0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.694 ( -17.336 10.649 -5.618) 21.106 3.067 ( 10.064 -6.298 -6.690) 13.628 3.314 ( 9.044 8.706 2.596) 12.819 5.122 ( -25.702 -1.646 -3.103) 25.941 5.229 ( 16.454 -3.560 -0.923) 16.860 6.423 ( 2.645 1.791 -1.188) 3.408 6.537 ( 1.742 -4.557 -8.108) 9.463 7.248 ( -3.499 0.359 -4.627) 5.812 7.345 ( -1.454 11.313 5.203) 12.537 7.796 ( 6.773 1.869 6.927) 9.867 8.128 ( 1.855 -12.648 0.207) 12.785 8.259 ( 1.864 -1.587 -0.636) 2.529 8.811 ( -4.565 4.040 -0.782) 6.146 9.694 ( -14.117 -2.080 -8.766) 16.747 9.767 ( 0.387 0.673 -7.991) 8.028 10.596 ( 1.693 1.966 10.619) 10.931 10.769 ( 0.409 -1.530 -6.331) 6.526 11.241 ( 3.525 -0.292 7.602) 8.385 14.725 ( -7.893 -3.144 -2.083) 8.748 15.739 ( 2.064 -0.741 2.947) 3.673 16.175 ( -5.852 3.425 5.865) 8.966 16.241 ( -5.441 -1.445 13.667) 14.781 16.698 ( 6.325 2.806 -0.459) 6.935 16.998 ( 0.134 4.121 -13.622) 14.232 17.209 ( -5.554 -6.595 -1.750) 8.798 18.511 ( 5.820 0.335 2.641) 6.400 18.908 ( -2.151 -0.413 -5.356) 5.786 19.607 ( 1.692 2.010 -2.114) 3.372 20.193 ( 5.777 2.177 -3.645) 7.170 20.226 ( -1.101 -3.728 4.861) 6.224 ======================= Grid point 163 (69/336) ======================= q-point: (-0.55 0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( -26.534 9.110 -8.391) 29.282 3.053 ( -9.368 16.176 -2.941) 18.923 3.416 ( 6.503 -6.968 -3.039) 10.004 4.730 ( -11.905 8.886 0.321) 14.859 5.547 ( 15.635 -2.806 -0.510) 15.893 6.446 ( 1.326 0.813 0.006) 1.555 6.560 ( -1.325 -4.732 -8.075) 9.453 7.090 ( -7.737 6.570 -1.023) 10.202 7.389 ( 10.679 1.047 1.696) 10.863 7.854 ( 2.601 3.409 0.631) 4.334 8.242 ( -1.324 -3.462 0.053) 3.707 8.382 ( 3.212 -11.752 3.733) 12.742 8.735 ( 1.702 4.851 3.896) 6.450 9.417 ( -16.927 -7.660 -7.548) 20.055 9.690 ( -2.509 1.057 -11.143) 11.471 10.646 ( 0.022 2.317 -5.830) 6.273 10.682 ( -4.941 -2.625 5.559) 7.887 11.423 ( 10.454 1.506 8.788) 13.740 14.622 ( -6.314 -4.792 -2.981) 8.468 15.737 ( -5.639 -1.238 0.907) 5.844 16.056 ( -7.425 2.739 8.146) 11.357 16.249 ( -1.584 0.583 13.474) 13.579 16.696 ( 2.011 9.970 0.802) 10.203 16.877 ( -1.308 1.898 -12.707) 12.914 17.275 ( 2.072 -11.217 -2.541) 11.687 18.612 ( 4.530 1.216 2.269) 5.210 18.869 ( -0.573 -0.720 -3.725) 3.837 19.588 ( 1.522 1.652 -5.944) 6.355 20.183 ( -2.027 2.870 0.733) 3.589 20.360 ( 6.796 -4.791 3.414) 8.988 ======================= Grid point 164 (70/336) ======================= q-point: (-0.45 0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( -29.098 8.626 -3.803) 30.587 2.515 ( -28.237 15.610 1.107) 32.284 3.600 ( 6.422 -8.770 -4.225) 11.663 4.488 ( 1.969 28.272 0.753) 28.351 5.818 ( 12.881 0.251 -0.651) 12.900 6.470 ( 1.048 0.321 3.492) 3.660 6.516 ( -2.654 -4.254 -5.647) 7.552 6.871 ( -8.329 5.812 -3.259) 10.666 7.654 ( 13.846 -4.568 0.584) 14.592 7.869 ( 1.961 -0.116 -2.576) 3.239 8.236 ( -2.312 -2.816 0.768) 3.724 8.418 ( -5.535 0.302 1.367) 5.710 8.846 ( 3.862 -1.787 8.627) 9.620 9.232 ( -8.682 -13.927 -6.178) 17.535 9.579 ( -4.021 -0.822 -9.557) 10.401 10.497 ( -5.691 1.219 -8.713) 10.479 10.743 ( 0.651 -3.804 5.702) 6.886 11.612 ( 8.934 4.050 8.501) 12.981 14.576 ( -1.743 -4.677 -4.154) 6.494 15.566 ( -16.202 -4.155 1.534) 16.796 15.938 ( -4.755 6.261 6.195) 10.009 16.262 ( 3.409 9.732 6.993) 12.459 16.627 ( -2.295 6.872 -1.217) 7.347 16.848 ( 2.691 -4.233 -2.937) 5.813 17.424 ( 3.142 -10.399 -0.872) 10.898 18.660 ( 1.599 1.788 1.426) 2.790 18.865 ( 0.547 -0.944 -1.622) 1.955 19.600 ( 4.234 0.199 -7.150) 8.312 20.093 ( -3.908 5.054 0.850) 6.445 20.538 ( 5.234 -6.160 1.236) 8.177 ======================= Grid point 165 (71/336) ======================= q-point: (-0.36 0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.979 ( -23.285 6.458 13.661) 27.758 1.903 ( -22.264 16.686 7.816) 28.899 3.765 ( 5.366 -6.374 -2.522) 8.705 4.193 ( 2.399 43.135 0.541) 43.205 5.965 ( 6.135 3.202 -2.191) 7.259 6.456 ( -2.166 -3.799 -0.826) 4.451 6.618 ( 7.606 -2.325 5.011) 9.401 6.667 ( -8.266 0.603 -6.462) 10.509 7.842 ( 2.920 -2.249 -2.337) 4.364 7.960 ( 8.384 0.632 1.108) 8.480 8.225 ( -2.789 -3.573 0.230) 4.538 8.302 ( -5.768 -1.546 -0.476) 5.991 8.837 ( -7.092 -2.850 2.597) 8.072 9.362 ( 8.687 -5.894 -0.309) 10.502 9.497 ( -6.525 -11.536 -5.780) 14.459 10.377 ( -2.049 1.095 -6.869) 7.251 10.805 ( -0.600 -4.197 2.467) 4.905 11.746 ( 5.816 3.303 9.978) 12.013 14.626 ( 5.897 -3.356 -5.168) 8.529 15.297 ( -18.980 -5.044 3.192) 19.897 15.825 ( -1.986 8.555 3.211) 9.351 16.265 ( 7.721 14.579 2.848) 16.741 16.453 ( -8.783 4.492 -5.131) 11.120 17.003 ( 5.135 -8.073 6.568) 11.605 17.563 ( 2.219 -8.332 0.456) 8.635 18.656 ( -0.446 1.521 0.406) 1.636 18.890 ( 1.253 -1.143 0.858) 1.901 19.653 ( 4.860 0.010 -7.414) 8.865 19.971 ( -3.629 5.809 0.683) 6.883 20.648 ( 0.412 -6.177 -4.041) 7.393 ======================= Grid point 166 (72/336) ======================= q-point: (-0.27 0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.957 ( 17.603 6.844 32.440) 37.538 1.537 ( -4.288 19.277 13.871) 24.133 3.693 ( 0.602 50.155 -1.817) 50.192 3.947 ( 2.761 -2.171 3.169) 4.731 5.981 ( 0.377 2.152 -2.777) 3.533 6.450 ( -4.256 2.517 -9.442) 10.658 6.516 ( -2.963 -8.423 0.815) 8.966 6.826 ( 7.755 -3.028 5.508) 9.982 7.898 ( 2.024 3.110 2.432) 4.437 8.031 ( 3.195 0.730 1.729) 3.705 8.178 ( -6.406 -3.996 -1.024) 7.620 8.315 ( 2.782 -6.471 -3.444) 7.841 8.767 ( -3.824 -2.758 1.268) 4.882 9.441 ( 5.370 7.807 1.312) 9.566 9.627 ( -1.133 -25.500 -5.365) 26.083 10.350 ( 3.200 1.459 -4.503) 5.713 10.796 ( -3.889 -0.085 -1.512) 4.173 11.859 ( 0.489 -3.183 15.291) 15.627 14.814 ( 14.291 -1.503 -6.224) 15.660 15.066 ( -12.605 -6.189 5.105) 14.942 15.749 ( 0.513 6.428 2.640) 6.968 16.180 ( -9.082 10.382 -3.426) 14.213 16.297 ( 6.648 10.457 -0.704) 12.411 17.196 ( 3.548 -7.252 7.729) 11.177 17.666 ( 0.986 -6.249 1.920) 6.611 18.622 ( -1.737 1.192 -0.920) 2.299 18.938 ( 1.589 -1.380 3.454) 4.045 19.682 ( 2.299 1.179 -6.956) 7.421 19.885 ( -0.193 4.193 0.652) 4.248 20.610 ( -6.264 -3.544 -11.970) 13.967 ======================= Grid point 167 (73/336) ======================= q-point: (-0.18 0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.399 ( 10.151 14.611 30.452) 35.268 1.595 ( 31.450 15.619 8.831) 36.208 3.177 ( 4.862 56.235 0.222) 56.445 4.047 ( 0.878 -4.469 4.010) 6.068 5.915 ( -4.856 0.517 -1.412) 5.084 6.302 ( -1.836 1.553 -8.743) 9.068 6.627 ( 2.404 -9.466 1.969) 9.962 6.973 ( 3.736 -1.995 3.131) 5.267 7.798 ( -6.560 5.375 0.243) 8.484 8.063 ( -6.823 -3.543 0.021) 7.688 8.208 ( 7.552 -1.425 1.185) 7.776 8.418 ( 1.662 -7.254 0.369) 7.451 8.790 ( 2.500 -5.647 -0.605) 6.206 9.499 ( 7.580 8.358 5.124) 12.392 9.818 ( 1.340 -23.408 -11.272) 26.015 10.393 ( 3.906 2.981 -3.412) 5.982 10.645 ( -6.619 6.519 -4.740) 10.430 11.946 ( -8.761 -10.829 22.232) 26.236 14.893 ( -2.014 -3.281 0.912) 3.957 15.232 ( 17.639 -4.261 -1.316) 18.194 15.748 ( 1.252 0.725 0.281) 1.474 15.903 ( -5.110 12.376 0.272) 13.392 16.325 ( 6.638 8.488 -1.057) 10.827 17.311 ( -0.218 -3.275 5.310) 6.243 17.741 ( 0.085 -4.565 3.756) 5.912 18.561 ( -3.123 0.942 -2.381) 4.038 19.001 ( 1.600 -1.402 5.377) 5.782 19.651 ( -0.701 1.767 -6.085) 6.375 19.899 ( 4.524 2.023 0.952) 5.046 20.402 ( -9.000 0.546 -19.277) 21.282 ======================= Grid point 168 (74/336) ======================= q-point: (-0.09 0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( 11.124 15.331 21.186) 28.419 1.875 ( 10.640 25.947 4.633) 28.424 3.047 ( 36.817 39.168 2.902) 53.833 4.075 ( -2.989 -2.087 2.767) 4.577 5.837 ( -4.306 -2.864 3.239) 6.102 6.282 ( 2.981 -0.493 -7.249) 7.854 6.768 ( 2.477 -7.469 1.857) 8.085 7.040 ( 0.150 -3.997 1.335) 4.217 7.616 ( -7.369 4.541 -1.568) 8.797 7.999 ( -4.577 -5.649 -0.645) 7.299 8.227 ( -3.048 4.316 -0.564) 5.314 8.557 ( 4.527 -6.668 5.959) 10.023 8.918 ( 1.241 -9.190 -1.254) 9.358 9.553 ( 4.202 8.413 2.045) 9.624 10.046 ( 8.463 -16.637 -16.526) 24.930 10.256 ( -8.493 9.081 -1.436) 12.516 10.553 ( 3.878 3.455 -4.255) 6.715 11.937 ( -16.621 -11.413 25.733) 32.692 14.980 ( 5.777 -7.220 1.549) 9.376 15.374 ( -0.637 11.077 -3.839) 11.741 15.748 ( 11.013 7.333 -1.605) 13.328 15.958 ( 8.623 -2.918 6.044) 10.927 16.355 ( 1.657 -0.302 -1.007) 1.963 17.296 ( -4.075 1.658 2.493) 5.057 17.785 ( -1.666 -3.024 4.680) 5.816 18.478 ( -3.798 0.288 -3.409) 5.111 19.069 ( 1.833 -1.012 6.019) 6.372 19.569 ( -3.655 1.386 -5.999) 7.160 19.985 ( 4.349 3.151 3.609) 6.470 20.203 ( -0.197 -2.869 -23.625) 23.800 ======================= Grid point 173 (75/336) ======================= q-point: (-0.64 0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.246 ( -28.068 -0.000 -10.942) 30.125 3.248 ( 12.155 0.000 -6.220) 13.654 3.308 ( -19.443 -0.000 2.377) 19.587 4.821 ( -3.589 -0.000 1.936) 4.078 5.509 ( 17.036 0.000 -2.150) 17.171 6.466 ( 0.928 0.000 1.775) 2.004 6.499 ( 1.520 0.000 -13.247) 13.334 7.161 ( -4.836 -0.000 -3.032) 5.708 7.406 ( 2.417 0.000 4.911) 5.474 8.013 ( -3.227 -0.000 -1.140) 3.422 8.045 ( 7.966 0.000 6.679) 10.396 8.290 ( 3.746 0.000 2.311) 4.402 8.794 ( -0.179 -0.000 3.550) 3.554 9.324 ( -21.110 -0.000 -4.613) 21.608 9.714 ( -0.698 -0.000 -15.114) 15.130 10.650 ( -0.624 -0.000 8.612) 8.635 10.674 ( -5.182 -0.000 -10.319) 11.547 11.438 ( 11.432 0.000 9.702) 14.994 14.575 ( -5.547 -0.000 -2.847) 6.235 15.724 ( -6.667 -0.000 1.275) 6.788 16.085 ( -6.262 -0.000 7.456) 9.737 16.244 ( -1.400 -0.000 17.131) 17.188 16.791 ( 1.754 0.000 -6.896) 7.115 17.002 ( 2.444 0.000 -9.499) 9.808 17.070 ( -1.947 -0.000 -0.980) 2.180 18.624 ( 4.913 0.000 2.010) 5.308 18.862 ( -0.527 -0.000 -3.791) 3.827 19.606 ( 0.450 0.000 -6.392) 6.408 20.203 ( -1.591 -0.000 3.570) 3.909 20.318 ( 6.890 0.000 1.220) 6.997 ======================= Grid point 175 (76/336) ======================= q-point: (-0.55 0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( -31.226 3.298 -7.223) 32.220 2.755 ( -32.269 7.993 3.440) 33.422 3.441 ( 8.052 -6.104 -4.792) 11.182 4.880 ( 9.614 11.164 2.681) 14.975 5.800 ( 15.526 -1.393 -3.049) 15.884 6.460 ( 0.240 -1.495 -10.572) 10.680 6.485 ( 0.450 0.705 2.417) 2.558 7.013 ( -7.579 6.711 -1.094) 10.182 7.551 ( 9.752 -4.632 2.149) 11.008 7.911 ( -2.023 3.422 -1.209) 4.155 8.136 ( -3.323 -5.862 1.387) 6.880 8.437 ( 5.730 1.251 3.561) 6.861 8.836 ( 2.123 0.340 8.625) 8.888 8.952 ( -21.669 -10.029 -2.701) 24.029 9.630 ( 1.083 2.509 -14.841) 15.090 10.526 ( -4.753 1.337 -9.698) 10.883 10.676 ( -0.992 -2.506 4.975) 5.658 11.663 ( 8.835 1.302 8.975) 12.661 14.514 ( -0.258 -1.705 -3.880) 4.246 15.511 ( -16.862 -1.450 1.852) 17.025 16.043 ( -1.659 3.714 7.439) 8.479 16.344 ( 3.795 0.336 15.587) 16.046 16.695 ( -5.957 -0.171 -12.290) 13.659 16.933 ( 3.605 12.275 -0.380) 12.799 17.194 ( 3.152 -13.243 -0.953) 13.646 18.687 ( 1.602 0.823 1.015) 2.067 18.852 ( 0.603 -0.362 -1.765) 1.900 19.604 ( 3.464 0.142 -7.455) 8.222 20.169 ( -2.408 2.478 0.872) 3.563 20.444 ( 4.452 -3.007 1.819) 5.673 ======================= Grid point 176 (77/336) ======================= q-point: (-0.45 0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.076 ( -25.996 3.305 11.418) 28.585 2.195 ( -19.999 12.559 7.420) 24.754 3.614 ( 5.875 -7.713 -2.376) 9.983 4.864 ( 5.980 24.329 -0.766) 25.065 6.019 ( 9.702 1.637 -4.636) 10.876 6.435 ( 0.058 1.288 -2.100) 2.464 6.544 ( 4.126 -2.958 3.332) 6.073 6.773 ( -8.346 8.825 -2.037) 12.316 7.787 ( 8.123 -2.982 -1.582) 8.797 7.925 ( 5.372 -5.750 -0.459) 7.882 8.118 ( -4.871 -4.543 2.173) 7.006 8.350 ( -8.626 5.269 -1.343) 10.197 8.767 ( -8.871 -6.956 0.453) 11.282 8.957 ( -3.211 -17.029 3.113) 17.607 9.598 ( 6.328 6.709 -6.322) 11.181 10.415 ( -0.821 2.556 -6.754) 7.268 10.711 ( -0.891 -5.014 1.832) 5.412 11.797 ( 3.671 1.864 8.000) 8.997 14.571 ( 6.934 -2.223 -4.479) 8.549 15.223 ( -17.833 -2.478 2.880) 18.233 15.992 ( -1.273 7.995 5.449) 9.759 16.437 ( -1.526 3.129 1.192) 3.680 16.548 ( -0.418 3.009 -2.359) 3.846 16.933 ( 4.332 3.665 6.252) 8.443 17.368 ( 2.632 -11.722 0.513) 12.024 18.683 ( -0.802 1.140 -0.023) 1.394 18.872 ( 1.286 -0.682 0.549) 1.556 19.653 ( 5.289 -0.008 -7.461) 9.146 20.080 ( -3.106 5.039 -1.242) 6.049 20.533 ( 0.246 -5.350 -1.253) 5.501 ======================= Grid point 177 (78/336) ======================= q-point: (-0.36 0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.063 ( 19.053 3.894 32.956) 38.266 1.897 ( -2.236 17.312 11.189) 20.734 3.778 ( 4.114 -8.292 1.024) 9.313 4.606 ( -1.228 35.783 -2.346) 35.881 6.063 ( 2.743 6.356 -4.947) 8.509 6.412 ( -5.434 -1.309 2.989) 6.338 6.506 ( -2.940 3.890 -5.921) 7.670 6.775 ( 8.731 -2.392 5.041) 10.362 7.911 ( 5.408 -1.616 -0.300) 5.652 8.036 ( -4.637 -4.766 -0.264) 6.655 8.080 ( -3.952 -1.121 2.748) 4.942 8.235 ( 2.906 -3.051 -5.346) 6.806 8.706 ( -3.618 -3.323 0.392) 4.928 9.061 ( -5.975 -26.027 -5.631) 27.292 9.655 ( 8.156 8.900 2.921) 12.420 10.395 ( 3.975 3.240 -2.885) 5.884 10.748 ( -1.110 -4.519 -0.435) 4.673 11.837 ( -2.042 0.114 8.331) 8.579 14.773 ( 15.490 -2.790 -4.527) 16.377 14.974 ( -14.107 -2.953 3.597) 14.855 15.899 ( -1.738 8.741 2.600) 9.284 16.271 ( -9.286 0.518 -5.842) 10.984 16.558 ( 6.842 14.163 2.898) 15.994 17.071 ( 4.613 -4.642 11.579) 13.300 17.512 ( 1.275 -9.712 2.015) 10.001 18.646 ( -1.664 1.170 -1.401) 2.470 18.914 ( 1.576 -1.034 2.867) 3.431 19.700 ( 3.346 0.643 -6.901) 7.696 19.974 ( -1.694 4.728 -2.300) 5.524 20.526 ( -4.788 -4.745 -6.973) 9.698 ======================= Grid point 178 (79/336) ======================= q-point: (-0.27 0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( 25.586 11.715 31.813) 42.473 1.900 ( 21.842 16.315 6.931) 28.129 3.920 ( 1.437 -7.754 4.300) 8.982 4.159 ( -2.900 42.996 -1.206) 43.111 5.964 ( -5.080 5.772 -2.303) 8.027 6.282 ( -5.810 -3.836 -6.761) 9.705 6.533 ( 5.875 0.925 1.202) 6.067 6.949 ( 5.391 -1.092 4.292) 6.977 7.847 ( -10.029 -1.061 -0.869) 10.123 7.984 ( -7.890 -4.825 -2.387) 9.551 8.167 ( 10.583 -2.775 1.663) 11.066 8.316 ( 2.904 -2.392 -0.843) 3.856 8.689 ( -2.569 -4.727 -2.509) 5.936 9.274 ( 5.339 -26.798 -7.132) 28.240 9.712 ( 5.393 8.400 4.450) 10.930 10.443 ( 4.365 2.778 -0.759) 5.230 10.729 ( -2.294 1.742 -2.283) 3.676 11.810 ( -7.653 -4.049 11.148) 14.116 14.830 ( -6.403 -3.414 2.847) 7.795 15.132 ( 21.532 -5.024 -3.105) 22.327 15.797 ( -2.738 4.448 -1.130) 5.344 16.091 ( -4.940 6.139 -0.347) 7.887 16.535 ( 3.879 12.871 2.575) 13.687 17.235 ( 2.343 -3.947 10.645) 11.592 17.624 ( 0.413 -7.595 4.151) 8.665 18.584 ( -2.876 1.398 -3.135) 4.478 18.972 ( 1.588 -1.440 4.852) 5.304 19.684 ( -0.585 1.613 -6.173) 6.407 19.937 ( 2.807 1.740 -2.621) 4.216 20.389 ( -8.384 -1.447 -13.014) 15.548 ======================= Grid point 179 (80/336) ======================= q-point: (-0.18 0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( 12.115 18.930 19.897) 30.016 2.310 ( 21.377 19.475 5.129) 29.369 3.831 ( 16.286 37.865 2.034) 41.269 3.999 ( -2.491 -4.764 5.481) 7.678 5.801 ( -8.034 -0.173 0.990) 8.096 6.245 ( 0.688 -3.174 -7.647) 8.308 6.661 ( 6.069 -2.589 2.140) 6.936 7.017 ( 0.814 0.844 1.396) 1.823 7.658 ( -10.936 -1.043 -1.918) 11.152 7.890 ( -5.790 -5.037 -2.467) 8.061 8.311 ( 0.545 4.214 -1.123) 4.395 8.412 ( 5.333 -7.860 3.922) 10.276 8.717 ( -0.548 -10.966 -3.465) 11.513 9.655 ( 11.019 -20.492 -10.083) 25.357 9.729 ( 5.802 7.622 4.814) 10.720 10.406 ( -5.882 5.062 -2.791) 8.247 10.654 ( 2.151 6.842 -1.538) 7.335 11.755 ( -11.382 -7.466 15.132) 20.353 14.849 ( 2.012 -6.422 2.187) 7.076 15.505 ( 12.100 2.160 -3.381) 12.748 15.758 ( 6.197 -4.050 -3.577) 8.222 15.999 ( 1.252 7.481 4.709) 8.928 16.474 ( -0.072 9.963 4.181) 10.805 17.304 ( -1.804 -0.406 7.637) 7.858 17.705 ( -1.027 -5.204 5.601) 7.714 18.491 ( -4.048 1.086 -4.340) 6.033 19.041 ( 1.655 -1.680 6.156) 6.593 19.599 ( -3.832 1.706 -5.821) 7.175 20.019 ( 7.832 -0.922 -2.887) 8.398 20.172 ( -7.521 0.772 -16.283) 17.953 ======================= Grid point 180 (81/336) ======================= q-point: (-0.09 0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( 5.775 18.567 11.753) 22.720 2.266 ( 7.160 24.192 2.485) 25.351 3.961 ( -7.797 -4.706 3.436) 9.734 4.075 ( 38.255 29.156 2.874) 48.185 5.731 ( -4.289 -6.308 4.398) 8.805 6.270 ( 1.793 -3.233 -7.442) 8.310 6.795 ( 3.729 -3.791 2.193) 5.752 6.992 ( -2.942 0.001 0.229) 2.950 7.485 ( -7.946 -0.895 -1.566) 8.148 7.864 ( -2.488 -6.797 -3.340) 7.972 8.208 ( -3.601 6.170 -1.654) 7.333 8.599 ( 3.967 -8.350 4.298) 10.194 8.822 ( 0.977 -10.026 -0.274) 10.078 9.607 ( -6.791 8.240 -3.097) 11.118 10.030 ( 8.924 -8.241 -17.417) 21.235 10.243 ( 1.362 3.003 8.596) 9.207 10.645 ( 2.777 4.923 -2.910) 6.357 11.680 ( -13.225 -6.846 16.939) 22.555 15.030 ( 8.024 -9.784 0.438) 12.661 15.455 ( -0.027 12.367 -3.222) 12.780 16.019 ( 4.283 3.737 3.591) 6.724 16.053 ( 12.820 -8.048 -2.037) 15.273 16.389 ( -2.007 7.726 7.319) 10.830 17.257 ( -4.622 3.277 4.751) 7.395 17.726 ( -4.062 -3.229 5.223) 7.362 18.397 ( -3.212 0.126 -4.101) 5.210 19.121 ( 2.312 -1.675 6.647) 7.234 19.469 ( -5.790 1.579 -6.249) 8.664 20.000 ( -3.172 -0.567 -13.185) 13.573 20.178 ( 9.322 -2.181 -5.464) 11.023 ======================= Grid point 186 (82/336) ======================= q-point: (-0.55 0.45 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.107 ( -27.333 -0.000 10.806) 29.391 2.329 ( -19.341 -0.000 7.543) 20.760 3.526 ( 6.343 0.000 -2.747) 6.912 5.098 ( 5.192 0.000 -0.256) 5.198 6.029 ( 12.482 0.000 -6.027) 13.861 6.455 ( 4.851 0.000 -4.955) 6.934 6.516 ( 0.728 0.000 3.739) 3.809 6.913 ( -7.726 -0.000 -0.211) 7.729 7.736 ( 13.721 0.000 1.379) 13.790 7.828 ( -5.376 -0.000 -2.582) 5.964 8.085 ( -1.037 -0.000 2.441) 2.652 8.461 ( -23.290 -0.000 -2.070) 23.382 8.580 ( 4.802 0.000 0.481) 4.826 8.846 ( -4.988 -0.000 3.766) 6.250 9.668 ( 7.144 0.000 -6.450) 9.625 10.451 ( 0.469 0.000 -7.824) 7.838 10.650 ( -2.041 -0.000 2.729) 3.408 11.815 ( 3.108 0.000 7.585) 8.198 14.548 ( 7.092 0.000 -4.157) 8.221 15.200 ( -17.280 -0.000 2.689) 17.488 16.083 ( -0.573 -0.000 7.381) 7.403 16.454 ( -8.332 -0.000 -7.119) 10.959 16.552 ( 6.354 0.000 8.636) 10.721 17.115 ( 2.013 0.000 0.493) 2.072 17.133 ( 4.069 0.000 2.713) 4.891 18.695 ( -0.998 -0.000 -0.189) 1.016 18.865 ( 1.307 0.000 0.449) 1.381 19.653 ( 5.421 0.000 -7.489) 9.246 20.137 ( -2.629 -0.000 -2.791) 3.834 20.472 ( -0.070 -0.000 0.546) 0.550 ======================= Grid point 188 (83/336) ======================= q-point: (-0.45 0.45 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( 19.777 1.010 33.358) 38.793 2.157 ( -1.161 8.019 10.722) 13.439 3.636 ( 3.811 -4.891 0.329) 6.210 5.044 ( -3.651 10.163 -4.629) 11.749 6.156 ( 6.377 1.904 -7.937) 10.358 6.477 ( -5.845 5.307 5.268) 9.491 6.586 ( 5.112 1.364 2.608) 5.899 6.785 ( 2.615 5.584 -0.109) 6.167 7.774 ( -4.148 -10.356 -5.361) 12.377 7.971 ( -1.182 -0.511 2.799) 3.081 8.090 ( -1.026 0.565 3.054) 3.271 8.163 ( 3.670 -3.521 -4.208) 6.601 8.641 ( -0.374 -3.498 -2.389) 4.252 8.726 ( -9.547 -6.619 -3.384) 12.100 9.781 ( 7.323 3.603 1.777) 8.352 10.472 ( 5.894 4.115 -2.299) 7.547 10.645 ( -1.285 -5.020 0.164) 5.184 11.844 ( -3.038 0.309 6.008) 6.739 14.724 ( 13.021 -1.591 -2.619) 13.377 14.945 ( -11.894 -0.510 1.725) 12.029 16.062 ( -2.401 7.213 4.432) 8.800 16.230 ( -10.040 -3.966 -7.853) 13.350 16.756 ( 9.398 4.661 8.846) 13.722 17.079 ( 2.317 6.629 6.520) 9.583 17.302 ( 1.980 -11.404 3.792) 12.180 18.663 ( -1.609 0.495 -1.670) 2.371 18.900 ( 1.574 -0.379 2.513) 2.989 19.708 ( 3.868 0.206 -6.725) 7.760 20.050 ( -2.932 2.519 -6.009) 7.145 20.448 ( -3.665 -2.580 -2.571) 5.166 ======================= Grid point 189 (84/336) ======================= q-point: (-0.36 0.45 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 37.774 4.983 31.092) 49.177 2.204 ( 13.858 13.715 8.861) 21.416 3.752 ( 0.704 -8.404 3.639) 9.185 4.769 ( -7.763 19.042 -4.297) 21.008 6.167 ( 0.790 11.893 -5.359) 13.068 6.209 ( -12.701 -0.545 -0.291) 12.716 6.638 ( 6.829 9.182 2.196) 11.652 6.920 ( 7.631 -1.732 4.058) 8.815 7.725 ( -13.914 -12.740 -5.027) 19.524 7.875 ( -3.449 -5.115 -3.239) 6.968 8.125 ( 3.855 -0.941 3.011) 4.981 8.333 ( 4.592 3.856 -2.547) 6.515 8.615 ( -3.664 -3.275 -4.781) 6.856 8.803 ( 9.888 -19.764 -3.137) 22.321 9.852 ( 4.399 5.432 2.975) 7.596 10.508 ( 2.108 3.831 0.307) 4.384 10.716 ( 3.888 -2.598 0.771) 4.739 11.767 ( -8.410 -0.965 5.537) 10.115 14.764 ( -7.836 -2.968 3.922) 9.252 15.063 ( 20.890 -2.084 -4.297) 21.429 15.897 ( -6.454 5.271 -4.409) 9.427 16.139 ( -3.617 -0.410 3.522) 5.065 16.797 ( 3.157 13.442 3.215) 14.177 17.172 ( 3.746 -2.531 11.095) 11.981 17.456 ( 1.557 -9.282 6.744) 11.578 18.610 ( -2.391 1.108 -3.681) 4.527 18.949 ( 1.572 -0.853 4.111) 4.483 19.710 ( 0.019 1.035 -5.795) 5.887 19.961 ( -0.765 0.747 -7.742) 7.815 20.361 ( -5.792 -1.128 -6.573) 8.833 ======================= Grid point 190 (85/336) ======================= q-point: (-0.27 0.45 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.236 ( 13.019 18.167 20.746) 30.494 2.621 ( 30.961 12.626 6.509) 34.064 3.836 ( -3.793 -9.243 5.701) 11.503 4.465 ( 2.838 23.564 0.890) 23.751 5.858 ( -13.676 5.903 1.333) 14.955 6.194 ( 2.800 -0.637 -8.547) 9.016 6.683 ( 4.962 4.900 1.207) 7.077 7.044 ( 3.675 1.385 3.406) 5.199 7.560 ( -13.100 -9.321 -4.339) 16.653 7.820 ( -4.762 -1.961 -3.825) 6.415 8.258 ( 2.955 -8.393 0.604) 8.919 8.348 ( 1.405 -2.547 -1.437) 3.245 8.561 ( -1.400 -1.930 -4.068) 4.715 9.269 ( 19.822 -17.626 -4.383) 26.885 9.869 ( 2.438 5.832 2.408) 6.765 10.467 ( -3.849 1.877 -1.301) 4.476 10.781 ( 3.400 5.506 1.545) 6.653 11.645 ( -10.379 -4.080 8.018) 13.735 14.736 ( -0.914 -5.085 2.511) 5.744 15.472 ( 21.804 -3.535 -2.873) 22.275 15.750 ( -2.822 2.283 -4.271) 5.605 16.103 ( -1.809 2.626 6.111) 6.893 16.703 ( -0.519 13.337 4.830) 14.194 17.282 ( 0.180 -2.292 8.364) 8.674 17.592 ( 0.789 -6.096 9.005) 10.903 18.517 ( -4.077 1.553 -5.362) 6.912 19.010 ( 1.646 -1.427 5.214) 5.651 19.635 ( -3.560 2.027 -5.767) 7.074 19.958 ( 2.813 -4.288 -11.487) 12.579 20.220 ( -4.561 3.084 -6.050) 8.180 ======================= Grid point 191 (86/336) ======================= q-point: (-0.18 0.45 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.326 ( 7.477 19.809 11.479) 24.084 2.739 ( 4.190 23.691 1.175) 24.088 3.839 ( -8.415 -7.859 5.856) 12.918 4.578 ( 29.989 20.548 5.083) 36.706 5.631 ( -10.293 -3.008 2.963) 11.125 6.219 ( 3.180 -1.090 -8.520) 9.160 6.720 ( -0.534 -3.103 -0.472) 3.183 7.060 ( 0.762 5.417 2.826) 6.157 7.420 ( -8.059 -5.517 -3.217) 10.283 7.754 ( -3.292 -4.075 -3.354) 6.220 8.279 ( -3.975 -0.829 -1.883) 4.477 8.452 ( 3.827 -7.926 -2.829) 9.245 8.624 ( 4.466 -6.473 1.099) 7.941 9.658 ( 5.678 -5.223 -7.455) 10.728 9.895 ( 7.727 -1.523 -3.229) 8.512 10.334 ( -5.026 4.440 3.285) 7.467 10.756 ( 0.888 6.259 -1.190) 6.432 11.565 ( -9.144 -5.067 11.921) 15.855 14.852 ( 5.411 -8.472 0.904) 10.093 15.638 ( 2.464 6.722 -3.318) 7.891 15.891 ( 12.169 -6.338 -0.146) 13.722 16.091 ( 1.062 1.789 5.320) 5.712 16.586 ( -1.197 12.057 7.036) 14.011 17.297 ( -3.054 0.401 5.983) 6.730 17.659 ( -2.959 -3.345 7.757) 8.950 18.406 ( -3.652 0.857 -4.966) 6.224 19.085 ( 2.170 -1.934 5.904) 6.581 19.505 ( -5.508 2.179 -6.319) 8.661 19.950 ( -1.866 -4.371 -20.137) 20.690 20.184 ( 6.067 2.291 2.099) 6.816 ======================= Grid point 192 (87/336) ======================= q-point: (-0.09 0.45 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( -9.248 17.916 2.566) 20.324 2.687 ( 14.046 18.780 2.426) 23.577 3.729 ( -13.950 -6.044 4.611) 15.887 4.941 ( 26.272 22.399 1.811) 34.572 5.632 ( 2.342 -10.830 4.904) 12.117 6.233 ( 0.760 -1.414 -7.980) 8.140 6.698 ( -8.511 -8.835 -0.528) 12.278 7.016 ( -0.048 6.325 2.455) 6.785 7.370 ( -0.375 -1.660 -1.411) 2.211 7.738 ( -2.927 -5.860 -4.405) 7.894 8.208 ( -0.350 2.490 -3.307) 4.154 8.560 ( 1.517 -6.987 -2.992) 7.750 8.812 ( 5.600 -8.496 5.534) 11.583 9.486 ( -12.190 8.163 -5.554) 15.687 9.997 ( 2.811 -2.457 -16.367) 16.787 10.422 ( 9.321 -2.238 14.951) 17.760 10.696 ( 0.314 4.140 -6.646) 7.836 11.499 ( -9.438 -2.520 13.491) 16.656 15.074 ( 8.101 -10.427 -1.171) 13.256 15.595 ( 3.903 11.399 -1.804) 12.183 15.994 ( -3.456 -2.492 4.211) 5.991 16.195 ( 3.071 -3.115 4.671) 6.400 16.533 ( 4.377 9.171 5.407) 11.511 17.231 ( -3.808 3.319 2.440) 5.610 17.624 ( -6.923 -2.465 4.966) 8.870 18.345 ( -0.728 0.203 -2.278) 2.400 19.180 ( 3.159 -2.217 5.933) 7.077 19.345 ( -6.542 1.928 -6.785) 9.620 19.875 ( 0.113 -3.393 -16.118) 16.472 20.319 ( 7.762 0.453 0.245) 7.779 ======================= Grid point 199 (88/336) ======================= q-point: ( 0.55 -0.45 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( 40.885 0.000 30.755) 51.161 2.353 ( 12.485 0.000 10.250) 16.153 3.657 ( 0.386 0.000 2.854) 2.880 4.935 ( -9.345 -0.000 -6.079) 11.148 6.170 ( -3.520 -0.000 -5.143) 6.232 6.351 ( -9.478 -0.000 1.811) 9.650 6.791 ( 9.422 0.000 8.823) 12.908 6.911 ( 7.415 0.000 -0.638) 7.442 7.504 ( -13.708 -0.000 -9.905) 16.912 7.826 ( -3.531 -0.000 -2.297) 4.213 8.121 ( 0.153 0.000 3.272) 3.276 8.439 ( -11.490 -0.000 -7.614) 13.784 8.496 ( 25.769 0.000 -0.640) 25.777 8.632 ( -0.718 -0.000 -1.737) 1.880 9.906 ( 3.863 0.000 1.926) 4.316 10.563 ( -3.268 -0.000 -0.880) 3.385 10.670 ( 10.693 0.000 3.463) 11.240 11.759 ( -8.784 -0.000 3.959) 9.635 14.733 ( -7.656 -0.000 4.061) 8.666 15.045 ( 19.876 0.000 -4.515) 20.382 15.962 ( -9.400 -0.000 -9.078) 13.068 16.120 ( -1.759 -0.000 8.737) 8.912 16.971 ( 6.189 0.000 6.285) 8.820 17.138 ( -1.305 -0.000 2.248) 2.599 17.334 ( 4.558 0.000 13.408) 14.161 18.621 ( -2.127 -0.000 -3.867) 4.413 18.941 ( 1.561 0.000 3.800) 4.108 19.721 ( 0.457 0.000 -5.497) 5.516 19.968 ( -2.906 -0.000 -10.426) 10.823 20.350 ( -4.231 -0.000 -3.616) 5.566 ======================= Grid point 201 (89/336) ======================= q-point: (-0.36 0.55 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( 15.529 8.603 24.625) 30.357 2.791 ( 35.472 4.867 5.687) 36.253 3.672 ( -4.214 -5.994 5.226) 9.000 4.735 ( -4.565 5.795 -2.191) 7.696 5.948 ( -17.713 1.970 2.939) 18.063 6.251 ( 1.884 4.338 -7.354) 8.744 6.859 ( 2.060 12.937 1.817) 13.225 7.054 ( 6.512 -1.017 4.020) 7.720 7.311 ( -10.184 -14.301 -9.053) 19.753 7.813 ( 1.128 0.705 -5.189) 5.357 8.092 ( -6.140 -6.458 -1.231) 8.996 8.287 ( -2.432 -1.806 -1.512) 3.386 8.606 ( 2.144 3.264 -2.951) 4.895 9.013 ( 25.831 -7.910 -1.191) 27.041 9.946 ( 1.281 2.034 0.131) 2.407 10.490 ( -3.982 0.605 -1.089) 4.173 10.851 ( 6.372 1.779 4.689) 8.109 11.595 ( -11.029 -1.216 4.439) 11.951 14.665 ( -2.315 -2.022 2.557) 3.998 15.421 ( 22.389 -1.402 -2.825) 22.610 15.794 ( -4.173 1.566 -5.720) 7.252 16.119 ( -3.245 -0.147 9.300) 9.851 16.960 ( -0.540 12.421 4.055) 13.078 17.187 ( -0.622 -7.796 4.529) 9.037 17.503 ( 3.934 -2.422 15.031) 15.725 18.542 ( -3.938 0.782 -6.018) 7.235 18.990 ( 1.639 -0.550 4.341) 4.672 19.671 ( -2.627 1.352 -5.568) 6.303 19.886 ( -0.832 -2.452 -12.875) 13.133 20.265 ( -2.497 1.297 -3.637) 4.599 ======================= Grid point 202 (90/336) ======================= q-point: (-0.27 0.55 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.692 ( 8.984 17.022 12.625) 23.018 3.128 ( 7.852 15.307 1.873) 17.306 3.663 ( -8.765 -9.845 6.911) 14.883 4.813 ( 20.988 4.836 5.155) 22.146 5.624 ( -16.826 1.153 3.031) 17.135 6.239 ( 4.042 2.234 -8.397) 9.583 6.715 ( -6.591 3.505 -5.474) 9.257 7.148 ( 1.698 2.057 4.002) 4.810 7.293 ( -0.320 -6.282 -4.177) 7.551 7.733 ( -4.347 2.482 -2.514) 5.602 8.130 ( -1.036 -14.248 -4.756) 15.057 8.293 ( -0.703 -4.465 -0.484) 4.546 8.639 ( 6.723 3.988 -1.267) 7.919 9.507 ( 20.480 -7.323 -5.076) 22.335 9.915 ( -1.951 1.470 -2.211) 3.294 10.395 ( -4.868 2.000 1.592) 5.498 10.864 ( -1.932 4.367 -0.908) 4.861 11.489 ( -6.292 -2.710 10.218) 12.302 14.718 ( 3.458 -5.090 1.103) 6.251 15.728 ( 2.701 2.960 -2.976) 4.992 15.806 ( 16.259 -2.704 -0.567) 16.492 16.098 ( -3.661 -0.565 9.209) 9.927 16.831 ( -1.947 12.791 5.400) 14.019 17.250 ( -2.114 -5.517 4.382) 7.356 17.614 ( -1.137 -1.144 12.330) 12.435 18.426 ( -4.182 0.973 -5.955) 7.342 19.053 ( 2.210 -1.283 4.471) 5.150 19.552 ( -5.120 2.586 -6.778) 8.879 19.858 ( 0.224 -4.533 -16.322) 16.942 20.234 ( 2.938 2.254 0.011) 3.704 ======================= Grid point 203 (91/336) ======================= q-point: (-0.18 0.55 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.508 ( -12.620 21.146 1.577) 24.676 3.056 ( 7.571 18.303 2.301) 19.940 3.592 ( -12.946 -8.508 7.471) 17.199 5.264 ( 19.519 9.302 3.584) 21.917 5.421 ( -2.319 -9.632 4.651) 10.944 6.259 ( 4.750 3.280 -9.122) 10.795 6.545 ( -9.833 -5.193 -4.867) 12.138 7.121 ( -1.635 3.690 0.559) 4.075 7.359 ( 4.667 0.960 0.799) 4.831 7.653 ( -3.010 -2.419 -2.133) 4.412 8.178 ( -1.439 -5.248 -5.503) 7.739 8.387 ( 2.657 -11.596 -0.882) 11.929 8.740 ( 7.259 2.003 1.180) 7.623 9.614 ( -8.008 5.386 -6.675) 11.734 9.934 ( 5.663 -4.301 -14.075) 15.769 10.386 ( 3.583 -1.362 13.753) 14.278 10.763 ( -2.211 2.561 -6.949) 7.729 11.473 ( -4.856 -0.312 14.002) 14.823 14.886 ( 7.414 -8.392 -0.391) 11.205 15.756 ( 5.826 5.255 -1.240) 7.944 15.973 ( -2.307 -0.123 6.398) 6.802 16.145 ( 3.894 -1.929 5.160) 6.746 16.715 ( -1.097 9.511 4.877) 10.745 17.258 ( -2.111 -0.824 2.762) 3.573 17.589 ( -7.142 -0.998 6.824) 9.928 18.353 ( -0.757 0.527 -2.261) 2.442 19.138 ( 3.328 -1.999 4.430) 5.891 19.388 ( -6.711 2.425 -7.392) 10.274 19.820 ( 0.882 -2.434 -16.561) 16.762 20.327 ( 7.396 0.440 1.677) 7.596 ======================= Grid point 204 (92/336) ======================= q-point: (-0.09 -0.45 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.054 ( -14.615 13.279 -0.377) 19.750 3.018 ( -0.362 8.618 -0.465) 8.638 3.465 ( -7.159 -0.299 4.298) 8.356 5.204 ( -7.636 -2.605 3.713) 8.882 5.783 ( 11.860 -5.114 0.216) 12.917 6.237 ( 5.486 8.046 -5.400) 11.135 6.461 ( -3.919 -7.013 -3.539) 8.779 7.049 ( -2.192 4.218 0.682) 4.802 7.402 ( -0.294 1.170 0.175) 1.219 7.665 ( 4.092 -1.536 -2.842) 5.214 8.180 ( -0.223 -4.100 -5.350) 6.744 8.545 ( 4.831 -5.769 -1.176) 7.616 8.834 ( -0.771 -3.934 0.280) 4.019 9.350 ( -5.637 6.221 -2.222) 8.684 9.946 ( 1.512 -1.713 -14.200) 14.383 10.555 ( -1.496 -1.915 10.647) 10.920 10.733 ( 8.174 -0.541 -7.179) 10.893 11.420 ( -7.202 2.836 14.357) 16.311 15.115 ( 8.068 -9.540 -1.633) 12.600 15.763 ( 0.949 10.315 -0.977) 10.405 15.924 ( -3.260 -0.443 6.059) 6.894 16.215 ( -0.743 -0.453 10.293) 10.330 16.650 ( -2.056 2.687 1.184) 3.585 17.218 ( -1.972 3.450 -0.233) 3.981 17.490 ( -6.368 -1.959 2.494) 7.114 18.360 ( 2.032 0.647 1.374) 2.537 19.202 ( -5.339 1.844 -5.436) 7.839 19.260 ( 3.441 -2.391 2.024) 4.653 19.809 ( 3.151 -2.532 -13.355) 13.954 20.458 ( 6.471 1.397 1.552) 6.799 ======================= Grid point 212 (93/336) ======================= q-point: ( 0.64 -0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.890 ( 11.352 0.000 14.739) 18.604 3.284 ( 10.818 0.000 1.850) 10.975 3.536 ( -10.548 -0.000 6.419) 12.347 4.845 ( 16.647 0.000 4.174) 17.162 5.637 ( -19.512 -0.000 3.463) 19.817 6.263 ( 1.711 0.000 -7.317) 7.514 6.796 ( -12.431 -0.000 -7.922) 14.741 7.115 ( 4.850 0.000 -5.817) 7.574 7.250 ( 6.562 0.000 5.241) 8.398 7.857 ( -11.431 -0.000 0.532) 11.444 7.872 ( 5.402 0.000 -6.864) 8.735 8.257 ( -0.860 -0.000 -1.032) 1.343 8.686 ( 6.462 0.000 -2.028) 6.773 9.430 ( 24.195 0.000 -3.290) 24.417 9.930 ( -3.786 -0.000 -3.288) 5.015 10.414 ( -4.427 -0.000 1.083) 4.558 10.908 ( -3.261 -0.000 -1.013) 3.414 11.463 ( -5.104 -0.000 10.138) 11.350 14.667 ( 2.792 0.000 1.158) 3.023 15.757 ( 1.523 0.000 -2.921) 3.294 15.780 ( 18.520 0.000 -0.774) 18.536 16.089 ( -4.818 -0.000 10.778) 11.806 17.020 ( -5.130 -0.000 4.669) 6.936 17.131 ( 0.890 0.000 3.520) 3.630 17.606 ( -0.354 -0.000 14.398) 14.402 18.437 ( -4.440 -0.000 -6.414) 7.800 19.040 ( 2.248 0.000 3.774) 4.393 19.584 ( -5.077 -0.000 -7.233) 8.838 19.806 ( 0.915 0.000 -14.160) 14.189 20.257 ( 2.111 0.000 -1.043) 2.355 ======================= Grid point 214 (94/336) ======================= q-point: (-0.27 -0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.881 ( -11.775 15.096 2.147) 19.265 3.320 ( -4.524 5.634 3.243) 7.920 3.412 ( -3.997 -7.000 8.401) 11.643 5.294 ( 18.970 -1.974 4.396) 19.572 5.319 ( -12.120 -2.196 3.197) 12.726 6.275 ( 3.244 -1.136 -6.819) 7.636 6.562 ( -5.467 4.026 -10.062) 12.139 7.156 ( 2.438 0.539 -6.734) 7.182 7.395 ( 6.782 1.781 6.949) 9.872 7.658 ( -7.481 2.623 2.010) 8.179 7.994 ( 2.940 -10.697 -5.642) 12.446 8.246 ( -0.041 -2.460 -1.834) 3.069 8.799 ( 7.173 2.261 -1.220) 7.619 9.716 ( -0.150 5.653 -7.547) 9.430 9.832 ( 4.621 -6.036 -9.291) 12.005 10.370 ( -1.301 -0.361 9.001) 9.102 10.793 ( -4.238 0.705 -7.437) 8.589 11.476 ( -1.930 0.294 15.313) 15.437 14.771 ( 6.616 -3.147 0.004) 7.326 15.816 ( 6.311 1.417 -0.329) 6.476 15.970 ( -2.967 -0.262 9.321) 9.785 16.123 ( 7.450 -0.419 3.442) 8.218 16.874 ( -8.339 5.681 4.213) 10.934 17.212 ( 3.251 -2.713 2.575) 4.956 17.583 ( -8.214 0.058 8.531) 11.842 18.361 ( -0.898 0.292 -2.398) 2.577 19.110 ( 3.562 -0.786 3.012) 4.730 19.428 ( -7.237 1.335 -8.187) 11.008 19.783 ( 2.581 -1.178 -14.294) 14.573 20.334 ( 6.488 0.216 0.981) 6.565 ======================= Grid point 215 (95/336) ======================= q-point: (-0.18 -0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( -22.096 18.271 -0.243) 28.673 3.078 ( -20.268 -2.986 4.413) 20.957 3.525 ( 8.379 5.469 2.700) 10.363 5.059 ( -17.869 -8.824 3.492) 20.233 5.674 ( 9.086 -5.785 -1.587) 10.888 6.339 ( 2.915 -4.391 -5.306) 7.478 6.471 ( 9.992 12.220 -6.635) 17.123 7.130 ( -0.072 4.034 -3.648) 5.439 7.441 ( -3.043 3.540 3.588) 5.888 7.638 ( 6.046 -1.941 1.558) 6.538 8.086 ( 0.325 -6.098 -5.341) 8.113 8.341 ( 4.716 -11.106 0.470) 12.075 8.834 ( -1.463 1.937 -3.960) 4.644 9.490 ( -5.924 7.337 -2.993) 9.893 9.912 ( 2.420 -1.956 -15.093) 15.410 10.491 ( 3.093 -3.848 13.820) 14.675 10.721 ( 2.339 -0.570 -11.320) 11.574 11.481 ( -4.478 2.844 16.391) 17.229 14.950 ( 7.982 -6.533 -0.686) 10.338 15.892 ( -7.458 1.774 7.912) 11.017 15.934 ( 6.731 2.354 2.814) 7.666 16.243 ( 3.545 2.703 5.257) 6.893 16.680 ( -10.869 0.654 2.117) 11.093 17.282 ( 0.922 3.297 1.032) 3.576 17.446 ( -7.263 -2.657 2.553) 8.144 18.373 ( 2.095 0.540 2.036) 2.971 19.208 ( 4.273 -1.099 1.777) 4.756 19.249 ( -6.122 1.121 -7.174) 9.498 19.782 ( 3.341 -0.531 -12.858) 13.296 20.472 ( 7.745 0.192 1.514) 7.894 ======================= Grid point 216 (96/336) ======================= q-point: (-0.09 -0.36 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.874 ( -16.980 8.043 0.331) 18.792 2.719 ( -26.190 -5.704 3.148) 26.988 3.607 ( 8.894 8.558 -3.299) 12.776 4.853 ( -22.263 -16.366 4.422) 27.983 5.711 ( -4.977 -2.217 -6.388) 8.396 6.389 ( 2.181 -1.754 -2.817) 3.971 6.614 ( 17.833 10.752 -2.291) 20.949 7.051 ( -2.784 5.210 0.447) 5.924 7.352 ( -3.098 1.336 -2.387) 4.133 7.819 ( 11.022 -0.431 0.738) 11.055 8.089 ( -2.162 -3.102 -4.198) 5.649 8.585 ( 7.383 -9.688 0.356) 12.186 8.676 ( -9.126 -2.241 -7.515) 12.032 9.439 ( 6.327 6.674 3.210) 9.740 9.891 ( 1.154 -2.747 -9.726) 10.173 10.506 ( -3.383 2.106 -4.369) 5.914 10.848 ( 7.888 -6.009 0.557) 9.932 11.402 ( -7.733 5.913 15.604) 18.392 15.159 ( 7.047 -8.618 -0.823) 11.163 15.704 ( -12.768 5.561 4.967) 14.786 16.015 ( 3.875 5.482 0.912) 6.775 16.277 ( 0.569 2.142 10.251) 10.487 16.518 ( -9.601 -4.353 0.293) 10.546 17.149 ( -8.429 1.878 -0.943) 8.687 17.476 ( 5.009 0.546 -0.293) 5.047 18.427 ( 2.960 0.721 3.806) 4.875 19.090 ( -5.032 1.600 -6.269) 8.196 19.338 ( 6.137 -1.803 0.465) 6.413 19.803 ( 3.750 -1.824 -9.509) 10.383 20.593 ( 5.918 2.407 1.673) 6.605 ======================= Grid point 225 (97/336) ======================= q-point: (-0.27 -0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.616 ( -24.789 -0.000 -0.494) 24.794 2.994 ( -23.202 -0.000 7.724) 24.454 3.594 ( 10.243 0.000 1.828) 10.405 4.962 ( -20.595 -0.000 2.147) 20.706 5.608 ( 8.899 0.000 -2.055) 9.133 6.296 ( 3.662 0.000 -5.452) 6.568 6.603 ( 11.482 0.000 -7.109) 13.504 7.178 ( 2.799 0.000 -9.060) 9.482 7.529 ( -9.086 -0.000 5.259) 10.498 7.582 ( 8.781 0.000 8.234) 12.038 7.983 ( 3.965 0.000 -4.817) 6.239 8.240 ( 2.037 0.000 -1.646) 2.619 8.856 ( -2.524 -0.000 -5.467) 6.021 9.577 ( -5.753 -0.000 -2.260) 6.181 9.885 ( 4.113 0.000 -15.707) 16.237 10.447 ( 4.326 0.000 14.071) 14.722 10.715 ( 0.167 0.000 -12.238) 12.239 11.511 ( -3.489 -0.000 17.152) 17.503 14.885 ( 7.574 0.000 -0.289) 7.580 15.897 ( -8.447 -0.000 12.054) 14.719 15.965 ( 8.625 0.000 1.305) 8.723 16.277 ( 6.560 0.000 2.864) 7.158 16.685 ( -15.736 -0.000 2.519) 15.936 17.328 ( 8.184 0.000 0.903) 8.234 17.405 ( -13.547 -0.000 3.078) 13.892 18.378 ( 2.108 0.000 2.276) 3.102 19.196 ( 5.412 0.000 1.598) 5.643 19.263 ( -7.284 -0.000 -7.874) 10.727 19.779 ( 3.611 0.000 -12.212) 12.735 20.472 ( 8.126 0.000 1.188) 8.213 ======================= Grid point 226 (98/336) ======================= q-point: (-0.18 -0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.083 ( -26.766 9.838 1.232) 28.543 2.603 ( -28.131 -5.513 7.060) 29.523 3.730 ( 7.606 3.577 -3.456) 9.088 4.603 ( -25.538 -7.683 2.169) 26.757 5.659 ( 0.102 -1.983 -6.594) 6.886 6.349 ( 3.464 -1.403 -4.202) 5.624 6.808 ( 14.956 6.261 -3.118) 16.511 7.154 ( 0.259 4.086 -5.756) 7.064 7.387 ( -5.938 2.190 2.176) 6.693 7.778 ( 7.453 -2.167 3.269) 8.422 8.071 ( 5.913 -0.071 -1.499) 6.101 8.342 ( 6.049 -9.689 1.054) 11.471 8.672 ( -10.932 0.090 -9.681) 14.602 9.578 ( 6.475 5.307 4.234) 9.382 9.844 ( -0.764 -1.767 -11.919) 12.074 10.566 ( 1.571 4.118 2.782) 5.212 10.713 ( 4.507 -6.839 -8.290) 11.654 11.491 ( -6.309 2.644 17.381) 18.679 15.027 ( 5.985 -3.928 0.432) 7.173 15.784 ( -9.442 2.228 9.427) 13.527 16.094 ( 4.823 2.170 0.545) 5.317 16.342 ( -5.710 4.201 4.515) 8.405 16.431 ( -7.332 -4.565 1.703) 8.803 17.173 ( -10.901 0.671 0.639) 10.940 17.478 ( 7.556 -0.106 -0.279) 7.562 18.438 ( 2.785 0.325 4.161) 5.018 19.113 ( -5.304 0.662 -6.466) 8.389 19.314 ( 6.862 -0.633 0.209) 6.894 19.788 ( 2.895 -0.132 -9.716) 10.139 20.620 ( 7.769 0.574 0.888) 7.841 ======================= Grid point 227 (99/336) ======================= q-point: (-0.09 -0.27 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -19.692 0.541 2.933) 19.916 2.157 ( -31.065 -6.257 5.302) 32.130 3.784 ( 6.196 4.602 -6.935) 10.376 4.185 ( -36.238 -15.378 3.526) 39.524 5.631 ( 0.121 0.354 -6.841) 6.851 6.394 ( 1.273 -2.314 -3.601) 4.465 6.942 ( 8.812 8.321 -2.378) 12.351 7.062 ( -2.832 7.253 1.817) 7.995 7.343 ( 2.745 -0.863 -2.898) 4.084 7.905 ( 2.011 -6.008 -1.997) 6.643 8.144 ( 7.186 7.777 2.035) 10.783 8.477 ( -5.445 -0.439 -7.753) 9.484 8.627 ( 9.563 -14.101 0.098) 17.038 9.626 ( 2.571 8.887 -1.236) 9.333 9.890 ( 7.640 -5.608 2.192) 9.727 10.459 ( -2.371 6.859 -13.672) 15.479 10.876 ( 3.662 -10.358 0.298) 10.990 11.390 ( -8.778 6.550 16.688) 19.961 15.179 ( 4.077 -8.707 1.613) 9.748 15.554 ( -13.870 9.938 4.326) 17.602 16.043 ( -6.774 1.531 -3.458) 7.759 16.156 ( -13.397 -7.287 3.931) 15.750 16.484 ( 4.970 3.529 5.598) 8.276 17.060 ( -0.571 1.451 -0.178) 1.569 17.590 ( 5.786 1.176 -0.714) 5.947 18.502 ( 2.540 0.412 4.280) 4.994 19.005 ( -3.023 0.985 -4.911) 5.850 19.443 ( 7.022 -0.373 -2.000) 7.311 19.803 ( 1.941 -2.015 -5.927) 6.555 20.731 ( 5.940 3.001 0.617) 6.684 ======================= Grid point 237 (100/336) ======================= q-point: (-0.18 -0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( -28.654 -0.000 3.262) 28.839 2.085 ( -30.656 -0.000 8.758) 31.883 3.829 ( 4.908 0.000 -6.746) 8.342 4.027 ( -36.216 -0.000 2.258) 36.286 5.631 ( 1.384 0.000 -7.710) 7.833 6.366 ( 0.813 0.000 -4.155) 4.234 7.042 ( 8.552 0.000 1.087) 8.621 7.152 ( 0.060 0.000 -4.880) 4.881 7.317 ( -2.316 -0.000 -1.664) 2.852 7.846 ( 2.092 0.000 0.210) 2.103 8.318 ( 16.668 0.000 1.263) 16.716 8.365 ( 1.035 0.000 3.348) 3.504 8.478 ( -3.016 -0.000 -8.964) 9.457 9.755 ( -1.893 -0.000 -8.483) 8.692 9.802 ( 11.081 0.000 9.512) 14.603 10.598 ( 0.316 0.000 -24.452) 24.454 10.697 ( 1.332 0.000 9.151) 9.247 11.458 ( -7.949 -0.000 17.693) 19.396 15.087 ( 2.347 0.000 2.733) 3.602 15.686 ( -7.819 -0.000 6.486) 10.159 15.984 ( -19.698 -0.000 0.144) 19.698 16.128 ( -7.798 -0.000 -2.130) 8.084 16.523 ( 6.994 0.000 4.350) 8.236 17.073 ( 0.101 0.000 1.584) 1.587 17.600 ( 5.943 0.000 -0.622) 5.975 18.506 ( 2.400 0.000 4.346) 4.965 19.015 ( -3.124 -0.000 -4.918) 5.827 19.439 ( 7.508 0.000 -1.568) 7.670 19.786 ( 1.157 0.000 -6.520) 6.622 20.759 ( 7.097 0.000 -0.238) 7.101 ======================= Grid point 238 (101/336) ======================= q-point: (-0.09 -0.18 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( -22.769 -8.355 4.851) 24.734 1.587 ( -31.191 -2.038 10.007) 32.820 3.331 ( -48.089 -8.777 4.832) 49.122 3.869 ( 4.472 1.371 -7.393) 8.748 5.634 ( 2.844 -0.020 -6.797) 7.368 6.339 ( -2.354 -2.374 -5.377) 6.332 7.098 ( 0.929 8.746 2.839) 9.242 7.122 ( 2.214 6.031 -2.053) 6.745 7.352 ( 3.450 -8.055 -2.360) 9.075 7.894 ( 2.523 -1.800 -0.541) 3.146 8.306 ( -1.184 4.032 3.048) 5.191 8.472 ( 6.533 4.871 -4.515) 9.317 8.686 ( 12.311 -10.531 -1.760) 16.296 9.672 ( -1.564 5.926 -4.178) 7.418 10.098 ( 14.618 -3.287 13.965) 20.482 10.392 ( -4.351 7.360 -27.221) 28.532 10.789 ( -1.257 -11.327 1.738) 11.528 11.368 ( -8.618 4.713 18.452) 20.903 15.149 ( -0.615 -6.180 4.948) 7.941 15.455 ( -12.201 14.420 0.828) 18.907 15.739 ( -13.982 -13.750 1.432) 19.663 15.918 ( -12.192 0.679 -4.137) 12.893 16.660 ( 7.376 3.746 3.900) 9.146 17.148 ( 6.662 1.824 -0.557) 6.930 17.681 ( 3.701 0.531 -0.267) 3.748 18.560 ( 1.649 0.115 3.636) 3.994 18.955 ( -1.311 0.443 -3.127) 3.419 19.553 ( 6.520 0.434 -4.290) 7.817 19.781 ( 0.028 -1.689 -2.293) 2.848 20.860 ( 5.726 2.251 -1.913) 6.443 ======================= Grid point 249 (102/336) ======================= q-point: (-0.09 -0.09 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.739 ( -23.292 -0.000 6.003) 24.053 1.116 ( -27.395 -0.000 17.395) 32.451 2.374 ( -57.073 -0.000 9.291) 57.824 3.922 ( 4.393 0.000 -5.588) 7.108 5.659 ( 3.416 0.000 -5.559) 6.524 6.242 ( -3.250 -0.000 -7.000) 7.717 7.186 ( -1.465 -0.000 6.959) 7.111 7.195 ( 2.913 0.000 -0.106) 2.915 7.330 ( 3.918 0.000 -5.133) 6.458 7.943 ( 3.177 0.000 1.238) 3.410 8.296 ( -2.164 -0.000 2.871) 3.596 8.584 ( 4.474 0.000 -3.540) 5.705 8.864 ( 12.390 0.000 -3.941) 13.001 9.697 ( 1.659 0.000 -1.083) 1.981 10.093 ( -16.013 -0.000 -42.828) 45.724 10.457 ( 17.761 0.000 19.026) 26.028 10.685 ( -4.530 -0.000 2.808) 5.329 11.372 ( -2.256 -0.000 27.622) 27.714 15.112 ( -2.912 -0.000 6.405) 7.036 15.290 ( -16.129 -0.000 -0.632) 16.142 15.486 ( -4.132 -0.000 -0.489) 4.161 15.704 ( -9.124 -0.000 -2.874) 9.566 16.831 ( 7.058 0.000 2.270) 7.414 17.233 ( 1.891 0.000 -10.354) 10.525 17.733 ( 1.961 0.000 0.777) 2.110 18.594 ( 0.511 0.000 2.343) 2.398 18.938 ( 0.073 0.000 -0.749) 0.752 19.626 ( 3.938 0.000 -7.237) 8.239 19.771 ( 0.383 0.000 1.983) 2.020 20.940 ( 3.496 0.000 -8.735) 9.408 ======================= Grid point 250 (103/336) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.402 ( -0.144 -0.000 13.052) 13.053 0.955 ( -3.413 -0.000 20.914) 21.191 1.743 ( -11.119 -0.000 37.601) 39.211 3.971 ( 3.848 0.000 -5.408) 6.638 5.833 ( 7.505 0.000 5.484) 9.295 5.967 ( 3.640 0.000 -9.504) 10.177 7.114 ( 1.976 0.000 3.102) 3.678 7.338 ( -7.293 -0.000 11.028) 13.222 7.485 ( 4.529 0.000 -3.676) 5.833 8.007 ( -2.707 -0.000 0.671) 2.789 8.428 ( 2.097 0.000 0.636) 2.191 8.585 ( 2.805 0.000 4.342) 5.169 8.923 ( 0.478 0.000 3.758) 3.788 9.063 ( 7.529 0.000 -2.824) 8.042 9.896 ( 3.086 0.000 5.276) 6.112 10.360 ( -6.612 -0.000 -8.920) 11.104 10.480 ( -9.190 -0.000 -12.408) 15.441 13.987 ( 28.467 0.000 0.762) 28.477 14.712 ( 1.210 0.000 -8.723) 8.806 15.105 ( -7.247 -0.000 5.107) 8.866 15.417 ( 3.133 0.000 -0.939) 3.271 15.673 ( -24.811 -0.000 5.948) 25.514 15.810 ( 19.436 0.000 -1.288) 19.479 16.943 ( -1.867 -0.000 -0.714) 1.999 17.902 ( 1.097 0.000 5.998) 6.098 18.576 ( -2.044 -0.000 -0.537) 2.113 18.978 ( -0.437 -0.000 1.487) 1.550 19.498 ( 1.287 0.000 -6.556) 6.681 19.861 ( 1.424 0.000 0.664) 1.571 20.162 ( -11.769 -0.000 0.560) 11.783 ======================= Grid point 251 (104/336) ======================= q-point: ( 0.09 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.874 ( 7.779 -41.656 9.204) 43.364 1.437 ( 34.708 -6.953 16.320) 38.978 1.814 ( 3.123 -2.525 30.183) 30.449 4.012 ( 2.088 -2.682 -5.946) 6.849 5.967 ( 4.369 1.612 4.307) 6.343 6.030 ( 5.705 -2.546 -6.726) 9.179 7.112 ( -3.906 7.864 3.931) 9.620 7.219 ( -1.349 3.897 5.949) 7.238 7.568 ( 0.806 -1.728 -2.578) 3.207 7.993 ( -1.957 -7.382 -0.097) 7.637 8.321 ( -8.875 1.928 0.218) 9.084 8.702 ( 7.393 2.859 7.042) 10.603 9.080 ( 9.441 5.782 0.016) 11.070 9.166 ( 4.942 -6.228 -2.672) 8.388 9.949 ( -1.521 -1.938 2.546) 3.543 10.243 ( -1.551 2.349 -10.653) 11.019 10.299 ( -2.529 -2.923 -11.794) 12.411 13.479 ( -36.858 24.498 16.312) 47.167 14.887 ( 11.895 2.053 -7.340) 14.127 15.109 ( -9.372 -16.722 2.126) 19.287 15.471 ( 5.990 2.294 1.079) 6.504 15.741 ( 11.247 -6.623 5.991) 14.361 16.299 ( 33.062 10.737 -11.888) 36.739 16.952 ( -1.943 -14.075 -3.411) 14.612 17.935 ( -0.116 0.737 5.839) 5.887 18.521 ( -3.829 0.158 -0.942) 3.946 19.017 ( 3.231 -2.533 0.281) 4.115 19.473 ( -1.057 -0.473 -6.735) 6.833 19.899 ( 2.928 0.118 1.098) 3.129 20.025 ( -5.085 0.267 -1.417) 5.285 ======================= Grid point 252 (105/336) ======================= q-point: ( 0.18 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( 8.901 -28.374 7.121) 30.578 1.854 ( 3.009 -5.279 26.420) 27.109 2.558 ( 46.693 -19.537 5.868) 50.954 4.033 ( -0.081 -2.675 -5.104) 5.763 5.996 ( -0.788 3.102 3.793) 4.963 6.113 ( 4.716 -1.358 -7.694) 9.126 6.949 ( -4.913 7.498 2.272) 9.247 7.212 ( 0.054 3.769 4.399) 5.793 7.518 ( -2.806 3.254 -2.405) 4.923 8.035 ( -1.918 -3.558 -0.561) 4.081 8.147 ( -8.247 -0.939 -2.052) 8.550 8.853 ( 8.793 5.234 12.255) 15.965 9.038 ( -7.423 0.205 0.871) 7.477 9.314 ( 4.937 -3.541 -8.711) 10.620 9.899 ( 1.457 6.528 -9.855) 11.910 10.159 ( -0.973 -3.892 -6.198) 7.383 10.384 ( 7.184 -4.871 -1.533) 8.815 12.762 ( -30.036 17.576 20.319) 40.298 15.024 ( 7.415 0.736 -5.959) 9.542 15.145 ( -0.412 -9.349 2.399) 9.660 15.619 ( 9.149 -4.268 1.135) 10.159 16.028 ( 11.601 -4.570 3.315) 12.902 16.473 ( 7.299 13.488 -1.625) 15.422 17.104 ( 2.515 -14.018 -4.774) 15.020 17.931 ( -2.175 1.443 5.407) 6.004 18.433 ( -4.700 0.653 -1.259) 4.909 19.126 ( 5.507 -2.530 -0.175) 6.063 19.405 ( -3.884 -1.166 -7.240) 8.299 19.913 ( -2.050 5.470 -9.036) 10.760 19.985 ( 5.149 -1.775 0.620) 5.482 ======================= Grid point 253 (106/336) ======================= q-point: ( 0.27 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.783 ( 6.797 -15.166 5.277) 17.437 2.115 ( 7.948 -9.223 16.216) 20.278 3.594 ( 41.116 -24.143 2.531) 47.748 4.000 ( -3.366 -0.785 -2.976) 4.561 5.920 ( -5.058 3.109 2.250) 6.350 6.153 ( 3.550 0.938 -8.412) 9.179 6.855 ( -1.333 0.952 1.002) 1.921 7.164 ( -1.531 9.133 4.399) 10.252 7.424 ( -2.861 2.153 -2.818) 4.556 7.919 ( -6.057 5.012 -4.618) 9.118 8.077 ( -4.255 -4.267 -0.631) 6.059 8.866 ( -7.456 5.589 -0.021) 9.318 9.004 ( 4.471 2.242 9.290) 10.551 9.315 ( -3.231 -4.853 -6.840) 8.988 9.822 ( 4.338 8.406 -13.919) 16.829 10.238 ( 6.537 -5.487 -5.755) 10.293 10.572 ( 5.721 -6.013 7.619) 11.267 12.232 ( -23.155 12.050 15.894) 30.561 15.085 ( 2.126 -2.651 -4.608) 5.726 15.284 ( 7.380 -1.932 2.976) 8.189 15.879 ( 11.322 -9.089 0.646) 14.533 16.223 ( 7.233 4.601 -0.376) 8.580 16.447 ( 0.564 1.156 5.321) 5.474 17.208 ( -2.701 -8.704 2.978) 9.588 17.875 ( -5.000 1.896 4.806) 7.189 18.346 ( -2.924 0.911 -1.419) 3.375 19.238 ( 3.075 -0.721 0.640) 3.223 19.304 ( -3.555 -1.957 -5.675) 6.977 19.763 ( -0.562 8.678 -14.930) 17.278 20.116 ( 6.842 -2.805 -0.829) 7.441 ======================= Grid point 254 (107/336) ======================= q-point: ( 0.36 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( 2.088 -3.104 4.083) 5.537 2.450 ( 11.977 -11.761 5.283) 17.598 3.825 ( -11.779 0.745 -1.863) 11.949 4.521 ( 30.974 -23.533 2.521) 38.981 5.827 ( -1.329 2.126 -0.278) 2.523 6.143 ( 1.657 3.341 -6.813) 7.767 6.866 ( -2.846 -2.555 0.045) 3.825 7.011 ( -5.089 10.137 5.055) 12.418 7.356 ( 0.199 3.242 -3.422) 4.718 7.741 ( -5.812 4.432 -5.757) 9.304 8.060 ( 0.057 -3.614 -3.391) 4.956 8.676 ( -4.537 8.817 -2.612) 10.254 9.001 ( -8.335 -4.654 -1.439) 9.655 9.325 ( 4.368 3.207 4.345) 6.946 9.764 ( 4.442 6.474 -13.215) 15.371 10.376 ( 5.146 -5.215 -10.132) 12.504 10.766 ( 4.902 -4.242 14.989) 16.331 11.850 ( -16.811 5.887 11.922) 21.434 15.125 ( 2.607 -1.375 -4.352) 5.256 15.453 ( 7.205 -2.374 3.392) 8.310 16.106 ( 0.201 -3.200 4.475) 5.505 16.259 ( 8.754 1.834 -0.190) 8.947 16.532 ( 2.622 -3.444 3.356) 5.477 17.214 ( -7.033 -6.238 8.609) 12.747 17.756 ( -8.526 2.106 3.836) 9.584 18.317 ( 1.028 0.161 -0.517) 1.162 19.149 ( -6.645 -1.852 -7.341) 10.073 19.368 ( 3.743 1.757 6.134) 7.398 19.617 ( 3.570 8.223 -19.552) 21.509 20.264 ( 6.701 -3.424 -1.665) 7.707 ======================= Grid point 255 (108/336) ======================= q-point: ( 0.45 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( -0.866 4.620 2.910) 5.528 2.771 ( 9.741 -9.675 -2.756) 14.003 3.536 ( -17.351 0.860 -0.451) 17.378 5.124 ( 11.642 -15.748 3.054) 19.821 5.839 ( -0.305 1.496 -2.630) 3.041 6.132 ( 8.054 1.264 -4.405) 9.267 6.624 ( -11.173 12.904 1.757) 17.159 6.983 ( -1.714 -2.780 1.287) 3.510 7.351 ( -0.081 -0.329 -2.618) 2.640 7.606 ( 0.478 2.344 -5.930) 6.395 8.107 ( 3.683 -0.483 -5.912) 6.982 8.550 ( 0.361 4.623 -3.257) 5.666 8.834 ( -12.568 -4.509 -4.328) 14.036 9.383 ( 4.718 6.728 0.819) 8.258 9.767 ( 7.291 4.119 -5.370) 9.948 10.383 ( -1.831 -1.257 -13.121) 13.308 10.963 ( 5.565 -1.707 15.931) 16.961 11.634 ( -11.530 -1.865 11.144) 16.143 15.165 ( 2.710 -0.891 -3.852) 4.793 15.593 ( 3.817 -2.637 0.560) 4.673 16.080 ( -3.937 0.187 9.706) 10.475 16.435 ( 5.507 -2.216 3.794) 7.046 16.589 ( 0.694 -0.532 -1.126) 1.425 17.183 ( -7.128 -5.539 10.124) 13.564 17.576 ( -10.107 1.830 2.445) 10.558 18.373 ( 4.089 -1.177 1.191) 4.418 19.023 ( -5.641 -2.070 -7.154) 9.343 19.365 ( 0.675 6.690 -3.347) 7.510 19.620 ( 9.797 3.503 -9.625) 14.173 20.398 ( 5.459 -3.638 -2.396) 6.984 ======================= Grid point 256 (109/336) ======================= q-point: (-0.45 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( -1.985 8.087 3.585) 9.066 2.786 ( -15.086 1.941 -3.391) 15.584 3.360 ( -0.245 -7.672 -3.898) 8.609 5.242 ( -9.253 7.573 5.899) 13.333 5.588 ( -14.683 -0.451 -5.855) 15.814 6.366 ( 3.573 1.758 -5.061) 6.440 6.524 ( 18.314 1.435 4.811) 18.990 6.959 ( -3.434 -3.076 -0.461) 4.633 7.250 ( -6.847 -0.623 -4.884) 8.433 7.729 ( 10.575 -5.769 -3.682) 12.596 8.091 ( 0.999 7.017 -5.744) 9.123 8.550 ( -1.907 -0.287 -2.858) 3.448 8.671 ( -1.993 -1.592 -3.854) 4.622 9.372 ( 1.150 1.623 -6.905) 7.186 9.894 ( 10.731 3.555 3.719) 11.901 10.255 ( -3.892 2.017 -13.880) 14.556 11.115 ( 3.602 1.705 12.843) 13.448 11.548 ( -9.825 -7.390 11.871) 17.090 15.199 ( 0.730 -2.885 -3.374) 4.499 15.620 ( -1.560 0.391 -1.865) 2.463 16.062 ( -5.705 -1.885 9.346) 11.111 16.517 ( 0.299 -1.054 3.886) 4.037 16.566 ( -0.594 4.378 3.260) 5.491 17.111 ( -12.073 -4.164 7.053) 14.589 17.472 ( -0.498 -1.929 2.414) 3.130 18.476 ( 4.417 -1.596 2.630) 5.383 18.930 ( -3.393 -1.972 -6.196) 7.334 19.308 ( 3.345 4.873 -9.545) 11.227 19.736 ( 9.199 3.928 -2.712) 10.363 20.505 ( 4.264 -3.752 -3.977) 6.934 ======================= Grid point 257 (110/336) ======================= q-point: (-0.36 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.788 ( -3.501 10.867 5.555) 12.697 2.326 ( -27.921 4.305 1.529) 28.292 3.502 ( 7.547 -7.112 -7.817) 12.986 4.650 ( -35.595 20.123 4.547) 41.141 5.518 ( 1.643 -1.156 -2.695) 3.362 6.358 ( 2.204 3.089 -4.708) 6.047 6.801 ( 4.862 1.736 -1.010) 5.261 6.972 ( -1.904 -8.278 2.841) 8.957 7.233 ( 9.271 -5.293 -3.512) 11.238 7.950 ( 2.130 -4.942 -5.620) 7.781 8.011 ( 7.518 5.329 -2.395) 9.521 8.445 ( -4.116 2.041 0.689) 4.646 8.732 ( 6.161 2.101 -5.648) 8.618 9.365 ( -0.641 -6.682 -7.113) 9.780 10.049 ( -0.184 -3.610 -5.116) 6.264 10.152 ( 8.924 7.927 -2.022) 12.106 11.162 ( 0.095 6.051 9.014) 10.857 11.520 ( -8.802 -9.648 12.945) 18.388 15.208 ( -4.303 -8.098 -3.193) 9.710 15.533 ( -3.334 6.456 0.251) 7.271 15.958 ( -9.572 -0.788 1.330) 9.696 16.408 ( -9.950 8.211 1.548) 12.993 16.589 ( 0.070 -1.092 8.152) 8.226 17.013 ( -3.886 -5.677 5.787) 8.990 17.565 ( 4.227 -3.785 2.989) 6.414 18.569 ( 2.875 -0.973 3.233) 4.435 18.885 ( -0.964 -1.735 -4.628) 5.035 19.314 ( 5.925 1.658 -10.546) 12.210 19.824 ( 6.028 5.089 -0.361) 7.897 20.590 ( 4.088 -3.647 -7.132) 8.993 ======================= Grid point 258 (111/336) ======================= q-point: (-0.27 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.568 ( -10.312 18.196 1.761) 20.989 1.838 ( -24.621 0.016 13.951) 28.299 3.654 ( 5.137 -2.876 -6.648) 8.880 3.770 ( -40.605 19.732 6.470) 45.607 5.563 ( 5.313 2.681 -2.299) 6.379 6.289 ( -2.138 6.389 -7.784) 10.295 6.833 ( 2.318 -4.888 -5.587) 7.777 7.032 ( -2.360 -11.363 5.045) 12.655 7.518 ( 13.936 2.157 3.802) 14.605 7.878 ( -0.410 2.199 -3.059) 3.790 8.219 ( 9.113 -6.865 -5.469) 12.653 8.400 ( -0.438 1.942 4.499) 4.920 8.758 ( 5.537 5.842 -8.099) 11.418 9.399 ( -3.810 -11.876 -3.923) 13.075 9.947 ( -3.664 0.682 -11.793) 12.368 10.354 ( 11.638 -0.117 4.901) 12.628 11.087 ( -3.313 9.964 5.395) 11.805 11.565 ( -2.209 -8.956 16.690) 19.070 15.154 ( -13.105 -14.608 -2.693) 19.809 15.414 ( 1.303 13.042 1.448) 13.187 15.786 ( -8.683 0.425 -2.442) 9.030 16.073 ( -16.130 10.936 2.598) 19.660 16.641 ( -0.984 -5.682 2.953) 6.479 17.096 ( 2.568 -3.521 3.894) 5.844 17.685 ( 3.555 -2.849 3.506) 5.749 18.623 ( 0.989 -0.255 2.747) 2.931 18.888 ( 1.295 -1.448 -2.170) 2.912 19.378 ( 6.664 -0.332 -9.882) 11.924 19.848 ( 2.190 4.865 0.834) 5.400 20.650 ( 3.618 -2.561 -11.764) 12.572 ======================= Grid point 259 (112/336) ======================= q-point: (-0.18 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.115 ( -17.973 17.929 1.877) 25.456 1.576 ( -14.976 5.584 23.824) 28.688 2.799 ( -47.213 18.036 12.031) 51.953 3.801 ( 7.962 -0.962 -4.552) 9.222 5.630 ( 7.131 4.726 -2.126) 8.815 6.126 ( -3.047 6.657 -10.168) 12.529 6.941 ( 3.997 -9.512 -4.768) 11.366 7.146 ( -1.181 -11.968 5.402) 13.184 7.605 ( 3.425 12.332 5.982) 14.128 7.940 ( 4.532 -3.403 1.316) 5.819 8.370 ( 2.752 -1.988 -5.526) 6.485 8.409 ( 1.300 -2.087 3.931) 4.637 8.796 ( 9.370 3.932 -8.863) 13.483 9.364 ( -13.399 -12.339 -3.216) 18.496 9.837 ( 0.953 6.477 -6.350) 9.120 10.533 ( 1.446 -7.577 -1.899) 7.944 10.916 ( -5.964 10.597 1.654) 12.272 11.870 ( 19.944 -7.781 27.929) 35.190 15.006 ( -16.171 -13.552 -2.868) 21.293 15.359 ( 4.544 11.085 0.244) 11.982 15.639 ( -5.975 2.531 -1.166) 6.593 15.706 ( -12.562 10.069 2.074) 16.232 16.658 ( -8.802 -12.292 -3.038) 15.421 17.125 ( 0.239 5.576 -2.788) 6.239 17.776 ( 2.365 -1.651 4.498) 5.344 18.634 ( -0.653 0.350 1.263) 1.465 18.934 ( 2.584 -0.895 0.759) 2.838 19.450 ( 5.309 -0.475 -8.710) 10.211 19.834 ( 0.338 2.657 1.332) 2.991 20.631 ( -1.123 -0.061 -16.270) 16.308 ======================= Grid point 260 (113/336) ======================= q-point: (-0.09 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.667 ( -13.065 20.411 7.826) 25.467 1.300 ( -20.921 14.559 20.265) 32.562 1.975 ( -34.883 6.279 27.870) 45.089 3.912 ( 6.406 1.063 -4.281) 7.778 5.707 ( 7.432 4.519 0.413) 8.708 5.996 ( -0.246 3.408 -10.243) 10.798 7.066 ( 2.105 -5.407 -2.668) 6.387 7.256 ( -2.976 -14.998 6.312) 16.542 7.551 ( 1.609 13.899 5.530) 15.045 8.022 ( 0.960 -0.656 2.369) 2.639 8.348 ( 1.095 1.129 0.257) 1.594 8.514 ( 3.039 -3.943 1.464) 5.189 8.923 ( 10.876 1.595 -6.974) 13.018 9.115 ( -19.228 -3.310 -0.598) 19.520 9.827 ( 5.006 5.250 1.511) 7.409 10.511 ( -7.958 -5.850 -6.463) 11.804 10.703 ( -8.040 5.369 -5.624) 11.184 12.781 ( 54.631 -15.435 30.875) 64.622 14.847 ( -12.424 -11.247 -6.436) 17.952 15.311 ( -0.297 17.208 3.245) 17.514 15.417 ( -4.223 3.652 -1.282) 5.728 15.625 ( 2.692 -0.102 0.690) 2.781 16.377 ( -35.787 -8.790 -11.894) 38.723 17.009 ( 0.856 11.661 -2.460) 11.949 17.846 ( 1.690 -0.767 5.539) 5.841 18.611 ( -1.571 0.517 0.052) 1.655 18.979 ( 0.997 0.479 1.517) 1.877 19.490 ( 3.138 0.041 -7.331) 7.975 19.835 ( 0.753 0.023 1.150) 1.375 20.435 ( -11.497 2.529 -12.414) 17.108 ======================= Grid point 262 (114/336) ======================= q-point: ( 0.09 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( 22.385 0.000 12.295) 25.539 1.805 ( 2.641 0.000 28.660) 28.781 2.384 ( 47.167 0.000 5.221) 47.455 4.002 ( 1.103 0.000 -5.832) 5.935 6.035 ( -1.771 -0.000 4.697) 5.020 6.089 ( 6.532 0.000 -9.259) 11.331 7.096 ( -8.425 -0.000 3.862) 9.268 7.139 ( -2.947 -0.000 2.031) 3.579 7.672 ( 6.336 0.000 -0.611) 6.365 7.902 ( -2.202 -0.000 0.624) 2.289 8.157 ( -8.956 -0.000 -3.214) 9.515 8.912 ( 9.124 0.000 13.781) 16.528 8.973 ( -13.926 -0.000 -0.941) 13.958 9.339 ( 8.892 0.000 -7.709) 11.769 9.950 ( 1.234 0.000 2.571) 2.852 10.129 ( 0.125 0.000 -17.130) 17.131 10.331 ( 6.436 0.000 -3.496) 7.324 12.957 ( -37.630 -0.000 20.371) 42.790 14.947 ( -3.112 -0.000 2.153) 3.784 15.121 ( 16.295 0.000 -6.455) 17.527 15.573 ( 4.489 0.000 2.302) 5.044 15.970 ( 13.897 0.000 4.210) 14.521 16.752 ( -7.898 -0.000 0.397) 7.908 16.831 ( 19.938 0.000 -10.970) 22.756 17.945 ( -2.185 -0.000 5.402) 5.827 18.440 ( -4.636 -0.000 -0.947) 4.731 19.098 ( 6.935 0.000 -1.020) 7.009 19.393 ( -4.082 -0.000 -7.101) 8.190 19.964 ( 4.211 0.000 0.878) 4.301 19.973 ( -0.489 -0.000 -7.480) 7.496 ======================= Grid point 263 (115/336) ======================= q-point: ( 0.18 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 22.561 -6.706 11.047) 26.000 2.002 ( 6.335 -2.758 20.547) 21.677 3.275 ( 44.566 -8.264 1.214) 45.342 3.979 ( -2.105 -0.898 -4.939) 5.444 5.954 ( -7.002 0.704 -0.255) 7.042 6.158 ( 5.475 -0.056 -8.682) 10.265 6.932 ( -5.335 5.922 0.738) 8.004 7.141 ( -3.149 -6.709 1.231) 7.512 7.654 ( 2.286 16.664 2.747) 17.043 7.957 ( -2.709 -8.872 1.293) 9.366 7.990 ( -4.279 1.624 -6.568) 8.005 8.703 ( -18.566 -9.982 -1.893) 21.165 9.124 ( 7.058 4.435 14.996) 17.157 9.356 ( 1.615 3.928 -6.823) 8.037 9.959 ( 2.478 5.131 -6.064) 8.321 10.142 ( 6.812 -4.021 -13.748) 15.861 10.469 ( 6.396 -3.543 5.129) 8.931 12.414 ( -29.514 5.544 17.354) 34.684 14.946 ( -1.571 -5.782 0.732) 6.036 15.383 ( 17.297 6.570 -4.355) 19.008 15.703 ( 6.205 -7.659 2.663) 10.211 16.232 ( 12.646 -0.892 1.050) 12.720 16.569 ( -6.671 6.795 1.992) 9.728 17.046 ( 2.468 -6.458 1.273) 7.030 17.901 ( -5.059 0.722 4.724) 6.959 18.360 ( -3.156 0.426 -0.930) 3.318 19.232 ( 6.668 0.035 0.296) 6.674 19.271 ( -5.174 -1.184 -6.923) 8.724 19.901 ( 0.429 4.796 -14.076) 14.877 20.064 ( 5.431 -2.279 -0.245) 5.895 ======================= Grid point 264 (116/336) ======================= q-point: ( 0.27 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 17.833 4.142 9.878) 20.802 2.279 ( 12.260 -6.086 9.762) 16.812 3.837 ( -6.966 0.850 -4.823) 8.515 4.132 ( 31.964 -15.828 1.196) 35.689 5.824 ( -5.344 -1.534 -3.716) 6.687 6.199 ( 3.871 2.225 -6.866) 8.190 6.815 ( -4.634 -0.299 -1.987) 5.051 7.138 ( -3.063 -0.940 0.842) 3.313 7.522 ( -0.550 15.773 4.140) 16.317 7.815 ( -5.547 3.103 -6.682) 9.222 8.008 ( 0.060 -1.864 -1.587) 2.449 8.548 ( -13.465 -18.392 -1.288) 22.831 9.069 ( -5.568 10.004 -2.542) 11.728 9.429 ( 8.900 4.980 7.609) 12.725 9.899 ( 2.147 6.959 -9.903) 12.293 10.269 ( 7.229 -5.583 -11.657) 14.809 10.660 ( 5.276 -5.705 12.349) 14.590 11.964 ( -22.675 4.998 12.347) 26.298 14.992 ( -1.098 -8.068 -0.919) 8.194 15.547 ( 11.543 8.943 0.855) 14.627 15.954 ( 8.525 -10.522 0.712) 13.561 16.357 ( 0.914 6.254 -0.470) 6.338 16.495 ( 4.269 -1.157 2.549) 5.105 17.094 ( -5.477 -5.506 9.786) 12.493 17.789 ( -8.663 1.279 3.752) 9.527 18.324 ( 0.179 0.429 -0.308) 0.558 19.120 ( -6.797 -1.065 -7.540) 10.207 19.385 ( 6.863 0.397 4.785) 8.376 19.781 ( 2.118 7.719 -18.790) 20.424 20.189 ( 5.373 -3.961 -1.303) 6.801 ======================= Grid point 265 (117/336) ======================= q-point: ( 0.36 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( 11.681 15.417 7.679) 20.811 2.618 ( 15.336 -5.848 0.494) 16.421 3.565 ( -17.686 1.930 -4.183) 18.276 4.792 ( 20.882 -16.997 1.978) 26.998 5.792 ( -1.709 -5.878 -4.285) 7.472 6.183 ( 2.298 4.293 -5.394) 7.267 6.722 ( -8.098 -3.850 -3.591) 9.659 7.041 ( -2.647 8.801 3.295) 9.763 7.400 ( -2.708 6.524 1.695) 7.264 7.686 ( -0.465 4.979 -6.138) 7.917 8.053 ( 4.368 -3.611 -4.562) 7.275 8.517 ( -7.565 -13.181 -0.799) 15.219 8.837 ( -6.739 9.052 -5.487) 12.549 9.523 ( 4.208 6.595 -0.008) 7.824 9.853 ( 3.866 4.324 -4.315) 7.229 10.355 ( 3.478 -1.350 -10.422) 11.069 10.872 ( 4.486 -6.842 14.563) 16.704 11.636 ( -15.877 1.460 9.795) 18.712 15.037 ( -2.634 -9.023 -2.342) 9.687 15.658 ( 8.461 6.409 2.560) 10.918 16.090 ( -1.301 0.050 5.136) 5.298 16.374 ( 5.096 -2.523 0.153) 5.688 16.599 ( 4.746 0.765 -0.816) 4.876 17.075 ( -7.679 -5.205 13.229) 16.157 17.606 ( -11.543 1.257 2.329) 11.843 18.359 ( 3.556 -0.301 0.797) 3.656 18.987 ( -5.524 -1.536 -7.246) 9.240 19.472 ( 1.372 4.021 2.359) 4.859 19.717 ( 9.326 6.194 -15.612) 19.211 20.311 ( 4.004 -5.069 -1.835) 6.716 ======================= Grid point 266 (118/336) ======================= q-point: (-0.55 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( 7.388 21.389 4.811) 23.134 2.844 ( 1.919 3.857 -5.118) 6.689 3.233 ( -10.603 -4.782 -3.254) 12.078 5.198 ( 10.057 -9.266 2.607) 13.921 5.609 ( -22.919 0.525 -3.488) 23.189 6.306 ( 11.468 -5.679 -3.495) 13.266 6.610 ( 0.437 1.730 -0.278) 1.806 6.958 ( -0.958 5.780 2.150) 6.241 7.268 ( -7.339 2.637 -2.686) 8.248 7.685 ( 6.763 1.439 -4.827) 8.433 8.158 ( 5.270 -0.948 -5.076) 7.378 8.534 ( -0.329 -8.251 -1.562) 8.404 8.631 ( -5.375 5.862 -4.490) 9.133 9.452 ( -1.545 5.566 -9.688) 11.280 9.912 ( 3.189 -1.827 0.930) 3.791 10.333 ( 2.701 5.797 -8.720) 10.813 11.058 ( 1.069 -6.940 12.792) 14.592 11.463 ( -8.988 -1.595 10.671) 14.042 15.040 ( -6.252 -10.347 -3.017) 12.460 15.731 ( 5.882 7.238 0.010) 9.326 16.060 ( -3.132 2.431 8.694) 9.556 16.479 ( 1.521 -2.858 2.957) 4.384 16.636 ( 1.940 2.783 -0.476) 3.425 17.030 ( -10.542 -3.944 11.377) 16.003 17.434 ( -6.172 -1.963 1.287) 6.604 18.451 ( 4.982 -0.908 1.715) 5.347 18.894 ( -3.180 -1.735 -6.330) 7.294 19.411 ( 0.682 5.478 -7.740) 9.507 19.825 ( 11.536 5.029 -4.552) 13.383 20.410 ( 2.348 -5.856 -2.548) 6.804 ======================= Grid point 267 (119/336) ======================= q-point: (-0.45 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 0.890 19.593 5.649) 20.410 2.485 ( -20.004 13.379 -5.025) 24.585 3.352 ( 9.755 -8.025 -5.435) 13.751 4.976 ( -34.185 12.440 1.653) 36.416 5.452 ( 6.902 -5.245 0.212) 8.672 6.403 ( 1.749 1.323 -2.331) 3.200 6.784 ( 0.060 -11.617 0.455) 11.626 6.921 ( 4.567 10.303 3.467) 11.791 7.142 ( 3.276 -3.120 -6.112) 7.604 7.811 ( 6.049 -5.426 -5.231) 9.664 8.177 ( 3.196 6.791 -2.655) 7.961 8.497 ( -2.211 4.494 -1.220) 5.155 8.668 ( 6.530 -7.758 -4.198) 10.975 9.318 ( -3.883 1.334 -10.304) 11.092 9.950 ( -3.394 -6.792 -4.057) 8.609 10.316 ( 7.170 8.339 -4.540) 11.898 11.140 ( -5.718 -8.019 10.792) 14.611 11.432 ( -1.435 0.888 12.131) 12.248 14.988 ( -9.955 -11.920 -3.119) 15.840 15.731 ( 4.113 9.760 -1.634) 10.717 15.985 ( -5.695 4.767 6.126) 9.627 16.477 ( -8.463 -0.664 3.564) 9.207 16.621 ( -0.466 3.668 2.170) 4.287 16.910 ( -6.641 -4.057 9.324) 12.145 17.470 ( 2.743 -6.109 2.128) 7.027 18.552 ( 4.067 -0.672 2.218) 4.681 18.850 ( -0.762 -1.762 -4.871) 5.236 19.361 ( 3.292 3.117 -9.779) 10.779 19.938 ( 7.917 6.390 -1.206) 10.245 20.492 ( 2.410 -6.305 -4.688) 8.218 ======================= Grid point 268 (120/336) ======================= q-point: (-0.36 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( -23.294 3.805 11.252) 26.147 2.022 ( -2.108 27.450 -3.848) 27.798 3.571 ( 10.067 -4.932 -4.893) 12.232 4.175 ( -38.357 20.249 4.756) 43.633 5.605 ( 7.966 1.398 0.087) 8.088 6.398 ( 1.060 4.066 -4.614) 6.241 6.793 ( -2.920 -4.722 -1.255) 5.692 6.826 ( -5.897 -3.563 0.147) 6.892 7.466 ( 19.036 -5.361 2.441) 19.926 7.890 ( -0.758 -4.001 -5.733) 7.032 8.183 ( 5.859 4.225 -1.986) 7.491 8.449 ( 0.198 3.119 2.541) 4.028 8.815 ( 7.385 -0.452 -7.787) 10.742 9.216 ( -5.547 -5.844 -5.711) 9.876 9.912 ( -3.328 -5.189 -7.214) 9.489 10.365 ( 4.357 1.069 -3.751) 5.848 11.132 ( -7.666 -6.224 8.423) 12.979 11.494 ( 4.767 3.328 15.022) 16.108 14.892 ( -12.061 -12.188 -3.046) 17.416 15.686 ( 3.452 11.623 -1.480) 12.215 15.836 ( -5.988 7.273 2.261) 9.688 16.207 ( -18.938 2.502 2.920) 19.325 16.580 ( -2.847 0.387 1.156) 3.097 17.008 ( 4.425 -5.271 8.722) 11.110 17.603 ( 3.657 -5.743 2.765) 7.349 18.620 ( 1.931 -0.018 2.140) 2.883 18.856 ( 1.405 -1.751 -2.651) 3.474 19.380 ( 5.412 0.550 -9.511) 10.957 19.960 ( 1.952 6.484 0.325) 6.779 20.574 ( 3.595 -5.188 -8.779) 10.812 ======================= Grid point 269 (121/336) ======================= q-point: (-0.27 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.414 ( -21.478 10.146 7.008) 24.766 1.790 ( -4.379 17.933 13.739) 23.012 3.283 ( -36.492 30.502 7.913) 48.215 3.767 ( 9.104 -2.684 -2.640) 9.851 5.718 ( 8.092 4.098 -1.040) 9.129 6.292 ( -1.325 9.329 -8.858) 12.933 6.773 ( -0.659 -6.757 -3.029) 7.434 6.899 ( -1.065 -13.151 4.340) 13.890 7.781 ( 7.075 3.903 5.453) 9.748 7.869 ( 3.466 -3.068 -1.477) 4.859 8.268 ( 4.073 -4.524 -3.658) 7.102 8.438 ( -1.308 2.140 3.626) 4.409 8.883 ( 9.122 5.092 -10.408) 14.747 9.159 ( -8.825 -8.674 0.389) 12.380 9.892 ( 1.184 -1.562 -6.306) 6.603 10.388 ( -2.642 -7.279 -7.192) 10.569 11.040 ( -8.867 1.054 2.929) 9.398 11.749 ( 16.434 -2.753 23.432) 28.752 14.775 ( -11.227 -10.238 -3.501) 15.592 15.627 ( 4.457 14.041 -1.558) 14.813 15.672 ( -6.419 3.517 -0.737) 7.356 15.872 ( -14.622 5.588 5.303) 16.527 16.497 ( -8.950 -3.511 -2.766) 10.005 17.163 ( 4.835 -1.178 4.274) 6.560 17.722 ( 2.684 -4.128 3.720) 6.171 18.641 ( -0.066 0.429 1.219) 1.294 18.908 ( 3.028 -1.676 0.517) 3.499 19.440 ( 5.547 -0.454 -8.669) 10.302 19.906 ( -1.702 4.602 1.183) 5.048 20.609 ( 1.043 -2.287 -13.914) 14.139 ======================= Grid point 270 (122/336) ======================= q-point: (-0.18 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -10.407 15.337 10.656) 21.379 1.648 ( -4.970 13.564 25.528) 29.332 2.380 ( -30.887 38.588 11.580) 50.766 3.927 ( 7.969 -0.139 -1.811) 8.174 5.804 ( 6.743 4.149 -2.067) 8.183 6.133 ( -0.292 9.879 -10.999) 14.787 6.875 ( 2.039 -12.539 -0.825) 12.730 7.009 ( -2.452 -10.720 4.559) 11.904 7.772 ( 1.850 8.350 5.268) 10.044 8.001 ( 3.280 -0.961 3.745) 5.070 8.377 ( 1.845 -1.029 -4.678) 5.133 8.392 ( -1.361 -5.724 4.775) 7.578 8.965 ( 4.346 0.643 -7.039) 8.298 9.059 ( -4.303 0.574 3.049) 5.305 9.925 ( 4.882 2.083 -3.717) 6.480 10.347 ( -6.454 -10.159 -10.758) 16.144 10.826 ( -11.049 5.973 -2.141) 12.741 12.389 ( 29.492 -20.014 29.841) 46.485 14.679 ( -5.332 -6.082 -5.211) 9.621 15.475 ( -8.786 2.237 -1.161) 9.140 15.630 ( 4.397 3.458 -0.493) 5.615 15.677 ( 1.269 15.285 4.915) 16.106 16.248 ( -21.483 -2.147 -6.280) 22.485 17.213 ( 2.814 6.711 -1.831) 7.504 17.814 ( 1.848 -2.685 4.958) 5.933 18.624 ( -1.501 0.673 -0.043) 1.646 18.984 ( 2.769 -0.364 2.536) 3.772 19.491 ( 3.784 -0.000 -7.663) 8.547 19.848 ( -1.549 1.550 1.789) 2.829 20.492 ( -7.057 2.270 -16.042) 17.672 ======================= Grid point 271 (123/336) ======================= q-point: (-0.09 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.964 ( 16.580 16.278 16.352) 28.412 1.379 ( -9.041 49.426 8.952) 51.037 1.782 ( -12.349 7.882 33.808) 36.845 4.014 ( 4.493 2.993 -4.250) 6.871 5.868 ( 5.045 2.262 0.812) 5.588 6.023 ( 2.508 5.734 -8.800) 10.799 7.057 ( 4.824 -9.527 1.297) 10.757 7.073 ( -3.817 -11.992 5.870) 13.886 7.692 ( -3.195 11.111 3.436) 12.061 8.060 ( 1.895 3.419 0.603) 3.955 8.370 ( -0.946 -4.915 1.880) 5.347 8.530 ( 4.923 -5.293 2.489) 7.645 8.900 ( -1.774 -2.005 3.051) 4.059 9.128 ( 8.999 6.371 -1.603) 11.141 9.967 ( 3.269 3.892 -0.489) 5.106 10.276 ( -4.170 -7.055 -11.963) 14.501 10.540 ( -11.424 5.550 -7.177) 14.588 13.299 ( 12.266 -45.357 21.249) 51.568 14.698 ( 8.877 -0.349 -7.711) 11.764 15.366 ( -1.403 -2.319 1.244) 2.982 15.585 ( -1.925 24.910 -3.244) 25.194 15.715 ( -11.441 2.468 -0.667) 11.723 15.804 ( 9.642 2.601 1.723) 10.134 17.123 ( 0.266 13.429 -4.469) 14.155 17.887 ( 1.179 -1.608 5.789) 6.123 18.580 ( -2.449 0.364 -0.755) 2.588 19.014 ( 0.917 2.761 1.656) 3.348 19.503 ( 1.561 0.506 -6.757) 6.953 19.848 ( 0.838 -0.879 2.091) 2.418 20.214 ( -11.406 4.357 -7.385) 14.269 ======================= Grid point 274 (124/336) ======================= q-point: ( 0.18 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( 26.786 0.000 11.606) 29.192 2.216 ( 10.456 0.000 13.015) 16.695 3.863 ( -8.644 -0.000 -5.412) 10.199 3.954 ( 35.311 0.000 -0.512) 35.315 5.804 ( -7.373 -0.000 -4.959) 8.885 6.221 ( 5.474 0.000 -6.994) 8.881 6.829 ( -9.293 -0.000 -2.426) 9.605 7.096 ( 1.880 0.000 -1.143) 2.201 7.766 ( -5.277 -0.000 3.839) 6.525 7.868 ( -1.414 -0.000 0.909) 1.681 7.969 ( 4.999 0.000 -5.252) 7.251 8.281 ( -19.080 -0.000 -1.809) 19.165 9.184 ( -6.025 -0.000 -0.665) 6.061 9.480 ( 8.927 0.000 7.361) 11.571 9.986 ( -0.349 -0.000 -5.954) 5.964 10.198 ( 9.954 0.000 -14.773) 17.813 10.594 ( 5.282 0.000 10.798) 12.020 12.016 ( -25.045 -0.000 12.629) 28.049 14.906 ( -0.602 -0.000 0.214) 0.639 15.733 ( 1.821 0.000 6.469) 6.721 15.751 ( 19.803 0.000 -6.145) 20.735 16.445 ( 11.272 0.000 -2.495) 11.545 16.468 ( -7.414 -0.000 2.491) 7.821 17.034 ( -4.135 -0.000 11.123) 11.866 17.802 ( -8.760 -0.000 3.721) 9.517 18.329 ( -0.132 -0.000 -0.181) 0.223 19.110 ( -6.869 -0.000 -7.620) 10.260 19.389 ( 7.851 0.000 4.423) 9.011 19.868 ( 2.118 0.000 -20.445) 20.554 20.140 ( 4.479 0.000 0.441) 4.501 ======================= Grid point 275 (125/336) ======================= q-point: ( 0.27 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.444 ( 14.338 6.323 8.636) 17.893 2.563 ( 22.559 0.798 6.966) 23.623 3.597 ( -17.253 1.060 -6.653) 18.522 4.531 ( 25.075 -8.210 0.129) 26.385 5.679 ( -5.884 -3.936 -6.210) 9.417 6.273 ( 4.266 3.771 -4.705) 7.386 6.627 ( -11.270 -3.854 -5.777) 13.238 7.135 ( 2.566 1.099 -3.771) 4.692 7.631 ( -5.868 13.759 6.547) 16.328 7.768 ( -2.422 3.189 -2.615) 4.783 8.007 ( 1.573 -0.008 -3.834) 4.144 8.188 ( -3.340 -17.656 -0.028) 17.969 9.011 ( -7.603 5.929 -3.978) 10.430 9.614 ( 3.956 2.514 0.424) 4.706 9.911 ( -2.625 1.416 -6.908) 7.525 10.346 ( 10.923 0.342 -7.760) 13.403 10.747 ( 3.186 -4.542 13.273) 14.385 11.665 ( -18.608 0.988 9.401) 20.871 14.902 ( -2.389 -3.961 -1.010) 4.735 15.767 ( 2.559 3.787 7.589) 8.859 16.062 ( 12.747 -2.112 -3.581) 13.408 16.368 ( -2.750 1.040 2.747) 4.023 16.602 ( 7.698 -0.343 -5.651) 9.556 17.002 ( -7.537 -2.044 17.392) 19.065 17.623 ( -12.486 0.414 2.269) 12.697 18.357 ( 3.136 0.005 0.762) 3.227 18.966 ( -5.457 -0.572 -7.311) 9.141 19.521 ( 3.649 1.223 4.367) 5.821 19.824 ( 7.132 3.767 -19.294) 20.912 20.224 ( 3.089 -3.063 -0.415) 4.370 ======================= Grid point 276 (126/336) ======================= q-point: (-0.64 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.594 ( 8.391 14.513 4.762) 17.427 2.929 ( 19.590 4.794 1.917) 20.259 3.200 ( -20.323 1.845 -7.020) 21.580 4.997 ( 16.797 -9.881 1.373) 19.536 5.536 ( -17.853 -7.093 -4.012) 19.625 6.261 ( 4.481 2.370 -4.665) 6.889 6.531 ( -3.351 -7.573 -5.343) 9.855 7.114 ( 1.873 5.512 -4.795) 7.543 7.402 ( -7.297 12.560 5.930) 15.689 7.750 ( 3.420 3.861 -2.209) 5.611 8.089 ( 6.561 -5.321 -4.971) 9.801 8.308 ( -0.323 -12.659 1.104) 12.711 8.799 ( -5.471 8.574 -4.001) 10.929 9.560 ( -2.564 5.219 -10.052) 11.613 9.841 ( -4.403 -4.831 -3.748) 7.535 10.455 ( 7.577 6.163 -5.384) 11.153 10.902 ( -0.044 -7.958 11.506) 13.990 11.455 ( -8.528 0.089 11.015) 13.931 14.870 ( -6.315 -6.524 -2.058) 9.310 15.819 ( 2.014 2.019 7.463) 7.989 16.163 ( 3.657 7.205 2.195) 8.373 16.410 ( 2.193 -4.196 2.088) 5.174 16.672 ( 3.629 0.967 -6.715) 7.694 16.971 ( -7.653 -1.956 17.941) 19.603 17.400 ( -11.787 -1.404 0.624) 11.886 18.440 ( 5.213 -0.261 1.232) 5.363 18.867 ( -3.010 -1.014 -6.415) 7.159 19.505 ( -0.566 3.899 -6.422) 7.534 19.914 ( 12.120 3.761 -6.707) 14.353 20.299 ( 1.238 -5.024 -1.327) 5.341 ======================= Grid point 277 (127/336) ======================= q-point: (-0.55 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -14.869 12.378 2.441) 19.500 2.846 ( -3.146 19.665 -5.583) 20.683 3.224 ( 13.905 -2.928 -1.415) 14.281 5.101 ( -29.946 0.916 -1.272) 29.987 5.344 ( 13.111 -5.656 2.024) 14.422 6.382 ( 4.777 -4.185 -1.599) 6.549 6.557 ( -0.410 -9.594 -5.275) 10.956 7.114 ( 4.235 0.852 -6.489) 7.796 7.184 ( -2.826 14.812 5.561) 16.072 7.773 ( 3.371 1.441 -3.353) 4.969 8.224 ( 4.570 -1.351 -1.954) 5.150 8.467 ( 4.856 -12.035 -0.217) 12.979 8.641 ( 0.061 8.890 -2.745) 9.305 9.379 ( -5.886 4.279 -12.498) 14.463 9.790 ( -7.295 -9.413 -3.733) 12.480 10.457 ( 3.291 6.132 -8.072) 10.658 10.968 ( -6.160 -8.173 9.864) 14.214 11.467 ( 2.978 1.659 13.807) 14.222 14.789 ( -9.187 -8.248 -2.604) 12.618 15.840 ( -0.699 2.479 4.125) 4.863 16.147 ( 2.170 9.893 5.050) 11.317 16.448 ( -5.520 -1.663 4.589) 7.368 16.661 ( 0.829 0.593 -7.710) 7.777 16.888 ( -8.792 1.702 16.244) 18.549 17.334 ( -0.652 -7.780 1.248) 7.906 18.544 ( 5.146 -0.151 1.218) 5.291 18.820 ( -0.575 -1.285 -5.010) 5.204 19.427 ( 0.800 3.437 -9.498) 10.132 20.054 ( 9.182 5.335 -2.042) 10.814 20.362 ( 1.265 -6.651 -2.821) 7.334 ======================= Grid point 278 (128/336) ======================= q-point: (-0.45 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.976 ( -24.306 6.444 6.536) 25.981 2.561 ( -3.107 26.753 -3.958) 27.222 3.477 ( 11.136 -4.635 -1.899) 12.210 4.510 ( -26.855 14.345 1.819) 30.500 5.610 ( 11.762 -1.090 1.496) 11.907 6.442 ( 2.578 0.865 -0.989) 2.893 6.594 ( -5.040 -11.277 -2.987) 12.708 6.922 ( -9.041 7.195 -1.916) 11.712 7.384 ( 19.211 -1.693 -0.038) 19.285 7.804 ( 1.244 -2.667 -4.957) 5.765 8.263 ( 1.238 1.959 1.163) 2.592 8.512 ( -2.452 1.692 -0.311) 2.996 8.767 ( 14.353 -2.014 -2.309) 14.676 9.178 ( -7.411 0.879 -10.384) 12.788 9.739 ( -7.604 -12.110 -3.869) 14.814 10.392 ( -1.537 1.606 -10.232) 10.471 10.975 ( -6.115 -7.850 9.542) 13.787 11.594 ( 7.227 5.119 13.714) 16.325 14.691 ( -9.263 -8.634 -2.970) 13.006 15.785 ( -4.441 1.711 1.768) 5.077 16.094 ( 2.600 14.087 4.745) 15.091 16.228 ( -17.075 2.942 0.682) 17.340 16.621 ( -2.689 1.887 -2.866) 4.359 16.914 ( 2.871 -3.583 14.368) 15.084 17.462 ( 3.351 -8.851 2.245) 9.727 18.624 ( 3.055 0.422 1.043) 3.256 18.824 ( 1.506 -1.483 -3.022) 3.688 19.398 ( 3.479 1.289 -9.347) 10.056 20.083 ( 0.944 5.923 -0.417) 6.012 20.460 ( 4.596 -6.171 -6.193) 9.877 ======================= Grid point 279 (129/336) ======================= q-point: (-0.36 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( -20.816 6.177 15.086) 26.439 2.188 ( -11.339 21.089 3.586) 24.211 3.686 ( 6.175 -5.065 -0.977) 8.047 3.911 ( -14.891 32.407 3.486) 35.834 5.786 ( 8.593 2.898 -0.018) 9.068 6.432 ( -0.222 3.947 -5.728) 6.959 6.653 ( 0.037 -11.115 2.876) 11.481 6.720 ( -5.995 1.163 -2.830) 6.731 7.745 ( 13.907 -5.392 0.855) 14.940 7.822 ( 2.040 -2.081 -3.370) 4.455 8.254 ( -0.538 2.004 1.379) 2.491 8.453 ( -4.179 -0.853 0.972) 4.374 8.991 ( 9.330 5.380 -13.335) 17.142 9.036 ( -1.957 -3.554 5.025) 6.459 9.735 ( -5.072 -14.751 -4.103) 16.129 10.292 ( -4.106 -2.032 -10.375) 11.341 10.977 ( -5.958 -5.909 5.891) 10.253 11.769 ( 10.844 3.462 15.951) 19.596 14.610 ( -6.250 -7.005 -3.505) 10.021 15.666 ( -10.485 -2.045 0.858) 10.717 15.894 ( -11.480 8.303 -0.402) 14.173 16.031 ( 3.685 15.044 4.863) 16.234 16.501 ( -7.123 2.288 -2.831) 7.999 17.102 ( 5.704 -4.464 10.688) 12.911 17.613 ( 3.119 -7.294 3.102) 8.518 18.652 ( 0.460 0.735 0.581) 1.044 18.874 ( 3.135 -1.772 -0.136) 3.604 19.434 ( 5.243 -0.209 -8.709) 10.168 20.000 ( -3.508 4.878 0.197) 6.012 20.547 ( 2.916 -3.871 -10.769) 11.809 ======================= Grid point 280 (130/336) ======================= q-point: (-0.27 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( -9.612 10.389 19.904) 24.423 1.866 ( -10.627 11.817 19.492) 25.150 3.261 ( -11.328 47.231 2.646) 48.642 3.900 ( 8.282 -2.161 0.713) 8.589 5.871 ( 5.024 3.164 -1.525) 6.130 6.313 ( -2.473 7.423 -10.139) 12.807 6.660 ( -2.308 -8.589 0.048) 8.894 6.823 ( 3.866 -8.357 3.281) 9.775 7.840 ( 3.865 -0.862 -0.200) 3.965 8.012 ( 6.115 1.130 6.376) 8.906 8.246 ( 0.322 -4.861 -1.380) 5.063 8.374 ( -6.480 -2.463 -0.206) 6.935 8.916 ( -5.652 -3.746 -2.434) 7.205 9.176 ( 12.164 9.215 0.392) 15.266 9.799 ( -2.774 -16.465 -6.184) 17.806 10.212 ( -1.447 -2.022 -9.254) 9.582 10.893 ( -8.593 0.460 0.256) 8.609 12.102 ( 13.980 -9.562 21.280) 27.197 14.590 ( 1.144 -3.534 -4.709) 5.998 15.445 ( -16.077 -4.479 0.958) 16.716 15.722 ( -0.540 7.037 1.584) 7.234 15.991 ( 7.150 16.695 3.222) 18.446 16.284 ( -12.310 4.258 -4.400) 13.749 17.262 ( 4.589 -0.856 5.349) 7.100 17.738 ( 2.221 -5.364 4.255) 7.198 18.636 ( -1.523 0.631 -0.351) 1.685 18.962 ( 3.720 -1.727 3.046) 5.108 19.490 ( 4.625 -0.122 -8.060) 9.294 19.894 ( -3.538 3.024 0.496) 4.681 20.508 ( -3.750 -0.509 -15.118) 15.584 ======================= Grid point 281 (131/336) ======================= q-point: (-0.18 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( 11.909 14.678 17.383) 25.680 1.773 ( -4.007 7.050 30.766) 31.816 2.607 ( -4.791 58.486 2.675) 58.743 4.041 ( 5.308 -0.556 -0.714) 5.384 5.905 ( 2.587 1.761 -1.076) 3.309 6.148 ( -1.893 6.200 -9.680) 11.650 6.767 ( 0.513 -13.828 2.491) 14.060 6.964 ( 3.275 -4.883 1.831) 6.158 7.872 ( -3.611 7.505 4.719) 9.572 8.081 ( 6.233 -0.923 1.411) 6.457 8.271 ( -6.803 -5.347 1.829) 8.844 8.400 ( 6.531 -7.757 -0.812) 10.173 8.854 ( -3.600 -2.828 1.707) 4.886 9.292 ( 10.739 9.953 0.685) 14.658 9.860 ( -4.096 -15.929 -10.647) 19.592 10.213 ( 5.170 1.546 -5.666) 7.824 10.667 ( -11.347 6.552 -4.245) 13.773 12.586 ( 4.940 -27.977 23.652) 36.966 14.694 ( 10.937 -0.192 -6.937) 12.953 15.282 ( -6.649 -5.760 3.510) 9.471 15.717 ( 2.987 1.536 1.238) 3.580 15.930 ( -13.455 10.592 -1.669) 17.205 16.015 ( 10.609 16.836 -0.564) 19.907 17.313 ( 2.139 5.494 -0.508) 5.917 17.836 ( 1.456 -3.728 5.405) 6.726 18.586 ( -3.013 0.274 -1.198) 3.254 19.048 ( 2.750 0.280 3.924) 4.800 19.515 ( 2.300 0.694 -7.258) 7.645 19.841 ( -0.460 0.262 0.380) 0.652 20.292 ( -10.085 3.266 -14.292) 17.794 ======================= Grid point 282 (132/336) ======================= q-point: (-0.09 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 15.224 16.183 11.292) 24.923 1.780 ( -0.452 13.804 25.038) 28.595 2.156 ( 19.846 47.554 9.587) 52.413 4.076 ( 1.339 2.776 -3.942) 5.004 5.940 ( 1.742 -1.169 2.598) 3.339 6.084 ( 3.417 2.648 -6.853) 8.103 6.914 ( -2.066 -12.120 4.415) 13.063 7.075 ( 3.558 -7.326 0.581) 8.165 7.679 ( -8.386 7.715 0.761) 11.420 8.110 ( -2.665 2.116 0.191) 3.409 8.262 ( -3.566 -3.462 -0.666) 5.014 8.608 ( 7.434 -6.703 6.182) 11.765 8.933 ( 6.046 -8.157 0.641) 10.174 9.348 ( 6.309 11.431 -0.934) 13.090 9.875 ( -2.393 -11.491 -12.865) 17.415 10.280 ( 4.529 5.634 0.670) 7.259 10.376 ( -7.218 5.934 -9.224) 13.130 12.880 ( -18.041 -31.299 21.621) 42.102 14.856 ( 9.497 -1.479 -7.284) 12.060 15.350 ( -1.087 0.815 6.338) 6.482 15.526 ( -2.673 11.834 -4.643) 12.990 15.869 ( 9.085 3.091 3.570) 10.239 16.162 ( 17.121 2.167 -2.341) 17.415 17.235 ( 0.534 11.991 -4.231) 12.727 17.906 ( 0.037 -2.364 5.715) 6.185 18.516 ( -4.236 -0.356 -1.437) 4.487 19.085 ( 2.586 3.378 1.721) 4.589 19.489 ( -0.641 1.142 -7.009) 7.131 19.877 ( 2.986 -2.417 -1.074) 3.989 20.039 ( -7.527 2.318 -7.019) 10.550 ======================= Grid point 286 (133/336) ======================= q-point: ( 0.27 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.720 ( 13.324 0.000 0.986) 13.361 2.985 ( 5.821 0.000 7.741) 9.686 3.252 ( -8.337 -0.000 -6.531) 10.591 4.884 ( 19.332 0.000 0.389) 19.336 5.446 ( -16.140 -0.000 -5.180) 16.951 6.372 ( 4.758 0.000 -2.295) 5.283 6.374 ( -7.310 -0.000 -8.989) 11.586 7.155 ( 1.195 0.000 -7.278) 7.376 7.610 ( -10.154 -0.000 3.919) 10.884 7.782 ( 7.423 0.000 4.451) 8.655 7.992 ( 0.852 0.000 -4.601) 4.679 8.165 ( 5.545 0.000 0.410) 5.560 8.892 ( -6.376 -0.000 -3.452) 7.250 9.626 ( -1.494 -0.000 -8.161) 8.297 9.774 ( -8.355 -0.000 -7.418) 11.173 10.530 ( 9.189 0.000 -6.233) 11.103 10.807 ( -0.154 -0.000 12.597) 12.598 11.457 ( -8.795 -0.000 11.174) 14.220 14.806 ( -5.925 -0.000 -1.591) 6.135 15.835 ( 0.106 0.000 10.355) 10.355 16.272 ( 10.711 0.000 -3.369) 11.228 16.336 ( -2.378 -0.000 4.980) 5.519 16.679 ( 4.977 0.000 -10.146) 11.301 16.953 ( -6.465 -0.000 21.216) 22.179 17.385 ( -14.280 -0.000 0.483) 14.288 18.438 ( 5.275 0.000 1.099) 5.388 18.857 ( -2.944 -0.000 -6.443) 7.084 19.545 ( -0.669 -0.000 -5.987) 6.025 19.954 ( 11.708 0.000 -7.996) 14.178 20.244 ( 1.079 0.000 -0.475) 1.179 ======================= Grid point 287 (134/336) ======================= q-point: (-0.64 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.606 ( -24.478 6.119 -2.691) 25.374 2.965 ( 9.206 -2.665 -3.096) 10.072 3.379 ( 10.452 11.294 3.676) 15.821 5.076 ( -21.917 -1.588 -1.499) 22.026 5.230 ( 15.748 -5.044 1.090) 16.572 6.292 ( 2.041 -2.820 -9.117) 9.759 6.447 ( 1.831 -2.715 -2.444) 4.086 7.125 ( -0.263 0.396 -6.811) 6.828 7.445 ( -3.719 8.868 3.860) 10.362 7.871 ( 4.019 9.460 -0.221) 10.281 8.111 ( 6.657 -12.075 -1.944) 13.925 8.277 ( 4.060 -4.255 3.198) 6.695 8.785 ( -0.722 4.614 -1.929) 5.053 9.473 ( -7.253 5.598 -11.892) 15.012 9.612 ( -10.050 -8.400 -6.428) 14.590 10.544 ( -0.540 2.610 -11.221) 11.533 10.851 ( -3.273 -3.480 10.008) 11.089 11.487 ( 4.609 0.500 15.210) 15.901 14.681 ( -8.299 -2.881 -2.059) 9.023 15.865 ( -2.140 0.489 7.907) 8.206 16.293 ( -1.162 4.484 6.822) 8.246 16.414 ( 2.437 -1.732 2.256) 3.745 16.680 ( 0.633 1.273 -10.006) 10.106 16.946 ( -4.579 3.291 17.652) 18.531 17.190 ( -7.242 -5.962 0.086) 9.381 18.544 ( 5.781 0.048 0.625) 5.815 18.803 ( -0.459 -0.471 -5.063) 5.106 19.480 ( -0.752 1.677 -9.763) 9.934 20.131 ( 10.662 2.311 -2.474) 11.187 20.259 ( -0.064 -3.287 -1.675) 3.690 ======================= Grid point 288 (135/336) ======================= q-point: (-0.55 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( -25.507 5.036 2.960) 26.168 2.989 ( -3.565 16.262 -2.957) 16.909 3.403 ( 1.955 -2.802 1.607) 3.776 4.743 ( -9.930 10.183 0.871) 14.250 5.556 ( 14.487 -4.467 1.449) 15.230 6.356 ( 0.756 -9.493 -6.648) 11.614 6.470 ( 0.770 -0.365 -2.387) 2.534 7.041 ( -5.786 4.343 -3.387) 7.988 7.417 ( 8.607 3.978 0.603) 9.501 7.827 ( 1.120 5.431 -2.804) 6.214 8.245 ( 0.402 -4.127 0.299) 4.157 8.447 ( 3.086 -6.316 2.856) 7.588 8.811 ( 10.891 4.891 1.976) 12.101 9.212 ( -10.672 1.940 -11.252) 15.628 9.498 ( -10.188 -11.271 -6.908) 16.690 10.420 ( -4.084 1.178 -12.623) 13.320 10.857 ( -4.376 -4.253 8.069) 10.117 11.669 ( 8.341 2.650 14.187) 16.669 14.564 ( -7.192 -4.479 -2.547) 8.848 15.794 ( -8.826 -0.355 3.873) 9.645 16.228 ( -6.699 3.929 8.136) 11.247 16.414 ( 0.935 9.931 2.131) 10.200 16.616 ( -1.958 -1.301 -7.750) 8.099 16.909 ( -0.685 3.476 15.209) 15.616 17.266 ( 2.344 -11.246 2.663) 11.793 18.634 ( 4.015 0.518 -0.035) 4.049 18.801 ( 1.581 -0.843 -3.197) 3.665 19.424 ( 1.514 1.236 -9.429) 9.629 20.175 ( -0.826 3.297 -1.715) 3.807 20.355 ( 6.813 -4.197 -3.742) 8.833 ======================= Grid point 289 (136/336) ======================= q-point: (-0.45 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.668 ( -20.427 5.298 15.264) 26.044 2.566 ( -19.744 17.875 3.479) 26.860 3.550 ( 5.729 -8.824 -0.455) 10.530 4.499 ( 0.734 27.328 0.374) 27.340 5.816 ( 10.441 -0.432 0.574) 10.466 6.400 ( -2.732 -7.364 -5.528) 9.605 6.513 ( 5.552 -1.864 0.830) 5.915 6.823 ( -9.156 8.175 -1.740) 12.397 7.632 ( 11.666 -5.220 -2.881) 13.101 7.815 ( 4.093 1.322 -2.244) 4.851 8.264 ( -2.189 -2.597 2.068) 3.976 8.439 ( -5.696 1.194 0.873) 5.885 8.974 ( -9.049 -1.932 -1.495) 9.373 9.091 ( 17.296 0.992 -2.198) 17.464 9.409 ( -10.235 -14.807 -6.775) 19.233 10.289 ( -2.861 0.929 -10.892) 11.299 10.859 ( -4.190 -5.673 5.295) 8.819 11.839 ( 7.248 3.273 12.627) 14.923 14.501 ( -2.786 -4.299 -3.095) 5.984 15.602 ( -15.848 -3.575 1.824) 16.348 16.056 ( -6.854 9.188 4.044) 12.156 16.348 ( 5.173 15.710 2.702) 16.759 16.528 ( -6.511 -0.437 -4.254) 7.790 17.022 ( 4.739 -2.745 14.743) 15.728 17.442 ( 3.498 -10.253 3.354) 11.340 18.669 ( 0.882 0.921 -0.494) 1.367 18.844 ( 3.081 -1.261 -0.742) 3.411 19.432 ( 4.500 0.025 -8.738) 9.828 20.082 ( -4.342 3.408 -2.133) 5.917 20.474 ( 4.195 -3.396 -6.969) 8.814 ======================= Grid point 290 (137/336) ======================= q-point: (-0.36 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -8.175 6.773 26.129) 28.203 2.125 ( -13.693 14.635 13.582) 24.210 3.734 ( 6.732 -4.701 -0.420) 8.222 4.202 ( 1.085 38.323 0.321) 38.340 5.928 ( 4.135 2.534 -0.896) 4.932 6.377 ( -1.331 -0.649 -6.097) 6.274 6.591 ( -8.661 2.208 -1.215) 9.021 6.699 ( 9.149 -4.706 2.327) 10.548 7.794 ( 6.064 -2.965 -2.176) 7.093 7.984 ( 10.921 -3.484 -0.072) 11.463 8.226 ( -4.981 0.438 2.027) 5.396 8.301 ( -9.411 -3.455 -0.372) 10.032 8.847 ( -6.313 -3.356 -1.498) 7.305 9.355 ( 0.688 -3.389 -6.044) 6.963 9.386 ( 5.142 -11.868 0.350) 12.939 10.223 ( 2.173 1.921 -7.544) 8.082 10.849 ( -4.996 -4.428 1.684) 6.885 11.999 ( 5.304 -2.103 13.289) 14.462 14.533 ( 4.847 -2.538 -3.913) 6.727 15.346 ( -17.267 -5.075 1.607) 18.069 15.891 ( -2.587 10.081 2.677) 10.746 16.315 ( 6.516 16.425 1.578) 17.741 16.359 ( -8.574 2.840 -1.702) 9.191 17.211 ( 5.103 -3.697 11.611) 13.211 17.606 ( 2.792 -8.265 4.281) 9.717 18.649 ( -1.577 0.761 -1.126) 2.082 18.925 ( 3.815 -1.856 2.347) 4.848 19.487 ( 5.287 -0.166 -8.348) 9.883 19.955 ( -4.718 2.996 -2.528) 6.135 20.483 ( -1.812 -1.720 -11.048) 11.327 ======================= Grid point 291 (138/336) ======================= q-point: (-0.27 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 13.179 11.458 20.385) 26.842 1.955 ( -1.732 12.258 25.625) 28.459 3.663 ( 1.408 46.301 -0.900) 46.331 4.002 ( 3.454 -0.509 1.737) 3.900 5.939 ( 0.416 1.791 -0.658) 1.953 6.253 ( -4.623 5.226 -8.880) 11.293 6.550 ( -0.321 -8.284 2.004) 8.529 6.892 ( 6.689 -2.761 0.655) 7.266 7.954 ( 6.004 0.343 2.671) 6.580 8.071 ( -3.536 0.408 1.733) 3.959 8.161 ( -6.588 -5.763 -0.389) 8.762 8.254 ( 4.968 -6.605 -1.490) 8.398 8.790 ( -4.239 -3.726 0.757) 5.694 9.375 ( -2.909 -16.330 -9.084) 18.911 9.564 ( 7.204 1.373 0.479) 7.349 10.266 ( 8.010 3.388 -3.444) 9.354 10.753 ( -7.603 1.750 -2.549) 8.208 12.195 ( 0.194 -13.595 15.954) 20.962 14.689 ( 12.557 -0.303 -5.904) 13.879 15.156 ( -9.428 -6.858 3.606) 12.203 15.792 ( -1.329 5.940 1.516) 6.273 16.122 ( -8.242 8.731 -1.202) 12.066 16.322 ( 8.359 15.382 2.521) 17.687 17.352 ( 3.165 -0.652 6.771) 7.503 17.741 ( 2.036 -6.177 5.579) 8.569 18.593 ( -3.276 0.395 -2.011) 3.864 19.028 ( 3.440 -1.934 5.052) 6.411 19.528 ( 3.300 0.599 -7.855) 8.541 19.854 ( -2.358 0.866 -3.945) 4.677 20.338 ( -7.881 1.655 -12.934) 15.236 ======================= Grid point 292 (139/336) ======================= q-point: (-0.18 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.783 ( 19.679 14.799 10.360) 26.713 2.004 ( 5.882 13.011 26.129) 29.776 3.201 ( 7.375 54.036 2.110) 54.578 4.088 ( 1.539 -1.976 -0.254) 2.517 5.919 ( -1.880 -0.856 2.233) 3.042 6.129 ( 0.006 2.064 -7.812) 8.081 6.685 ( 2.726 -10.316 3.651) 11.278 6.988 ( 2.348 -1.966 -1.651) 3.479 7.806 ( -10.967 4.409 0.515) 11.832 8.065 ( -8.399 -5.334 0.435) 9.959 8.215 ( 6.609 -1.468 -0.984) 6.842 8.454 ( 7.028 -8.577 3.739) 11.702 8.787 ( -0.804 -7.173 -0.120) 7.219 9.486 ( 5.205 -10.548 -10.846) 16.000 9.634 ( 2.412 0.510 -1.408) 2.839 10.381 ( 8.826 4.781 0.805) 10.070 10.525 ( -9.295 8.117 -6.078) 13.756 12.367 ( -9.987 -21.554 17.819) 29.695 14.831 ( 5.334 -1.107 -6.001) 8.105 15.278 ( 11.846 -6.698 4.633) 14.375 15.693 ( -5.253 4.199 -3.216) 7.455 15.957 ( 1.906 9.151 3.345) 9.927 16.346 ( 8.423 13.053 2.529) 15.739 17.388 ( 0.521 4.288 2.393) 4.938 17.843 ( 0.643 -4.127 6.046) 7.349 18.510 ( -4.580 -0.173 -2.487) 5.215 19.118 ( 2.521 -0.178 5.477) 6.032 19.514 ( -0.083 1.295 -7.278) 7.393 19.820 ( 0.012 -3.020 -9.263) 9.743 20.107 ( -6.965 4.293 -7.270) 10.946 ======================= Grid point 293 (140/336) ======================= q-point: (-0.09 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( 5.057 20.221 6.891) 21.954 2.037 ( 4.086 15.800 17.311) 23.791 3.142 ( 35.735 38.432 5.870) 52.806 4.075 ( -2.000 1.132 -2.573) 3.450 5.925 ( -2.457 -4.200 5.066) 7.024 6.124 ( 3.153 -0.381 -7.786) 8.409 6.828 ( 0.885 -5.835 3.798) 7.018 7.044 ( 1.210 -7.662 -0.673) 7.786 7.575 ( -9.111 4.145 -2.127) 10.233 7.984 ( -6.595 -5.783 -0.933) 8.821 8.208 ( -3.831 3.619 -1.331) 5.436 8.699 ( 6.601 -10.818 7.504) 14.728 8.894 ( 1.311 -10.676 -0.823) 10.788 9.531 ( 0.636 13.682 -5.086) 14.610 9.701 ( 4.381 -13.121 -14.474) 20.021 10.275 ( -4.139 7.693 -1.720) 8.903 10.492 ( 7.734 5.816 1.501) 9.792 12.387 ( -19.245 -19.503 17.833) 32.692 14.942 ( 7.636 -5.273 -4.914) 10.501 15.381 ( -4.153 11.151 3.808) 12.494 15.705 ( 14.208 2.860 -2.076) 14.641 16.040 ( 7.581 -2.679 2.084) 8.306 16.393 ( 5.510 6.168 3.663) 9.045 17.322 ( -1.231 8.486 0.489) 8.589 17.891 ( -1.918 -2.617 5.565) 6.442 18.418 ( -4.795 -0.791 -2.184) 5.328 19.175 ( 3.081 1.898 3.302) 4.899 19.433 ( -3.531 1.639 -7.251) 8.229 19.785 ( -2.644 -6.917 -15.252) 16.955 20.033 ( 4.030 3.149 0.968) 5.205 ======================= Grid point 298 (141/336) ======================= q-point: (-0.64 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( -26.275 -0.000 1.531) 26.319 3.150 ( 11.347 0.000 -3.187) 11.786 3.375 ( -19.532 -0.000 4.010) 19.939 4.863 ( -0.355 -0.000 2.088) 2.118 5.489 ( 15.238 0.000 0.297) 15.241 6.253 ( 1.773 0.000 -10.646) 10.792 6.469 ( 1.870 0.000 -1.398) 2.335 7.082 ( -1.871 -0.000 -4.511) 4.884 7.466 ( 1.355 0.000 1.043) 1.710 7.949 ( -2.033 -0.000 -4.648) 5.073 8.137 ( 3.098 0.000 2.586) 4.036 8.380 ( 7.435 0.000 5.980) 9.542 8.871 ( 7.493 0.000 3.369) 8.215 9.235 ( -18.933 -0.000 -4.362) 19.429 9.373 ( -4.269 -0.000 -16.488) 17.032 10.432 ( -4.698 -0.000 -13.107) 13.924 10.815 ( -3.954 -0.000 7.398) 8.388 11.695 ( 8.738 0.000 14.451) 16.887 14.520 ( -6.480 -0.000 -2.326) 6.885 15.788 ( -10.563 -0.000 4.114) 11.336 16.279 ( -4.735 -0.000 11.328) 12.278 16.481 ( 3.116 0.000 1.416) 3.423 16.626 ( -3.489 -0.000 -5.340) 6.379 17.037 ( 2.048 0.000 13.437) 13.592 17.059 ( -1.096 -0.000 0.514) 1.211 18.639 ( 4.398 0.000 -0.481) 4.424 18.793 ( 1.604 0.000 -3.240) 3.615 19.438 ( 0.609 0.000 -9.535) 9.555 20.205 ( -2.307 -0.000 -3.213) 3.956 20.314 ( 8.637 0.000 -1.813) 8.826 ======================= Grid point 300 (142/336) ======================= q-point: (-0.55 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -21.003 2.091 14.687) 25.714 2.857 ( -26.581 10.813 6.097) 29.337 3.370 ( 7.610 -8.073 -1.933) 11.262 4.910 ( 7.549 13.152 0.458) 15.171 5.764 ( 12.652 -3.631 -0.284) 13.166 6.279 ( 3.781 -3.518 -7.238) 8.892 6.499 ( 2.750 -0.263 -0.908) 2.908 6.981 ( -5.758 6.076 -2.127) 8.637 7.558 ( 8.507 -2.342 -1.333) 8.923 7.857 ( -2.254 2.141 -3.886) 4.976 8.179 ( -1.908 -4.066 2.909) 5.351 8.504 ( 1.732 4.104 3.445) 5.631 8.889 ( -18.501 -8.004 -3.599) 20.477 9.006 ( -1.399 -2.585 6.690) 7.307 9.312 ( 9.571 0.644 -14.790) 17.628 10.308 ( -2.061 0.661 -11.070) 11.280 10.778 ( -4.350 -2.393 4.596) 6.766 11.884 ( 5.880 1.195 11.680) 13.131 14.445 ( -1.151 -1.488 -2.714) 3.303 15.551 ( -16.961 -1.421 1.895) 17.126 16.225 ( -3.544 7.067 8.543) 11.640 16.476 ( -5.823 -4.019 -7.319) 10.180 16.579 ( 3.768 6.753 6.241) 9.937 17.041 ( 3.374 5.356 10.060) 11.886 17.231 ( 3.763 -10.965 6.288) 13.188 18.683 ( 1.107 0.450 -1.335) 1.791 18.827 ( 3.029 -0.456 -1.026) 3.230 19.433 ( 3.813 0.060 -8.737) 9.533 20.126 ( -3.969 1.097 -5.063) 6.526 20.427 ( 4.363 -1.253 -3.322) 5.625 ======================= Grid point 301 (143/336) ======================= q-point: (-0.45 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( -8.490 3.308 28.598) 30.014 2.400 ( -14.321 12.728 12.311) 22.774 3.581 ( 7.722 -8.674 -0.822) 11.642 4.825 ( 3.090 23.474 -2.534) 23.812 5.950 ( 5.785 -0.432 -1.680) 6.039 6.366 ( 6.105 0.837 -3.655) 7.165 6.606 ( 6.383 -4.019 1.506) 7.692 6.741 ( -8.953 11.001 -1.322) 14.246 7.748 ( 8.319 -1.553 -2.042) 8.705 7.875 ( 5.402 -8.515 -4.889) 11.207 8.180 ( -3.097 -2.346 3.874) 5.487 8.327 ( -13.124 4.324 -0.577) 13.830 8.767 ( -6.696 -7.439 0.099) 10.009 8.939 ( -11.911 -15.575 -5.050) 20.248 9.525 ( 16.984 6.117 -0.861) 18.073 10.265 ( 3.940 2.138 -7.289) 8.557 10.753 ( -3.968 -4.688 1.966) 6.449 11.986 ( 1.249 0.142 9.457) 9.540 14.493 ( 6.505 -1.576 -3.130) 7.389 15.268 ( -17.137 -2.787 1.460) 17.424 16.092 ( -4.249 10.285 2.541) 11.415 16.364 ( -7.630 -2.314 -0.327) 7.980 16.609 ( 7.031 12.686 2.897) 14.790 17.152 ( 4.537 -1.490 12.913) 13.767 17.427 ( 3.615 -9.791 6.361) 12.223 18.663 ( -1.671 0.605 -1.991) 2.669 18.896 ( 3.646 -1.096 1.449) 4.074 19.484 ( 5.665 -0.110 -8.506) 10.221 20.002 ( -5.124 1.740 -6.413) 8.391 20.452 ( -0.841 -1.272 -6.146) 6.333 ======================= Grid point 302 (144/336) ======================= q-point: (-0.36 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( 15.095 6.234 24.677) 29.592 2.229 ( 0.489 15.148 21.163) 26.031 3.802 ( 7.129 -8.891 1.284) 11.468 4.546 ( -2.296 32.504 -3.182) 32.740 5.983 ( 1.153 2.923 -2.221) 3.848 6.389 ( -6.055 10.153 -4.691) 12.718 6.469 ( 0.320 0.234 1.762) 1.806 6.835 ( 9.083 -3.634 0.389) 9.791 7.890 ( 4.100 -7.931 -1.744) 9.096 8.041 ( -4.706 -2.331 0.737) 5.303 8.075 ( -3.942 -3.572 -6.245) 8.204 8.187 ( 2.738 -0.518 3.894) 4.788 8.717 ( -5.208 -3.814 0.781) 6.502 8.913 ( -7.303 -23.607 -8.453) 26.117 9.706 ( 9.909 7.269 1.723) 12.409 10.342 ( 9.911 4.401 -2.169) 11.059 10.733 ( -3.673 -3.432 -0.993) 5.124 12.026 ( -3.637 -4.923 9.083) 10.952 14.679 ( 14.315 -0.814 -4.537) 15.038 15.039 ( -12.113 -4.741 2.718) 13.289 15.923 ( -5.730 6.901 0.304) 8.975 16.248 ( -4.803 4.231 2.723) 6.956 16.614 ( 7.150 14.727 2.928) 16.631 17.311 ( 3.631 -3.261 10.776) 11.830 17.604 ( 3.209 -7.649 7.662) 11.292 18.602 ( -3.281 0.499 -3.007) 4.478 18.987 ( 3.373 -2.025 3.987) 5.601 19.537 ( 4.245 0.385 -8.372) 9.395 19.869 ( -4.333 0.557 -8.198) 9.289 20.362 ( -5.635 0.908 -8.222) 10.009 ======================= Grid point 303 (145/336) ======================= q-point: (-0.27 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( 23.134 13.036 8.663) 27.931 2.283 ( 10.408 15.455 26.492) 32.388 3.994 ( 3.060 -7.569 2.547) 8.552 4.135 ( -0.116 40.681 -0.815) 40.689 5.932 ( -2.722 3.392 0.017) 4.349 6.159 ( -6.608 1.115 -5.159) 8.457 6.565 ( 6.216 -1.132 1.712) 6.546 6.975 ( 4.722 -0.106 -1.779) 5.048 7.817 ( -14.277 -3.732 -2.298) 14.934 7.937 ( -7.584 -8.106 -1.636) 11.221 8.195 ( 9.996 -0.938 0.364) 10.046 8.320 ( 5.335 -4.243 1.788) 7.047 8.651 ( -6.863 -6.799 -1.572) 9.788 9.096 ( 6.811 -21.984 -9.776) 25.005 9.771 ( 4.946 7.029 1.556) 8.734 10.470 ( 7.686 4.429 3.084) 9.391 10.651 ( -3.427 4.585 -5.376) 7.853 12.046 ( -8.309 -12.042 11.005) 18.307 14.812 ( 0.182 -0.917 -4.392) 4.490 15.130 ( 15.653 -7.657 2.600) 17.618 15.767 ( -5.724 4.042 0.016) 7.007 16.148 ( -0.641 8.995 3.989) 9.861 16.608 ( 5.635 13.761 4.091) 15.422 17.417 ( 1.035 -1.040 7.369) 7.514 17.752 ( 2.156 -4.987 8.167) 9.809 18.511 ( -4.626 0.258 -3.926) 6.073 19.086 ( 2.504 -2.632 6.110) 7.108 19.537 ( 0.524 1.159 -7.748) 7.852 19.769 ( -2.470 -2.167 -13.509) 13.903 20.190 ( -5.678 4.025 -5.729) 9.015 ======================= Grid point 304 (146/336) ======================= q-point: (-0.18 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( 8.196 16.137 11.434) 21.408 2.436 ( 9.607 21.778 8.280) 25.202 3.883 ( 16.653 30.853 2.606) 35.157 4.082 ( 1.429 3.796 2.855) 4.960 5.852 ( -5.453 -2.326 4.312) 7.331 6.094 ( 0.186 -2.616 -6.876) 7.360 6.712 ( 5.450 -5.016 2.655) 7.868 7.003 ( 1.388 2.461 -2.249) 3.611 7.592 ( -12.509 -3.118 -4.213) 13.562 7.861 ( -7.134 -6.463 -0.645) 9.647 8.286 ( -0.592 4.566 -1.328) 4.791 8.466 ( 2.520 -12.313 0.583) 12.582 8.679 ( 1.805 -11.425 0.717) 11.589 9.413 ( 12.071 -15.305 -13.070) 23.468 9.756 ( 0.374 8.512 -1.044) 8.584 10.428 ( -5.910 7.002 0.801) 9.198 10.608 ( 7.251 6.773 -0.151) 9.923 12.052 ( -12.285 -14.758 13.218) 23.311 14.841 ( 3.111 -5.138 -3.027) 6.726 15.510 ( 10.974 0.606 3.805) 11.631 15.686 ( 6.293 -1.070 -2.434) 6.832 16.097 ( 2.058 7.744 4.018) 8.963 16.584 ( 3.036 11.717 5.427) 13.265 17.430 ( -1.930 2.732 5.426) 6.374 17.837 ( -0.911 -2.743 6.762) 7.353 18.406 ( -4.774 -0.342 -3.601) 5.990 19.178 ( 1.888 -1.854 6.960) 7.446 19.463 ( -3.468 1.447 -7.121) 8.052 19.676 ( -2.630 -3.997 -20.578) 21.127 20.101 ( 2.134 3.651 0.121) 4.230 ======================= Grid point 305 (147/336) ======================= q-point: (-0.09 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.117 ( -3.983 18.773 2.610) 19.367 2.373 ( 8.197 17.918 8.801) 21.580 3.993 ( -6.575 -1.310 -0.114) 6.705 4.146 ( 35.637 30.577 3.779) 47.108 5.829 ( -4.679 -6.067 4.888) 9.088 6.113 ( 1.872 -3.082 -7.479) 8.303 6.855 ( 2.224 -5.077 3.568) 6.592 6.985 ( -0.516 -0.386 -0.578) 0.866 7.415 ( -7.499 -2.594 -4.804) 9.276 7.808 ( -5.335 -6.063 -2.468) 8.445 8.162 ( -4.623 4.798 -2.832) 7.239 8.612 ( -0.805 -14.513 -2.600) 14.766 8.892 ( 6.843 -9.998 7.032) 14.008 9.529 ( -10.375 10.171 -4.076) 15.090 9.661 ( 8.227 -6.125 -17.682) 20.441 10.350 ( 4.982 6.029 -1.904) 8.050 10.673 ( 4.077 4.202 8.126) 10.016 11.996 ( -15.280 -11.474 13.558) 23.430 14.990 ( 7.333 -7.921 -4.057) 11.531 15.469 ( -0.185 11.704 4.032) 12.380 15.999 ( 16.907 -1.469 -1.244) 17.016 16.106 ( 1.137 0.033 3.412) 3.597 16.544 ( 1.028 8.744 5.854) 10.573 17.351 ( -4.929 5.675 5.606) 9.377 17.834 ( -4.837 -2.111 5.112) 7.348 18.331 ( -2.385 -0.580 -2.164) 3.273 19.251 ( 1.668 -0.075 4.570) 4.866 19.336 ( -4.976 1.099 -5.548) 7.533 19.603 ( -0.191 -6.792 -20.155) 21.270 20.167 ( 7.043 2.325 -0.191) 7.420 ======================= Grid point 311 (148/336) ======================= q-point: (-0.55 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( -8.952 -0.000 29.300) 30.637 2.542 ( -14.862 -0.000 12.995) 19.742 3.478 ( 8.443 0.000 -2.034) 8.685 5.056 ( 0.665 0.000 -3.024) 3.096 5.937 ( 9.015 0.000 -2.641) 9.394 6.390 ( 11.992 0.000 -2.166) 12.186 6.552 ( 3.832 0.000 -0.102) 3.833 6.900 ( -6.829 -0.000 -1.193) 6.932 7.733 ( 13.155 0.000 -1.301) 13.219 7.746 ( -5.548 -0.000 -5.530) 7.833 8.164 ( -0.503 -0.000 4.795) 4.821 8.409 ( -23.656 -0.000 -2.967) 23.841 8.596 ( 0.339 0.000 1.162) 1.210 8.838 ( -10.604 -0.000 -3.923) 11.307 9.586 ( 17.182 0.000 -1.572) 17.254 10.289 ( 5.119 0.000 -7.516) 9.094 10.701 ( -4.434 -0.000 2.212) 4.955 11.989 ( 0.154 0.000 8.461) 8.462 14.477 ( 6.906 0.000 -2.799) 7.452 15.241 ( -16.949 -0.000 1.307) 16.999 16.261 ( -10.278 -0.000 -6.900) 12.379 16.274 ( -1.622 -0.000 10.017) 10.148 16.745 ( 7.564 0.000 5.217) 9.189 17.163 ( 2.314 0.000 5.242) 5.730 17.291 ( 5.220 0.000 12.932) 13.946 18.669 ( -1.728 -0.000 -2.368) 2.931 18.885 ( 3.557 0.000 1.092) 3.721 19.483 ( 5.782 0.000 -8.555) 10.325 20.019 ( -5.144 -0.000 -8.397) 9.848 20.439 ( -0.588 -0.000 -3.770) 3.816 ======================= Grid point 313 (149/336) ======================= q-point: (-0.45 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( 16.142 1.820 27.164) 31.651 2.477 ( 1.900 8.321 20.645) 22.340 3.636 ( 6.490 -6.112 -0.467) 8.928 4.940 ( -5.284 8.992 -4.769) 11.468 6.030 ( 3.831 1.306 -4.123) 5.778 6.540 ( -0.360 5.515 0.970) 5.611 6.628 ( 3.434 7.399 1.061) 8.226 6.778 ( 5.614 2.056 -0.894) 6.045 7.649 ( -7.806 -13.556 -6.858) 17.080 8.013 ( -17.710 -1.328 -1.771) 17.848 8.041 ( 18.897 0.408 -3.293) 19.186 8.183 ( 0.515 -0.267 4.581) 4.618 8.550 ( -8.729 -9.019 -5.690) 13.781 8.693 ( -4.819 -1.653 0.353) 5.107 9.804 ( 8.590 2.653 0.224) 8.993 10.426 ( 13.003 3.535 -2.166) 13.648 10.652 ( -3.246 -3.708 0.448) 4.948 11.975 ( -5.571 -1.026 5.878) 8.163 14.663 ( 14.929 -0.614 -3.238) 15.289 14.980 ( -13.285 -1.447 1.610) 13.460 16.029 ( -9.835 3.324 -2.812) 10.756 16.292 ( -1.712 0.749 8.234) 8.444 16.860 ( 7.499 9.060 2.382) 12.000 17.237 ( 1.539 -3.796 8.321) 9.274 17.478 ( 5.564 -4.192 13.300) 15.014 18.609 ( -3.197 0.243 -3.688) 4.887 18.959 ( 3.145 -0.805 2.746) 4.252 19.542 ( 4.823 0.133 -8.680) 9.931 19.875 ( -5.579 0.135 -10.697) 12.066 20.374 ( -4.259 0.336 -4.748) 6.387 ======================= Grid point 314 (150/336) ======================= q-point: (-0.36 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( 29.569 6.807 10.975) 32.266 2.581 ( 9.879 14.368 26.061) 31.356 3.812 ( 3.314 -10.045 2.076) 10.779 4.694 ( -5.196 16.669 -2.592) 17.651 6.034 ( 2.164 3.479 -4.871) 6.365 6.242 ( -15.526 10.414 1.437) 18.750 6.649 ( 6.973 9.796 -1.223) 12.086 6.963 ( 9.072 -1.368 -0.338) 9.181 7.599 ( -14.857 -19.208 -7.068) 25.291 7.807 ( -6.283 -3.998 -3.103) 8.068 8.183 ( 2.013 0.121 2.113) 2.921 8.292 ( 4.528 0.572 -0.566) 4.598 8.537 ( -2.367 -5.097 -3.225) 6.480 8.737 ( 9.193 -13.420 -3.087) 16.557 9.873 ( 3.482 3.514 -0.326) 4.958 10.541 ( 1.526 2.658 3.013) 4.298 10.703 ( 7.379 1.253 -2.684) 7.952 11.889 ( -9.197 -4.778 5.849) 11.900 14.791 ( -5.468 -1.272 -2.258) 6.051 15.015 ( 18.990 -3.828 0.568) 19.380 15.839 ( -7.143 2.982 0.450) 7.753 16.277 ( -0.969 4.343 7.298) 8.547 16.868 ( 4.433 12.832 3.482) 14.016 17.348 ( 0.541 -6.060 7.735) 9.841 17.670 ( 4.845 -3.015 12.969) 14.169 18.518 ( -4.423 0.402 -5.239) 6.868 19.036 ( 2.173 -2.209 3.837) 4.932 19.557 ( 1.285 0.759 -8.435) 8.566 19.737 ( -4.130 -1.227 -13.346) 14.024 20.253 ( -4.612 2.374 -4.351) 6.770 ======================= Grid point 315 (151/336) ======================= q-point: (-0.27 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.540 ( 11.400 17.101 8.365) 22.189 2.813 ( 16.500 16.736 11.788) 26.292 3.923 ( -2.331 -7.952 2.610) 8.688 4.517 ( 9.079 20.587 4.100) 22.871 5.893 ( -11.092 7.382 2.267) 13.516 6.043 ( 0.180 -1.698 -5.713) 5.962 6.667 ( 2.061 0.659 -2.701) 3.460 7.086 ( 6.734 5.020 0.834) 8.441 7.439 ( -14.923 -12.937 -7.389) 21.087 7.756 ( -4.279 -3.988 -2.416) 6.328 8.245 ( -1.460 -10.474 -1.472) 10.677 8.346 ( -0.096 -1.019 0.950) 1.396 8.512 ( 2.227 -2.375 -0.678) 3.326 9.135 ( 18.338 -12.911 -8.386) 23.944 9.870 ( 0.224 3.715 -1.559) 4.035 10.511 ( -3.755 1.839 4.516) 6.155 10.755 ( 4.500 7.565 -4.140) 9.727 11.827 ( -8.442 -8.530 9.457) 15.280 14.748 ( -0.671 -4.336 -1.554) 4.655 15.441 ( 22.102 -4.593 -0.050) 22.574 15.728 ( -2.450 3.334 2.855) 5.027 16.244 ( -0.359 6.269 6.158) 8.795 16.818 ( 1.398 12.279 5.539) 13.543 17.421 ( -1.834 -3.796 6.879) 8.067 17.800 ( 1.116 -0.764 10.213) 10.302 18.405 ( -4.658 0.181 -5.197) 6.981 19.115 ( 1.290 -3.955 4.440) 6.084 19.491 ( -3.113 1.494 -7.666) 8.407 19.627 ( -2.061 -1.525 -17.825) 18.008 20.166 ( 0.299 2.952 -1.461) 3.307 ======================= Grid point 316 (152/336) ======================= q-point: (-0.18 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( -2.543 19.872 3.740) 20.381 2.782 ( 4.143 22.958 3.190) 23.546 3.931 ( -6.260 -5.292 3.093) 8.762 4.686 ( 28.089 22.579 4.839) 36.362 5.715 ( -8.686 -4.469 5.118) 11.028 6.057 ( 2.220 -1.753 -6.743) 7.312 6.688 ( -3.023 -8.774 -2.447) 9.597 7.107 ( 1.381 7.426 1.109) 7.635 7.309 ( -5.208 -6.716 -6.324) 10.594 7.708 ( -3.968 -3.699 -1.778) 5.708 8.210 ( -6.766 -2.783 -4.700) 8.696 8.398 ( 2.830 -6.389 -2.069) 7.287 8.685 ( 7.364 -9.183 4.807) 12.715 9.463 ( 10.457 -7.794 -11.623) 17.470 9.753 ( -6.426 6.362 -7.288) 11.614 10.460 ( 1.914 4.926 2.169) 5.713 10.731 ( 0.092 1.989 2.336) 3.070 11.817 ( -7.636 -6.772 12.381) 16.045 14.837 ( 4.942 -7.524 -2.378) 9.311 15.658 ( 1.928 7.559 4.931) 9.229 15.882 ( 16.124 -5.982 0.187) 17.199 16.209 ( 0.881 6.055 5.016) 7.912 16.736 ( -0.979 10.654 5.850) 12.194 17.409 ( -5.060 0.051 6.796) 8.473 17.807 ( -4.841 -0.391 6.079) 7.781 18.327 ( -1.524 0.176 -2.487) 2.922 19.199 ( 0.937 -5.225 4.323) 6.845 19.360 ( -5.710 1.766 -7.509) 9.597 19.534 ( 0.556 -0.718 -19.136) 19.158 20.203 ( 5.995 1.419 -0.360) 6.171 ======================= Grid point 317 (153/336) ======================= q-point: (-0.09 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.149 ( -10.800 15.551 0.298) 18.936 2.730 ( 9.317 16.953 1.353) 19.392 3.799 ( -13.551 -2.244 2.056) 13.889 4.986 ( 25.127 23.138 2.382) 34.240 5.725 ( 0.550 -8.431 3.861) 9.290 6.081 ( 1.402 -2.477 -6.436) 7.038 6.686 ( -9.528 -14.153 -0.077) 17.062 7.038 ( -1.379 3.888 -1.022) 4.250 7.317 ( 3.790 0.930 -2.682) 4.735 7.659 ( -4.645 -3.640 -3.623) 6.924 8.113 ( -1.625 0.163 -5.710) 5.939 8.492 ( 1.678 -6.668 -3.433) 7.686 8.931 ( 3.706 -10.022 5.592) 12.060 9.391 ( -10.375 6.326 -3.619) 12.679 9.669 ( 6.094 -2.954 -14.793) 16.269 10.464 ( 2.753 3.847 -10.478) 11.496 10.796 ( 3.399 -1.405 15.584) 16.012 11.769 ( -9.397 -2.067 12.575) 15.834 15.023 ( 7.556 -8.687 -3.535) 12.044 15.623 ( 2.234 11.377 3.593) 12.138 16.085 ( -0.564 -2.387 5.325) 5.863 16.283 ( 10.116 1.760 3.669) 10.903 16.641 ( -1.478 7.459 2.331) 7.954 17.312 ( -7.094 3.480 8.124) 11.333 17.715 ( -8.800 -1.945 3.870) 9.808 18.323 ( 2.084 0.896 -0.139) 2.273 19.189 ( -6.555 2.206 -7.213) 9.993 19.291 ( 0.703 -6.419 1.818) 6.709 19.515 ( 5.449 -1.777 -16.008) 17.003 20.313 ( 7.446 1.575 -1.485) 7.754 ======================= Grid point 324 (154/336) ======================= q-point: ( 0.55 -0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( 31.940 0.000 12.853) 34.429 2.746 ( 10.037 0.000 26.808) 28.626 3.690 ( 3.184 0.000 0.082) 3.185 4.836 ( -7.224 -0.000 -3.063) 7.847 6.054 ( 0.385 0.000 -4.676) 4.692 6.393 ( -13.680 -0.000 1.174) 13.730 6.883 ( 5.681 0.000 -2.102) 6.058 6.923 ( 14.121 0.000 3.582) 14.568 7.277 ( -17.223 -0.000 -12.026) 21.006 7.770 ( -6.567 -0.000 -2.914) 7.185 8.189 ( -2.812 -0.000 3.027) 4.131 8.314 ( -6.961 -0.000 -3.920) 7.989 8.462 ( 25.907 0.000 -2.725) 26.050 8.616 ( -3.668 -0.000 0.067) 3.669 9.907 ( 2.849 0.000 -1.131) 3.066 10.567 ( -3.552 -0.000 1.347) 3.799 10.713 ( 14.330 0.000 -0.138) 14.330 11.846 ( -9.849 -0.000 4.044) 10.647 14.775 ( -7.557 -0.000 -1.030) 7.627 14.980 ( 20.206 0.000 -0.587) 20.215 15.869 ( -7.766 -0.000 0.242) 7.770 16.318 ( -1.180 -0.000 9.228) 9.303 17.039 ( 5.476 0.000 0.871) 5.545 17.242 ( -1.347 -0.000 8.926) 9.027 17.642 ( 6.345 0.000 15.614) 16.854 18.522 ( -4.283 -0.000 -5.779) 7.193 19.013 ( 1.965 0.000 2.525) 3.199 19.564 ( 1.733 0.000 -8.834) 9.002 19.724 ( -4.833 -0.000 -12.641) 13.533 20.277 ( -4.214 -0.000 -3.839) 5.701 ======================= Grid point 326 (155/336) ======================= q-point: (-0.36 0.55 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.808 ( 17.995 8.475 5.819) 20.724 3.063 ( 17.489 8.388 18.170) 26.577 3.750 ( -1.642 -7.601 2.128) 8.063 4.737 ( 1.780 4.228 2.663) 5.305 5.978 ( -11.189 -0.065 -0.198) 11.191 6.135 ( -4.911 8.102 -3.201) 10.001 6.772 ( -5.141 11.669 -8.480) 15.314 7.111 ( -9.387 -19.268 -8.269) 22.973 7.164 ( 11.343 2.173 3.011) 11.935 7.713 ( -0.172 -0.784 -4.069) 4.148 8.084 ( -8.316 -5.079 0.529) 9.759 8.285 ( -0.562 -2.288 1.213) 2.649 8.560 ( 1.805 3.359 -1.709) 4.178 8.940 ( 23.885 -6.327 -5.938) 25.412 9.913 ( -0.630 1.011 -2.457) 2.730 10.524 ( -2.556 0.065 4.312) 5.013 10.863 ( 3.424 3.066 -4.687) 6.564 11.721 ( -6.753 -2.683 7.847) 10.694 14.686 ( -2.550 -1.791 -0.706) 3.195 15.380 ( 23.076 -1.589 -0.842) 23.146 15.776 ( -2.836 1.366 3.983) 5.077 16.323 ( -1.933 1.956 9.061) 9.469 17.042 ( 0.742 9.983 3.035) 10.460 17.301 ( -1.789 -7.383 8.279) 11.236 17.800 ( 2.846 0.252 13.236) 13.540 18.410 ( -4.576 0.187 -6.387) 7.860 19.053 ( 0.965 -1.859 0.559) 2.168 19.516 ( -2.292 0.849 -8.654) 8.992 19.606 ( -2.045 -0.641 -12.910) 13.086 20.207 ( -0.749 1.134 -2.631) 2.961 ======================= Grid point 327 (156/336) ======================= q-point: (-0.27 0.55 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.870 ( 1.195 18.602 4.978) 19.294 3.184 ( 3.899 16.937 3.039) 17.644 3.782 ( -6.317 -9.954 4.389) 12.580 4.939 ( 22.256 4.423 6.720) 23.666 5.692 ( -15.963 1.070 3.436) 16.364 6.076 ( 3.326 3.363 -6.846) 8.321 6.555 ( -9.669 -4.025 -9.418) 14.085 7.078 ( -4.866 -7.688 -8.362) 12.358 7.327 ( 9.459 6.067 5.027) 12.311 7.683 ( -1.638 1.393 -2.589) 3.365 8.054 ( -4.427 -11.024 -2.876) 12.223 8.292 ( -1.880 -5.332 0.814) 5.712 8.626 ( 8.211 1.829 0.307) 8.418 9.333 ( 16.813 -5.250 -11.119) 20.829 9.827 ( -6.332 1.863 -5.107) 8.346 10.521 ( 0.345 1.370 7.725) 7.853 10.762 ( -5.758 1.327 -7.900) 9.865 11.734 ( -1.522 -2.223 13.090) 13.364 14.717 ( 2.989 -4.600 -1.290) 5.636 15.760 ( 7.367 2.745 4.579) 9.098 15.802 ( 14.107 -2.012 1.970) 14.386 16.298 ( -2.369 2.990 8.537) 9.351 16.941 ( -2.665 10.163 3.915) 11.212 17.354 ( -3.549 -5.215 7.536) 9.828 17.819 ( -5.392 1.160 6.810) 8.763 18.334 ( -0.650 0.441 -2.006) 2.155 19.096 ( 1.100 -4.422 -2.401) 5.151 19.395 ( -5.379 1.584 -8.124) 9.871 19.539 ( 0.869 0.672 -12.214) 12.263 20.222 ( 4.443 0.557 -1.486) 4.718 ======================= Grid point 328 (157/336) ======================= q-point: (-0.18 0.55 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.529 ( -15.409 22.291 0.872) 27.112 3.077 ( 4.469 18.051 -0.759) 18.612 3.721 ( -12.197 -6.318 4.833) 14.561 5.330 ( 15.845 10.309 2.600) 19.081 5.531 ( -1.572 -10.303 6.006) 12.029 6.081 ( 3.939 2.901 -7.615) 9.051 6.425 ( -9.377 -11.677 -6.667) 16.393 7.032 ( -1.158 -2.378 -7.676) 8.119 7.428 ( 6.612 8.352 4.703) 11.644 7.621 ( -2.606 0.188 -1.297) 2.917 8.048 ( -2.602 -5.931 -6.885) 9.453 8.379 ( 3.151 -8.310 0.007) 8.888 8.779 ( 6.146 -2.941 2.997) 7.443 9.468 ( -2.863 1.930 -8.210) 8.906 9.652 ( -0.577 0.490 -11.736) 11.761 10.524 ( -0.596 2.382 -11.284) 11.548 10.723 ( 1.425 -5.325 13.386) 14.476 11.768 ( -3.089 1.423 14.334) 14.732 14.860 ( 7.009 -7.406 -2.074) 10.405 15.811 ( 4.162 7.466 5.561) 10.197 16.057 ( 5.105 -0.554 3.629) 6.288 16.305 ( 3.298 0.709 8.189) 8.857 16.792 ( -5.384 7.624 0.755) 9.364 17.341 ( -4.511 -0.298 7.768) 8.988 17.686 ( -10.302 -0.938 3.182) 10.823 18.349 ( 2.848 1.611 1.588) 3.637 19.159 ( 2.138 -6.108 -5.421) 8.442 19.231 ( -6.699 1.833 -7.769) 10.421 19.521 ( 4.148 1.578 -9.182) 10.198 20.325 ( 7.419 -0.199 -1.945) 7.673 ======================= Grid point 329 (158/336) ======================= q-point: (-0.09 -0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( -13.853 13.246 1.849) 19.256 2.974 ( -0.206 10.709 -3.972) 11.424 3.532 ( -12.518 0.244 1.739) 12.640 5.299 ( -5.548 -0.226 5.305) 7.679 5.757 ( 0.190 -6.303 -2.592) 6.818 6.150 ( 15.551 4.772 -3.510) 16.641 6.383 ( -4.805 -10.438 -3.222) 11.934 7.011 ( -0.207 -0.126 -4.058) 4.065 7.397 ( -4.513 3.653 -0.870) 5.871 7.626 ( 6.585 4.390 -0.906) 7.966 8.048 ( 0.359 -5.295 -7.056) 8.829 8.508 ( 5.232 -2.183 -2.356) 6.139 8.823 ( -9.179 -4.860 -1.278) 10.465 9.332 ( 1.407 2.288 -1.317) 2.992 9.700 ( 6.842 -2.911 -7.949) 10.885 10.399 ( -4.130 0.435 -15.012) 15.576 10.928 ( 5.854 -4.873 15.307) 17.097 11.710 ( -6.972 5.392 13.509) 16.130 15.067 ( 8.166 -8.122 -2.832) 11.860 15.759 ( -1.849 11.567 0.020) 11.714 16.090 ( -1.564 1.050 10.448) 10.617 16.437 ( 3.957 -1.269 9.708) 10.560 16.627 ( -5.581 2.587 -4.555) 7.655 17.276 ( -5.523 4.045 8.443) 10.870 17.537 ( -8.661 -2.249 2.487) 9.287 18.405 ( 4.144 2.025 2.397) 5.199 19.063 ( -5.788 2.006 -7.145) 9.412 19.237 ( 3.081 -6.127 -8.048) 10.573 19.583 ( 7.272 -0.442 -5.456) 9.102 20.443 ( 6.880 0.997 -3.118) 7.619 ======================= Grid point 337 (159/336) ======================= q-point: ( 0.64 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.096 ( 4.477 0.000 5.922) 7.423 3.368 ( 5.397 0.000 5.519) 7.719 3.632 ( -8.139 -0.000 2.663) 8.564 4.961 ( 19.137 0.000 6.940) 20.357 5.704 ( -18.971 -0.000 3.094) 19.221 6.120 ( 1.017 0.000 -6.209) 6.292 6.534 ( -13.645 -0.000 -15.775) 20.857 6.984 ( 2.715 0.000 -6.455) 7.002 7.395 ( 9.947 0.000 6.957) 12.139 7.732 ( 4.146 0.000 -6.103) 7.378 7.896 ( -9.181 -0.000 2.263) 9.456 8.238 ( -3.139 -0.000 -0.229) 3.148 8.657 ( 7.669 0.000 -0.602) 7.692 9.278 ( 19.650 0.000 -10.698) 22.373 9.843 ( -6.258 -0.000 -4.553) 7.739 10.530 ( -0.050 -0.000 9.294) 9.294 10.776 ( -8.360 -0.000 -11.822) 14.479 11.715 ( 0.790 0.000 13.686) 13.708 14.671 ( 2.334 0.000 -0.896) 2.500 15.765 ( 20.402 0.000 -0.093) 20.402 15.804 ( 2.199 0.000 7.054) 7.389 16.326 ( -3.646 -0.000 10.439) 11.058 17.073 ( -4.632 -0.000 -0.251) 4.639 17.269 ( -1.427 -0.000 10.955) 11.048 17.833 ( -5.724 -0.000 6.814) 8.899 18.339 ( -0.278 -0.000 -1.585) 1.609 19.051 ( 1.403 0.000 -4.922) 5.118 19.412 ( -5.329 -0.000 -8.962) 10.427 19.547 ( 1.165 0.000 -8.866) 8.942 20.227 ( 3.674 0.000 -2.204) 4.284 ======================= Grid point 339 (160/336) ======================= q-point: (-0.27 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.926 ( -15.363 15.497 2.870) 22.009 3.367 ( -2.235 10.603 0.365) 10.842 3.551 ( -6.984 -10.267 4.765) 13.300 5.382 ( 19.889 -2.293 4.027) 20.421 5.384 ( -19.035 -3.436 3.634) 19.682 6.132 ( 4.285 0.323 -6.690) 7.951 6.308 ( -3.173 -0.303 -14.156) 14.510 7.001 ( 1.976 -0.649 -7.686) 7.962 7.573 ( 7.898 4.933 9.338) 13.187 7.678 ( -3.451 6.763 -0.891) 7.645 7.886 ( 0.483 -11.142 -4.718) 12.110 8.217 ( -0.342 -5.197 -0.209) 5.213 8.785 ( 5.747 1.261 0.435) 5.900 9.493 ( 9.427 0.810 -13.646) 16.605 9.660 ( -8.698 0.159 -6.304) 10.743 10.559 ( -4.646 1.318 -12.499) 13.400 10.629 ( 1.438 -3.495 11.847) 12.435 11.797 ( 0.042 1.052 15.489) 15.524 14.759 ( 6.324 -2.785 -1.235) 7.020 15.904 ( 5.685 2.269 8.127) 10.174 16.055 ( 9.324 0.104 1.690) 9.476 16.314 ( -1.222 0.217 11.255) 11.323 16.910 ( -9.903 3.756 -1.762) 10.737 17.318 ( 0.125 -1.311 9.039) 9.134 17.677 ( -12.265 -0.163 1.678) 12.380 18.375 ( 3.104 0.823 3.634) 4.850 19.074 ( 3.636 -2.351 -8.836) 9.840 19.257 ( -6.778 0.723 -8.292) 10.734 19.552 ( 3.434 1.097 -5.862) 6.882 20.315 ( 7.019 -0.461 -2.778) 7.562 ======================= Grid point 340 (161/336) ======================= q-point: (-0.18 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( -21.167 19.921 4.009) 29.342 3.133 ( -15.266 3.923 0.302) 15.765 3.544 ( -0.791 1.286 -0.939) 1.778 5.147 ( -18.249 -11.503 4.989) 22.141 5.622 ( 0.789 -6.637 -3.152) 7.390 6.214 ( 5.265 -3.186 -6.090) 8.658 6.331 ( 15.936 7.347 -7.126) 18.940 7.002 ( 1.726 -0.498 -7.930) 8.131 7.496 ( -6.461 7.201 0.767) 9.705 7.723 ( 7.271 3.967 6.519) 10.540 7.955 ( 1.900 -3.875 -7.303) 8.483 8.356 ( 5.248 -12.226 1.051) 13.347 8.767 ( -8.072 -0.400 -1.972) 8.319 9.438 ( 1.762 7.245 -3.967) 8.446 9.645 ( 5.330 -3.068 -9.248) 11.106 10.407 ( -3.900 0.525 -15.947) 16.426 10.809 ( 4.808 -6.328 14.138) 16.219 11.810 ( -3.939 4.233 15.170) 16.235 14.926 ( 8.242 -5.606 -1.588) 10.094 15.963 ( -0.310 8.639 2.570) 9.019 16.107 ( -0.468 0.267 9.378) 9.394 16.413 ( 3.926 -0.911 10.353) 11.110 16.663 ( -12.379 1.039 -4.525) 13.221 17.345 ( -3.141 3.378 6.752) 8.177 17.486 ( -8.142 -3.057 2.494) 9.048 18.443 ( 3.593 1.656 4.216) 5.782 19.095 ( -5.732 1.220 -7.345) 9.396 19.144 ( 5.455 -3.346 -10.366) 12.182 19.594 ( 5.018 1.126 -3.616) 6.287 20.443 ( 7.833 -0.691 -4.227) 8.927 ======================= Grid point 341 (162/336) ======================= q-point: (-0.09 -0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( -15.821 10.244 5.651) 19.677 2.766 ( -23.959 -0.581 1.182) 23.995 3.505 ( 3.633 6.891 -6.532) 10.166 4.960 ( -23.491 -18.412 5.764) 30.398 5.580 ( -5.164 -2.282 -6.110) 8.319 6.297 ( 3.570 -3.491 -5.252) 7.247 6.591 ( 19.470 6.694 -0.442) 20.594 7.003 ( 1.713 0.554 -5.178) 5.482 7.309 ( -6.328 5.981 -1.388) 8.817 7.848 ( 8.893 3.248 2.083) 9.695 7.974 ( 0.982 -1.577 -6.850) 7.097 8.558 ( -4.087 -0.514 -1.897) 4.534 8.588 ( 0.204 -9.712 -2.274) 9.976 9.427 ( 4.187 6.890 -5.459) 9.737 9.805 ( 11.108 -4.879 2.395) 12.366 10.250 ( -4.686 1.190 -15.806) 16.529 11.013 ( 3.261 -7.820 11.330) 14.148 11.710 ( -7.921 8.103 13.804) 17.859 15.128 ( 7.778 -6.928 -2.029) 10.612 15.754 ( -10.378 11.026 -0.035) 15.142 16.111 ( -5.108 2.765 6.954) 9.060 16.467 ( -7.444 -5.497 -1.219) 9.333 16.527 ( 2.054 -0.066 8.916) 9.149 17.178 ( -11.328 2.581 5.267) 12.757 17.503 ( 3.389 1.173 3.596) 5.079 18.508 ( 3.470 1.609 3.816) 5.403 18.966 ( -3.580 1.608 -6.039) 7.202 19.233 ( 6.266 -2.818 -11.031) 12.996 19.683 ( 6.241 -1.496 -1.649) 6.627 20.549 ( 6.303 0.877 -5.793) 8.605 ======================= Grid point 350 (163/336) ======================= q-point: (-0.27 -0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.664 ( -23.987 -0.000 5.190) 24.542 3.132 ( -21.567 -0.000 5.362) 22.223 3.569 ( 5.206 0.000 -4.514) 6.890 5.010 ( -21.519 -0.000 2.589) 21.674 5.550 ( 1.728 0.000 -3.122) 3.569 6.179 ( 4.937 0.000 -5.419) 7.331 6.418 ( 18.417 0.000 -10.360) 21.131 6.997 ( 1.362 0.000 -9.025) 9.127 7.616 ( -7.944 -0.000 2.648) 8.374 7.750 ( 4.138 0.000 4.855) 6.379 7.906 ( 9.736 0.000 0.112) 9.736 8.201 ( 2.614 0.000 -1.332) 2.933 8.768 ( -8.741 -0.000 -2.503) 9.092 9.556 ( 2.259 0.000 -0.116) 2.262 9.578 ( 5.643 0.000 -14.172) 15.254 10.415 ( -2.768 -0.000 -16.508) 16.738 10.736 ( 3.445 0.000 14.007) 14.424 11.853 ( -2.917 -0.000 15.678) 15.947 14.870 ( 7.979 0.000 -1.084) 8.052 16.066 ( 6.131 0.000 7.583) 9.751 16.093 ( -5.418 -0.000 5.757) 7.906 16.405 ( 4.628 0.000 9.753) 10.796 16.672 ( -15.774 -0.000 -4.281) 16.344 17.399 ( 4.394 0.000 6.781) 8.080 17.434 ( -14.543 -0.000 1.563) 14.626 18.460 ( 3.214 0.000 5.163) 6.082 19.109 ( -5.942 -0.000 -7.225) 9.355 19.110 ( 6.721 0.000 -11.401) 13.234 19.608 ( 4.199 0.000 -2.957) 5.135 20.433 ( 8.157 0.000 -4.862) 9.495 ======================= Grid point 351 (164/336) ======================= q-point: (-0.18 -0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.178 ( -25.676 10.371 7.880) 28.791 2.742 ( -26.377 -1.810 6.052) 27.123 3.605 ( 4.304 2.980 -8.657) 10.117 4.656 ( -25.790 -10.064 2.968) 27.843 5.526 ( -1.520 -2.106 -6.072) 6.604 6.250 ( 4.305 -1.261 -4.895) 6.640 6.720 ( 19.106 5.022 -4.998) 20.377 6.977 ( 1.839 -2.256 -10.542) 10.937 7.454 ( -7.146 6.668 3.123) 10.261 7.817 ( 1.739 -2.435 -0.347) 3.012 8.069 ( 9.777 7.548 1.422) 12.433 8.340 ( 6.211 -12.609 -0.706) 14.074 8.552 ( -10.772 -0.441 -1.981) 10.962 9.566 ( 4.101 5.386 -8.481) 10.852 9.728 ( 11.188 -2.683 3.926) 12.157 10.287 ( -2.695 1.935 -17.357) 17.671 10.867 ( 1.608 -5.472 11.316) 12.672 11.825 ( -6.299 3.289 14.626) 16.261 15.021 ( 7.449 -3.177 -0.820) 8.139 15.946 ( -9.986 7.035 5.164) 13.261 16.149 ( -2.167 0.736 3.793) 4.430 16.368 ( -15.641 -3.765 -3.440) 16.452 16.524 ( 3.759 -0.155 8.508) 9.303 17.209 ( -10.384 0.760 4.522) 11.352 17.516 ( 5.337 0.280 4.525) 7.003 18.531 ( 2.682 0.669 4.691) 5.445 18.988 ( -3.706 0.646 -5.877) 6.978 19.198 ( 8.215 -0.835 -11.742) 14.355 19.672 ( 4.140 -0.001 -1.217) 4.315 20.551 ( 7.676 -0.257 -7.331) 10.618 ======================= Grid point 352 (165/336) ======================= q-point: (-0.09 -0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( -19.661 2.624 8.583) 21.613 2.287 ( -28.770 -0.545 7.142) 29.648 3.613 ( 5.762 4.181 -9.370) 11.768 4.270 ( -35.241 -17.055 4.542) 39.414 5.508 ( 0.936 -1.455 -5.021) 5.311 6.293 ( 0.637 -3.112 -5.901) 6.702 6.845 ( 5.160 5.393 -6.608) 9.969 7.084 ( 6.886 1.445 0.547) 7.057 7.322 ( 1.958 4.406 0.676) 4.868 7.860 ( 0.513 -3.497 -2.279) 4.206 8.149 ( 9.545 9.441 -2.383) 13.635 8.405 ( -4.171 -1.865 1.028) 4.683 8.598 ( 6.715 -10.569 -2.971) 12.869 9.527 ( 1.926 7.775 -6.031) 10.027 10.030 ( 15.148 -3.317 8.141) 17.514 10.115 ( -4.772 2.885 -15.127) 16.122 10.992 ( -0.953 -9.714 7.802) 12.495 11.703 ( -8.179 7.687 13.474) 17.537 15.183 ( 6.020 -6.064 -0.930) 8.595 15.632 ( -15.818 12.439 2.309) 20.255 15.986 ( -11.138 1.370 -2.550) 11.508 16.210 ( -12.834 -11.349 1.195) 17.174 16.620 ( 3.283 1.495 7.174) 8.030 17.105 ( -2.162 3.526 5.541) 6.914 17.616 ( 4.698 1.602 3.637) 6.153 18.586 ( 1.979 0.712 3.900) 4.431 18.913 ( -1.144 1.108 -4.357) 4.639 19.297 ( 7.867 -0.260 -11.187) 13.679 19.751 ( 3.863 -2.374 0.141) 4.537 20.632 ( 5.846 0.932 -9.659) 11.329 ======================= Grid point 362 (166/336) ======================= q-point: (-0.18 -0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.775 ( -28.265 -0.000 10.084) 30.010 2.283 ( -27.879 -0.000 9.989) 29.614 3.655 ( 4.928 0.000 -9.931) 11.086 4.087 ( -34.322 -0.000 3.574) 34.507 5.489 ( 1.358 0.000 -5.983) 6.135 6.260 ( -0.451 -0.000 -5.985) 6.002 6.941 ( 3.501 0.000 -11.831) 12.338 7.047 ( 14.626 0.000 -0.245) 14.628 7.380 ( -5.892 -0.000 4.152) 7.208 7.836 ( 2.479 0.000 -1.113) 2.717 8.325 ( 4.346 0.000 -6.637) 7.933 8.359 ( 12.316 0.000 2.324) 12.533 8.424 ( -3.191 -0.000 2.774) 4.228 9.603 ( 2.537 0.000 -6.194) 6.694 10.006 ( 16.125 0.000 10.184) 19.072 10.156 ( -5.051 -0.000 -17.829) 18.531 10.875 ( -2.278 -0.000 8.194) 8.504 11.781 ( -7.397 -0.000 13.540) 15.428 15.115 ( 5.042 0.000 0.214) 5.046 15.830 ( -10.954 -0.000 6.672) 12.826 15.969 ( -18.480 -0.000 -1.962) 18.584 16.062 ( -12.145 -0.000 -4.690) 13.020 16.636 ( 4.957 0.000 6.512) 8.184 17.140 ( -1.378 -0.000 5.769) 5.932 17.631 ( 4.785 0.000 3.898) 6.172 18.593 ( 1.661 0.000 4.112) 4.435 18.924 ( -1.227 -0.000 -4.229) 4.404 19.296 ( 8.611 0.000 -11.369) 14.262 19.730 ( 2.797 0.000 0.266) 2.809 20.638 ( 6.631 0.000 -10.843) 12.710 ======================= Grid point 363 (167/336) ======================= q-point: (-0.09 -0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.348 ( -24.710 -4.968 9.090) 26.794 1.852 ( -25.498 0.779 15.055) 29.621 3.457 ( -44.017 -9.215 7.154) 45.536 3.709 ( 6.680 1.265 -7.830) 10.370 5.517 ( 3.833 -1.567 -4.444) 6.075 6.192 ( -3.999 -2.889 -8.665) 9.971 6.955 ( 5.959 5.830 -8.509) 11.912 7.215 ( 2.218 6.806 5.512) 9.035 7.386 ( 4.544 -8.343 3.444) 10.105 7.886 ( 3.864 1.356 -0.117) 4.097 8.359 ( 6.740 5.076 -6.815) 10.846 8.384 ( -0.746 1.617 4.617) 4.948 8.617 ( 9.111 -7.481 -4.985) 12.800 9.601 ( 1.135 6.775 -2.556) 7.329 9.926 ( -9.675 -0.684 -16.056) 18.759 10.372 ( 17.080 1.402 11.576) 20.681 10.876 ( -4.810 -8.521 4.727) 10.867 11.714 ( -3.047 4.698 15.649) 16.621 15.212 ( 3.212 -5.090 1.067) 6.112 15.472 ( -17.917 15.887 0.032) 23.946 15.757 ( -11.570 -7.438 -0.041) 13.755 15.847 ( -13.391 -7.316 -2.215) 15.419 16.742 ( 4.663 3.430 3.882) 6.970 17.139 ( -1.136 1.009 0.229) 1.536 17.718 ( 3.401 0.778 4.025) 5.326 18.627 ( 0.399 0.132 2.882) 2.912 18.908 ( 1.197 0.566 -1.825) 2.255 19.387 ( 7.160 0.407 -10.266) 12.523 19.782 ( 1.922 -1.764 1.107) 2.834 20.676 ( 3.946 0.474 -14.146) 14.694 ======================= Grid point 374 (168/336) ======================= q-point: (-0.09 -0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.905 ( -24.858 -0.000 9.807) 26.723 1.522 ( -21.074 -0.000 20.602) 29.471 2.624 ( -48.390 -0.000 14.515) 50.520 3.809 ( 7.167 0.000 -5.523) 9.048 5.573 ( 5.459 0.000 -2.406) 5.965 6.061 ( -3.409 -0.000 -10.148) 10.706 7.059 ( 5.253 0.000 -7.232) 8.939 7.362 ( 0.842 0.000 10.042) 10.077 7.365 ( 2.470 0.000 2.954) 3.851 7.976 ( 3.762 0.000 2.226) 4.371 8.367 ( -2.947 -0.000 1.013) 3.117 8.459 ( 5.531 0.000 -4.086) 6.877 8.751 ( 11.347 0.000 -7.546) 13.627 9.562 ( -20.547 -0.000 -12.527) 24.064 9.702 ( 4.404 0.000 1.369) 4.612 10.685 ( 7.983 0.000 3.548) 8.736 10.715 ( -8.457 -0.000 0.346) 8.464 11.960 ( 22.209 0.000 28.351) 36.014 15.223 ( 0.021 0.000 3.691) 3.691 15.231 ( -18.009 -0.000 -5.632) 18.869 15.497 ( -8.652 -0.000 1.978) 8.875 15.655 ( -5.444 -0.000 -1.698) 5.702 16.873 ( 5.044 0.000 1.727) 5.331 16.985 ( -15.088 -0.000 -11.745) 19.120 17.791 ( 2.268 0.000 4.831) 5.337 18.630 ( -1.018 -0.000 1.178) 1.557 18.942 ( 2.218 0.000 0.724) 2.333 19.455 ( 5.038 0.000 -8.792) 10.133 19.808 ( 1.403 0.000 1.214) 1.855 20.627 ( -2.468 -0.000 -17.070) 17.247 ======================= Grid point 375 (169/336) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.678 ( 0.367 0.000 13.506) 13.511 1.331 ( -2.655 -0.000 15.782) 16.004 2.412 ( -9.074 -0.000 27.694) 29.143 3.818 ( 3.380 0.000 -9.027) 9.639 5.779 ( 3.664 0.000 -8.502) 9.258 5.988 ( 8.483 0.000 9.001) 12.368 7.157 ( 4.844 0.000 1.255) 5.004 7.435 ( 1.521 0.000 -1.429) 2.087 7.572 ( -9.517 -0.000 11.529) 14.950 8.026 ( -4.646 -0.000 1.125) 4.780 8.359 ( 3.880 0.000 -4.527) 5.962 8.763 ( -0.720 -0.000 9.761) 9.787 8.993 ( 12.775 0.000 -4.022) 13.393 9.011 ( 1.675 0.000 5.562) 5.809 9.986 ( 6.837 0.000 2.297) 7.212 10.178 ( -12.165 -0.000 -7.477) 14.279 10.191 ( -10.616 -0.000 -15.755) 18.998 13.983 ( 13.185 0.000 -1.099) 13.231 14.556 ( 4.678 0.000 -6.354) 7.890 15.212 ( -9.145 -0.000 4.973) 10.410 15.400 ( 5.215 0.000 -0.633) 5.253 15.722 ( 2.486 0.000 -0.434) 2.524 15.850 ( -2.871 -0.000 4.504) 5.341 16.931 ( -1.807 -0.000 -0.383) 1.847 18.026 ( 0.711 0.000 5.880) 5.923 18.564 ( -2.240 -0.000 -0.600) 2.319 19.008 ( -0.468 -0.000 1.380) 1.457 19.374 ( 1.217 0.000 -5.364) 5.500 19.858 ( 1.682 0.000 -0.881) 1.899 20.172 ( -6.314 -0.000 0.405) 6.327 ======================= Grid point 376 (170/336) ======================= q-point: ( 0.09 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.069 ( 8.712 -32.930 9.379) 35.330 1.727 ( 34.446 -6.229 12.336) 37.115 2.389 ( -6.910 -0.107 24.938) 25.878 3.850 ( 2.863 -3.646 -9.176) 10.281 5.832 ( 5.779 -0.927 -8.590) 10.395 6.121 ( 1.600 0.260 6.122) 6.333 7.165 ( -2.873 7.100 1.089) 7.736 7.348 ( 0.937 11.401 5.604) 12.738 7.551 ( -6.117 -7.909 2.163) 10.230 7.998 ( -1.921 -6.651 0.549) 6.945 8.270 ( -8.313 1.963 -4.052) 9.454 8.892 ( 11.148 2.272 9.323) 14.709 9.098 ( 5.470 2.037 -1.581) 6.047 9.135 ( 0.512 -1.520 2.930) 3.340 9.859 ( -5.389 11.480 -11.639) 17.213 10.050 ( -5.715 -6.368 -10.255) 13.356 10.178 ( 8.372 -7.055 2.720) 11.281 13.665 ( -25.193 16.870 3.990) 30.581 14.730 ( 12.974 1.731 -7.813) 15.244 15.155 ( -7.779 -12.278 2.516) 14.751 15.500 ( 6.447 0.642 1.645) 6.685 15.827 ( 8.873 -3.598 1.518) 9.695 16.156 ( 27.180 3.002 -2.299) 27.442 16.918 ( -3.313 -8.948 -0.480) 9.554 18.049 ( -0.612 0.726 5.090) 5.178 18.511 ( -3.495 0.386 -0.003) 3.517 19.021 ( 0.774 -1.986 0.149) 2.136 19.346 ( -1.762 -0.278 -5.497) 5.779 19.898 ( 2.996 -0.894 -1.051) 3.298 20.034 ( -7.775 3.702 1.606) 8.760 ======================= Grid point 377 (171/336) ======================= q-point: ( 0.18 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.525 ( 9.685 -20.492 5.036) 23.218 2.361 ( -0.811 -0.046 22.457) 22.472 2.673 ( 40.479 -21.217 5.019) 45.977 3.896 ( 1.535 -4.826 -7.624) 9.153 5.914 ( 6.179 -1.307 -7.983) 10.179 6.083 ( -6.711 0.490 0.630) 6.758 7.001 ( -5.212 7.979 2.419) 9.833 7.314 ( 0.202 6.402 5.490) 8.436 7.481 ( -4.324 2.414 -0.537) 4.981 8.007 ( -5.812 -0.180 -2.308) 6.256 8.106 ( -5.646 -4.157 -1.655) 7.205 9.010 ( -9.001 -5.063 -3.059) 10.770 9.128 ( 2.462 10.198 -1.848) 10.652 9.162 ( 10.431 1.886 9.141) 13.997 9.663 ( 0.536 9.197 -11.593) 14.807 10.023 ( 0.277 -6.141 -6.862) 9.213 10.459 ( 11.253 -8.754 6.928) 15.851 13.039 ( -27.825 16.750 7.840) 33.410 14.901 ( 12.033 4.118 -6.061) 14.088 15.187 ( -2.744 -13.427 1.881) 13.833 15.660 ( 9.348 -3.108 2.788) 10.238 16.029 ( 9.695 -2.656 -3.034) 10.501 16.482 ( 13.022 8.953 2.072) 15.938 17.042 ( 4.998 -15.805 -1.278) 16.626 18.033 ( -2.697 1.247 4.368) 5.283 18.433 ( -4.488 1.189 1.364) 4.839 19.080 ( 4.001 -2.883 -3.479) 6.035 19.267 ( -4.685 -0.800 -5.991) 7.648 19.839 ( -8.184 7.676 0.424) 11.228 19.975 ( 4.545 -2.089 -1.615) 5.256 ======================= Grid point 378 (172/336) ======================= q-point: ( 0.27 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.849 ( 9.163 -8.229 1.437) 12.399 2.434 ( 0.143 -2.728 13.705) 13.974 3.640 ( 34.238 -24.076 1.562) 41.885 3.922 ( 2.283 -5.169 -3.741) 6.777 5.919 ( -9.721 -0.841 -2.828) 10.159 5.995 ( 5.334 -0.197 -6.298) 8.255 6.895 ( -2.917 0.572 2.621) 3.963 7.255 ( -2.845 6.726 4.295) 8.472 7.368 ( -1.523 8.117 -2.273) 8.565 7.825 ( -8.488 2.931 -4.287) 9.950 8.055 ( -4.883 -1.844 -1.449) 5.417 8.828 ( -8.127 5.475 -3.270) 10.331 9.016 ( -6.938 -3.254 -8.860) 11.714 9.358 ( 8.808 6.184 10.183) 14.817 9.582 ( 5.252 9.394 -7.797) 13.290 10.098 ( 3.831 -6.595 -7.256) 10.527 10.779 ( 10.100 -8.407 11.143) 17.229 12.463 ( -23.934 12.491 7.049) 27.903 14.999 ( 6.001 2.989 -3.722) 7.668 15.336 ( 4.997 -8.949 1.998) 10.442 15.915 ( 11.514 -7.788 2.657) 14.152 16.175 ( 7.377 0.734 -4.245) 8.543 16.535 ( 0.457 2.635 3.571) 4.461 17.305 ( 6.512 -10.577 5.845) 13.728 17.964 ( -5.733 1.682 3.746) 7.052 18.353 ( -3.358 1.762 2.275) 4.422 19.142 ( -6.102 -1.374 -6.176) 8.790 19.181 ( 6.673 -1.211 -9.436) 11.620 19.617 ( -7.065 8.826 0.533) 11.318 20.084 ( 5.835 -2.950 -2.641) 7.051 ======================= Grid point 379 (173/336) ======================= q-point: ( 0.36 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.016 ( 5.638 1.901 0.768) 5.999 2.552 ( 4.012 -5.625 4.040) 8.004 3.755 ( -11.149 -3.190 -4.949) 12.609 4.580 ( 30.539 -23.335 3.204) 38.567 5.784 ( -3.953 -2.282 -3.682) 5.864 6.035 ( 2.668 2.479 -3.495) 5.048 6.871 ( -7.354 -4.472 0.835) 8.647 7.117 ( -4.477 7.904 3.978) 9.917 7.273 ( 3.447 9.731 -4.043) 11.087 7.635 ( -7.300 3.282 -4.213) 9.045 7.984 ( -2.012 -1.240 -3.815) 4.488 8.616 ( -3.590 11.718 -2.950) 12.605 8.882 ( -11.079 -9.885 -8.876) 17.298 9.383 ( 0.179 6.523 -3.843) 7.572 9.647 ( 11.718 8.726 5.679) 15.675 10.168 ( 1.840 -3.171 -10.190) 10.830 11.064 ( 7.378 -5.994 13.729) 16.699 12.041 ( -16.882 4.897 6.779) 18.840 15.050 ( 4.109 1.405 -2.977) 5.265 15.505 ( 4.587 -4.920 1.537) 6.900 16.211 ( 9.265 -9.834 2.510) 13.742 16.256 ( 5.149 2.187 1.277) 5.738 16.524 ( -0.789 -0.637 -0.803) 1.293 17.487 ( -0.971 -5.934 15.726) 16.836 17.827 ( -9.476 1.987 3.340) 10.242 18.319 ( 0.891 1.043 0.663) 1.524 19.003 ( -7.023 -1.819 -6.831) 9.964 19.223 ( 4.885 6.209 -17.689) 19.373 19.494 ( 0.703 3.073 5.650) 6.470 20.207 ( 5.984 -3.326 -3.978) 7.918 ======================= Grid point 380 (174/336) ======================= q-point: (-0.55 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( 1.568 6.733 2.767) 7.446 2.702 ( 5.065 -5.975 -3.859) 8.732 3.493 ( -17.051 -2.008 -3.809) 17.586 5.192 ( 12.312 -16.383 3.446) 20.782 5.777 ( -2.589 0.546 -3.278) 4.213 6.063 ( 9.122 -0.239 -1.932) 9.328 6.624 ( -11.182 9.814 -2.135) 15.030 7.046 ( -2.092 4.049 4.541) 6.433 7.290 ( 0.403 -0.218 -3.021) 3.056 7.491 ( -0.092 0.235 -4.831) 4.838 7.983 ( 2.821 0.379 -5.916) 6.565 8.486 ( 0.492 5.412 -2.844) 6.134 8.725 ( -10.923 -6.101 -6.511) 14.104 9.284 ( -0.898 4.930 -7.435) 8.966 9.822 ( 11.457 5.480 7.493) 14.745 10.114 ( -1.779 2.337 -12.575) 12.913 11.271 ( 4.352 -1.842 13.845) 14.629 11.830 ( -10.714 -3.627 7.857) 13.773 15.095 ( 3.103 -0.119 -2.886) 4.240 15.587 ( 0.680 -2.099 -1.112) 2.471 16.320 ( -5.137 -2.357 10.404) 11.840 16.386 ( 5.948 -3.009 -4.685) 8.147 16.580 ( 6.724 -1.631 1.635) 7.110 17.511 ( -10.388 -1.999 16.340) 19.466 17.645 ( -9.281 0.794 7.392) 11.891 18.379 ( 5.543 -1.288 -1.181) 5.812 18.878 ( -5.170 -1.960 -7.163) 9.048 19.122 ( 2.575 8.087 -15.415) 17.597 19.591 ( 7.758 1.199 2.739) 8.315 20.313 ( 4.804 -2.846 -5.720) 7.994 ======================= Grid point 381 (175/336) ======================= q-point: (-0.45 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( -1.287 6.350 4.777) 8.050 2.700 ( -10.479 -1.056 -4.713) 11.539 3.281 ( -4.268 -4.954 -3.408) 7.374 5.368 ( -10.026 6.036 6.264) 13.274 5.477 ( -12.818 0.813 -4.866) 13.735 6.272 ( 4.141 3.042 -4.214) 6.645 6.591 ( 20.598 0.175 1.180) 20.633 6.976 ( -3.404 4.182 2.470) 5.931 7.158 ( -8.803 -2.387 -3.596) 9.804 7.641 ( 8.638 -9.151 -4.687) 13.429 7.977 ( 2.414 5.764 -5.122) 8.080 8.499 ( 1.627 -2.158 -2.450) 3.648 8.585 ( -3.844 -1.004 -4.381) 5.914 9.218 ( 0.211 -0.175 -6.551) 6.557 9.946 ( -2.348 -1.949 -7.913) 8.481 10.048 ( 10.644 8.202 1.953) 13.579 11.371 ( 0.865 3.224 11.548) 12.021 11.761 ( -8.580 -8.318 8.841) 14.865 15.130 ( 0.384 -3.203 -3.218) 4.556 15.577 ( -1.406 0.269 -2.210) 2.633 16.190 ( -10.540 0.859 0.384) 10.582 16.508 ( 4.147 1.601 3.942) 5.942 16.694 ( 0.772 -1.826 4.518) 4.934 17.323 ( -14.109 -0.913 9.981) 17.307 17.612 ( -2.550 -2.562 13.002) 13.495 18.507 ( 6.087 -2.743 0.055) 6.677 18.799 ( -2.067 -2.002 -6.970) 7.541 19.057 ( 5.024 5.575 -12.971) 14.985 19.729 ( 8.336 2.714 0.890) 8.811 20.374 ( 3.040 -1.850 -8.389) 9.113 ======================= Grid point 382 (176/336) ======================= q-point: (-0.36 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( -7.281 7.185 3.469) 10.801 2.391 ( -19.680 -1.011 4.876) 20.300 3.373 ( 8.185 -4.055 -4.073) 10.001 4.723 ( -34.738 18.418 2.299) 39.386 5.493 ( 3.488 1.782 0.356) 3.933 6.244 ( 0.602 4.559 -6.234) 7.747 6.787 ( -1.588 7.372 0.262) 7.546 7.044 ( 1.034 -8.584 3.895) 9.483 7.180 ( 17.376 -7.248 -2.039) 18.938 7.816 ( 2.704 -5.471 -6.885) 9.200 7.962 ( 5.910 2.697 -2.321) 6.898 8.480 ( -1.615 -0.080 1.802) 2.421 8.602 ( 3.672 0.789 -6.042) 7.114 9.249 ( 1.555 -7.503 -4.024) 8.655 9.853 ( -2.168 0.407 -8.393) 8.678 10.224 ( 9.882 0.535 3.044) 10.354 11.342 ( -3.229 7.626 7.941) 11.473 11.759 ( -5.175 -8.724 10.563) 14.644 15.134 ( -4.602 -8.269 -3.901) 10.236 15.520 ( -1.652 4.351 -1.132) 4.789 15.971 ( -10.931 3.555 -0.326) 11.499 16.432 ( -9.016 8.876 0.851) 12.680 16.698 ( -3.762 -3.677 3.673) 6.416 17.222 ( -5.268 -2.788 12.401) 13.759 17.690 ( 1.479 -3.736 9.190) 10.030 18.623 ( 3.148 -2.152 2.114) 4.360 18.783 ( 1.390 -2.074 -5.635) 6.163 19.081 ( 8.048 2.355 -11.306) 14.076 19.829 ( 6.003 4.130 0.450) 7.300 20.385 ( 2.080 -1.025 -12.105) 12.325 ======================= Grid point 383 (177/336) ======================= q-point: (-0.27 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.589 ( -17.160 8.762 1.645) 19.338 2.172 ( -11.955 -0.036 16.784) 20.607 3.546 ( 8.664 -0.734 -3.450) 9.355 3.892 ( -38.094 18.796 4.854) 42.755 5.545 ( 6.050 4.886 0.640) 7.802 6.115 ( -4.233 7.641 -8.633) 12.281 6.756 ( 2.230 -2.625 -1.534) 3.771 7.130 ( -1.737 -12.069 4.479) 12.990 7.601 ( 19.784 3.607 3.393) 20.395 7.825 ( 2.105 -2.601 -2.026) 3.912 8.101 ( 7.838 -3.789 -5.452) 10.272 8.491 ( 1.268 -0.137 2.969) 3.231 8.593 ( 1.151 3.148 -5.870) 6.760 9.341 ( -1.518 -11.220 -2.104) 11.516 9.794 ( 0.054 2.267 -3.802) 4.427 10.383 ( 3.096 -7.216 -2.277) 8.176 11.184 ( -7.572 10.199 3.429) 13.157 11.898 ( 7.645 -7.164 16.066) 19.180 15.077 ( -11.928 -13.489 -4.528) 18.568 15.426 ( -0.022 10.464 -0.172) 10.466 15.761 ( -8.269 2.803 -0.196) 8.733 16.106 ( -14.433 11.808 0.654) 18.659 16.680 ( -5.825 -7.227 1.407) 9.388 17.211 ( -3.448 1.921 6.432) 7.547 17.799 ( 2.428 -3.154 7.343) 8.352 18.666 ( -0.548 -0.587 1.262) 1.496 18.845 ( 4.981 -2.056 -1.987) 5.743 19.178 ( 8.725 0.076 -9.121) 12.622 19.863 ( 2.320 4.397 0.607) 5.008 20.366 ( 1.897 -0.663 -14.848) 14.984 ======================= Grid point 384 (178/336) ======================= q-point: (-0.18 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.202 ( -17.133 9.780 6.574) 20.794 2.034 ( -11.317 9.019 20.566) 25.147 3.024 ( -38.452 12.586 8.917) 41.431 3.721 ( 8.388 1.963 -3.110) 9.159 5.630 ( 8.111 4.545 2.368) 9.595 5.923 ( -3.577 6.759 -8.978) 11.793 6.874 ( 5.166 -7.597 -1.449) 9.300 7.244 ( -1.374 -12.066 4.260) 12.870 7.722 ( 4.524 8.425 4.472) 10.557 8.023 ( 8.387 -1.812 7.199) 11.201 8.217 ( 5.298 -0.673 -7.073) 8.862 8.553 ( 0.876 -2.939 8.238) 8.790 8.583 ( 8.263 2.606 -11.659) 14.526 9.325 ( -10.791 -7.853 -1.194) 13.399 9.793 ( 4.268 3.494 0.412) 5.531 10.422 ( -6.420 -12.170 -8.702) 16.280 10.914 ( -11.268 11.262 -1.840) 16.037 12.382 ( 28.646 -9.088 22.264) 37.402 14.914 ( -16.947 -11.836 -5.710) 21.445 15.350 ( 3.372 9.935 -1.146) 10.554 15.631 ( -4.761 1.438 0.476) 4.996 15.753 ( -11.447 12.103 2.371) 16.826 16.597 ( -15.865 -11.233 -2.273) 19.572 17.098 ( -2.808 10.570 -0.483) 10.948 17.897 ( 2.067 -2.034 6.836) 7.425 18.644 ( -1.808 0.305 -0.304) 1.858 18.949 ( 4.559 -0.707 0.595) 4.652 19.284 ( 6.793 -0.300 -7.226) 9.922 19.850 ( 0.478 2.863 0.351) 2.924 20.328 ( -0.028 -0.864 -12.750) 12.779 ======================= Grid point 385 (179/336) ======================= q-point: (-0.09 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.869 ( -10.645 16.421 11.413) 22.654 1.654 ( -25.229 15.559 14.825) 33.142 2.511 ( -18.743 0.064 23.125) 29.767 3.797 ( 5.355 2.937 -6.736) 9.093 5.766 ( 5.668 -0.242 0.175) 5.676 5.817 ( 4.221 5.136 -2.016) 6.946 7.034 ( 5.681 -5.058 -0.528) 7.625 7.348 ( -2.072 -13.010 3.062) 13.525 7.705 ( -0.596 11.252 8.462) 14.092 8.095 ( -2.736 0.519 5.102) 5.813 8.268 ( 5.504 0.434 -5.149) 7.549 8.670 ( 3.265 -4.714 9.970) 11.502 8.754 ( 16.261 1.741 -8.749) 18.547 9.129 ( -13.552 -0.949 1.147) 13.634 9.870 ( 6.084 1.758 1.924) 6.618 10.331 ( -11.163 -12.484 -11.505) 20.318 10.563 ( -13.102 11.489 -7.246) 18.872 13.243 ( 42.665 -12.442 16.607) 47.444 14.690 ( -13.094 -5.792 -8.033) 16.417 15.342 ( 4.431 5.579 -1.033) 7.199 15.429 ( -10.030 9.380 3.037) 14.064 15.641 ( 2.254 0.804 1.081) 2.626 16.236 ( -29.582 -3.786 -3.060) 29.980 16.979 ( 0.551 7.984 -0.977) 8.062 17.973 ( 1.508 -0.950 6.497) 6.737 18.604 ( -1.966 0.277 -0.712) 2.109 19.005 ( 1.384 0.832 1.017) 1.908 19.353 ( 4.029 -0.045 -5.941) 7.178 19.842 ( 0.885 1.001 -0.291) 1.367 20.264 ( -3.634 -1.349 -5.619) 6.827 ======================= Grid point 387 (180/336) ======================= q-point: ( 0.09 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( 22.139 0.000 10.675) 24.578 2.366 ( -1.457 -0.000 25.579) 25.620 2.476 ( 40.300 0.000 3.444) 40.447 3.843 ( 2.700 0.000 -9.142) 9.533 5.901 ( 6.669 0.000 -8.833) 11.067 6.086 ( -7.284 -0.000 -0.175) 7.286 7.154 ( -3.818 -0.000 -0.815) 3.904 7.226 ( -12.437 -0.000 9.213) 15.478 7.653 ( 9.402 0.000 -1.259) 9.486 7.923 ( -1.931 -0.000 1.322) 2.340 8.080 ( -10.549 -0.000 -3.980) 11.275 8.907 ( -14.424 -0.000 -5.938) 15.598 9.180 ( 12.949 0.000 4.840) 13.824 9.280 ( 4.098 0.000 8.771) 9.681 9.799 ( -0.541 -0.000 -15.024) 15.034 9.928 ( -0.156 -0.000 -3.527) 3.531 10.356 ( 12.108 0.000 4.926) 13.071 13.218 ( -32.755 -0.000 6.595) 33.412 14.977 ( 17.628 0.000 -7.251) 19.061 15.008 ( -4.430 -0.000 3.551) 5.677 15.624 ( 6.377 0.000 2.654) 6.907 15.993 ( 10.973 0.000 -2.263) 11.204 16.694 ( 27.688 0.000 -2.641) 27.814 16.774 ( -6.725 -0.000 1.782) 6.957 18.045 ( -2.726 -0.000 4.219) 5.022 18.445 ( -4.362 -0.000 1.495) 4.611 19.052 ( 4.695 0.000 -2.883) 5.510 19.259 ( -4.875 -0.000 -5.842) 7.609 19.915 ( -8.388 -0.000 0.430) 8.399 19.954 ( 4.433 0.000 -1.702) 4.748 ======================= Grid point 388 (181/336) ======================= q-point: ( 0.18 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( 23.056 -1.537 8.412) 24.590 2.406 ( -1.385 -0.693 17.572) 17.640 3.311 ( 41.496 -8.809 2.593) 42.500 3.841 ( -0.438 -2.695 -8.144) 8.590 5.897 ( -11.367 -0.893 -5.152) 12.512 5.986 ( 6.891 -0.429 -7.821) 10.433 6.981 ( -7.685 7.416 3.182) 11.143 7.157 ( -7.036 -8.841 1.043) 11.347 7.691 ( 5.724 17.034 0.054) 17.970 7.868 ( -8.319 1.530 -4.389) 9.530 7.979 ( -1.166 -7.571 0.470) 7.675 8.632 ( -16.826 -10.152 -5.107) 20.304 9.190 ( -3.567 7.819 -5.134) 10.010 9.464 ( 8.076 3.392 11.408) 14.383 9.768 ( 7.297 9.125 -7.098) 13.671 9.960 ( 2.600 -7.384 -5.916) 9.812 10.628 ( 11.040 -5.491 9.052) 15.296 12.649 ( -29.928 5.549 6.228) 31.068 14.977 ( -2.202 -2.997 2.026) 4.235 15.285 ( 18.850 1.466 -4.631) 19.465 15.776 ( 6.853 -5.039 3.975) 9.389 16.169 ( 9.955 -0.596 -6.454) 11.879 16.632 ( -5.375 4.771 3.962) 8.207 17.131 ( 14.465 -6.115 5.968) 16.800 17.986 ( -5.710 0.597 3.473) 6.710 18.378 ( -3.547 0.696 2.752) 4.543 19.125 ( -6.755 -0.407 -6.228) 9.197 19.162 ( 9.429 -0.576 -7.435) 12.021 19.742 ( -8.385 3.602 -1.651) 9.274 20.038 ( 5.268 -1.429 -2.583) 6.039 ======================= Grid point 389 (182/336) ======================= q-point: ( 0.27 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( 20.440 9.450 5.405) 23.159 2.494 ( 2.871 -1.154 10.156) 10.617 3.705 ( -6.984 -1.164 -7.932) 10.632 4.170 ( 31.640 -18.104 2.720) 36.555 5.714 ( -7.042 -3.897 -6.511) 10.352 6.073 ( 5.910 1.178 -5.339) 8.051 6.803 ( -9.772 -0.637 0.859) 9.830 7.116 ( -4.655 -4.574 -2.803) 7.103 7.586 ( 2.289 17.740 -0.837) 17.907 7.701 ( -5.537 3.875 -1.773) 6.987 7.972 ( -2.620 -0.069 -1.815) 3.188 8.505 ( -11.039 -17.620 -3.138) 21.028 8.969 ( -6.040 12.564 -5.507) 14.989 9.511 ( 0.920 5.871 -3.910) 7.113 9.801 ( 5.885 6.318 2.715) 9.051 10.097 ( 7.496 -3.488 -4.561) 9.442 10.913 ( 7.711 -8.204 11.854) 16.349 12.143 ( -23.207 4.693 5.525) 24.313 14.989 ( -1.880 -5.275 0.504) 5.623 15.538 ( 14.746 6.369 -1.340) 16.118 16.007 ( 7.872 -10.585 3.462) 13.638 16.288 ( 7.142 1.070 -6.698) 9.849 16.536 ( -3.698 1.242 4.266) 5.781 17.389 ( 3.545 -3.826 16.364) 17.175 17.856 ( -9.676 1.060 2.892) 10.154 18.342 ( -0.467 1.028 2.088) 2.374 18.974 ( -7.149 -1.072 -6.657) 9.827 19.307 ( 11.264 2.586 -15.336) 19.203 19.568 ( -4.740 3.821 1.755) 6.337 20.140 ( 5.198 -3.088 -3.766) 7.123 ======================= Grid point 390 (183/336) ======================= q-point: ( 0.36 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.333 ( 13.104 20.691 5.171) 25.031 2.632 ( 8.553 -1.504 0.787) 8.719 3.457 ( -17.095 -1.567 -6.297) 18.285 4.847 ( 20.629 -18.120 3.413) 27.669 5.693 ( -0.512 -8.271 -5.091) 9.726 6.101 ( 3.118 4.028 -2.532) 5.688 6.642 ( -10.914 -5.479 -3.778) 12.783 7.051 ( -3.804 -0.942 -2.484) 4.640 7.465 ( 1.018 14.743 2.163) 14.935 7.565 ( -2.327 5.719 -3.245) 6.975 7.955 ( 2.396 -2.155 -4.660) 5.666 8.491 ( -6.178 -12.040 -2.105) 13.695 8.721 ( -5.124 11.513 -5.294) 13.668 9.401 ( -2.061 6.662 -8.466) 10.968 9.863 ( 2.110 -1.463 0.618) 2.641 10.191 ( 6.074 5.469 -4.313) 9.241 11.154 ( 3.515 -8.926 12.584) 15.823 11.812 ( -13.923 0.978 7.603) 15.893 15.003 ( -3.396 -6.986 -1.059) 7.839 15.674 ( 9.432 8.875 -0.640) 12.967 16.216 ( 1.625 -7.372 2.675) 8.009 16.371 ( 5.698 0.473 1.171) 5.837 16.538 ( 2.708 -2.461 0.388) 3.680 17.478 ( -6.407 -1.152 21.186) 22.164 17.658 ( -12.252 0.442 4.170) 12.950 18.370 ( 3.781 0.080 -0.188) 3.786 18.844 ( -5.172 -1.500 -6.852) 8.715 19.273 ( 1.618 7.109 -17.509) 18.967 19.619 ( 9.289 1.509 2.703) 9.791 20.240 ( 4.023 -4.261 -5.075) 7.752 ======================= Grid point 391 (184/336) ======================= q-point: (-0.55 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( 7.208 23.398 4.213) 24.843 2.734 ( -1.008 5.000 -5.489) 7.493 3.180 ( -8.737 -5.342 -1.555) 10.358 5.257 ( 9.630 -10.668 3.142) 14.711 5.554 ( -21.192 1.157 -1.629) 21.286 6.260 ( 12.644 -4.542 -1.386) 13.506 6.544 ( 1.553 -5.547 -5.186) 7.751 6.985 ( -3.633 -0.838 -0.920) 3.840 7.274 ( -8.766 12.184 4.029) 15.541 7.568 ( 8.015 1.915 -6.230) 10.330 8.038 ( 6.696 -0.561 -6.462) 9.322 8.498 ( -1.053 -5.829 -1.802) 6.191 8.541 ( -2.760 5.890 -4.132) 7.706 9.264 ( -2.706 4.247 -7.538) 9.065 9.880 ( -3.012 -5.092 -5.260) 7.917 10.206 ( 6.016 7.732 -3.219) 10.312 11.307 ( -2.347 -8.826 10.847) 14.180 11.686 ( -5.245 0.120 11.056) 12.238 14.985 ( -6.590 -9.129 -2.324) 11.496 15.710 ( 6.318 10.653 -1.602) 12.489 16.211 ( -5.030 1.114 1.928) 5.501 16.505 ( 6.165 -1.447 5.063) 8.108 16.632 ( 0.331 -4.375 1.351) 4.591 17.331 ( -14.187 1.602 9.710) 17.266 17.557 ( -6.061 -2.992 15.532) 16.939 18.465 ( 5.894 -1.537 -0.685) 6.129 18.763 ( -2.072 -1.693 -6.725) 7.238 19.170 ( 2.589 5.866 -13.719) 15.143 19.791 ( 10.996 3.443 -0.082) 11.522 20.310 ( 1.987 -4.450 -6.844) 8.402 ======================= Grid point 392 (185/336) ======================= q-point: (-0.45 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( 4.485 23.755 1.357) 24.213 2.419 ( -19.999 4.437 0.425) 20.490 3.289 ( 10.179 -4.287 -0.188) 11.047 4.999 ( -32.641 9.430 0.609) 33.981 5.484 ( 7.764 -2.660 2.856) 8.690 6.328 ( 1.764 3.772 -5.067) 6.559 6.811 ( -1.149 -16.154 2.790) 16.433 7.000 ( -9.750 10.861 1.301) 14.654 7.037 ( 18.333 -3.082 -1.822) 18.679 7.688 ( 5.803 -4.317 -6.254) 9.562 8.102 ( 7.355 7.564 -5.171) 11.750 8.473 ( -0.352 0.723 -1.324) 1.550 8.564 ( 3.975 -4.224 -4.823) 7.543 9.174 ( -2.059 -0.600 -3.752) 4.322 9.829 ( -3.325 -3.619 -6.472) 8.126 10.238 ( 3.554 0.960 -4.199) 5.585 11.339 ( -7.607 -7.840 8.282) 13.709 11.695 ( 1.075 2.541 13.138) 13.424 14.924 ( -9.718 -11.108 -2.969) 15.055 15.695 ( 4.808 11.072 -1.623) 12.180 16.074 ( -6.416 7.089 1.967) 9.762 16.536 ( -11.202 1.020 2.067) 11.436 16.624 ( -1.137 -2.766 1.768) 3.475 17.191 ( -4.934 -0.372 13.349) 14.236 17.600 ( -0.794 -5.353 11.384) 12.604 18.581 ( 4.497 -2.073 0.592) 4.987 18.744 ( 1.306 -1.893 -5.853) 6.289 19.138 ( 5.253 3.443 -11.061) 12.719 19.923 ( 8.277 5.291 -0.707) 9.849 20.335 ( 0.706 -4.026 -9.970) 10.775 ======================= Grid point 393 (186/336) ======================= q-point: (-0.36 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.892 ( -12.254 19.974 -3.232) 23.656 2.202 ( -4.812 5.236 14.495) 16.146 3.524 ( 12.071 -1.490 0.571) 12.176 4.260 ( -35.720 17.837 3.288) 40.061 5.625 ( 7.397 3.019 1.930) 8.219 6.268 ( -0.417 7.254 -7.346) 10.333 6.771 ( -5.593 4.291 0.226) 7.053 6.877 ( -4.122 -13.671 3.491) 14.700 7.523 ( 22.318 -9.278 2.244) 24.274 7.766 ( 1.186 -4.525 -5.506) 7.225 8.148 ( 9.163 8.195 -2.141) 12.478 8.480 ( 0.691 -0.819 0.398) 1.143 8.626 ( 3.349 0.134 -8.245) 8.900 9.173 ( -1.236 -5.781 0.322) 5.921 9.798 ( -0.630 -2.520 -3.484) 4.346 10.251 ( -2.420 -6.234 -7.821) 10.290 11.265 ( -9.965 -2.689 4.689) 11.336 11.819 ( 8.692 0.403 15.865) 18.095 14.828 ( -11.768 -11.624 -3.058) 16.821 15.656 ( 3.594 11.227 -1.050) 11.835 15.875 ( -7.235 9.967 1.374) 12.392 16.252 ( -16.673 2.451 1.316) 16.903 16.586 ( -5.846 -1.276 0.546) 6.008 17.233 ( 0.669 0.274 11.210) 11.233 17.714 ( 1.938 -5.653 8.033) 10.013 18.650 ( 0.941 -1.032 0.716) 1.569 18.800 ( 4.956 -2.454 -2.836) 6.214 19.186 ( 7.155 0.802 -8.861) 11.417 19.964 ( 2.559 5.798 0.009) 6.337 20.331 ( 1.367 -2.922 -13.987) 14.354 ======================= Grid point 394 (187/336) ======================= q-point: (-0.27 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -9.918 19.067 3.787) 21.824 2.169 ( -2.455 5.785 19.719) 20.696 3.419 ( -33.583 26.801 4.666) 43.219 3.747 ( 9.073 0.175 0.909) 9.120 5.721 ( 6.795 4.449 1.311) 8.227 6.107 ( -2.301 11.245 -8.213) 14.114 6.733 ( 0.426 -5.703 -0.435) 5.735 6.989 ( -1.635 -14.219 3.975) 14.854 7.782 ( 2.191 -2.072 -2.673) 4.030 7.971 ( 14.235 -5.731 7.466) 17.065 8.233 ( 5.532 3.934 1.072) 6.872 8.494 ( -2.409 -2.873 2.120) 4.307 8.645 ( 8.776 3.676 -12.108) 15.399 9.194 ( -4.221 -4.829 2.367) 6.837 9.824 ( 2.237 -1.698 -0.991) 2.978 10.196 ( -7.629 -10.574 -11.604) 17.455 11.071 ( -12.199 4.146 0.071) 12.884 12.193 ( 20.401 -8.800 19.552) 29.596 14.703 ( -11.852 -9.497 -3.351) 15.553 15.594 ( 2.459 14.182 -1.527) 14.475 15.668 ( -7.178 2.641 0.451) 7.662 15.963 ( -10.267 8.530 3.429) 13.782 16.448 ( -12.337 -3.174 -1.512) 12.828 17.255 ( 0.603 5.658 4.073) 6.998 17.835 ( 2.133 -4.442 6.967) 8.533 18.649 ( -1.228 0.062 -0.626) 1.380 18.924 ( 6.074 -1.988 0.876) 6.451 19.276 ( 6.620 -0.449 -7.060) 9.689 19.921 ( -1.275 4.156 0.403) 4.366 20.303 ( 0.078 -1.577 -14.970) 15.053 ======================= Grid point 395 (188/336) ======================= q-point: (-0.18 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( -0.056 19.513 10.752) 22.279 2.109 ( -6.534 20.417 18.744) 28.476 2.628 ( -26.362 20.180 11.533) 35.145 3.874 ( 6.808 3.836 -3.061) 8.393 5.791 ( 4.188 2.569 -1.387) 5.105 5.962 ( 2.290 9.402 -3.123) 10.168 6.864 ( 4.386 -11.143 0.252) 11.978 7.095 ( -2.935 -12.399 3.255) 13.151 7.857 ( 5.120 2.413 2.657) 6.252 8.134 ( -3.029 4.080 9.189) 10.500 8.276 ( 3.927 -0.479 -4.340) 5.872 8.522 ( -0.848 -9.543 7.244) 12.011 8.795 ( 14.367 1.850 -9.537) 17.344 9.128 ( -4.940 2.085 3.636) 6.479 9.889 ( 2.523 -2.960 -1.391) 4.130 10.097 ( -7.169 -9.631 -13.097) 17.767 10.763 ( -13.935 8.802 -3.913) 16.940 12.872 ( 27.019 -22.487 18.146) 39.560 14.578 ( -6.919 -4.690 -4.510) 9.498 15.442 ( -5.440 3.970 -1.843) 6.982 15.622 ( 3.291 5.241 0.082) 6.189 15.767 ( -0.842 14.708 3.558) 15.156 16.170 ( -20.358 -1.132 -1.505) 20.445 17.186 ( 0.323 10.939 -1.063) 10.995 17.935 ( 1.676 -3.009 6.538) 7.389 18.611 ( -2.101 0.311 -1.181) 2.430 19.026 ( 3.492 0.927 1.566) 3.938 19.350 ( 4.306 -0.265 -5.930) 7.333 19.873 ( -0.718 1.691 0.657) 1.951 20.225 ( -4.087 -2.080 -10.247) 11.226 ======================= Grid point 396 (189/336) ======================= q-point: (-0.09 0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( 20.044 25.430 13.282) 34.998 1.558 ( -16.832 37.848 8.638) 42.313 2.399 ( -8.018 -0.342 25.335) 26.576 3.887 ( 3.358 5.995 -7.481) 10.158 5.800 ( 3.469 2.187 -7.605) 8.640 6.012 ( 6.359 2.269 7.069) 9.775 7.073 ( 6.250 -9.048 0.485) 11.007 7.169 ( -3.557 -14.665 3.388) 15.466 7.797 ( -7.458 11.998 6.617) 15.601 8.075 ( -0.862 3.352 0.966) 3.593 8.318 ( 1.269 -3.587 -4.155) 5.634 8.689 ( 3.132 -7.666 10.221) 13.155 8.928 ( 3.712 -3.719 -0.921) 5.335 9.114 ( 8.177 8.112 1.147) 11.575 9.909 ( -6.540 -11.929 -9.124) 16.380 10.060 ( 4.648 1.229 -6.489) 8.076 10.396 ( -13.047 10.899 -5.896) 17.994 13.577 ( 7.741 -32.633 7.907) 34.458 14.557 ( 6.613 0.229 -5.981) 8.920 15.361 ( -0.030 1.737 -1.213) 2.119 15.528 ( -5.987 17.206 -0.710) 18.232 15.736 ( 5.801 2.488 1.147) 6.415 15.878 ( -1.916 3.918 4.399) 6.195 17.062 ( -0.920 11.696 -1.933) 11.890 18.010 ( 0.835 -1.729 5.934) 6.236 18.563 ( -2.569 -0.109 -0.880) 2.718 19.041 ( 0.316 3.088 1.010) 3.265 19.376 ( 1.418 0.178 -5.436) 5.621 19.871 ( 1.366 0.864 0.071) 1.618 20.124 ( -6.951 -4.189 -2.297) 8.434 ======================= Grid point 399 (190/336) ======================= q-point: ( 0.18 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( 26.465 0.000 8.927) 27.930 2.483 ( 2.906 0.000 12.013) 12.359 3.713 ( -8.404 -0.000 -9.100) 12.387 3.962 ( 34.326 0.000 1.653) 34.366 5.671 ( -8.844 -0.000 -7.563) 11.637 6.083 ( 7.757 0.000 -6.277) 9.978 6.817 ( -15.389 -0.000 1.353) 15.448 7.047 ( -0.306 -0.000 -3.781) 3.793 7.713 ( -4.654 -0.000 -6.685) 8.146 7.872 ( -1.609 -0.000 -0.562) 1.705 7.970 ( 6.787 0.000 2.759) 7.327 8.244 ( -17.189 -0.000 -1.477) 17.252 9.107 ( -6.861 -0.000 -4.792) 8.369 9.577 ( 1.549 0.000 -1.789) 2.367 9.859 ( -2.211 -0.000 -6.219) 6.600 10.064 ( 14.607 0.000 3.661) 15.059 10.818 ( 7.973 0.000 10.477) 13.166 12.193 ( -25.659 -0.000 5.076) 26.157 14.929 ( -2.323 -0.000 1.850) 2.970 15.641 ( 20.251 0.000 -4.348) 20.713 15.867 ( 4.574 0.000 6.051) 7.586 16.298 ( 8.628 0.000 -9.775) 13.038 16.551 ( -6.481 -0.000 5.785) 8.687 17.351 ( 5.678 0.000 17.127) 18.044 17.867 ( -9.759 -0.000 2.637) 10.109 18.353 ( -0.862 -0.000 2.566) 2.707 18.964 ( -7.202 -0.000 -6.601) 9.770 19.331 ( 13.497 0.000 -13.519) 19.103 19.610 ( -6.456 -0.000 -0.947) 6.525 20.107 ( 4.722 0.000 -3.513) 5.885 ======================= Grid point 400 (191/336) ======================= q-point: ( 0.27 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( 5.980 1.131 7.171) 9.406 2.708 ( 24.302 11.422 6.536) 27.636 3.438 ( -17.348 -0.323 -8.656) 19.390 4.554 ( 25.265 -9.931 2.218) 27.237 5.542 ( -4.768 -5.195 -6.926) 9.884 6.184 ( 6.387 3.384 -3.857) 8.192 6.533 ( -15.703 -4.040 -3.225) 16.532 7.030 ( -0.512 -0.898 -6.436) 6.519 7.649 ( 2.502 3.007 -5.648) 6.870 7.763 ( -5.310 12.013 3.056) 13.485 7.941 ( -2.159 2.764 -1.906) 3.992 8.206 ( -0.956 -15.477 0.990) 15.539 8.925 ( -6.946 6.746 -3.905) 10.441 9.523 ( -2.220 5.085 -7.010) 8.940 9.794 ( -3.604 -4.159 -5.678) 7.907 10.290 ( 9.636 3.533 0.723) 10.289 10.997 ( 3.337 -5.519 10.877) 12.646 11.835 ( -15.886 0.849 7.684) 17.667 14.897 ( -4.029 -3.134 0.358) 5.117 15.865 ( 11.034 10.221 1.098) 15.081 16.054 ( 7.904 -9.266 2.750) 12.486 16.384 ( 6.391 0.556 -8.415) 10.582 16.498 ( -2.502 -1.315 6.380) 6.978 17.467 ( -3.611 -0.187 24.437) 24.703 17.663 ( -13.898 0.091 2.068) 14.051 18.374 ( 2.670 0.228 0.599) 2.745 18.823 ( -5.137 -0.559 -6.729) 8.484 19.376 ( 0.908 2.982 -19.036) 19.290 19.641 ( 10.377 0.663 2.636) 10.727 20.172 ( 3.389 -2.180 -4.629) 6.137 ======================= Grid point 401 (192/336) ======================= q-point: (-0.64 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.681 ( 3.201 10.302 3.695) 11.403 2.968 ( 16.134 19.889 -0.659) 25.619 3.083 ( -14.888 -4.464 -1.942) 15.664 5.043 ( 16.256 -10.641 3.135) 19.680 5.464 ( -14.195 -9.134 -2.883) 17.125 6.185 ( 3.251 -0.553 -2.652) 4.232 6.415 ( -2.796 -6.979 -5.883) 9.546 6.988 ( -0.228 0.645 -7.096) 7.129 7.529 ( -8.417 12.606 5.944) 16.281 7.667 ( 6.257 6.797 -5.270) 10.636 7.977 ( 6.316 -4.663 -5.516) 9.595 8.336 ( 1.467 -9.171 1.138) 9.358 8.722 ( -4.496 9.603 -3.081) 11.042 9.366 ( -4.547 6.180 -7.855) 10.981 9.750 ( -5.524 -8.048 -5.329) 11.121 10.333 ( 2.422 5.140 -6.802) 8.862 11.123 ( -2.486 -8.442 9.583) 13.010 11.706 ( -3.328 1.116 13.267) 13.723 14.838 ( -7.185 -5.518 -1.089) 9.125 15.916 ( 5.172 9.571 1.857) 11.037 16.222 ( 3.624 -0.222 1.025) 3.773 16.471 ( 5.315 -1.769 0.435) 5.619 16.544 ( 0.620 -4.109 3.046) 5.152 17.371 ( -14.265 2.148 6.964) 16.019 17.503 ( -8.576 -2.428 20.348) 22.214 18.447 ( 5.255 -0.459 -0.999) 5.369 18.737 ( -1.976 -0.970 -6.521) 6.883 19.268 ( 0.657 3.952 -14.537) 15.079 19.850 ( 12.799 2.405 -0.877) 13.053 20.222 ( 1.415 -4.016 -5.917) 7.290 ======================= Grid point 402 (193/336) ======================= q-point: (-0.55 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.491 ( -15.749 6.486 3.701) 17.430 2.744 ( 0.363 23.107 -3.883) 23.434 3.245 ( 14.218 2.289 3.530) 14.828 5.086 ( -26.466 0.361 -0.082) 26.469 5.404 ( 11.705 -5.501 3.827) 13.487 6.364 ( 4.808 -3.222 -1.102) 5.892 6.440 ( 0.562 -16.440 -5.380) 17.307 6.976 ( 3.074 -0.299 -6.726) 7.401 7.294 ( -4.272 14.383 4.946) 15.798 7.685 ( 4.282 3.847 -4.643) 7.396 8.153 ( 10.216 -2.600 -5.673) 11.971 8.459 ( 4.453 -5.917 -0.174) 7.407 8.571 ( -0.508 8.938 -3.262) 9.528 9.201 ( -5.119 2.951 -4.747) 7.579 9.701 ( -6.693 -9.489 -4.680) 12.520 10.262 ( -1.434 1.447 -10.732) 10.923 11.158 ( -6.955 -8.901 8.233) 13.979 11.765 ( 3.694 3.428 14.739) 15.576 14.743 ( -9.368 -7.347 -1.847) 12.048 15.891 ( 1.313 8.439 1.044) 8.604 16.226 ( 1.532 7.907 1.354) 8.167 16.502 ( -10.303 -1.875 -1.597) 10.593 16.594 ( 2.271 -1.926 5.627) 6.366 17.194 ( -6.237 0.020 9.797) 11.614 17.498 ( -4.640 -4.657 16.678) 17.927 18.548 ( 5.197 -1.238 -0.914) 5.420 18.713 ( 1.258 -1.275 -5.829) 6.098 19.205 ( 2.855 3.265 -11.205) 12.016 20.019 ( 9.897 4.372 -1.779) 10.965 20.243 ( -0.053 -4.950 -8.232) 9.606 ======================= Grid point 403 (194/336) ======================= q-point: (-0.45 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( -16.933 6.894 9.126) 20.433 2.513 ( 0.664 24.694 -0.063) 24.703 3.494 ( 11.886 -1.510 3.689) 12.537 4.550 ( -25.590 12.458 2.098) 28.538 5.653 ( 10.485 -0.284 2.761) 10.847 6.370 ( 1.474 3.075 -5.556) 6.519 6.586 ( -4.032 -16.622 1.560) 17.175 6.893 ( -8.821 5.968 -0.600) 10.667 7.368 ( 17.546 -3.487 -2.005) 18.001 7.711 ( 2.925 -0.301 -3.587) 4.638 8.283 ( 5.723 2.425 -0.776) 6.264 8.490 ( -0.691 2.968 -1.750) 3.514 8.616 ( 10.459 0.134 -8.648) 13.572 9.111 ( -2.574 -1.218 1.966) 3.460 9.664 ( -6.540 -11.532 -3.113) 13.618 10.168 ( -3.626 -2.032 -11.754) 12.468 11.137 ( -8.367 -8.335 6.375) 13.420 11.882 ( 6.757 4.441 13.681) 15.892 14.639 ( -9.340 -7.931 -1.977) 12.411 15.817 ( -2.750 5.389 1.309) 6.190 16.134 ( -2.669 15.218 -0.264) 15.452 16.248 ( -12.800 -0.008 0.899) 12.831 16.605 ( -3.818 1.219 1.801) 4.394 17.225 ( 1.215 -1.006 13.942) 14.031 17.587 ( 0.697 -7.133 10.380) 12.614 18.629 ( 2.464 -1.074 -0.506) 2.735 18.756 ( 4.532 -1.935 -3.802) 6.224 19.208 ( 5.086 1.421 -8.630) 10.118 20.069 ( 0.806 4.406 -0.967) 4.582 20.264 ( 3.262 -3.463 -12.396) 13.278 ======================= Grid point 404 (195/336) ======================= q-point: (-0.36 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( -10.879 15.125 11.789) 22.048 2.331 ( -2.408 12.560 10.368) 16.464 3.713 ( 6.073 -3.939 3.542) 8.059 3.976 ( -16.159 29.312 2.725) 33.582 5.798 ( 6.880 3.556 1.205) 7.838 6.298 ( -1.508 6.872 -6.278) 9.429 6.693 ( -6.323 2.017 0.210) 6.640 6.711 ( 0.708 -13.969 2.210) 14.161 7.684 ( 6.648 -7.696 -4.718) 11.211 7.833 ( 12.384 -5.755 2.139) 13.822 8.323 ( 0.988 3.150 4.831) 5.851 8.443 ( -4.092 -1.827 -1.458) 4.712 8.719 ( 9.367 3.815 -12.367) 15.976 9.151 ( 3.235 0.172 5.854) 6.691 9.658 ( -7.425 -15.536 -3.897) 17.655 10.076 ( -2.327 -1.627 -10.289) 10.674 11.064 ( -9.808 -4.339 2.638) 11.044 12.085 ( 11.403 -2.336 14.189) 18.352 14.552 ( -6.884 -6.311 -2.090) 9.570 15.684 ( -12.011 -1.262 0.752) 12.101 15.867 ( -4.960 12.738 -1.179) 13.720 16.126 ( 0.299 10.764 3.793) 11.416 16.469 ( -8.743 3.629 -0.316) 9.471 17.320 ( 2.454 1.365 9.759) 10.155 17.726 ( 2.241 -6.664 7.903) 10.578 18.646 ( -0.550 -0.276 -1.273) 1.414 18.875 ( 6.712 -2.816 0.241) 7.283 19.270 ( 6.002 -0.146 -6.959) 9.191 19.989 ( -4.373 2.307 -1.346) 5.124 20.279 ( 2.251 -0.458 -14.340) 14.523 ======================= Grid point 405 (196/336) ======================= q-point: (-0.27 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( -3.338 17.614 13.040) 22.169 2.288 ( -1.392 5.196 19.757) 20.476 3.318 ( -14.543 41.755 2.553) 44.289 3.917 ( 7.625 0.907 1.111) 7.759 5.857 ( 3.972 4.068 -0.613) 5.718 6.147 ( -2.430 8.886 -4.661) 10.324 6.668 ( -0.203 -8.055 1.084) 8.130 6.869 ( 1.734 -10.764 0.810) 10.933 7.827 ( 7.889 -3.773 -0.963) 8.797 8.151 ( 10.982 -7.586 4.827) 14.193 8.268 ( -7.379 3.444 5.338) 9.737 8.365 ( -6.772 -5.801 -0.178) 8.919 8.803 ( 6.580 -0.873 -8.204) 10.553 9.228 ( 6.643 7.470 4.265) 10.868 9.649 ( -8.771 -18.597 -9.436) 22.623 10.050 ( 3.893 1.582 -5.910) 7.252 10.880 ( -11.925 2.853 -1.494) 12.353 12.477 ( 13.696 -17.058 15.071) 26.565 14.511 ( -0.672 -2.557 -3.038) 4.027 15.447 ( -13.784 -3.185 -0.670) 14.163 15.753 ( 1.709 8.966 2.033) 9.351 16.062 ( 4.778 14.805 3.180) 15.878 16.225 ( -12.594 6.504 -1.450) 14.249 17.354 ( 1.815 6.199 3.512) 7.353 17.857 ( 2.093 -5.102 7.051) 8.952 18.613 ( -2.292 -0.072 -1.843) 2.942 19.024 ( 5.930 -1.386 2.864) 6.730 19.343 ( 4.724 -0.433 -6.087) 7.718 19.888 ( -4.550 -0.400 -1.118) 4.703 20.210 ( -2.586 0.921 -13.164) 13.447 ======================= Grid point 406 (197/336) ======================= q-point: (-0.18 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( 9.815 14.076 13.623) 21.910 2.298 ( -2.325 10.697 19.669) 22.510 2.686 ( -5.760 47.700 4.870) 48.292 3.994 ( 3.700 3.923 -3.280) 6.312 5.862 ( 3.043 4.180 -5.049) 7.226 6.064 ( 0.766 2.958 3.118) 4.365 6.820 ( 3.417 -13.917 2.667) 14.576 6.972 ( -0.116 -7.770 -0.943) 7.828 7.976 ( -2.241 5.748 4.951) 7.910 8.095 ( -0.926 -1.127 0.030) 1.459 8.255 ( -5.313 -2.431 -1.356) 5.998 8.486 ( 7.719 -12.505 7.811) 16.643 8.858 ( -0.082 -3.670 -1.652) 4.026 9.292 ( 7.565 7.711 -1.228) 10.872 9.630 ( -5.493 -14.456 -10.878) 18.907 10.117 ( 8.066 3.559 -4.753) 10.016 10.590 ( -12.126 8.647 -2.805) 15.155 12.951 ( 3.399 -30.039 12.636) 32.766 14.566 ( 7.888 0.619 -5.500) 9.637 15.325 ( -2.443 -4.531 0.804) 5.211 15.725 ( -1.396 5.150 1.046) 5.438 15.913 ( -8.120 11.764 0.167) 14.295 16.053 ( 9.311 14.891 2.409) 17.727 17.297 ( 0.693 11.181 -0.873) 11.236 17.959 ( 1.259 -3.467 6.295) 7.296 18.557 ( -3.268 -0.517 -1.561) 3.659 19.106 ( 2.560 2.991 1.758) 4.312 19.379 ( 1.998 0.108 -5.708) 6.049 19.845 ( -2.535 -4.596 0.195) 5.252 20.074 ( -5.559 0.605 -7.714) 9.527 ======================= Grid point 407 (198/336) ======================= q-point: (-0.09 0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( 3.658 18.561 6.207) 19.910 2.136 ( 18.260 33.099 12.298) 39.752 2.462 ( 3.868 15.630 17.049) 23.451 3.959 ( 1.488 6.388 -6.567) 9.282 5.868 ( 4.881 2.780 -7.307) 9.217 6.107 ( 0.270 -1.404 5.978) 6.146 6.992 ( -3.653 -9.939 2.282) 10.832 7.078 ( 5.958 -13.528 0.665) 14.797 7.721 ( -13.114 8.115 3.626) 15.843 8.112 ( -3.423 2.584 0.016) 4.289 8.211 ( -2.765 -3.096 -3.275) 5.288 8.797 ( 10.495 -8.771 11.670) 17.979 8.933 ( 3.394 -9.662 -0.712) 10.265 9.283 ( 0.311 7.859 -6.689) 10.325 9.638 ( -1.855 -9.605 -9.155) 13.398 10.145 ( -0.201 4.986 -10.931) 12.017 10.368 ( 2.473 10.363 5.238) 11.872 13.184 ( -15.994 -28.886 9.317) 34.307 14.703 ( 10.337 -0.942 -7.366) 12.728 15.436 ( 0.324 8.919 -3.660) 9.647 15.485 ( -0.849 3.186 6.571) 7.352 15.901 ( 8.112 2.826 -0.153) 8.591 16.167 ( 15.940 7.112 1.711) 17.538 17.168 ( 0.186 14.539 -2.272) 14.716 18.022 ( -0.385 -2.139 5.344) 5.769 18.496 ( -4.001 -1.124 -0.375) 4.173 19.091 ( 0.926 4.939 -0.727) 5.077 19.356 ( -1.364 0.651 -5.733) 5.928 19.868 ( -3.620 -8.476 0.802) 9.251 19.965 ( -1.990 1.415 -2.188) 3.279 ======================= Grid point 411 (199/336) ======================= q-point: ( 0.27 0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.772 ( 8.621 0.000 3.962) 9.488 3.030 ( -22.612 -0.000 -4.645) 23.084 3.221 ( 20.861 0.000 4.768) 21.399 4.914 ( 19.615 0.000 2.578) 19.784 5.347 ( -12.158 -0.000 -4.322) 12.903 6.216 ( -11.153 -0.000 -6.338) 12.828 6.318 ( 6.251 0.000 -2.866) 6.877 6.995 ( 0.705 0.000 -8.416) 8.445 7.673 ( -10.197 -0.000 2.239) 10.440 7.769 ( 10.958 0.000 -4.495) 11.844 7.902 ( -0.463 -0.000 -3.420) 3.452 8.222 ( 5.971 0.000 3.647) 6.996 8.828 ( -5.418 -0.000 -2.424) 5.935 9.463 ( -4.574 -0.000 -6.372) 7.844 9.630 ( -7.731 -0.000 -7.097) 10.494 10.386 ( 0.615 0.000 -8.535) 8.557 11.033 ( -1.227 -0.000 9.497) 9.576 11.717 ( -3.042 -0.000 13.971) 14.298 14.784 ( -7.023 -0.000 -0.564) 7.045 16.026 ( 0.089 0.000 7.101) 7.102 16.210 ( 12.055 0.000 -2.206) 12.256 16.449 ( 5.898 0.000 -9.976) 11.589 16.501 ( -0.787 -0.000 11.266) 11.293 17.396 ( -15.651 -0.000 1.272) 15.702 17.476 ( -8.399 -0.000 26.857) 28.140 18.443 ( 4.939 0.000 -1.045) 5.048 18.727 ( -1.926 -0.000 -6.445) 6.727 19.309 ( -0.062 -0.000 -14.920) 14.920 19.874 ( 13.374 0.000 -1.168) 13.425 20.180 ( 1.296 0.000 -5.615) 5.762 ======================= Grid point 412 (200/336) ======================= q-point: (-0.64 0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.593 ( -20.927 3.437 1.572) 21.265 2.947 ( 7.564 1.078 1.326) 7.754 3.457 ( 9.965 12.816 3.804) 16.674 5.064 ( -17.923 -1.249 0.524) 17.974 5.276 ( 15.306 -6.195 3.450) 16.869 6.121 ( 0.230 -8.189 -7.649) 11.208 6.388 ( 2.744 -0.226 -3.487) 4.443 6.982 ( 2.010 0.423 -7.052) 7.345 7.499 ( -6.191 5.655 1.740) 8.563 7.821 ( 2.927 9.239 -3.374) 10.262 8.040 ( 10.881 -8.053 -5.115) 14.471 8.363 ( 5.872 -3.049 4.060) 7.763 8.737 ( 0.240 5.889 -1.987) 6.220 9.287 ( -7.610 6.091 -5.553) 11.218 9.493 ( -10.441 -10.568 -5.513) 15.845 10.285 ( -3.806 0.747 -13.772) 14.307 11.034 ( -5.037 -3.483 7.667) 9.813 11.811 ( 4.667 1.199 15.738) 16.459 14.648 ( -8.783 -2.491 -1.131) 9.199 16.001 ( -4.327 2.766 4.843) 7.059 16.340 ( 5.328 3.226 -2.611) 6.753 16.506 ( 1.121 1.699 -3.534) 4.078 16.546 ( -0.160 -2.347 9.002) 9.305 17.178 ( -8.261 -1.164 4.391) 9.428 17.440 ( -8.122 -1.311 23.270) 24.682 18.533 ( 5.405 -0.348 -1.837) 5.720 18.696 ( 1.267 -0.451 -5.749) 5.904 19.253 ( 1.482 1.438 -11.452) 11.637 20.080 ( 11.056 1.743 -2.652) 11.502 20.167 ( -0.610 -2.386 -7.025) 7.444 ======================= Grid point 413 (201/336) ======================= q-point: (-0.55 0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -15.714 4.170 12.013) 20.215 2.949 ( -0.507 17.683 -0.765) 17.707 3.469 ( 0.661 -0.977 4.592) 4.741 4.770 ( -9.730 10.990 2.182) 14.840 5.607 ( 13.571 -4.608 3.591) 14.775 6.236 ( -0.275 -15.929 -5.250) 16.774 6.411 ( 2.869 0.243 -3.549) 4.570 6.965 ( -1.924 2.044 -3.930) 4.830 7.408 ( 3.736 4.755 -1.323) 6.190 7.764 ( 1.346 5.581 -2.873) 6.420 8.237 ( 4.538 -5.197 -2.017) 7.188 8.514 ( 3.812 -1.017 3.959) 5.590 8.719 ( 9.893 9.550 -9.737) 16.849 9.107 ( -5.089 0.486 1.503) 5.329 9.391 ( -12.765 -15.313 -4.213) 20.376 10.157 ( -2.714 0.235 -12.913) 13.197 10.998 ( -6.949 -5.434 5.733) 10.521 11.954 ( 5.633 2.745 13.009) 14.439 14.524 ( -7.529 -3.973 -1.230) 8.601 15.864 ( -11.219 0.230 2.705) 11.543 16.301 ( -6.433 5.604 -0.785) 8.567 16.411 ( 2.639 11.446 -1.278) 11.816 16.595 ( -2.055 -1.853 4.531) 5.309 17.189 ( 1.127 -2.870 11.708) 12.107 17.463 ( -2.193 -4.947 16.216) 17.095 18.612 ( 3.478 -0.604 -2.014) 4.064 18.728 ( 4.137 -0.995 -4.349) 6.085 19.236 ( 3.296 1.249 -8.403) 9.112 20.103 ( -3.280 -0.839 -5.770) 6.690 20.234 ( 7.897 0.585 -7.071) 10.616 ======================= Grid point 414 (202/336) ======================= q-point: (-0.45 0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( -9.531 7.734 20.875) 24.216 2.643 ( -10.042 18.202 3.958) 21.161 3.586 ( 3.204 -9.246 3.897) 10.532 4.513 ( -1.269 25.787 1.326) 25.852 5.846 ( 8.753 0.685 2.305) 9.077 6.301 ( -2.711 -7.523 -3.860) 8.879 6.505 ( 6.848 -5.248 -1.767) 8.807 6.800 ( -8.795 7.602 -0.344) 11.630 7.547 ( 10.653 -4.794 -5.182) 12.780 7.774 ( 4.696 -1.043 -1.981) 5.202 8.302 ( -1.057 -3.818 0.756) 4.033 8.470 ( -5.809 3.985 2.340) 7.423 8.780 ( 5.386 2.224 -11.074) 12.513 9.183 ( 11.544 2.502 6.325) 13.399 9.296 ( -14.396 -20.184 -4.876) 25.267 10.080 ( 0.818 1.068 -9.129) 9.228 10.949 ( -7.406 -6.343 3.374) 10.319 12.079 ( 5.049 0.909 10.173) 11.393 14.456 ( -3.388 -3.691 -1.260) 5.166 15.628 ( -17.296 -3.485 0.545) 17.652 16.096 ( -4.750 11.317 1.328) 12.345 16.370 ( 4.433 12.158 -0.422) 12.948 16.534 ( -5.782 2.903 3.158) 7.199 17.315 ( 3.004 -1.793 13.258) 13.712 17.589 ( 2.043 -7.023 10.938) 13.158 18.639 ( 0.140 -0.384 -2.391) 2.426 18.825 ( 6.371 -2.239 -1.402) 6.897 19.271 ( 5.068 0.228 -6.600) 8.325 19.999 ( -5.990 -0.913 -6.211) 8.677 20.294 ( 4.021 1.671 -9.530) 10.477 ======================= Grid point 415 (203/336) ======================= q-point: (-0.36 0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( -6.761 12.640 17.710) 22.784 2.433 ( -1.874 10.494 15.947) 19.182 3.754 ( 5.623 -3.463 2.540) 7.075 4.207 ( -0.971 34.144 0.331) 34.159 5.935 ( 3.656 3.529 1.246) 5.231 6.265 ( -2.610 2.674 -3.754) 5.297 6.592 ( -6.924 1.133 1.137) 7.108 6.700 ( 7.943 -6.507 -2.352) 10.534 7.748 ( 9.790 -3.885 -2.548) 10.837 7.954 ( 8.663 -10.755 -1.937) 13.945 8.275 ( -7.645 -3.677 -1.417) 8.600 8.332 ( -6.937 1.935 6.815) 9.915 8.782 ( 0.993 -0.917 -4.962) 5.142 9.200 ( -13.527 -19.903 -8.042) 25.372 9.429 ( 14.412 5.355 3.213) 15.706 10.092 ( 6.131 2.440 -5.221) 8.415 10.870 ( -8.261 -3.339 0.408) 8.920 12.237 ( 4.288 -8.052 9.455) 13.138 14.472 ( 3.335 -1.587 -2.021) 4.210 15.360 ( -16.074 -4.943 -0.187) 16.818 15.946 ( -1.896 10.428 3.608) 11.196 16.301 ( -2.422 8.539 -0.430) 8.887 16.406 ( 0.812 12.550 2.522) 12.827 17.424 ( 2.719 1.175 9.207) 9.672 17.745 ( 2.823 -6.188 8.915) 11.213 18.609 ( -2.403 -0.357 -2.820) 3.722 18.976 ( 6.837 -3.307 2.448) 7.979 19.336 ( 4.965 -0.205 -6.098) 7.866 19.863 ( -7.117 -1.762 -6.550) 9.831 20.253 ( -0.830 3.018 -10.388) 10.850 ======================= Grid point 416 (204/336) ======================= q-point: (-0.27 0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.829 ( 6.631 12.854 12.232) 18.942 2.443 ( 1.906 9.397 20.162) 22.326 3.659 ( 1.470 45.164 0.419) 45.190 4.018 ( 2.371 0.036 0.283) 2.388 5.947 ( 1.747 3.811 -0.032) 4.192 6.131 ( -4.373 4.966 -1.401) 6.764 6.597 ( 1.162 -8.617 2.734) 9.115 6.852 ( 4.535 -4.550 -4.282) 7.721 7.978 ( 12.149 -3.898 -1.127) 12.809 8.081 ( -13.999 -1.155 -0.061) 14.047 8.169 ( -4.527 -11.112 1.301) 12.069 8.298 ( 5.631 -2.274 5.668) 8.307 8.788 ( -2.080 -3.330 -1.279) 4.130 9.143 ( -7.854 -20.148 -12.430) 24.942 9.598 ( 10.049 7.873 2.602) 13.028 10.193 ( 10.634 4.505 -4.560) 12.416 10.708 ( -9.435 3.308 -1.415) 10.098 12.463 ( -0.371 -20.222 10.017) 22.570 14.580 ( 9.104 0.814 -4.727) 10.290 15.208 ( -5.726 -7.002 1.527) 9.173 15.844 ( -3.128 7.027 4.458) 8.890 16.121 ( -5.107 10.382 0.489) 11.581 16.368 ( 8.400 16.271 1.194) 18.350 17.463 ( 1.781 5.720 4.306) 7.378 17.881 ( 2.168 -4.485 7.554) 9.049 18.544 ( -3.913 -0.840 -2.645) 4.797 19.128 ( 5.131 -1.254 4.529) 6.958 19.380 ( 2.735 0.062 -6.342) 6.907 19.733 ( -7.394 -5.348 -7.165) 11.602 20.132 ( -3.322 4.268 -7.277) 9.067 ======================= Grid point 417 (205/336) ======================= q-point: (-0.18 0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( 13.741 13.427 6.732) 20.357 2.440 ( -1.275 11.266 16.282) 19.841 3.257 ( 10.714 49.714 3.059) 50.948 4.052 ( 1.242 2.500 -2.337) 3.640 5.934 ( 2.473 3.657 -4.245) 6.124 6.067 ( -2.596 -2.172 4.730) 5.816 6.766 ( 3.730 -11.811 3.902) 12.985 6.920 ( 1.628 -3.725 -4.565) 6.113 7.816 ( -15.192 0.777 0.283) 15.214 8.078 ( -9.540 -4.699 1.056) 10.687 8.188 ( 6.795 0.068 -1.057) 6.877 8.560 ( 6.937 -13.221 5.836) 16.030 8.778 ( -1.355 -7.626 -0.385) 7.755 9.205 ( 1.853 -14.211 -14.296) 20.243 9.654 ( 3.316 8.408 1.498) 9.162 10.264 ( 3.759 7.562 -10.998) 13.866 10.538 ( -0.132 6.840 5.656) 8.876 12.648 ( -10.056 -25.444 9.945) 29.111 14.693 ( 7.127 -0.150 -6.931) 9.943 15.358 ( 12.359 -7.884 2.322) 14.843 15.690 ( -7.721 9.286 3.547) 12.587 16.006 ( 3.267 9.055 1.516) 9.745 16.388 ( 9.643 13.872 0.747) 16.911 17.419 ( 1.114 10.657 0.879) 10.751 17.970 ( 0.222 -3.007 6.054) 6.763 18.469 ( -4.636 -1.610 -1.299) 5.076 19.191 ( 2.077 4.689 0.969) 5.219 19.368 ( -0.656 0.493 -6.402) 6.454 19.654 ( -7.496 -11.752 -4.574) 14.671 20.030 ( -0.187 4.126 -2.449) 4.802 ======================= Grid point 418 (206/336) ======================= q-point: (-0.09 0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 1.489 21.304 -0.420) 21.360 2.404 ( 0.066 5.603 15.595) 16.571 3.262 ( 33.607 37.037 5.496) 50.312 3.997 ( -0.872 4.956 -4.340) 6.645 5.945 ( 4.178 1.627 -5.707) 7.258 6.053 ( -5.673 -2.868 2.857) 6.969 6.899 ( -0.283 -2.559 2.474) 3.570 7.035 ( 4.523 -15.108 0.343) 15.774 7.549 ( -12.638 2.389 0.147) 12.862 7.957 ( -8.638 -4.079 -1.578) 9.682 8.177 ( -3.873 3.177 -1.608) 5.261 8.765 ( -1.914 -19.189 -2.292) 19.419 8.977 ( 9.371 -8.841 10.190) 16.426 9.284 ( 4.039 1.357 -15.253) 15.837 9.556 ( -4.244 3.104 -3.456) 6.292 10.147 ( 0.874 7.002 -8.465) 11.020 10.626 ( 10.068 7.544 9.092) 15.522 12.656 ( -19.259 -21.194 8.931) 29.998 14.821 ( 9.105 -4.037 -6.243) 11.755 15.466 ( -4.942 14.290 3.288) 15.474 15.696 ( 16.001 -1.274 1.782) 16.150 16.055 ( 6.718 1.474 -0.372) 6.888 16.454 ( 7.757 6.019 1.632) 9.953 17.330 ( 2.760 13.543 0.511) 13.831 17.999 ( -2.548 -2.177 4.733) 5.799 18.401 ( -4.687 -1.994 0.806) 5.157 19.159 ( 2.322 5.114 -4.737) 7.348 19.287 ( -4.194 1.162 -6.396) 7.736 19.637 ( -7.205 -12.637 -0.134) 14.547 20.027 ( 4.236 3.103 -1.409) 5.437 ======================= Grid point 423 (207/336) ======================= q-point: (-0.64 0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -15.703 -0.000 12.599) 20.132 3.128 ( 9.521 0.000 1.155) 9.591 3.458 ( -17.543 -0.000 3.750) 17.939 4.915 ( 0.044 0.000 3.518) 3.518 5.526 ( 13.983 0.000 3.379) 14.386 6.065 ( 3.128 0.000 -8.343) 8.910 6.414 ( 2.216 0.000 -3.978) 4.554 6.985 ( 0.641 0.000 -4.889) 4.931 7.461 ( -0.516 -0.000 -1.080) 1.197 7.852 ( -1.978 -0.000 -4.272) 4.708 8.160 ( 6.528 0.000 -0.716) 6.567 8.499 ( 7.916 0.000 4.947) 9.334 8.858 ( 11.312 0.000 -5.357) 12.516 9.135 ( -17.222 -0.000 -5.678) 18.134 9.170 ( -8.786 -0.000 -1.068) 8.850 10.161 ( -2.440 -0.000 -13.131) 13.355 10.944 ( -6.504 -0.000 5.202) 8.329 11.981 ( 5.362 0.000 12.917) 13.985 14.486 ( -6.912 -0.000 -0.958) 6.978 15.861 ( -13.975 -0.000 2.703) 14.234 16.388 ( 0.418 0.000 -4.496) 4.515 16.492 ( -5.253 -0.000 7.608) 9.245 16.596 ( 4.289 0.000 -0.851) 4.372 17.145 ( 1.353 0.000 9.754) 9.848 17.416 ( -4.314 -0.000 20.243) 20.697 18.606 ( 3.802 0.000 -2.706) 4.667 18.718 ( 4.005 0.000 -4.492) 6.018 19.249 ( 2.557 0.000 -8.303) 8.688 20.086 ( -3.072 -0.000 -8.068) 8.633 20.247 ( 8.034 0.000 -4.581) 9.248 ======================= Grid point 425 (208/336) ======================= q-point: (-0.55 0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.159 ( -8.835 2.691 23.972) 25.689 2.978 ( -17.741 14.917 5.295) 23.776 3.370 ( 3.640 -11.778 2.022) 12.493 4.923 ( 4.187 14.169 1.503) 14.851 5.795 ( 10.297 -5.016 3.338) 11.930 6.153 ( 7.021 -4.190 -5.573) 9.895 6.453 ( 4.423 -1.371 -3.580) 5.854 6.928 ( -3.942 4.303 -2.839) 6.490 7.505 ( 7.295 -0.403 -3.664) 8.174 7.771 ( -3.055 0.239 -4.037) 5.068 8.237 ( 0.875 -2.067 2.092) 3.068 8.581 ( -3.937 7.330 3.477) 9.017 8.791 ( -6.174 -2.242 -6.381) 9.157 8.951 ( -13.211 -12.138 -9.577) 20.337 9.226 ( 16.550 1.316 5.743) 17.567 10.099 ( 1.710 0.607 -9.027) 9.208 10.855 ( -6.790 -2.738 2.963) 7.898 12.097 ( 2.393 0.622 8.607) 8.955 14.409 ( -1.710 -1.242 -0.807) 2.262 15.577 ( -18.243 -1.477 0.440) 18.308 16.290 ( -4.558 7.681 0.183) 8.933 16.463 ( -3.064 -1.777 2.920) 4.590 16.639 ( 4.172 6.126 0.836) 7.459 17.264 ( 3.310 -2.590 13.097) 13.755 17.486 ( 1.175 -2.972 16.119) 16.433 18.634 ( 0.594 -0.175 -3.458) 3.513 18.795 ( 5.865 -0.801 -2.642) 6.482 19.276 ( 4.307 0.183 -6.203) 7.554 19.977 ( -5.319 -0.856 -9.074) 10.553 20.324 ( 3.890 0.980 -6.437) 7.585 ======================= Grid point 426 (209/336) ======================= q-point: (-0.45 0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( -8.075 6.068 22.451) 24.618 2.676 ( -3.018 13.438 14.631) 20.094 3.587 ( 7.076 -10.916 1.686) 13.117 4.784 ( 0.122 22.496 -1.089) 22.523 5.959 ( 3.004 -1.449 2.542) 4.193 6.294 ( 8.821 2.470 -3.311) 9.740 6.591 ( 7.983 -5.128 -3.076) 9.974 6.722 ( -9.022 10.269 -0.385) 13.675 7.693 ( 13.356 -2.435 -5.223) 14.546 7.752 ( -0.922 -9.445 -4.872) 10.667 8.238 ( -5.363 0.118 0.946) 5.447 8.344 ( -10.806 -0.139 2.325) 11.054 8.774 ( -3.200 -0.764 -3.410) 4.739 8.800 ( -12.594 -17.711 -3.651) 22.037 9.543 ( 17.310 4.588 2.550) 18.088 10.137 ( 7.945 2.026 -5.258) 9.741 10.785 ( -6.112 -4.406 1.165) 7.624 12.144 ( -1.141 -2.363 5.502) 6.096 14.447 ( 5.428 -0.932 -1.243) 5.646 15.280 ( -16.646 -3.006 -0.276) 16.918 16.128 ( -5.735 7.635 3.186) 10.067 16.407 ( -3.779 3.060 2.238) 5.353 16.651 ( 6.334 11.157 0.818) 12.855 17.404 ( 2.522 -2.819 12.711) 13.262 17.639 ( 3.924 -4.213 12.950) 14.172 18.601 ( -2.386 -0.346 -4.000) 4.670 18.915 ( 6.347 -2.554 0.035) 6.842 19.335 ( 4.985 0.009 -5.697) 7.570 19.833 ( -7.081 -1.217 -9.668) 12.045 20.307 ( -0.367 2.189 -7.634) 7.950 ======================= Grid point 427 (210/336) ======================= q-point: (-0.36 0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 5.839 9.167 12.538) 16.593 2.676 ( 5.596 14.182 20.103) 25.230 3.838 ( 7.935 -9.943 2.684) 13.001 4.489 ( -2.990 30.892 -2.266) 31.119 5.987 ( -0.548 0.775 2.525) 2.698 6.309 ( -2.125 14.084 -2.929) 14.542 6.501 ( -1.524 -1.207 1.585) 2.508 6.783 ( 8.082 -3.218 -5.169) 10.119 7.850 ( -0.520 -15.069 -2.292) 15.251 7.921 ( 3.684 -5.987 -7.724) 10.444 8.065 ( -5.071 -0.707 1.181) 5.255 8.291 ( -1.103 -0.717 5.561) 5.715 8.729 ( -11.434 -13.724 -3.635) 18.229 8.748 ( -0.387 -7.576 -3.411) 8.317 9.735 ( 8.934 5.563 1.924) 10.699 10.287 ( 13.966 4.968 -4.020) 15.359 10.717 ( -5.948 -1.975 -0.255) 6.273 12.175 ( -4.247 -9.936 5.329) 12.048 14.594 ( 10.613 0.524 -3.734) 11.263 15.081 ( -8.525 -5.558 1.425) 10.276 15.974 ( -6.344 5.931 5.558) 10.311 16.305 ( -2.022 8.286 2.041) 8.770 16.659 ( 7.567 13.603 0.524) 15.575 17.511 ( 1.567 -0.712 9.771) 9.922 17.803 ( 4.019 -3.079 10.570) 11.720 18.527 ( -4.279 -0.828 -4.137) 6.009 19.063 ( 5.276 -4.679 3.219) 7.752 19.384 ( 3.333 0.299 -6.322) 7.153 19.666 ( -7.926 -1.781 -10.716) 13.447 20.211 ( -2.913 3.612 -6.510) 7.994 ======================= Grid point 428 (211/336) ======================= q-point: (-0.27 0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( 16.518 12.246 5.739) 21.348 2.710 ( 4.327 16.126 15.013) 22.453 4.009 ( -1.936 -0.826 -0.990) 2.326 4.148 ( 8.264 33.911 2.359) 34.983 5.973 ( -1.336 0.423 2.997) 3.308 6.085 ( -6.887 5.318 -1.190) 8.783 6.595 ( 4.553 -5.233 0.807) 6.984 6.896 ( 6.177 0.632 -5.118) 8.046 7.750 ( -16.815 -7.748 -4.232) 18.992 7.917 ( -7.649 -11.887 -0.494) 14.144 8.193 ( 9.462 0.159 -0.103) 9.464 8.382 ( 3.301 -4.487 3.857) 6.775 8.621 ( -7.244 -8.461 -1.101) 11.193 8.907 ( 7.052 -14.709 -8.234) 18.273 9.795 ( 3.144 5.463 1.318) 6.439 10.427 ( 8.282 8.719 -10.218) 15.781 10.624 ( -1.674 2.067 4.865) 5.545 12.234 ( -7.430 -17.048 7.426) 20.025 14.694 ( 3.607 0.180 -6.418) 7.364 15.195 ( 12.455 -8.180 3.160) 15.232 15.837 ( -5.697 6.297 6.842) 10.905 16.209 ( 0.855 10.710 1.920) 10.914 16.660 ( 7.006 13.740 -0.018) 15.423 17.558 ( 0.844 3.355 6.771) 7.604 17.921 ( 1.733 -1.537 7.661) 8.004 18.437 ( -5.038 -1.624 -2.940) 6.055 19.211 ( 3.457 -4.701 5.918) 8.311 19.376 ( -0.194 0.890 -8.489) 8.538 19.492 ( -8.230 -3.212 -11.344) 14.379 20.109 ( -1.144 3.806 -3.224) 5.118 ======================= Grid point 429 (212/336) ======================= q-point: (-0.18 0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( 6.040 17.256 0.459) 18.289 2.625 ( -0.115 17.539 8.089) 19.315 3.919 ( 14.151 19.016 0.891) 23.720 4.126 ( 6.448 17.453 1.573) 18.672 5.965 ( -0.490 -0.177 1.431) 1.523 5.980 ( -4.925 -3.398 0.533) 6.008 6.746 ( 3.452 -11.136 -0.085) 11.659 6.958 ( 5.582 4.971 -1.369) 7.599 7.508 ( -15.643 -6.905 -3.511) 17.456 7.849 ( -8.663 -7.191 -0.585) 11.274 8.257 ( -3.122 5.349 -1.552) 6.385 8.425 ( -1.733 -14.678 -3.674) 15.229 8.770 ( 7.255 -12.113 7.831) 16.145 9.152 ( 10.799 -10.202 -12.066) 19.138 9.723 ( -5.061 8.654 -1.954) 10.214 10.302 ( -0.651 9.112 -11.021) 14.315 10.728 ( 8.506 2.857 9.073) 12.760 12.276 ( -11.460 -17.247 8.762) 22.484 14.747 ( 4.919 -3.697 -5.587) 8.311 15.595 ( 19.513 -7.340 2.262) 20.970 15.707 ( -3.054 10.191 5.743) 12.090 16.157 ( 2.875 8.487 2.176) 9.222 16.639 ( 4.371 11.554 -0.793) 12.379 17.542 ( 0.641 7.796 5.453) 9.536 17.960 ( -2.108 -1.416 5.012) 5.618 18.361 ( -4.438 -2.010 -0.414) 4.889 19.267 ( -0.390 5.180 -8.894) 10.300 19.301 ( -2.784 -0.958 -4.379) 5.277 19.386 ( -5.377 -11.013 -0.953) 12.293 20.086 ( 3.223 2.759 -1.571) 4.523 ======================= Grid point 430 (213/336) ======================= q-point: (-0.09 0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( -3.632 17.883 -2.769) 18.457 2.548 ( 2.211 10.044 6.786) 12.321 3.964 ( -6.127 3.283 -2.527) 7.396 4.216 ( 34.243 29.080 3.001) 45.025 5.905 ( -7.865 -2.669 1.285) 8.405 5.987 ( 2.625 -0.993 -3.882) 4.790 6.933 ( 1.750 -11.393 3.542) 12.059 6.984 ( 3.005 2.002 0.890) 3.719 7.315 ( -10.195 -5.567 -4.403) 12.423 7.755 ( -7.696 -4.451 -2.765) 9.311 8.096 ( -6.462 2.676 -3.521) 7.830 8.538 ( -1.238 -15.011 -3.885) 15.555 9.044 ( 3.615 -9.246 4.011) 10.707 9.350 ( 8.929 -0.767 -8.116) 12.090 9.462 ( -8.133 3.712 -3.771) 9.703 10.213 ( 2.726 5.497 -9.447) 11.265 10.903 ( 8.741 3.624 12.180) 15.424 12.218 ( -15.202 -11.724 8.169) 20.863 14.895 ( 7.982 -6.624 -4.815) 11.435 15.571 ( -1.115 13.338 4.859) 14.239 15.994 ( 17.342 -2.080 0.488) 17.473 16.172 ( 3.988 3.684 3.104) 6.254 16.583 ( 0.070 6.895 -1.413) 7.039 17.502 ( 1.033 9.063 8.382) 12.388 17.925 ( -5.774 -2.086 3.784) 7.212 18.317 ( -2.519 -1.687 1.053) 3.209 19.174 ( -6.153 1.315 -7.322) 9.654 19.194 ( 1.668 -0.578 -13.828) 13.940 19.439 ( -2.474 -7.801 5.518) 9.871 20.139 ( 5.965 2.469 -2.479) 6.915 ======================= Grid point 436 (214/336) ======================= q-point: (-0.55 0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.138 ( -8.393 -0.000 24.238) 25.650 2.845 ( -4.494 -0.000 16.765) 17.356 3.444 ( 8.007 0.000 -1.269) 8.106 5.011 ( -2.717 -0.000 -0.880) 2.856 5.928 ( 6.014 0.000 1.641) 6.234 6.346 ( 16.087 0.000 -2.281) 16.248 6.517 ( 5.373 0.000 -3.249) 6.279 6.865 ( -5.081 -0.000 -2.117) 5.505 7.603 ( -2.557 -0.000 -8.567) 8.941 7.698 ( 7.870 0.000 -1.814) 8.077 8.254 ( 0.022 0.000 3.599) 3.599 8.346 ( -22.284 -0.000 -3.005) 22.485 8.587 ( -8.479 -0.000 -3.854) 9.314 8.777 ( -2.332 -0.000 0.548) 2.395 9.588 ( 17.672 0.000 1.827) 17.767 10.159 ( 8.963 0.000 -5.341) 10.434 10.737 ( -5.843 -0.000 1.297) 5.985 12.124 ( -2.761 -0.000 4.279) 5.092 14.438 ( 6.037 0.000 -0.937) 6.109 15.251 ( -16.728 -0.000 -0.383) 16.733 16.208 ( -8.555 -0.000 1.853) 8.753 16.433 ( -1.451 -0.000 4.972) 5.179 16.774 ( 7.032 0.000 -1.622) 7.217 17.362 ( 1.960 0.000 14.360) 14.494 17.598 ( 4.557 0.000 15.512) 16.167 18.598 ( -2.348 -0.000 -4.599) 5.164 18.889 ( 5.939 0.000 -1.276) 6.074 19.335 ( 4.947 0.000 -5.453) 7.363 19.820 ( -6.729 -0.000 -10.423) 12.407 20.329 ( -0.322 -0.000 -6.701) 6.709 ======================= Grid point 438 (215/336) ======================= q-point: (-0.45 0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( 6.344 3.299 14.292) 15.981 2.943 ( 7.454 10.852 22.742) 26.278 3.620 ( 6.997 -9.730 -0.714) 12.006 4.874 ( -5.368 9.263 -1.493) 10.810 5.997 ( 1.272 0.331 0.806) 1.542 6.525 ( 1.567 3.549 -2.069) 4.396 6.625 ( 5.467 9.246 -1.171) 10.805 6.742 ( 4.149 4.041 -2.275) 6.222 7.490 ( -10.365 -17.562 -9.138) 22.346 7.874 ( -0.170 -0.757 -6.961) 7.004 8.069 ( 2.859 0.735 1.774) 3.444 8.267 ( -0.929 -1.113 3.430) 3.724 8.446 ( -8.148 -8.545 -4.192) 12.529 8.732 ( -4.695 -0.077 3.104) 5.629 9.807 ( 7.506 1.843 0.827) 7.773 10.366 ( 16.389 2.593 -4.330) 17.149 10.665 ( -4.045 -2.224 0.944) 4.712 12.059 ( -6.705 -2.650 2.398) 7.599 14.599 ( 11.797 0.096 -2.882) 12.145 15.007 ( -10.346 -1.992 1.009) 10.584 16.055 ( -8.381 2.222 5.531) 10.284 16.421 ( -0.643 3.306 3.978) 5.213 16.865 ( 7.612 6.543 -2.152) 10.266 17.463 ( 0.410 -2.738 14.314) 14.579 17.768 ( 5.919 -0.752 13.863) 15.092 18.515 ( -4.372 -0.364 -5.425) 6.977 18.988 ( 4.161 -2.354 -0.553) 4.812 19.389 ( 3.644 0.149 -5.859) 6.902 19.650 ( -6.939 -0.250 -10.472) 12.565 20.261 ( -2.867 1.364 -6.116) 6.891 ======================= Grid point 439 (216/336) ======================= q-point: (-0.36 0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.418 ( 20.181 8.657 6.078) 22.785 3.031 ( 6.926 16.536 16.038) 24.055 3.841 ( 3.587 -12.393 1.058) 12.945 4.676 ( -0.741 16.818 0.924) 16.860 5.993 ( -0.620 1.345 0.879) 1.723 6.263 ( -14.252 11.781 0.607) 18.501 6.588 ( 3.395 6.064 -4.656) 8.366 6.919 ( 12.148 1.203 -3.002) 12.571 7.443 ( -15.870 -22.972 -8.187) 29.096 7.756 ( -5.657 -4.188 -1.952) 7.304 8.205 ( 2.923 1.378 0.443) 3.261 8.326 ( 4.353 -2.677 3.542) 6.218 8.472 ( 0.746 -6.600 -3.163) 7.357 8.692 ( 1.928 -6.799 -1.180) 7.165 9.867 ( 2.006 2.279 0.288) 3.050 10.571 ( 11.524 5.574 -8.795) 15.531 10.629 ( -2.099 -0.853 3.316) 4.016 11.997 ( -6.836 -7.779 4.918) 11.464 14.696 ( 0.025 -0.018 -5.916) 5.916 15.067 ( 13.563 -4.657 3.574) 14.779 15.933 ( -5.653 3.495 8.451) 10.751 16.384 ( 0.190 6.777 3.096) 7.453 16.896 ( 5.876 10.111 -1.819) 11.835 17.552 ( -0.493 -2.891 12.673) 13.008 17.919 ( 3.990 0.872 10.508) 11.274 18.410 ( -5.048 -1.054 -4.852) 7.081 19.071 ( 0.461 -6.949 -1.701) 7.169 19.396 ( 0.664 0.736 -6.679) 6.753 19.493 ( -4.873 1.426 -8.691) 10.066 20.168 ( -2.142 2.233 -4.139) 5.168 ======================= Grid point 440 (217/336) ======================= q-point: (-0.27 0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.634 ( 12.094 16.292 2.057) 20.394 3.003 ( 2.667 19.502 5.406) 20.412 3.944 ( -0.827 -6.460 -0.404) 6.525 4.610 ( 12.710 20.555 4.379) 24.561 5.955 ( -11.147 3.401 2.843) 11.996 5.974 ( -0.671 0.565 -0.116) 0.885 6.583 ( -0.621 -5.536 -5.351) 7.724 7.089 ( 11.989 7.214 -0.379) 13.997 7.281 ( -17.520 -15.902 -7.335) 24.772 7.719 ( -4.339 -5.038 -1.164) 6.750 8.212 ( -5.533 -7.908 -1.725) 9.805 8.367 ( -1.541 4.522 0.757) 4.837 8.548 ( 6.157 -8.988 4.592) 11.823 8.955 ( 14.540 -9.745 -8.579) 19.493 9.835 ( -3.273 3.283 -1.513) 4.877 10.478 ( -2.580 8.436 -11.743) 14.688 10.736 ( 5.748 -1.672 5.672) 8.246 12.016 ( -4.776 -9.541 8.855) 13.866 14.681 ( 1.112 -3.050 -4.607) 5.636 15.464 ( 21.327 -5.516 2.088) 22.127 15.862 ( -2.017 5.954 9.558) 11.440 16.331 ( 0.807 8.394 2.651) 8.840 16.861 ( 2.420 10.786 -2.507) 11.334 17.609 ( -1.391 -0.615 11.656) 11.755 17.964 ( -1.731 1.707 5.182) 5.724 18.332 ( -2.901 -0.895 -1.510) 3.391 19.105 ( -4.359 -11.414 -8.782) 15.047 19.343 ( -2.891 0.665 -5.967) 6.664 19.384 ( 0.125 5.127 -2.498) 5.705 20.128 ( 1.662 1.590 -2.329) 3.274 ======================= Grid point 441 (218/336) ======================= q-point: (-0.18 0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.501 ( -5.818 22.410 -1.480) 23.200 2.831 ( 1.177 18.635 0.609) 18.682 3.963 ( -4.623 -3.214 0.002) 5.631 4.751 ( 25.618 23.790 1.270) 34.984 5.819 ( -8.109 -5.451 3.960) 10.543 5.971 ( 0.741 -0.124 -0.913) 1.183 6.637 ( -2.482 -14.972 -2.212) 15.336 7.073 ( -11.612 -6.408 -3.980) 13.847 7.225 ( 8.337 5.917 -1.744) 10.370 7.672 ( -4.769 -3.200 -1.609) 5.964 8.106 ( -8.727 -3.519 -5.094) 10.700 8.369 ( 2.162 -2.029 -0.864) 3.088 8.812 ( 7.076 -12.299 6.549) 15.628 9.230 ( 11.655 -7.192 -9.269) 16.537 9.632 ( -11.480 7.881 -5.050) 14.812 10.315 ( -0.921 5.118 -13.069) 14.066 10.904 ( 6.076 -3.341 11.108) 13.094 12.047 ( -5.727 -5.650 9.877) 12.738 14.768 ( 5.740 -6.157 -4.020) 9.328 15.796 ( 0.718 8.544 7.150) 11.164 15.909 ( 17.683 -3.615 2.455) 18.215 16.294 ( 2.781 7.241 3.863) 8.666 16.750 ( -2.089 9.382 -4.488) 10.608 17.619 ( -2.778 2.424 13.222) 13.726 17.897 ( -6.407 -0.634 2.900) 7.061 18.303 ( -0.151 0.678 -0.278) 0.748 19.073 ( -3.173 -9.640 -15.254) 18.322 19.215 ( -6.199 1.595 -6.456) 9.091 19.393 ( 3.012 2.268 4.656) 5.991 20.171 ( 5.220 0.793 -2.619) 5.894 ======================= Grid point 442 (219/336) ======================= q-point: (-0.09 0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.143 ( -8.049 15.248 -0.650) 17.254 2.726 ( 3.645 12.501 -1.775) 13.142 3.800 ( -13.329 0.915 -2.201) 13.540 5.026 ( 26.046 21.622 1.298) 33.876 5.773 ( -2.862 -3.784 0.551) 4.777 5.992 ( 1.271 -1.692 -1.961) 2.885 6.709 ( -11.680 -20.048 2.285) 23.315 6.978 ( -1.198 -5.917 -3.788) 7.127 7.284 ( 6.967 9.287 -0.910) 11.646 7.584 ( -6.414 -1.521 -3.616) 7.519 7.995 ( -2.737 -1.368 -5.447) 6.248 8.430 ( 1.481 -4.801 -2.450) 5.590 8.968 ( -4.879 -3.747 -4.149) 7.420 9.321 ( -6.731 0.529 -4.443) 8.082 9.500 ( 12.311 -5.159 1.502) 13.432 10.210 ( -1.399 1.271 -13.601) 13.731 11.104 ( 6.404 -2.090 13.911) 15.456 11.990 ( -8.658 0.013 8.830) 12.366 14.947 ( 7.979 -7.448 -3.625) 11.502 15.693 ( -1.822 12.280 2.487) 12.661 16.206 ( 8.133 -2.590 5.448) 10.126 16.364 ( 9.456 5.705 5.175) 12.196 16.581 ( -4.700 5.360 -6.300) 9.514 17.589 ( -4.956 3.771 17.128) 18.225 17.784 ( -9.415 -2.230 3.226) 10.199 18.316 ( 3.138 1.096 -1.277) 3.561 19.034 ( -5.437 -0.307 -9.552) 10.995 19.083 ( -0.429 -6.283 -13.408) 14.813 19.466 ( 4.109 0.264 4.991) 6.470 20.253 ( 6.275 1.266 -4.197) 7.655 ======================= Grid point 449 (220/336) ======================= q-point: ( 0.55 -0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( 22.299 0.000 6.944) 23.356 3.254 ( 7.388 0.000 20.685) 21.965 3.654 ( 4.459 0.000 -3.527) 5.685 4.825 ( -3.473 -0.000 1.964) 3.990 6.007 ( -0.656 -0.000 0.159) 0.675 6.385 ( -12.092 -0.000 -1.938) 12.247 6.835 ( 3.231 0.000 -2.235) 3.928 6.918 ( 7.300 0.000 -5.558) 9.175 7.049 ( -11.653 -0.000 -7.988) 14.128 7.718 ( -5.989 -0.000 -2.031) 6.324 8.231 ( -7.123 -0.000 1.155) 7.216 8.293 ( 0.240 0.000 1.604) 1.622 8.392 ( 22.615 0.000 -3.827) 22.936 8.635 ( -6.736 -0.000 1.729) 6.954 9.889 ( 1.469 0.000 -0.152) 1.477 10.616 ( -1.263 -0.000 3.239) 3.476 10.627 ( 11.868 0.000 -8.930) 14.853 11.924 ( -6.887 -0.000 3.994) 7.962 14.695 ( -1.708 -0.000 -5.623) 5.877 15.022 ( 14.454 0.000 3.604) 14.896 15.967 ( -5.768 -0.000 8.887) 10.595 16.452 ( -0.085 -0.000 3.834) 3.835 17.006 ( 5.849 0.000 -4.350) 7.289 17.509 ( -1.346 -0.000 16.627) 16.682 17.931 ( 4.949 0.000 12.092) 13.065 18.400 ( -4.937 -0.000 -5.738) 7.570 18.998 ( -0.383 -0.000 -5.161) 5.175 19.403 ( 0.728 0.000 -6.416) 6.457 19.510 ( -3.654 -0.000 -6.934) 7.838 20.190 ( -2.550 -0.000 -4.551) 5.217 ======================= Grid point 451 (221/336) ======================= q-point: (-0.36 0.55 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.896 ( 18.977 8.600 3.415) 21.113 3.332 ( 2.965 13.634 7.042) 15.629 3.754 ( 0.034 -11.180 -1.655) 11.302 4.837 ( 6.979 4.539 6.746) 10.715 5.974 ( -4.540 0.158 1.065) 4.666 6.103 ( -12.359 7.185 -1.202) 14.346 6.554 ( -11.778 2.995 -12.431) 17.384 6.949 ( -5.219 -14.610 -6.493) 16.818 7.208 ( 13.262 3.399 1.175) 13.741 7.663 ( -1.068 -1.147 -0.817) 1.768 8.100 ( -8.642 -3.399 0.764) 9.318 8.345 ( -1.116 -3.255 5.007) 6.075 8.535 ( 2.390 3.882 -0.858) 4.639 8.795 ( 19.020 -5.967 -7.513) 21.303 9.870 ( -2.962 0.708 -1.558) 3.421 10.608 ( -1.586 4.946 -6.620) 8.415 10.685 ( 1.562 -3.236 -2.528) 4.393 11.902 ( -0.555 -2.701 9.472) 9.865 14.637 ( -1.001 -1.265 -3.822) 4.149 15.393 ( 22.112 -1.824 2.004) 22.278 15.939 ( -1.566 1.987 11.236) 11.517 16.449 ( -0.237 3.362 3.509) 4.866 17.024 ( 1.439 5.181 -5.269) 7.528 17.565 ( -2.467 -2.328 16.896) 17.233 17.996 ( -2.719 1.052 4.951) 5.746 18.328 ( -0.392 0.226 -0.407) 0.608 18.940 ( -3.506 -4.834 -11.966) 13.374 19.353 ( -2.801 0.294 -6.775) 7.337 19.456 ( 0.402 2.076 -1.217) 2.439 20.147 ( 0.365 0.451 -3.198) 3.251 ======================= Grid point 452 (222/336) ======================= q-point: (-0.27 0.55 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.932 ( -0.756 21.034 1.876) 21.131 3.201 ( -0.889 17.617 -2.224) 17.780 3.829 ( -3.701 -10.785 0.090) 11.403 5.060 ( 20.345 7.818 4.543) 22.264 5.754 ( -13.600 -0.390 2.356) 13.808 5.991 ( 0.162 2.096 -1.009) 2.332 6.354 ( -11.536 -13.636 -9.856) 20.400 6.917 ( -4.614 -5.476 -6.606) 9.742 7.394 ( 12.429 7.733 1.005) 14.672 7.653 ( -0.778 1.098 0.338) 1.387 7.996 ( -8.077 -6.396 -2.893) 10.701 8.335 ( -2.885 -4.098 3.120) 5.903 8.664 ( 9.698 -1.629 3.392) 10.402 9.106 ( 13.893 -5.310 -9.856) 17.842 9.733 ( -9.695 2.881 -4.202) 10.952 10.406 ( -6.021 4.033 -16.895) 18.384 10.806 ( 4.130 -5.557 9.872) 12.058 11.989 ( 1.205 -1.076 11.458) 11.571 14.670 ( 3.815 -3.729 -3.077) 6.158 15.807 ( 19.132 -2.398 1.999) 19.385 15.966 ( 2.483 4.699 11.075) 12.284 16.419 ( 0.266 5.151 3.867) 6.447 16.913 ( -4.077 6.859 -6.843) 10.512 17.609 ( -3.955 -2.218 16.900) 17.498 17.892 ( -8.434 -0.283 1.512) 8.573 18.347 ( 2.771 3.360 1.720) 4.682 18.889 ( -1.692 -8.220 -15.405) 17.543 19.239 ( -5.699 0.839 -6.672) 8.815 19.459 ( 2.422 3.460 2.396) 4.856 20.172 ( 3.960 -0.434 -3.209) 5.116 ======================= Grid point 453 (223/336) ======================= q-point: (-0.18 -0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.554 ( -13.273 25.236 1.690) 28.564 3.014 ( 0.808 16.407 -5.321) 17.267 3.768 ( -12.179 -4.928 -0.631) 13.153 5.354 ( 17.191 10.902 -0.552) 20.364 5.647 ( -3.563 -8.475 4.624) 10.291 5.978 ( 0.732 0.127 -2.062) 2.192 6.298 ( -9.508 -19.728 -4.935) 22.449 6.878 ( -0.018 -3.043 -6.645) 7.309 7.475 ( 3.446 7.625 -0.710) 8.398 7.619 ( 1.590 6.352 1.009) 6.625 7.922 ( -3.800 -5.393 -4.673) 8.085 8.383 ( 2.269 -3.658 0.324) 4.317 8.847 ( 2.779 -4.795 1.989) 5.888 9.292 ( 2.908 -3.612 -6.549) 8.024 9.497 ( -2.758 3.236 -4.212) 5.986 10.223 ( -3.964 0.273 -16.240) 16.719 11.007 ( 5.378 -6.751 12.840) 15.471 12.028 ( -2.129 3.009 10.693) 11.310 14.809 ( 7.469 -6.211 -2.737) 10.092 15.918 ( -0.525 10.113 3.639) 10.761 16.163 ( 10.669 -1.846 6.813) 12.793 16.445 ( 6.075 3.173 6.045) 9.138 16.700 ( -8.370 5.921 -8.723) 13.460 17.617 ( -5.662 -0.553 18.081) 18.955 17.745 ( -10.246 -1.865 3.088) 10.863 18.371 ( 4.556 4.452 -1.213) 6.485 18.901 ( 1.677 -8.219 -15.501) 17.625 19.085 ( -6.510 1.497 -6.386) 9.241 19.498 ( 3.763 2.654 3.669) 5.888 20.254 ( 5.900 -1.047 -4.770) 7.659 ======================= Grid point 454 (224/336) ======================= q-point: (-0.09 -0.45 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.130 ( -10.681 15.471 4.180) 19.259 2.863 ( -0.432 10.476 -6.539) 12.357 3.520 ( -15.213 0.364 -3.001) 15.510 5.403 ( -1.226 2.821 4.491) 5.444 5.691 ( -8.183 -7.420 -3.715) 11.655 6.093 ( 15.820 2.786 -1.668) 16.150 6.342 ( -2.029 -15.035 -1.159) 15.216 6.924 ( 2.038 -6.106 -3.592) 7.372 7.359 ( -7.462 4.160 -2.540) 8.913 7.616 ( 7.139 11.678 -0.825) 13.712 7.926 ( 0.404 -4.718 -4.271) 6.376 8.459 ( 4.395 0.222 -2.246) 4.941 8.769 ( -11.643 -1.139 -4.452) 12.517 9.238 ( 0.354 0.570 -6.433) 6.468 9.694 ( 13.810 -6.653 5.970) 16.450 10.087 ( -4.029 -0.797 -14.769) 15.329 11.218 ( 4.059 -6.371 12.745) 14.816 11.945 ( -6.553 7.245 9.178) 13.404 15.009 ( 8.343 -6.859 -2.735) 11.141 15.747 ( -5.586 12.188 -1.207) 13.461 16.328 ( 0.148 -0.597 11.914) 11.930 16.459 ( -4.783 3.382 -9.391) 11.068 16.599 ( 7.148 0.476 5.536) 9.054 17.540 ( -12.797 0.700 11.509) 17.225 17.630 ( -5.413 -0.751 11.107) 12.379 18.425 ( 6.435 3.506 -1.423) 7.465 18.908 ( -3.258 0.102 -9.674) 10.208 18.983 ( 2.199 -5.243 -11.650) 12.963 19.582 ( 5.865 0.415 2.836) 6.528 20.339 ( 5.390 -0.223 -6.751) 8.642 ======================= Grid point 462 (225/336) ======================= q-point: ( 0.64 -0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.185 ( 3.150 0.000 3.432) 4.658 3.435 ( -0.023 -0.000 0.162) 0.164 3.630 ( -5.235 -0.000 -3.028) 6.048 5.116 ( 17.816 0.000 8.045) 19.548 5.765 ( -18.263 -0.000 2.890) 18.490 6.028 ( -0.245 -0.000 -2.599) 2.611 6.193 ( -14.497 -0.000 -17.409) 22.655 6.872 ( 1.075 0.000 -4.267) 4.401 7.477 ( 13.633 0.000 0.132) 13.633 7.677 ( 2.290 0.000 1.725) 2.866 7.915 ( -9.632 -0.000 -0.446) 9.642 8.275 ( -5.279 -0.000 4.032) 6.643 8.672 ( 9.648 0.000 2.208) 9.897 9.048 ( 15.556 0.000 -10.757) 18.913 9.758 ( -8.774 -0.000 -3.750) 9.541 10.450 ( -9.102 -0.000 -19.465) 21.488 10.741 ( 4.361 0.000 10.509) 11.379 11.982 ( 3.501 0.000 11.989) 12.490 14.633 ( 3.148 0.000 -2.676) 4.132 15.783 ( 20.545 0.000 1.765) 20.620 16.012 ( 2.280 0.000 12.484) 12.690 16.472 ( -0.751 -0.000 4.160) 4.227 16.985 ( -5.115 -0.000 -8.452) 9.880 17.580 ( -3.785 -0.000 18.813) 19.190 17.887 ( -9.297 -0.000 0.312) 9.302 18.391 ( 3.861 0.000 5.179) 6.460 18.800 ( -0.918 -0.000 -17.985) 18.009 19.247 ( -5.495 -0.000 -6.822) 8.760 19.497 ( 2.169 0.000 2.311) 3.170 20.166 ( 3.270 0.000 -3.626) 4.883 ======================= Grid point 464 (226/336) ======================= q-point: (-0.27 -0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.001 ( -13.398 16.762 3.959) 21.821 3.315 ( -2.512 14.373 -5.232) 15.500 3.593 ( -8.755 -13.088 -0.622) 15.758 5.434 ( -5.695 -0.572 1.801) 6.000 5.491 ( 1.020 -5.810 5.924) 8.360 5.976 ( 1.732 -0.737 -13.454) 13.584 6.060 ( 1.295 -4.218 -4.445) 6.263 6.860 ( 0.279 0.305 -5.964) 5.978 7.610 ( 2.508 7.459 -3.610) 8.658 7.759 ( 7.874 4.993 4.861) 10.514 7.802 ( -3.851 -6.511 -1.384) 7.690 8.255 ( -1.363 -6.525 3.645) 7.597 8.829 ( 4.241 1.025 3.600) 5.657 9.234 ( 9.505 -1.780 -10.414) 14.211 9.551 ( -7.812 1.677 -4.911) 9.379 10.226 ( -5.529 0.044 -17.651) 18.497 10.896 ( 4.738 -3.621 12.072) 13.465 12.076 ( 0.882 1.524 11.467) 11.602 14.724 ( 6.849 -2.312 -2.007) 7.502 16.060 ( 6.399 4.339 3.311) 8.411 16.134 ( 7.537 -1.197 8.972) 11.779 16.490 ( 2.447 1.318 6.100) 6.704 16.784 ( -10.686 2.381 -9.979) 14.813 17.597 ( -4.173 -0.856 17.531) 18.041 17.715 ( -11.061 -1.036 3.173) 11.553 18.462 ( 3.864 3.792 3.076) 6.227 18.768 ( 4.026 -4.718 -18.443) 19.458 19.105 ( -6.402 0.550 -6.372) 9.049 19.547 ( 2.997 1.778 3.403) 4.871 20.228 ( 5.306 -1.057 -5.496) 7.712 ======================= Grid point 465 (227/336) ======================= q-point: (-0.18 -0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.534 ( -17.807 22.718 7.267) 29.766 3.076 ( -8.241 10.297 -5.642) 14.345 3.490 ( -9.549 -3.743 -4.238) 11.097 5.250 ( -18.083 -15.034 4.838) 24.008 5.550 ( -5.968 -5.929 -4.193) 9.400 6.124 ( 4.975 -1.879 -2.288) 5.790 6.194 ( 22.377 0.881 -5.782) 23.128 6.840 ( 0.240 -2.609 -7.390) 7.841 7.479 ( -4.620 8.465 -1.768) 9.805 7.807 ( 2.671 -1.379 -6.783) 7.419 7.868 ( 5.299 7.386 6.818) 11.363 8.376 ( 3.610 -9.481 0.641) 10.165 8.752 ( -11.386 0.336 -0.268) 11.394 9.291 ( 4.311 3.778 -7.879) 9.743 9.595 ( 11.650 -3.300 2.306) 12.326 10.080 ( -3.229 -0.033 -15.098) 15.439 11.075 ( 3.101 -7.162 11.499) 13.897 12.070 ( -3.763 4.980 9.909) 11.711 14.891 ( 8.581 -4.650 -1.801) 9.925 15.988 ( -4.473 11.811 0.042) 12.630 16.296 ( 1.946 -3.126 8.455) 9.222 16.505 ( -11.639 1.536 -9.910) 15.363 16.602 ( 5.478 -0.109 7.674) 9.429 17.537 ( -12.378 -0.680 8.859) 15.237 17.618 ( -2.415 -0.460 13.282) 13.508 18.505 ( 5.044 4.283 0.449) 6.632 18.838 ( 6.475 -4.767 -16.063) 17.963 18.965 ( -4.815 0.852 -5.926) 7.683 19.605 ( 4.024 1.733 3.131) 5.385 20.313 ( 5.649 -1.948 -8.078) 10.047 ======================= Grid point 466 (228/336) ======================= q-point: (-0.09 -0.36 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( -14.399 13.963 8.546) 21.802 2.759 ( -17.500 4.306 -1.877) 18.120 3.362 ( -0.401 3.292 -6.851) 7.611 5.067 ( -25.984 -20.371 4.075) 33.268 5.476 ( -2.760 -2.194 -3.742) 5.141 6.202 ( 2.846 -2.923 -3.836) 5.600 6.588 ( 20.884 0.639 0.077) 20.894 6.875 ( 3.969 -5.498 -6.261) 9.229 7.292 ( -5.429 9.980 -0.524) 11.373 7.829 ( 3.795 3.008 -6.673) 8.245 7.899 ( 3.012 4.104 2.385) 5.621 8.520 ( 4.019 -5.913 -3.928) 8.157 8.556 ( -7.427 0.770 0.757) 7.505 9.288 ( 4.228 6.566 -6.307) 10.038 9.899 ( 9.523 -5.774 -1.231) 11.204 9.977 ( 2.396 0.698 -3.865) 4.601 11.235 ( 0.333 -9.207 9.864) 13.497 11.941 ( -7.576 8.703 8.586) 14.383 15.083 ( 7.686 -5.390 -2.247) 9.653 15.726 ( -9.476 12.934 -2.256) 16.192 16.183 ( -13.342 0.065 -1.936) 13.482 16.432 ( -1.165 -6.336 1.391) 6.591 16.707 ( 1.646 -0.184 6.887) 7.083 17.357 ( -11.719 2.115 11.095) 16.276 17.652 ( 0.203 1.481 11.208) 11.307 18.565 ( 4.977 3.071 1.283) 5.987 18.837 ( -1.556 1.784 -7.277) 7.652 18.965 ( 7.275 -3.811 -12.792) 15.201 19.695 ( 5.481 -0.697 1.850) 5.827 20.378 ( 4.250 -1.216 -10.367) 11.270 ======================= Grid point 475 (229/336) ======================= q-point: (-0.27 -0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.810 ( -20.595 -0.000 8.319) 22.212 3.192 ( -18.109 -0.000 0.190) 18.110 3.423 ( 0.537 0.000 -8.866) 8.883 5.061 ( -21.986 -0.000 2.228) 22.099 5.487 ( -4.275 -0.000 -3.331) 5.419 6.103 ( 4.565 0.000 -1.607) 4.840 6.215 ( 25.033 0.000 -8.784) 26.529 6.816 ( -1.718 -0.000 -8.298) 8.474 7.620 ( -5.298 -0.000 -1.938) 5.642 7.721 ( 3.329 0.000 -3.648) 4.939 8.022 ( 11.196 0.000 6.537) 12.965 8.211 ( -0.683 -0.000 2.179) 2.284 8.760 ( -12.018 -0.000 1.296) 12.088 9.334 ( 7.505 0.000 -9.003) 11.721 9.566 ( 9.933 0.000 1.033) 9.987 10.081 ( -2.473 -0.000 -15.289) 15.488 10.996 ( 2.310 0.000 11.140) 11.377 12.120 ( -2.826 -0.000 10.058) 10.448 14.844 ( 8.411 0.000 -1.374) 8.522 16.155 ( -1.953 -0.000 1.364) 2.383 16.218 ( 0.706 0.000 6.159) 6.200 16.520 ( -14.111 -0.000 -9.693) 17.119 16.600 ( 4.659 0.000 8.051) 9.302 17.528 ( -11.652 -0.000 8.426) 14.379 17.613 ( -1.371 -0.000 13.632) 13.701 18.557 ( 2.845 0.000 3.603) 4.591 18.783 ( 9.499 0.000 -18.793) 21.057 18.975 ( -5.215 -0.000 -5.773) 7.780 19.627 ( 3.221 0.000 3.414) 4.694 20.289 ( 5.706 0.000 -8.838) 10.520 ======================= Grid point 476 (230/336) ======================= q-point: (-0.18 -0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.381 ( -23.996 11.648 11.405) 29.009 2.829 ( -21.513 2.058 2.227) 21.725 3.404 ( 2.895 1.036 -10.225) 10.678 4.715 ( -25.746 -12.223 2.525) 28.612 5.420 ( -1.850 -2.258 -4.373) 5.257 6.170 ( 2.657 -0.701 -2.877) 3.978 6.623 ( 21.531 2.599 -4.182) 22.087 6.771 ( 2.852 -4.553 -8.709) 10.233 7.486 ( -4.434 7.831 -0.025) 8.999 7.777 ( 1.914 -3.054 -2.780) 4.552 8.097 ( 4.245 11.489 0.653) 12.266 8.331 ( 4.109 -11.815 -0.559) 12.521 8.570 ( -7.465 0.222 3.155) 8.108 9.405 ( 6.338 3.791 -5.670) 9.311 9.832 ( 14.225 -1.265 1.899) 14.407 9.991 ( 0.402 0.589 -8.102) 8.134 11.077 ( -1.170 -5.402 8.948) 10.518 12.062 ( -6.358 3.395 8.338) 11.022 14.999 ( 7.910 -2.526 -1.287) 8.403 15.989 ( -8.620 12.891 -0.267) 15.510 16.183 ( -12.725 -0.859 -2.359) 12.970 16.274 ( -8.439 -8.797 -3.304) 12.630 16.699 ( 2.173 -0.327 7.527) 7.841 17.388 ( -9.176 0.915 12.821) 15.793 17.670 ( 1.600 0.434 10.066) 10.202 18.612 ( 2.966 1.442 2.759) 4.299 18.867 ( -0.758 1.418 -7.211) 7.388 18.909 ( 9.188 -2.040 -13.717) 16.635 19.696 ( 3.336 0.375 2.675) 4.293 20.347 ( 5.167 -1.331 -12.076) 13.202 ======================= Grid point 477 (231/336) ======================= q-point: (-0.09 -0.27 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.912 ( -22.066 7.018 9.177) 24.907 2.437 ( -20.734 2.843 7.452) 22.215 3.435 ( 7.274 2.324 -7.268) 10.542 4.352 ( -33.516 -17.569 3.095) 37.968 5.434 ( 2.105 -3.500 -2.179) 4.629 6.165 ( -2.544 -3.289 -6.477) 7.697 6.726 ( 3.449 0.542 -3.799) 5.160 7.093 ( 18.693 -2.883 0.298) 18.916 7.341 ( 0.213 8.832 0.773) 8.869 7.814 ( 1.351 -1.004 -2.278) 2.832 8.071 ( 5.347 8.399 -4.341) 10.862 8.453 ( 0.947 -3.374 0.377) 3.525 8.547 ( 1.056 -3.473 0.594) 3.678 9.427 ( 4.579 8.908 -3.524) 10.618 9.842 ( -2.704 -0.085 -9.801) 10.167 10.221 ( 15.291 0.359 7.928) 17.228 11.143 ( -3.920 -10.704 6.648) 13.196 11.928 ( -5.922 7.108 8.748) 12.733 15.151 ( 5.880 -3.782 -2.110) 7.302 15.632 ( -14.716 13.488 -1.950) 20.057 15.933 ( -12.156 -0.721 -2.524) 12.436 16.215 ( -11.531 -13.385 -0.496) 17.674 16.748 ( 0.227 1.520 5.047) 5.275 17.282 ( -7.072 2.819 10.932) 13.322 17.741 ( 2.596 1.665 8.234) 8.793 18.658 ( 1.652 1.311 3.152) 3.792 18.819 ( 1.292 1.497 -5.150) 5.516 19.050 ( 10.412 -0.885 -11.986) 15.901 19.772 ( 3.529 -1.770 1.498) 4.222 20.380 ( 3.695 -1.086 -14.094) 14.611 ======================= Grid point 487 (232/336) ======================= q-point: (-0.18 -0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( -28.396 -0.000 12.277) 30.936 2.469 ( -21.815 -0.000 8.034) 23.247 3.458 ( 7.054 0.000 -8.540) 11.076 4.160 ( -31.678 -0.000 3.068) 31.826 5.394 ( 2.006 0.000 -3.339) 3.895 6.131 ( -4.133 -0.000 -6.524) 7.723 6.750 ( 5.243 0.000 -5.904) 7.896 7.040 ( 21.088 0.000 -0.445) 21.093 7.439 ( -4.658 -0.000 1.606) 4.927 7.810 ( 4.015 0.000 -1.160) 4.179 8.180 ( 2.430 0.000 -7.349) 7.740 8.384 ( 6.900 0.000 -0.420) 6.913 8.514 ( -2.327 -0.000 6.227) 6.647 9.519 ( 6.148 0.000 -1.766) 6.397 9.849 ( -3.795 -0.000 -11.698) 12.298 10.230 ( 18.354 0.000 10.033) 20.917 11.020 ( -5.708 -0.000 5.822) 8.153 12.000 ( -5.575 -0.000 8.121) 9.850 15.104 ( 5.894 0.000 -1.175) 6.010 15.898 ( -18.740 -0.000 -5.518) 19.535 15.935 ( -9.976 -0.000 3.684) 10.634 15.951 ( -12.177 -0.000 -4.869) 13.114 16.762 ( 2.148 0.000 5.228) 5.652 17.311 ( -7.827 -0.000 10.608) 13.183 17.757 ( 2.933 0.000 7.918) 8.444 18.671 ( 1.018 0.000 3.494) 3.639 18.834 ( 1.109 0.000 -4.812) 4.938 19.042 ( 11.416 0.000 -12.451) 16.893 19.756 ( 2.282 0.000 1.987) 3.026 20.365 ( 4.507 0.000 -14.978) 15.641 ======================= Grid point 488 (233/336) ======================= q-point: (-0.09 -0.18 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( -26.908 1.541 9.921) 28.720 2.163 ( -17.537 -1.032 14.942) 23.062 3.553 ( -4.690 0.171 -3.622) 5.929 3.613 ( -24.848 -8.347 3.893) 26.500 5.463 ( 5.456 -2.741 -0.672) 6.142 6.008 ( -6.040 -2.960 -8.800) 11.076 6.831 ( 6.822 3.542 -3.153) 8.309 7.318 ( 3.501 7.179 4.420) 9.128 7.455 ( 10.009 -8.030 3.178) 13.220 7.892 ( 6.691 2.687 0.597) 7.235 8.188 ( 4.656 3.310 -8.868) 10.548 8.483 ( 4.431 -1.039 -3.067) 5.489 8.532 ( -0.052 -1.993 4.845) 5.239 9.561 ( -0.065 9.995 -2.083) 10.210 9.723 ( -3.484 -5.010 -4.857) 7.799 10.525 ( 9.825 6.656 2.811) 12.195 10.957 ( -7.893 -10.250 2.851) 13.247 12.017 ( 7.264 3.805 14.650) 16.789 15.200 ( 4.036 -2.167 -1.935) 4.972 15.424 ( -20.398 10.691 -4.791) 23.523 15.739 ( -8.347 0.149 -0.741) 8.381 15.848 ( -12.954 -12.988 1.611) 18.415 16.806 ( 1.180 4.438 2.347) 5.157 17.168 ( -11.592 -1.926 2.518) 12.018 17.837 ( 2.637 0.933 7.178) 7.704 18.673 ( -1.510 0.158 1.408) 2.071 18.874 ( 4.702 0.820 -1.527) 5.011 19.180 ( 9.403 0.097 -9.517) 13.379 19.804 ( 1.603 -1.579 1.033) 2.475 20.366 ( 2.931 -0.262 -15.066) 15.351 ======================= Grid point 499 (234/336) ======================= q-point: (-0.09 -0.09 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.121 ( -25.542 -0.000 11.153) 27.871 1.911 ( -18.689 -0.000 17.368) 25.513 2.917 ( -35.840 -0.000 13.110) 38.163 3.697 ( 7.673 0.000 -5.481) 9.429 5.578 ( 8.539 0.000 3.111) 9.088 5.859 ( -3.856 -0.000 -9.030) 9.819 6.961 ( 6.421 0.000 -2.382) 6.849 7.415 ( 0.886 0.000 2.400) 2.559 7.569 ( 4.577 0.000 9.467) 10.515 8.048 ( 5.643 0.000 5.323) 7.758 8.222 ( 3.050 0.000 -8.708) 9.227 8.555 ( 9.432 0.000 -11.603) 14.953 8.585 ( 2.554 0.000 10.274) 10.587 9.425 ( -15.480 -0.000 -3.600) 15.893 9.742 ( 6.024 0.000 2.289) 6.444 10.633 ( -3.037 -0.000 -7.923) 8.485 10.704 ( -12.630 -0.000 -1.369) 12.704 12.480 ( 32.623 0.000 22.689) 39.737 15.071 ( -19.918 -0.000 -9.185) 21.933 15.248 ( 3.478 0.000 -0.824) 3.574 15.567 ( -11.938 -0.000 4.322) 12.696 15.643 ( -3.425 -0.000 0.571) 3.472 16.806 ( -24.832 -0.000 -5.756) 25.490 16.897 ( 3.189 0.000 0.621) 3.249 17.916 ( 2.063 0.000 6.860) 7.164 18.641 ( -2.087 -0.000 -0.172) 2.094 18.955 ( 3.670 0.000 0.420) 3.694 19.287 ( 6.791 0.000 -7.397) 10.042 19.821 ( 0.998 0.000 0.237) 1.026 20.336 ( 0.336 0.000 -11.368) 11.373 ======================= Grid point 500 (235/336) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.916 ( 0.187 0.000 9.119) 9.121 1.581 ( -1.484 -0.000 8.572) 8.700 2.846 ( -5.283 -0.000 14.681) 15.603 3.642 ( 2.016 0.000 -7.255) 7.530 5.639 ( 2.284 0.000 -4.989) 5.487 6.158 ( 5.815 0.000 6.798) 8.946 7.176 ( 4.306 0.000 0.725) 4.366 7.414 ( -0.333 -0.000 -0.766) 0.835 7.781 ( -6.869 -0.000 8.303) 10.776 8.049 ( -6.094 -0.000 0.975) 6.172 8.282 ( 2.341 0.000 -2.727) 3.594 8.907 ( -1.989 -0.000 3.913) 4.389 8.908 ( 13.109 0.000 -3.966) 13.696 9.189 ( 5.816 0.000 12.205) 13.520 9.857 ( -9.942 -0.000 -16.758) 19.485 9.929 ( 0.461 0.000 -5.417) 5.437 10.136 ( -5.293 -0.000 1.429) 5.483 13.953 ( 4.676 0.000 -1.475) 4.903 14.458 ( 3.850 0.000 -3.260) 5.045 15.290 ( -7.750 -0.000 2.398) 8.112 15.397 ( 5.418 0.000 0.371) 5.431 15.711 ( 3.751 0.000 -0.387) 3.770 15.932 ( -2.778 -0.000 3.022) 4.105 16.927 ( -1.119 -0.000 -0.054) 1.120 18.125 ( 0.258 0.000 3.506) 3.516 18.553 ( -1.487 -0.000 -0.396) 1.538 19.031 ( -0.305 -0.000 0.802) 0.858 19.289 ( 0.721 0.000 -2.854) 2.944 19.835 ( 1.180 0.000 -1.130) 1.634 20.178 ( -2.852 -0.000 0.172) 2.857 ======================= Grid point 501 (236/336) ======================= q-point: ( 0.09 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( 8.336 -24.951 4.945) 26.767 1.925 ( 31.225 -7.828 6.768) 32.895 2.790 ( -6.039 3.610 14.115) 15.772 3.680 ( 2.350 -5.896 -6.573) 9.137 5.684 ( 4.563 -1.421 -5.598) 7.361 6.193 ( -4.146 -0.193 0.332) 4.164 7.157 ( -2.694 6.060 -1.829) 6.879 7.405 ( 6.404 12.224 0.720) 13.819 7.691 ( -12.547 -7.266 10.226) 17.742 8.016 ( -1.972 -5.618 1.400) 6.117 8.191 ( -7.992 1.450 -3.173) 8.720 8.954 ( -0.536 -0.237 -9.109) 9.128 9.015 ( 5.984 -0.751 1.441) 6.201 9.343 ( 6.815 5.924 14.287) 16.901 9.589 ( -4.689 8.810 -13.368) 16.683 9.900 ( -0.878 -2.671 -3.973) 4.867 10.263 ( 9.561 -8.903 4.452) 13.802 13.689 ( -20.863 12.697 -0.969) 24.442 14.588 ( 11.896 0.816 -5.671) 13.204 15.208 ( -6.583 -7.585 2.539) 10.359 15.531 ( 7.423 -1.850 1.174) 7.739 15.804 ( 6.225 -2.260 -2.942) 7.247 16.166 ( 23.050 0.675 1.868) 23.135 16.922 ( -2.615 -6.896 0.740) 7.412 18.129 ( -1.011 0.603 2.531) 2.791 18.522 ( -1.959 0.466 1.084) 2.287 19.024 ( -1.270 -1.269 0.130) 1.800 19.259 ( -2.723 -0.177 -2.978) 4.039 19.866 ( 2.444 -1.239 -1.803) 3.279 20.074 ( -6.888 4.246 2.177) 8.379 ======================= Grid point 502 (237/336) ======================= q-point: ( 0.18 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 10.470 -12.361 0.182) 16.201 2.678 ( 1.679 -6.600 3.762) 7.780 2.798 ( 33.358 -10.763 11.458) 36.877 3.761 ( 1.286 -8.372 -4.985) 9.828 5.773 ( 5.934 -2.452 -5.416) 8.400 6.042 ( -11.275 -1.843 -4.610) 12.319 7.016 ( -3.563 6.901 -1.431) 7.898 7.391 ( 6.334 15.585 0.949) 16.849 7.554 ( -14.053 -4.435 8.406) 16.965 7.960 ( -9.375 0.926 -1.465) 9.534 8.084 ( -3.654 -4.798 -0.555) 6.057 8.831 ( -9.037 -8.896 -12.608) 17.882 9.034 ( 0.265 13.430 -3.800) 13.960 9.433 ( 0.376 2.080 -3.904) 4.440 9.514 ( 12.917 12.474 12.749) 22.022 9.912 ( 0.624 -3.993 -3.842) 5.576 10.610 ( 13.883 -10.954 7.381) 19.163 13.106 ( -26.624 14.659 -0.827) 30.405 14.792 ( 14.773 4.424 -4.115) 15.961 15.226 ( -2.934 -12.645 1.981) 13.131 15.717 ( 9.631 -3.797 2.291) 10.603 15.932 ( 7.080 -3.350 -5.683) 9.677 16.529 ( 16.148 8.009 2.029) 18.139 17.043 ( 6.423 -15.061 0.973) 16.402 18.097 ( -2.852 1.047 1.778) 3.520 18.485 ( -2.493 1.151 3.483) 4.436 19.014 ( -0.736 -1.450 -2.655) 3.114 19.170 ( -5.849 -0.530 -3.413) 6.792 19.884 ( -8.627 6.931 3.330) 11.557 19.930 ( 3.371 -2.240 -2.362) 4.687 ======================= Grid point 503 (238/336) ======================= q-point: ( 0.27 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( 11.224 -2.166 -2.306) 11.661 2.628 ( -2.801 2.672 4.872) 6.223 3.634 ( 16.829 -18.256 -2.312) 24.936 3.889 ( 16.917 -13.256 0.914) 21.511 5.810 ( -7.854 -2.694 -6.431) 10.502 5.915 ( 2.754 -4.026 -2.450) 5.458 6.924 ( -1.419 0.450 -0.846) 1.712 7.334 ( 2.423 14.202 1.108) 14.450 7.350 ( -13.501 1.209 3.174) 13.921 7.761 ( -8.969 2.852 -1.562) 9.541 8.021 ( -5.491 -0.298 -1.746) 5.770 8.722 ( -7.399 -6.364 -7.996) 12.616 8.828 ( -3.719 11.658 -7.167) 14.181 9.378 ( -1.274 3.768 -4.728) 6.179 9.699 ( 11.437 10.935 13.844) 21.025 9.965 ( 3.138 -3.128 -5.220) 6.847 10.989 ( 12.349 -9.939 9.169) 18.313 12.524 ( -22.930 10.625 -0.927) 25.289 14.941 ( 9.141 6.266 -1.814) 11.230 15.368 ( 3.264 -12.139 1.306) 12.638 15.952 ( 10.135 -5.070 -0.943) 11.371 16.079 ( 8.102 -5.778 -3.132) 10.433 16.610 ( 2.111 5.796 3.848) 7.270 17.400 ( 15.084 -10.673 2.704) 18.675 18.021 ( -5.328 1.365 1.758) 5.774 18.438 ( -3.622 2.193 5.802) 7.183 18.991 ( 0.225 1.262 -7.923) 8.026 19.035 ( -7.969 -1.034 -4.139) 9.039 19.690 ( -6.851 5.932 5.474) 10.587 20.017 ( 4.591 -3.242 -3.560) 6.653 ======================= Grid point 504 (239/336) ======================= q-point: ( 0.36 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.008 ( 9.583 4.114 -1.343) 10.515 2.596 ( 0.048 0.524 0.291) 0.602 3.629 ( -11.370 -5.232 -7.219) 14.449 4.646 ( 30.658 -21.789 3.161) 37.745 5.696 ( -4.154 -4.985 -4.639) 7.976 6.000 ( 3.281 -0.158 -0.087) 3.286 6.908 ( -11.653 -4.892 2.522) 12.887 7.106 ( -5.380 -1.025 -4.075) 6.826 7.229 ( 2.668 15.701 -1.232) 15.973 7.593 ( -5.318 5.822 0.242) 7.889 7.919 ( -3.464 0.863 -2.279) 4.235 8.566 ( -2.482 12.339 -1.854) 12.722 8.684 ( -7.905 -8.468 -9.518) 14.993 9.274 ( -3.074 4.440 -4.642) 7.122 9.830 ( 6.080 3.804 6.381) 9.600 9.996 ( 3.551 5.560 -3.617) 7.524 11.304 ( 8.676 -6.878 9.650) 14.687 12.121 ( -14.431 3.144 0.974) 14.801 15.008 ( 5.340 4.024 -0.993) 6.760 15.517 ( 2.033 -6.133 -0.193) 6.464 16.128 ( 6.640 -5.371 -6.646) 10.822 16.333 ( 10.683 -8.780 3.346) 14.227 16.593 ( -0.082 4.320 6.658) 7.937 17.717 ( 6.539 -4.454 4.048) 8.887 17.920 ( -4.197 -0.318 6.099) 7.410 18.355 ( -4.785 3.869 3.666) 7.163 18.870 ( -7.299 0.498 -7.032) 10.147 18.932 ( 0.115 3.000 -9.619) 10.077 19.612 ( -0.584 2.091 6.206) 6.575 20.114 ( 4.539 -3.352 -4.639) 7.305 ======================= Grid point 505 (240/336) ======================= q-point: (-0.55 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( 4.431 5.681 1.823) 7.432 2.626 ( 2.431 -1.981 -3.287) 4.543 3.392 ( -14.030 -2.619 -5.712) 15.373 5.258 ( 13.271 -14.982 3.078) 20.250 5.705 ( -0.144 -0.670 -3.909) 3.969 6.061 ( 7.008 -0.837 1.688) 7.257 6.565 ( -15.221 7.523 -2.675) 17.189 7.112 ( -2.034 2.068 1.045) 3.083 7.232 ( 5.156 -0.991 -3.053) 6.073 7.445 ( -3.340 4.001 0.858) 5.282 7.882 ( 1.128 0.393 -3.735) 3.921 8.443 ( -0.090 5.588 -1.279) 5.734 8.584 ( -6.633 -5.451 -6.601) 10.829 9.167 ( -1.926 3.146 -3.810) 5.304 9.847 ( -2.573 -0.900 -8.067) 8.515 10.022 ( 8.201 8.926 6.036) 13.541 11.505 ( 4.124 -1.815 8.777) 9.866 11.944 ( -7.749 -3.329 3.233) 9.033 15.053 ( 2.916 1.102 -1.236) 3.354 15.556 ( -0.718 -1.865 -1.691) 2.618 16.212 ( 0.021 -3.562 -6.721) 7.607 16.579 ( 3.718 -3.637 8.302) 9.796 16.637 ( 6.692 -0.121 4.714) 8.187 17.647 ( -10.885 -0.031 3.145) 11.331 17.996 ( -4.325 -0.743 19.581) 20.067 18.298 ( 5.963 0.891 -7.011) 9.247 18.717 ( -4.724 0.208 -9.022) 10.186 18.877 ( 1.597 3.267 -7.266) 8.126 19.659 ( 4.030 0.926 3.706) 5.553 20.187 ( 3.012 -2.120 -5.945) 6.993 ======================= Grid point 506 (241/336) ======================= q-point: (-0.45 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( -2.738 2.541 2.937) 4.752 2.615 ( -5.890 -1.872 -3.223) 6.970 3.242 ( -0.896 -1.850 0.000) 2.056 5.387 ( -17.245 7.449 -3.715) 19.148 5.497 ( -4.038 1.302 6.036) 7.378 6.192 ( 0.172 3.468 -3.777) 5.131 6.575 ( 23.999 -4.247 -2.101) 24.462 7.050 ( -2.363 13.135 4.155) 13.978 7.119 ( -8.735 -4.346 -0.181) 9.758 7.554 ( 5.522 -10.855 -3.564) 12.689 7.889 ( 2.177 1.376 -3.468) 4.319 8.450 ( 2.755 -2.635 -1.947) 4.281 8.510 ( -2.287 -0.786 -2.665) 3.598 9.132 ( 1.182 -0.667 -2.036) 2.447 9.769 ( -1.179 0.652 -6.188) 6.333 10.128 ( 6.408 1.645 2.565) 7.096 11.559 ( -0.983 3.785 6.409) 7.508 11.901 ( -4.560 -5.761 4.901) 8.832 15.075 ( -0.751 -2.966 -2.157) 3.744 15.538 ( -0.713 0.678 -1.341) 1.663 16.138 ( -5.822 2.028 -2.790) 6.767 16.622 ( -1.517 5.626 4.229) 7.200 16.756 ( -0.291 -4.365 1.658) 4.679 17.507 ( -8.072 -3.171 9.339) 12.745 17.927 ( -7.886 1.144 14.554) 16.593 18.468 ( 10.839 -3.533 -3.363) 11.886 18.635 ( -0.010 -1.158 -9.099) 9.172 18.858 ( 3.265 3.379 -5.698) 7.386 19.747 ( 5.707 1.526 0.531) 5.931 20.199 ( 0.578 -0.046 -7.718) 7.740 ======================= Grid point 507 (242/336) ======================= q-point: (-0.36 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( -12.833 1.183 1.712) 13.001 2.497 ( -7.287 -3.163 4.743) 9.252 3.362 ( 9.725 0.292 3.085) 10.207 4.738 ( -32.756 17.846 -0.683) 37.308 5.529 ( 3.827 4.281 2.982) 6.470 6.120 ( -1.892 4.459 -5.607) 7.410 6.829 ( -3.888 10.454 3.815) 11.788 7.117 ( 9.053 -5.811 2.721) 11.096 7.133 ( 16.216 -9.646 -2.410) 19.021 7.695 ( 2.618 -6.479 -4.725) 8.435 7.920 ( 3.857 -0.623 -1.711) 4.265 8.490 ( 1.422 2.901 -0.305) 3.245 8.537 ( 1.768 -6.006 -0.281) 6.267 9.201 ( 3.087 -5.975 -0.874) 6.782 9.749 ( 1.402 0.747 -1.645) 2.286 10.228 ( 2.334 -5.564 -2.865) 6.679 11.456 ( -6.610 7.678 2.770) 10.503 11.950 ( 1.972 -5.265 8.201) 9.943 15.059 ( -5.459 -7.692 -3.195) 9.958 15.503 ( -0.562 4.443 -0.360) 4.493 15.965 ( -8.347 5.191 0.510) 9.843 16.430 ( -10.668 10.074 -1.186) 14.721 16.749 ( -4.902 -4.671 0.845) 6.824 17.469 ( -7.123 -1.643 11.663) 13.765 17.890 ( -1.834 -1.246 8.659) 8.938 18.649 ( 2.467 -2.556 -6.400) 7.320 18.661 ( 6.993 -3.698 0.884) 7.960 18.895 ( 8.161 2.656 -6.227) 10.603 19.828 ( 5.399 2.249 -1.124) 5.956 20.146 ( -0.888 1.191 -9.919) 10.030 ======================= Grid point 508 (243/336) ======================= q-point: (-0.27 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( -17.019 1.778 4.663) 17.735 2.469 ( -3.836 -1.027 11.730) 12.384 3.521 ( 6.093 4.631 0.896) 7.705 3.951 ( -32.983 17.350 0.832) 37.277 5.590 ( 7.121 5.604 3.634) 9.763 5.965 ( -5.165 7.727 -5.680) 10.892 6.774 ( 1.082 -1.272 3.088) 3.511 7.216 ( -1.389 -12.402 4.125) 13.144 7.604 ( 20.571 2.938 -3.531) 21.078 7.803 ( 10.289 -5.474 -0.841) 11.685 8.014 ( 6.075 -0.858 -2.828) 6.756 8.469 ( -0.188 4.927 -0.200) 4.935 8.620 ( 0.119 -6.805 4.641) 8.237 9.308 ( 0.072 -8.506 -1.052) 8.571 9.772 ( 2.717 2.318 1.222) 3.774 10.265 ( -5.136 -11.714 -9.066) 15.678 11.209 ( -11.443 10.443 -1.126) 15.533 12.204 ( 15.862 -6.628 13.634) 21.941 14.988 ( -11.679 -11.242 -3.869) 16.666 15.414 ( -0.625 10.658 -0.862) 10.712 15.781 ( -7.350 3.513 2.406) 8.494 16.104 ( -12.456 11.415 -0.684) 16.909 16.699 ( -7.760 -7.587 0.170) 10.854 17.330 ( -10.253 5.979 5.001) 12.879 17.947 ( 1.650 -2.277 6.277) 6.878 18.656 ( -1.214 -1.037 -2.669) 3.110 18.825 ( 7.565 -2.448 0.559) 7.971 19.031 ( 10.126 0.352 -4.985) 11.292 19.873 ( 2.300 3.218 0.273) 3.964 20.088 ( 1.410 -0.732 -11.673) 11.780 ======================= Grid point 509 (244/336) ======================= q-point: (-0.18 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( -14.682 5.579 8.806) 18.007 2.393 ( -10.857 12.235 14.609) 21.932 3.115 ( -28.172 5.612 -0.448) 28.729 3.686 ( 4.154 7.091 -0.258) 8.222 5.701 ( 4.400 1.711 2.224) 5.218 5.807 ( 2.030 7.971 -0.175) 8.227 6.885 ( 4.595 -6.492 2.323) 8.285 7.322 ( -2.468 -12.287 3.428) 12.992 7.768 ( 7.057 1.556 0.238) 7.230 8.102 ( 6.744 2.857 -4.288) 8.487 8.182 ( 22.414 0.158 2.372) 22.540 8.373 ( -4.029 5.172 -2.834) 7.142 8.737 ( 1.668 -8.089 9.526) 12.608 9.307 ( -7.516 -4.563 -0.505) 8.807 9.818 ( 4.389 2.433 1.654) 5.284 10.188 ( -11.053 -14.411 -14.122) 23.006 10.850 ( -14.575 12.435 -4.241) 19.623 12.767 ( 29.249 -10.548 15.639) 34.804 14.803 ( -16.887 -7.948 -4.554) 19.211 15.315 ( 2.724 10.079 -2.139) 10.658 15.664 ( -5.477 1.398 2.843) 6.327 15.796 ( -9.312 10.481 1.752) 14.129 16.570 ( -18.533 -9.811 -0.648) 20.979 17.088 ( -5.020 12.656 -0.650) 13.631 18.027 ( 1.817 -1.739 5.395) 5.953 18.620 ( -1.814 -0.113 -2.148) 2.814 18.959 ( 5.256 -0.243 0.519) 5.287 19.170 ( 7.529 -0.010 -3.808) 8.438 19.856 ( -0.267 2.897 0.497) 2.952 20.117 ( 3.765 -3.566 -8.305) 9.791 ======================= Grid point 510 (245/336) ======================= q-point: (-0.09 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.097 ( -9.122 15.615 10.150) 20.738 1.894 ( -27.010 14.045 8.514) 31.612 2.864 ( -7.613 -4.362 11.003) 14.073 3.666 ( 2.381 5.868 -5.303) 8.260 5.655 ( -0.941 1.607 -4.439) 4.814 5.963 ( 11.295 1.797 9.221) 14.691 7.048 ( 5.800 -4.764 1.838) 7.728 7.392 ( -3.307 -10.694 1.425) 11.284 7.839 ( 2.221 5.934 4.132) 7.564 8.176 ( 3.640 0.171 -2.148) 4.230 8.205 ( -5.087 3.554 1.040) 6.292 8.589 ( 22.405 0.727 -2.783) 22.589 8.900 ( 1.668 -5.862 10.387) 12.043 9.160 ( -8.261 0.900 2.614) 8.711 9.888 ( 4.540 1.030 -0.217) 4.660 10.046 ( -11.827 -13.405 -16.168) 24.104 10.436 ( -15.066 12.299 -5.109) 20.108 13.499 ( 31.039 -11.062 9.259) 34.228 14.556 ( -11.873 -2.028 -4.598) 12.893 15.304 ( 4.396 4.037 -2.240) 6.375 15.497 ( -9.161 6.290 2.973) 11.503 15.676 ( 0.206 2.288 2.396) 3.319 16.209 ( -24.552 -2.186 -0.443) 24.653 16.961 ( 0.575 6.712 -0.890) 6.795 18.089 ( 1.179 -0.834 4.515) 4.740 18.582 ( -1.498 -0.063 -1.386) 2.042 19.020 ( 1.990 0.845 0.476) 2.214 19.259 ( 4.195 0.019 -3.132) 5.235 19.833 ( 0.181 1.385 -0.366) 1.444 20.178 ( 1.436 -3.281 -3.274) 4.853 ======================= Grid point 512 (246/336) ======================= q-point: ( 0.09 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( 22.158 0.000 5.146) 22.748 2.499 ( 27.987 0.000 -1.203) 28.013 2.820 ( 6.286 0.000 18.207) 19.261 3.664 ( 2.293 0.000 -7.570) 7.909 5.748 ( 6.266 0.000 -5.814) 8.548 6.023 ( -12.218 -0.000 -5.750) 13.503 7.107 ( -4.302 -0.000 -3.608) 5.615 7.458 ( -15.210 -0.000 12.842) 19.907 7.616 ( 8.267 0.000 -2.527) 8.645 7.954 ( -2.352 -0.000 1.904) 3.027 8.012 ( -9.609 -0.000 -2.343) 9.891 8.731 ( -12.149 -0.000 -11.060) 16.429 9.166 ( 3.545 0.000 -2.119) 4.130 9.460 ( 1.842 0.000 -6.927) 7.168 9.676 ( 10.387 0.000 14.061) 17.481 9.861 ( -1.026 -0.000 -2.600) 2.795 10.475 ( 14.944 0.000 6.042) 16.119 13.259 ( -30.403 -0.000 -2.050) 30.472 14.851 ( 19.078 0.000 -4.610) 19.628 15.082 ( -4.852 -0.000 3.556) 6.015 15.671 ( 8.222 0.000 1.721) 8.401 15.899 ( 7.709 0.000 -6.151) 9.862 16.687 ( 30.364 0.000 0.982) 30.380 16.820 ( -4.969 -0.000 2.551) 5.585 18.107 ( -2.918 -0.000 1.762) 3.408 18.496 ( -2.330 -0.000 3.308) 4.046 19.000 ( -0.044 -0.000 -2.040) 2.040 19.165 ( -6.000 -0.000 -3.264) 6.830 19.905 ( 3.647 0.000 -2.821) 4.611 19.955 ( -9.811 -0.000 3.103) 10.291 ======================= Grid point 513 (247/336) ======================= q-point: ( 0.18 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( 23.772 3.762 2.901) 24.242 2.648 ( -1.650 -1.252 5.249) 5.642 3.395 ( 34.333 -4.237 5.360) 35.007 3.683 ( 1.555 -7.695 -6.200) 10.004 5.761 ( -12.683 -1.703 -7.634) 14.901 5.856 ( 7.291 -1.642 -4.718) 8.838 6.990 ( -4.200 4.706 -2.797) 6.900 7.243 ( -17.256 -5.893 7.545) 19.734 7.630 ( 1.047 9.803 -5.247) 11.168 7.836 ( -4.281 6.030 0.622) 7.421 7.977 ( -1.813 -5.427 -0.507) 5.744 8.508 ( -11.543 -8.179 -6.605) 15.613 9.081 ( -4.129 7.923 -6.193) 10.871 9.466 ( 2.204 3.885 -4.732) 6.508 9.820 ( -0.812 -0.089 -1.246) 1.490 9.955 ( 12.633 3.438 12.640) 18.199 10.801 ( 13.148 -7.198 7.609) 16.810 12.682 ( -28.492 4.700 -2.631) 28.996 15.019 ( -0.492 1.250 2.133) 2.521 15.219 ( 17.966 -2.797 -1.461) 18.241 15.845 ( 8.057 -4.101 2.399) 9.354 16.012 ( 7.819 -1.502 -7.969) 11.265 16.722 ( -3.269 4.213 4.581) 7.030 17.237 ( 23.998 -5.250 3.642) 24.834 18.038 ( -5.622 0.417 1.562) 5.850 18.467 ( -2.975 0.776 5.695) 6.472 19.004 ( 2.438 0.313 -6.896) 7.321 19.022 ( -8.068 -0.416 -3.894) 8.968 19.777 ( -9.545 2.536 4.057) 10.677 19.967 ( 4.248 -1.518 -4.023) 6.044 ======================= Grid point 514 (248/336) ======================= q-point: ( 0.27 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( 21.997 14.014 0.685) 26.091 2.647 ( 0.070 2.886 4.312) 5.189 3.534 ( -7.769 -3.421 -8.288) 11.863 4.243 ( 31.270 -18.605 4.277) 36.637 5.581 ( -6.734 -5.784 -6.192) 10.824 5.990 ( 7.348 -0.811 -2.594) 7.834 6.835 ( -11.364 -0.118 1.222) 11.431 7.046 ( -11.073 -5.800 -3.073) 12.872 7.489 ( -1.432 9.869 -5.690) 11.482 7.732 ( -0.793 8.507 1.704) 8.712 7.947 ( -2.667 2.118 -0.354) 3.424 8.426 ( -7.714 -13.811 -3.995) 16.316 8.869 ( -4.794 12.957 -4.564) 14.550 9.393 ( -1.455 7.398 -4.734) 8.903 9.808 ( -1.628 -4.292 -3.716) 5.906 10.147 ( 8.727 8.027 7.917) 14.257 11.121 ( 8.589 -10.279 8.352) 15.785 12.197 ( -19.281 3.726 0.025) 19.637 15.010 ( -2.301 -2.697 1.510) 3.853 15.515 ( 15.307 4.689 -0.453) 16.016 16.032 ( 6.542 -4.930 -2.811) 8.660 16.167 ( 9.234 -7.041 -2.480) 11.875 16.664 ( -2.176 2.631 7.235) 8.001 17.654 ( 14.744 -1.907 7.757) 16.769 17.916 ( -8.196 -0.188 3.223) 8.809 18.414 ( -4.484 2.223 5.276) 7.272 18.856 ( -8.414 -0.850 -4.939) 9.794 19.001 ( 3.168 2.920 -12.711) 13.421 19.655 ( -2.897 2.019 5.575) 6.599 20.045 ( 4.113 -3.253 -5.136) 7.340 ======================= Grid point 515 (249/336) ======================= q-point: ( 0.36 0.09 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( 16.416 22.810 0.768) 28.113 2.647 ( 3.349 3.683 0.673) 5.023 3.328 ( -13.743 -3.675 -5.790) 15.359 4.927 ( 20.912 -18.204 4.445) 28.079 5.595 ( 1.428 -9.764 -4.528) 10.857 6.078 ( 4.291 2.260 0.101) 4.851 6.584 ( -17.281 -4.178 -1.730) 17.863 6.964 ( -3.676 -6.968 -5.473) 9.593 7.387 ( 4.440 9.677 -5.455) 11.963 7.626 ( -3.670 10.507 4.160) 11.881 7.889 ( -0.373 0.926 -1.144) 1.518 8.428 ( -3.595 -10.222 -3.541) 11.400 8.645 ( -3.716 13.284 -2.224) 13.972 9.260 ( -2.529 6.520 -4.914) 8.547 9.794 ( -2.780 -4.674 -5.861) 7.995 10.185 ( 2.652 7.570 1.506) 8.162 11.362 ( 2.441 -10.881 7.451) 13.412 11.947 ( -7.479 2.197 5.694) 9.653 14.994 ( -4.425 -5.221 0.164) 6.846 15.655 ( 9.328 10.104 -0.872) 13.779 16.145 ( 4.078 -3.109 -5.338) 7.402 16.425 ( 8.329 -10.088 2.197) 13.265 16.670 ( 0.874 1.561 9.309) 9.479 17.668 ( -11.369 2.038 3.549) 12.084 17.965 ( 1.266 -2.041 18.547) 18.702 18.332 ( -0.473 2.171 -3.542) 4.181 18.706 ( -5.984 -0.907 -6.940) 9.208 18.957 ( 2.979 4.278 -11.985) 13.070 19.686 ( 4.898 1.682 3.618) 6.317 20.121 ( 2.900 -4.212 -5.911) 7.816 ======================= Grid point 516 (250/336) ======================= q-point: (-0.55 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( 6.647 24.443 0.301) 25.332 2.642 ( -3.076 4.729 -2.797) 6.296 3.189 ( -0.819 -3.521 2.652) 4.484 5.325 ( 6.744 -9.055 3.610) 11.854 5.548 ( -15.927 -0.245 0.907) 15.955 6.232 ( 8.611 -0.911 -1.827) 8.850 6.428 ( 4.856 -9.766 -5.728) 12.319 6.942 ( -5.884 -8.158 -2.324) 10.323 7.376 ( -3.308 13.213 2.415) 13.833 7.464 ( 3.124 3.908 -1.557) 5.240 7.915 ( 4.546 0.166 -4.906) 6.690 8.452 ( -0.625 -2.873 -2.575) 3.909 8.496 ( -0.170 5.779 0.098) 5.782 9.160 ( -0.925 3.189 -3.003) 4.476 9.750 ( -2.551 -2.991 -5.705) 6.928 10.153 ( -0.450 1.070 -3.360) 3.555 11.475 ( -4.308 -10.132 5.369) 12.249 11.898 ( 0.024 3.688 9.411) 10.107 14.949 ( -7.340 -7.742 -1.111) 10.726 15.681 ( 6.802 11.779 -0.908) 13.633 16.173 ( -0.060 1.460 -2.354) 2.771 16.622 ( 2.122 -7.439 2.353) 8.086 16.707 ( -1.593 1.585 5.517) 5.957 17.475 ( -9.559 -0.340 8.439) 12.755 17.949 ( -10.084 1.262 18.091) 20.750 18.409 ( 9.213 -2.483 -4.703) 10.638 18.611 ( -1.474 -1.166 -8.337) 8.546 18.932 ( 4.086 4.047 -8.392) 10.173 19.790 ( 7.653 2.729 -0.475) 8.139 20.163 ( 0.410 -3.483 -6.554) 7.433 ======================= Grid point 517 (251/336) ======================= q-point: (-0.45 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( -2.578 22.104 -2.736) 22.422 2.490 ( -5.868 2.711 4.565) 7.913 3.357 ( 11.628 -0.577 6.697) 13.431 5.008 ( -30.251 9.549 0.543) 31.727 5.562 ( 6.518 -1.082 4.564) 8.030 6.209 ( 0.663 4.511 -6.222) 7.714 6.874 ( 2.773 -19.871 2.407) 20.207 6.930 ( 9.029 -7.951 -3.941) 12.660 7.108 ( -3.846 14.912 4.651) 16.087 7.578 ( 6.499 -3.091 -4.284) 8.375 7.976 ( 7.567 4.217 -6.201) 10.654 8.439 ( 0.440 -1.878 -2.067) 2.827 8.526 ( 2.847 0.352 1.701) 3.335 9.146 ( 1.453 -0.388 0.471) 1.576 9.735 ( 0.053 -2.669 -1.990) 3.330 10.116 ( -3.697 -5.767 -8.095) 10.605 11.459 ( -8.813 -6.822 3.241) 11.607 11.939 ( 4.058 3.975 10.363) 11.818 14.875 ( -9.583 -9.658 -1.691) 13.710 15.676 ( 5.569 11.635 -0.067) 12.899 16.093 ( -3.843 7.575 0.983) 8.551 16.540 ( -14.504 -0.620 -1.343) 14.580 16.680 ( -2.271 -0.087 1.755) 2.871 17.445 ( -2.360 -1.107 12.903) 13.164 17.864 ( -5.583 -1.211 11.658) 12.982 18.583 ( 7.026 -4.105 -0.177) 8.140 18.605 ( 2.914 -2.038 -7.596) 8.387 18.954 ( 6.388 3.268 -6.413) 9.624 19.887 ( 7.547 3.585 -3.833) 9.192 20.138 ( -2.399 -1.926 -7.470) 8.079 ======================= Grid point 518 (252/336) ======================= q-point: (-0.36 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( -6.591 19.569 1.107) 20.678 2.454 ( -0.492 1.185 9.667) 9.752 3.599 ( 11.884 2.750 6.480) 13.813 4.302 ( -33.606 17.637 0.810) 37.962 5.681 ( 6.398 3.489 3.427) 8.053 6.128 ( -0.555 8.247 -5.997) 10.212 6.812 ( -7.011 4.875 3.759) 9.330 6.948 ( -4.317 -14.741 3.192) 15.688 7.504 ( 19.730 -12.551 -4.377) 23.790 7.706 ( 8.892 -4.095 -0.585) 9.807 8.069 ( 11.969 6.273 -5.097) 14.443 8.475 ( -0.333 -5.771 -0.976) 5.862 8.559 ( 0.527 2.785 2.404) 3.717 9.206 ( 2.076 -2.316 2.768) 4.164 9.777 ( 1.325 -2.725 1.362) 3.322 10.046 ( -7.814 -10.201 -12.189) 17.711 11.316 ( -11.955 -0.096 0.170) 11.957 12.107 ( 11.448 -2.315 11.920) 16.689 14.778 ( -11.161 -9.916 -1.645) 15.020 15.651 ( 4.354 12.598 0.508) 13.339 15.899 ( -8.873 8.862 1.427) 12.621 16.259 ( -13.553 3.286 -0.492) 13.955 16.598 ( -7.536 -1.237 0.143) 7.638 17.435 ( -3.642 4.490 8.769) 10.503 17.889 ( 0.120 -3.622 7.802) 8.603 18.630 ( 0.352 -1.550 -3.250) 3.617 18.762 ( 8.505 -4.078 -0.102) 9.432 19.043 ( 8.506 1.080 -4.769) 9.812 19.949 ( 5.120 4.342 -3.486) 7.564 20.061 ( -3.095 -2.073 -9.826) 10.509 ======================= Grid point 519 (253/336) ======================= q-point: (-0.27 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( -3.462 18.872 7.007) 20.426 2.508 ( 0.939 1.148 12.704) 12.790 3.455 ( -29.662 27.199 -0.780) 40.252 3.802 ( 4.563 3.927 3.850) 7.146 5.753 ( 3.300 3.450 1.245) 4.934 6.001 ( 1.528 11.428 -1.466) 11.622 6.763 ( -0.293 -4.822 3.281) 5.839 7.050 ( -3.189 -15.650 1.935) 16.089 7.727 ( 5.959 -4.958 -2.556) 8.163 8.065 ( 13.198 -7.472 1.948) 15.291 8.261 ( 21.406 6.740 -5.088) 23.011 8.490 ( -4.319 6.023 3.200) 8.073 8.536 ( -2.014 -10.746 2.326) 11.178 9.254 ( -0.675 -0.261 3.772) 3.841 9.819 ( -3.488 -7.235 -1.638) 8.197 9.937 ( -5.791 -7.039 -11.852) 14.952 11.042 ( -14.276 6.505 -2.954) 15.964 12.525 ( 20.499 -13.003 12.992) 27.534 14.650 ( -11.695 -7.312 -1.641) 13.890 15.562 ( -0.513 14.485 -1.742) 14.599 15.701 ( -5.926 2.019 2.843) 6.876 16.007 ( -7.446 10.187 0.930) 12.653 16.437 ( -13.474 -2.937 0.139) 13.791 17.318 ( -3.206 10.694 2.124) 11.364 17.976 ( 1.579 -3.513 6.185) 7.287 18.614 ( -1.393 -0.533 -2.761) 3.138 18.945 ( 7.617 -1.564 1.285) 7.881 19.167 ( 7.235 -0.276 -3.532) 8.056 19.928 ( -1.371 3.933 0.460) 4.191 20.031 ( 1.588 -4.542 -11.603) 12.561 ======================= Grid point 520 (254/336) ======================= q-point: (-0.18 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 4.445 19.289 10.689) 22.496 2.398 ( -17.048 30.913 9.743) 36.622 2.787 ( -12.285 2.650 3.329) 13.001 3.826 ( 3.060 8.750 -1.256) 9.355 5.714 ( -0.689 4.455 -3.822) 5.910 6.031 ( 7.933 5.117 6.924) 11.707 6.892 ( 4.160 -10.076 2.420) 11.167 7.134 ( -4.094 -14.388 0.748) 14.978 7.889 ( 8.092 -1.880 0.899) 8.356 8.203 ( 1.517 1.625 -2.708) 3.503 8.318 ( -7.650 7.547 5.000) 11.853 8.608 ( 19.382 0.738 -3.325) 19.679 8.690 ( 2.488 -14.956 7.100) 16.742 9.212 ( -2.750 4.950 4.809) 7.429 9.738 ( -11.456 -16.312 -14.358) 24.566 9.931 ( 3.831 2.000 -2.278) 4.885 10.677 ( -14.435 11.088 -4.431) 18.733 13.147 ( 21.411 -22.826 9.541) 32.718 14.508 ( -7.412 -2.382 -2.125) 8.071 15.406 ( -3.862 4.690 -1.615) 6.287 15.641 ( 1.044 6.890 1.631) 7.157 15.817 ( -1.448 13.025 1.519) 13.193 16.169 ( -17.640 -0.524 0.926) 17.672 17.166 ( -0.881 12.777 -0.976) 12.845 18.057 ( 1.275 -2.482 4.947) 5.680 18.578 ( -1.682 -0.411 -1.933) 2.595 19.048 ( 3.555 1.861 0.717) 4.076 19.258 ( 4.253 -0.161 -3.014) 5.215 19.879 ( -0.416 2.742 0.117) 2.776 20.065 ( -0.146 -7.494 -5.842) 9.503 ======================= Grid point 521 (255/336) ======================= q-point: (-0.09 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( 18.328 35.355 10.031) 41.067 1.694 ( -17.244 22.813 3.991) 28.874 2.777 ( -3.882 -5.572 11.636) 13.473 3.753 ( 1.406 9.763 -4.778) 10.960 5.668 ( 2.102 3.062 -4.770) 6.045 6.166 ( 4.934 0.736 6.615) 8.285 7.081 ( 4.108 -9.024 0.266) 9.919 7.213 ( -1.834 -14.911 1.215) 15.072 7.929 ( -5.554 9.649 5.405) 12.375 8.099 ( -3.858 2.992 1.276) 5.046 8.249 ( -0.130 -1.987 -2.098) 2.893 8.846 ( 4.131 -3.754 -0.997) 5.670 8.915 ( 10.157 -4.692 5.756) 12.583 9.183 ( 1.988 1.581 5.634) 6.180 9.648 ( -7.421 -13.588 -13.879) 20.793 9.955 ( 1.793 2.083 -5.131) 5.821 10.332 ( -6.901 13.320 -0.807) 15.024 13.670 ( 3.430 -25.253 2.092) 25.570 14.462 ( 3.726 0.446 -3.273) 4.980 15.338 ( -0.710 1.763 -0.811) 2.066 15.542 ( -2.253 13.636 1.313) 13.883 15.751 ( 3.495 4.554 0.386) 5.753 15.955 ( -0.940 3.095 2.794) 4.275 17.036 ( -0.837 10.447 -0.738) 10.506 18.111 ( 0.360 -1.427 3.666) 3.950 18.548 ( -1.682 -0.592 -0.579) 1.874 19.056 ( 0.009 2.538 0.496) 2.586 19.291 ( 0.824 0.118 -2.879) 2.997 19.859 ( 1.057 2.304 -0.892) 2.688 20.100 ( -3.247 -7.744 -0.469) 8.410 ======================= Grid point 524 (256/336) ======================= q-point: ( 0.18 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( 26.771 0.000 3.325) 26.977 2.661 ( 1.389 0.000 4.913) 5.105 3.516 ( -8.463 -0.000 -9.502) 12.724 4.029 ( 32.302 0.000 4.844) 32.663 5.518 ( -8.545 -0.000 -7.064) 11.087 5.980 ( 9.105 0.000 -3.524) 9.763 6.877 ( -21.804 -0.000 4.137) 22.192 6.945 ( -2.436 -0.000 -6.154) 6.618 7.580 ( -3.394 -0.000 -5.760) 6.686 7.847 ( -3.155 -0.000 -1.696) 3.582 7.999 ( 6.873 0.000 0.043) 6.874 8.232 ( -12.420 -0.000 0.504) 12.430 9.003 ( -5.292 -0.000 -6.059) 8.045 9.498 ( -0.105 -0.000 -2.469) 2.471 9.736 ( -3.723 -0.000 -5.918) 6.992 10.240 ( 8.101 0.000 10.064) 12.919 11.000 ( 9.040 0.000 7.129) 11.513 12.236 ( -21.150 -0.000 -0.338) 21.152 14.974 ( -3.745 -0.000 2.460) 4.481 15.589 ( 21.042 0.000 -0.469) 21.047 15.961 ( 6.085 0.000 3.032) 6.799 16.101 ( 7.381 0.000 -8.876) 11.544 16.690 ( -3.525 -0.000 7.149) 7.971 17.638 ( 17.950 0.000 9.436) 20.279 17.914 ( -9.612 -0.000 2.155) 9.850 18.436 ( -4.230 -0.000 5.781) 7.163 18.847 ( -8.481 -0.000 -4.815) 9.753 19.030 ( 4.287 0.000 -13.146) 13.828 19.677 ( -3.948 -0.000 5.511) 6.780 20.010 ( 3.792 0.000 -5.639) 6.795 ======================= Grid point 525 (257/336) ======================= q-point: ( 0.27 0.18 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.722 ( 6.192 3.601 3.978) 8.194 2.802 ( 21.809 13.527 2.185) 25.757 3.271 ( -14.112 -1.454 -6.996) 15.818 4.620 ( 25.154 -10.977 4.036) 27.740 5.416 ( -3.089 -6.218 -5.116) 8.624 6.124 ( 7.908 1.757 -1.966) 8.336 6.500 ( -21.181 -2.887 -0.134) 21.377 6.881 ( -2.456 -2.116 -8.029) 8.659 7.532 ( 3.291 4.265 -4.996) 7.348 7.770 ( -2.799 3.231 -1.814) 4.644 7.965 ( -5.015 7.981 3.761) 10.148 8.209 ( 1.189 -11.563 -0.408) 11.631 8.855 ( -4.927 6.379 -3.443) 8.765 9.413 ( -3.041 8.287 -2.903) 9.292 9.672 ( -4.411 -7.088 -5.925) 10.237 10.298 ( -1.359 3.561 -1.178) 3.990 11.175 ( 3.177 -6.329 6.480) 9.598 11.985 ( -7.726 1.190 7.067) 10.538 14.913 ( -5.609 -2.416 1.152) 6.215 15.871 ( 14.286 10.517 0.674) 17.752 16.090 ( 5.432 -3.262 -0.679) 6.372 16.232 ( 7.961 -7.884 -4.117) 11.937 16.688 ( -0.662 0.384 9.478) 9.509 17.708 ( -13.277 1.528 4.105) 13.981 17.930 ( 5.526 -1.266 17.941) 18.815 18.366 ( -3.240 1.087 -1.301) 3.657 18.692 ( -6.000 -0.431 -6.338) 8.739 19.020 ( 3.156 1.879 -14.255) 14.721 19.714 ( 5.458 0.982 4.468) 7.122 20.050 ( 2.604 -2.387 -6.840) 7.698 ======================= Grid point 526 (258/336) ======================= q-point: (-0.64 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.744 ( -0.335 8.995 2.478) 9.336 2.889 ( 2.039 18.355 -4.133) 18.925 3.140 ( 7.394 2.713 4.860) 9.254 5.125 ( 15.557 -10.749 5.011) 19.562 5.425 ( -8.610 -11.182 -0.976) 14.147 6.147 ( -0.967 -4.322 -1.435) 4.656 6.300 ( -2.984 -3.699 -5.356) 7.161 6.842 ( -0.353 -2.431 -6.827) 7.255 7.546 ( 5.367 7.763 -5.125) 10.739 7.636 ( -5.792 7.755 2.899) 10.104 7.897 ( 1.631 -1.209 -1.345) 2.436 8.347 ( 4.122 -6.100 0.226) 7.365 8.689 ( -3.228 10.453 -0.229) 10.943 9.254 ( -3.522 6.907 -3.497) 8.505 9.641 ( -4.838 -8.303 -4.664) 10.681 10.173 ( -5.778 0.956 -8.931) 10.680 11.276 ( -3.134 -8.772 5.254) 10.694 11.967 ( 1.245 2.717 11.726) 12.101 14.826 ( -8.141 -4.564 -0.074) 9.334 15.931 ( 6.904 13.106 0.315) 14.817 16.191 ( 4.891 0.413 -1.921) 5.271 16.450 ( 4.782 -9.714 0.044) 10.828 16.724 ( -0.860 0.153 7.781) 7.830 17.480 ( -12.247 0.515 8.623) 14.988 17.973 ( -10.282 1.032 20.924) 23.336 18.375 ( 7.145 -0.998 -6.413) 9.653 18.593 ( -1.867 -0.699 -7.898) 8.146 19.002 ( 3.944 2.880 -10.111) 11.229 19.844 ( 8.790 2.624 -0.148) 9.175 20.082 ( 0.677 -4.202 -6.847) 8.062 ======================= Grid point 527 (259/336) ======================= q-point: (-0.55 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.559 ( -10.211 7.977 2.880) 13.274 2.705 ( 3.728 24.888 0.185) 25.167 3.362 ( 14.031 2.496 7.639) 16.170 5.110 ( -24.127 1.733 2.736) 24.344 5.496 ( 10.553 -5.409 5.055) 12.891 6.269 ( 0.581 -0.068 -6.951) 6.975 6.389 ( 6.706 -24.839 -1.401) 25.766 6.851 ( 3.434 -1.205 -5.285) 6.417 7.380 ( -7.949 11.377 3.313) 14.269 7.606 ( 5.980 5.932 -2.695) 8.844 8.004 ( 9.571 -1.986 -7.566) 12.360 8.449 ( 2.415 -0.474 -1.280) 2.774 8.568 ( 0.262 7.263 3.493) 8.063 9.163 ( -0.635 1.776 0.272) 1.906 9.622 ( -4.933 -9.384 -2.591) 10.914 10.031 ( -5.450 -2.621 -11.779) 13.241 11.286 ( -7.549 -9.165 4.082) 12.556 12.032 ( 3.580 4.490 10.923) 12.341 14.718 ( -9.395 -6.319 -0.506) 11.333 15.905 ( 3.456 11.164 0.811) 11.715 16.231 ( 3.051 5.999 0.607) 6.758 16.472 ( -11.480 -3.438 -1.376) 12.062 16.704 ( -2.146 0.368 2.499) 3.314 17.417 ( -1.761 -1.777 14.520) 14.734 17.852 ( -9.132 0.025 14.310) 16.976 18.513 ( 6.879 -2.971 -2.010) 7.758 18.572 ( 2.584 -1.316 -8.118) 8.621 19.016 ( 5.184 3.007 -6.670) 8.967 19.954 ( 7.939 2.970 -6.434) 10.641 20.083 ( -1.816 -3.272 -4.872) 6.143 ======================= Grid point 528 (260/336) ======================= q-point: (-0.45 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.298 ( -5.668 20.121 5.250) 21.553 2.572 ( 1.476 13.466 5.374) 14.574 3.620 ( 11.169 -0.596 8.225) 13.884 4.600 ( -24.738 13.392 2.894) 28.279 5.718 ( 8.643 0.330 3.471) 9.320 6.252 ( 2.430 3.888 -5.697) 7.313 6.615 ( -4.856 -19.793 0.748) 20.394 6.907 ( -5.734 0.716 1.918) 6.089 7.301 ( 12.297 -2.526 -4.110) 13.209 7.665 ( 5.780 0.242 -1.204) 5.909 8.170 ( 12.772 1.782 -8.641) 15.523 8.428 ( 0.038 2.425 -3.121) 3.953 8.592 ( 1.547 0.825 4.570) 4.895 9.195 ( 3.176 0.533 6.126) 6.920 9.611 ( -8.522 -14.118 -3.101) 16.780 9.932 ( -1.883 -1.849 -10.266) 10.600 11.226 ( -10.028 -7.646 2.161) 12.794 12.117 ( 5.721 2.489 8.970) 10.926 14.616 ( -8.950 -6.836 -0.211) 11.264 15.850 ( -0.975 6.789 2.179) 7.197 16.107 ( -9.803 11.767 -2.115) 15.460 16.272 ( -5.507 1.349 1.936) 5.991 16.636 ( -5.228 2.943 0.146) 6.001 17.491 ( 0.187 1.113 13.042) 13.090 17.820 ( -2.336 -3.151 10.224) 10.950 18.598 ( 1.450 -1.775 -3.293) 4.012 18.676 ( 8.583 -4.359 -3.031) 10.093 19.073 ( 6.628 1.861 -4.295) 8.115 19.989 ( 0.148 -2.424 -13.736) 13.949 20.053 ( 1.317 3.421 -0.557) 3.707 ======================= Grid point 529 (261/336) ======================= q-point: (-0.36 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.031 ( -3.376 23.359 7.402) 24.735 2.552 ( 1.993 5.146 9.741) 11.195 3.817 ( 2.797 -2.623 5.927) 7.059 4.023 ( -15.751 29.670 2.237) 33.667 5.825 ( 4.593 3.778 1.112) 6.050 6.206 ( 1.375 8.614 -2.565) 9.092 6.729 ( -2.917 -16.077 -0.083) 16.340 6.736 ( -6.289 1.083 3.699) 7.376 7.593 ( 9.314 -8.941 -4.014) 13.521 7.868 ( 12.720 -10.301 1.162) 16.409 8.353 ( 9.170 -2.082 -3.567) 10.057 8.401 ( 2.647 1.394 -4.710) 5.580 8.587 ( -2.270 3.833 3.383) 5.593 9.291 ( 5.258 3.557 8.499) 10.608 9.531 ( -14.424 -18.135 -9.675) 25.111 9.920 ( 3.320 0.870 -4.012) 5.280 11.083 ( -12.010 -2.130 -0.777) 12.222 12.318 ( 10.533 -7.694 8.495) 15.566 14.530 ( -7.008 -5.062 0.081) 8.645 15.687 ( -16.758 -2.176 -0.650) 16.911 15.867 ( 1.951 15.064 1.229) 15.240 16.188 ( -0.311 9.542 2.592) 9.892 16.467 ( -9.290 4.813 -0.274) 10.467 17.489 ( -0.870 6.938 6.991) 9.888 17.897 ( 1.269 -4.445 7.742) 9.017 18.599 ( -0.967 -1.030 -3.411) 3.692 18.887 ( 9.808 -4.514 1.036) 10.847 19.166 ( 6.409 0.347 -3.045) 7.104 19.908 ( -5.521 -4.624 -9.036) 11.554 20.046 ( 2.879 4.785 -5.430) 7.789 ======================= Grid point 530 (262/336) ======================= q-point: (-0.27 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -0.044 18.345 9.347) 20.589 2.606 ( 1.909 2.382 10.930) 11.348 3.345 ( -15.495 41.014 -0.070) 43.844 3.954 ( 4.349 4.310 2.504) 6.615 5.820 ( 0.940 6.326 -2.386) 6.826 6.152 ( 2.178 7.014 3.962) 8.345 6.711 ( -0.160 -7.651 2.976) 8.211 6.856 ( -1.239 -14.255 -1.743) 14.414 7.807 ( 9.859 -5.583 -0.828) 11.361 8.186 ( 5.771 -5.483 -0.119) 7.961 8.369 ( -2.641 -14.634 2.146) 15.024 8.458 ( -8.009 5.336 8.583) 12.895 8.613 ( 14.811 -0.048 -8.464) 17.059 9.313 ( -7.526 -1.951 -0.815) 7.818 9.448 ( -0.454 -7.020 -4.812) 8.523 9.969 ( 4.648 1.817 -2.639) 5.645 10.836 ( -12.643 5.003 -2.813) 13.885 12.707 ( 11.614 -21.284 7.720) 25.446 14.472 ( -2.441 -1.307 -0.626) 2.839 15.425 ( -12.489 -2.678 -1.346) 12.844 15.813 ( 3.656 11.236 3.515) 12.328 16.102 ( 3.167 14.946 0.167) 15.279 16.218 ( -12.437 5.677 1.060) 13.712 17.406 ( -0.364 11.451 1.725) 11.586 17.996 ( 1.593 -3.693 5.998) 7.222 18.565 ( -2.023 -1.009 -2.781) 3.584 19.075 ( 6.752 0.144 2.140) 7.084 19.251 ( 4.292 -0.481 -2.832) 5.164 19.838 ( -4.915 -7.983 -4.350) 10.335 20.009 ( 0.473 3.328 -5.827) 6.727 ======================= Grid point 531 (263/336) ======================= q-point: (-0.18 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( 6.792 11.628 8.140) 15.735 2.573 ( -4.398 29.766 8.642) 31.306 2.767 ( -1.252 23.687 1.805) 23.788 3.943 ( 1.247 8.398 -1.256) 8.582 5.757 ( 1.632 6.167 -4.100) 7.583 6.186 ( 2.099 1.315 6.514) 6.969 6.863 ( 3.894 -12.580 0.755) 13.190 6.945 ( -1.916 -12.278 -0.735) 12.449 8.038 ( 9.922 -2.378 0.592) 10.220 8.083 ( -12.361 -0.193 -0.641) 12.380 8.289 ( -8.028 4.661 4.617) 10.368 8.671 ( 9.778 -16.333 9.758) 21.392 8.788 ( 4.951 -4.420 -4.531) 8.036 9.173 ( -8.351 -8.441 -10.623) 15.933 9.516 ( 5.236 3.937 0.126) 6.552 10.003 ( 2.953 2.782 -5.929) 7.184 10.562 ( -6.785 9.947 -0.228) 12.043 13.122 ( 1.607 -29.243 4.877) 29.690 14.477 ( 4.055 1.117 -3.078) 5.212 15.326 ( -0.755 -3.295 -0.367) 3.400 15.781 ( -0.787 10.233 3.961) 11.001 15.912 ( -5.185 11.371 -0.630) 12.514 16.086 ( 6.268 11.097 0.762) 12.768 17.282 ( -0.047 13.803 -0.611) 13.816 18.071 ( 0.693 -2.575 4.235) 5.005 18.529 ( -2.192 -1.379 -1.089) 2.809 19.125 ( 1.201 4.352 0.318) 4.526 19.292 ( 1.166 -0.092 -2.912) 3.138 19.854 ( -2.710 -9.745 0.677) 10.137 19.959 ( -1.166 0.442 -3.925) 4.119 ======================= Grid point 532 (264/336) ======================= q-point: (-0.09 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( -3.225 19.622 -0.579) 19.894 2.358 ( 28.174 36.612 9.582) 47.181 2.718 ( -2.800 0.214 7.341) 7.860 3.852 ( 0.673 10.215 -3.275) 10.749 5.738 ( 4.072 4.127 -4.948) 7.622 6.198 ( -3.751 0.198 1.812) 4.170 6.991 ( -1.665 -9.469 -1.495) 9.730 7.113 ( 5.257 -16.286 1.696) 17.197 7.822 ( -14.449 4.211 5.570) 16.048 8.118 ( -6.363 3.048 1.437) 7.201 8.163 ( -1.106 -0.105 -0.968) 1.473 8.884 ( 3.876 -7.969 -3.888) 9.677 9.057 ( 2.781 -0.991 -0.694) 3.033 9.084 ( 3.095 -16.921 2.213) 17.344 9.505 ( -1.396 3.038 -5.630) 6.548 9.960 ( 0.137 3.474 -6.049) 6.977 10.481 ( 7.867 11.420 5.485) 14.913 13.292 ( -15.078 -25.740 1.929) 29.893 14.572 ( 9.389 -0.647 -5.228) 10.766 15.387 ( 1.776 6.702 -1.210) 7.038 15.604 ( 0.034 6.717 4.774) 8.241 15.878 ( 5.554 5.410 -1.797) 7.959 16.195 ( 15.451 5.085 0.625) 16.278 17.142 ( 0.319 14.409 -0.386) 14.418 18.107 ( -0.846 -1.704 2.684) 3.289 18.504 ( -2.246 -1.456 1.124) 2.903 19.072 ( -1.609 3.702 -0.837) 4.122 19.265 ( -2.442 0.415 -3.167) 4.020 19.896 ( -0.861 -3.804 0.924) 4.009 19.932 ( -3.265 -4.634 -0.301) 5.676 ======================= Grid point 536 (265/336) ======================= q-point: ( 0.27 0.27 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.875 ( 7.184 0.000 6.052) 9.394 2.932 ( -15.014 -0.000 -3.319) 15.377 3.313 ( 19.105 0.000 2.634) 19.286 4.984 ( 20.006 0.000 3.973) 20.397 5.286 ( -6.910 -0.000 -1.247) 7.021 6.117 ( -16.302 -0.000 -3.547) 16.683 6.259 ( 5.693 0.000 -2.947) 6.411 6.823 ( 1.548 0.000 -8.198) 8.343 7.655 ( 10.360 0.000 -5.758) 11.852 7.686 ( -7.383 -0.000 -1.037) 7.456 7.893 ( -5.255 -0.000 3.009) 6.056 8.273 ( 7.804 0.000 1.355) 7.921 8.802 ( -3.006 -0.000 -0.331) 3.024 9.400 ( -4.334 -0.000 0.308) 4.345 9.480 ( -7.661 -0.000 -7.757) 10.902 10.184 ( -7.701 -0.000 -11.103) 13.512 11.185 ( -1.791 -0.000 5.219) 5.517 11.994 ( 1.454 0.000 12.486) 12.571 14.782 ( -8.107 -0.000 0.322) 8.113 16.119 ( 0.637 0.000 2.723) 2.796 16.185 ( 9.803 0.000 -0.418) 9.812 16.307 ( 9.369 0.000 -3.699) 10.073 16.723 ( -1.143 -0.000 8.024) 8.105 17.486 ( -13.647 -0.000 9.021) 16.359 17.984 ( -9.848 -0.000 21.943) 24.052 18.367 ( 6.063 0.000 -7.176) 9.394 18.586 ( -1.926 -0.000 -7.749) 7.985 19.032 ( 3.819 0.000 -10.686) 11.348 19.875 ( 9.284 0.000 1.337) 9.379 20.033 ( 0.722 0.000 -8.334) 8.365 ======================= Grid point 537 (266/336) ======================= q-point: (-0.64 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.673 ( -10.890 3.755 6.281) 13.121 3.017 ( 6.085 5.326 5.311) 9.674 3.518 ( 9.425 10.591 1.748) 14.285 5.116 ( -14.070 -0.015 5.094) 14.964 5.364 ( 15.612 -6.859 5.002) 17.771 5.972 ( -1.460 -11.533 -7.308) 13.731 6.302 ( 1.913 0.209 -5.137) 5.486 6.849 ( 4.161 0.285 -5.761) 7.113 7.522 ( -7.655 3.652 0.493) 8.496 7.767 ( 4.630 9.015 -2.022) 10.335 7.919 ( 8.381 -6.348 -5.416) 11.826 8.415 ( 5.947 -1.602 0.872) 6.221 8.752 ( -0.055 7.864 3.856) 8.759 9.222 ( -5.919 5.218 -2.371) 8.239 9.401 ( -9.073 -11.946 -2.719) 15.245 10.007 ( -4.755 -0.334 -12.939) 13.790 11.153 ( -6.136 -3.873 3.839) 8.209 12.093 ( 3.347 1.633 11.421) 12.013 14.637 ( -8.997 -2.121 0.084) 9.244 16.067 ( -4.099 4.672 2.076) 6.553 16.298 ( 4.907 1.071 -0.098) 5.024 16.455 ( 3.479 1.199 -1.424) 3.945 16.683 ( -5.387 -1.702 1.968) 5.982 17.387 ( -3.522 -0.993 16.832) 17.225 17.858 ( -11.089 0.324 15.367) 18.953 18.474 ( 6.571 -1.041 -3.118) 7.347 18.555 ( 2.409 -0.463 -8.574) 8.918 19.060 ( 4.533 1.327 -6.780) 8.263 19.987 ( 1.269 0.304 -9.106) 9.199 20.038 ( 5.627 -0.846 -2.110) 6.069 ======================= Grid point 538 (267/336) ======================= q-point: (-0.55 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( -4.329 7.304 14.757) 17.025 2.958 ( -0.713 20.721 1.467) 20.785 3.575 ( 1.314 -3.976 5.524) 6.932 4.848 ( -10.295 13.094 5.691) 17.602 5.693 ( 12.800 -3.072 4.448) 13.895 6.140 ( 1.047 -20.602 -3.970) 21.007 6.320 ( 3.145 -2.102 -5.629) 6.782 6.888 ( 1.898 -0.290 -3.504) 3.996 7.378 ( -1.768 5.673 -1.200) 6.062 7.722 ( 0.942 5.110 -1.245) 5.343 8.135 ( 11.136 -3.701 -7.470) 13.910 8.517 ( 6.174 2.575 -4.299) 7.952 8.646 ( -3.320 7.874 3.552) 9.254 9.191 ( 1.754 -3.836 5.652) 7.052 9.315 ( -12.395 -12.761 -2.886) 18.022 9.923 ( 0.910 0.208 -9.116) 9.164 11.082 ( -8.565 -6.108 2.358) 10.781 12.168 ( 2.432 2.205 7.513) 8.199 14.517 ( -7.323 -3.435 0.527) 8.106 15.900 ( -13.280 -0.257 0.836) 13.309 16.299 ( -4.654 7.152 1.378) 8.644 16.384 ( 3.892 9.484 -0.688) 10.275 16.654 ( -2.985 -1.796 0.085) 3.485 17.483 ( 1.817 -1.372 17.551) 17.698 17.778 ( -4.811 -1.259 12.305) 13.272 18.563 ( 2.482 -1.746 -2.533) 3.953 18.611 ( 7.286 -2.145 -7.216) 10.477 19.108 ( 5.256 1.590 -3.823) 6.691 19.930 ( -3.329 -2.755 -10.530) 11.382 20.119 ( 5.201 2.709 -3.857) 7.019 ======================= Grid point 539 (268/336) ======================= q-point: (-0.45 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( -6.642 16.139 13.923) 22.326 2.737 ( -0.834 14.442 6.147) 15.718 3.695 ( 0.871 -9.976 6.298) 11.830 4.562 ( -3.789 25.881 3.516) 26.392 5.893 ( 7.897 3.085 1.878) 8.684 6.262 ( -1.370 -6.975 0.400) 7.119 6.432 ( 5.510 -9.411 -5.497) 12.213 6.818 ( -7.950 4.551 2.370) 9.462 7.432 ( 10.454 -5.135 -5.998) 13.100 7.738 ( 3.521 -3.442 -1.439) 5.130 8.281 ( 3.152 -3.196 -2.668) 5.222 8.470 ( -0.832 3.708 -3.922) 5.461 8.646 ( 3.675 2.484 -0.490) 4.463 9.164 ( -16.405 -19.384 -8.116) 26.660 9.365 ( 9.408 3.442 11.846) 15.514 9.939 ( 4.458 1.010 -4.526) 6.433 10.991 ( -9.254 -6.159 0.614) 11.133 12.230 ( 2.552 -2.110 4.395) 5.503 14.453 ( -3.639 -2.996 1.002) 4.819 15.620 ( -18.938 -3.797 -1.334) 19.360 16.145 ( -0.767 13.253 3.162) 13.646 16.376 ( 3.247 9.019 1.815) 9.756 16.563 ( -5.500 4.147 -0.973) 6.956 17.579 ( 0.965 2.335 12.933) 13.178 17.820 ( 0.733 -3.178 9.989) 10.508 18.576 ( -0.692 -1.276 -3.852) 4.116 18.784 ( 9.972 -5.465 -2.367) 11.615 19.180 ( 5.464 0.974 -2.176) 5.962 19.828 ( -6.042 -3.400 -10.246) 12.371 20.135 ( 2.627 3.972 -5.558) 7.319 ======================= Grid point 540 (269/336) ======================= q-point: (-0.36 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( -8.155 15.235 8.155) 19.108 2.722 ( 4.302 9.952 11.517) 15.818 3.830 ( 4.089 -0.907 4.513) 6.157 4.220 ( -4.105 31.651 0.990) 31.932 5.951 ( 4.048 7.040 -0.008) 8.121 6.260 ( -2.007 2.220 3.200) 4.381 6.591 ( 2.256 -8.174 -5.809) 10.279 6.654 ( -3.692 -1.160 2.883) 4.826 7.690 ( 11.903 -6.791 -2.997) 14.028 7.927 ( 7.377 -16.129 -0.752) 17.752 8.239 ( -7.895 -1.976 -1.779) 8.331 8.471 ( -3.266 -3.471 5.544) 7.311 8.659 ( 5.335 3.961 -5.733) 8.776 9.026 ( -14.803 -17.842 -9.285) 24.973 9.550 ( 11.098 7.507 9.330) 16.327 10.004 ( 6.197 1.971 -3.654) 7.460 10.864 ( -9.387 -1.777 -1.104) 9.617 12.371 ( 3.254 -13.044 3.812) 13.974 14.454 ( 1.342 -0.655 0.346) 1.532 15.341 ( -14.957 -5.025 -1.562) 15.856 16.046 ( 0.821 12.108 5.552) 13.345 16.321 ( -3.584 7.485 2.790) 8.756 16.405 ( 0.639 12.736 -2.918) 13.081 17.589 ( 0.551 7.236 6.907) 10.018 17.925 ( 2.280 -3.341 7.824) 8.808 18.540 ( -2.495 -1.518 -3.788) 4.783 19.023 ( 9.692 -5.763 2.208) 11.490 19.250 ( 3.943 0.540 -2.143) 4.520 19.697 ( -7.844 -5.324 -9.246) 13.242 20.093 ( 0.295 4.410 -5.246) 6.860 ======================= Grid point 541 (270/336) ======================= q-point: (-0.27 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( 3.249 11.162 5.868) 13.023 2.737 ( 1.474 9.013 8.906) 12.757 3.667 ( 0.848 46.306 0.150) 46.314 4.033 ( 0.906 0.657 1.312) 1.724 5.906 ( 1.147 9.249 -2.596) 9.675 6.212 ( -2.567 1.329 7.200) 7.758 6.643 ( 1.058 -9.482 -0.051) 9.541 6.749 ( 3.074 -7.549 -3.852) 9.015 7.923 ( 4.678 -6.685 -3.183) 8.758 8.089 ( -4.932 -0.720 0.490) 5.008 8.209 ( -3.093 -18.672 2.291) 19.064 8.446 ( 1.367 -1.685 8.111) 8.397 8.726 ( 2.788 -1.326 -4.841) 5.741 8.913 ( -8.999 -15.846 -9.284) 20.452 9.679 ( 7.946 9.084 5.368) 13.209 10.067 ( 5.802 4.076 -7.549) 10.357 10.700 ( -5.784 4.175 0.323) 7.141 12.604 ( -0.471 -23.482 4.203) 23.860 14.504 ( 4.716 1.562 -2.658) 5.635 15.224 ( -2.703 -6.578 0.293) 7.117 15.974 ( -1.632 9.841 7.721) 12.614 16.128 ( -5.285 10.906 0.046) 12.119 16.350 ( 7.710 14.686 -2.978) 16.852 17.531 ( 0.815 11.401 2.340) 11.667 18.019 ( 1.371 -2.581 5.392) 6.133 18.494 ( -2.892 -2.194 -1.975) 4.133 19.204 ( 5.040 2.425 2.771) 6.242 19.281 ( 1.065 -0.927 -3.286) 3.576 19.602 ( -7.323 -12.509 -5.089) 15.362 20.028 ( -0.263 4.275 -3.302) 5.408 ======================= Grid point 542 (271/336) ======================= q-point: (-0.18 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( 6.523 13.545 0.389) 15.039 2.670 ( -3.079 7.046 6.881) 10.319 3.305 ( 13.529 45.785 1.496) 47.765 4.020 ( 0.167 6.375 -0.799) 6.427 5.839 ( 2.166 6.260 -3.786) 7.630 6.194 ( -4.023 -0.710 5.399) 6.770 6.798 ( 3.876 -13.639 -2.345) 14.371 6.851 ( 2.317 -6.377 -0.398) 6.796 7.810 ( -14.028 -4.709 -0.747) 14.816 8.130 ( -11.681 -3.437 3.803) 12.756 8.187 ( 4.450 1.734 1.784) 5.099 8.602 ( -5.737 -16.858 -3.118) 18.079 8.831 ( 12.403 -9.029 4.142) 15.891 8.957 ( 1.605 -9.271 -7.030) 11.745 9.668 ( -0.849 10.823 -1.183) 10.920 10.036 ( 1.311 4.754 -9.659) 10.845 10.661 ( 6.559 6.836 5.848) 11.133 12.782 ( -9.590 -25.643 3.562) 27.608 14.567 ( 6.151 0.088 -5.213) 8.063 15.382 ( 11.761 -5.372 0.674) 12.947 15.803 ( -7.408 11.921 5.902) 15.226 16.026 ( 3.847 9.884 0.821) 10.638 16.361 ( 9.600 11.230 -3.265) 15.130 17.429 ( 1.636 14.488 0.226) 14.582 18.067 ( -0.604 -2.156 3.009) 3.751 18.466 ( -2.649 -2.473 1.071) 3.779 19.161 ( -2.786 5.079 -2.703) 6.392 19.273 ( -1.677 0.490 -3.236) 3.677 19.642 ( -4.685 -15.750 2.547) 16.628 19.985 ( 1.385 3.787 -1.895) 4.455 ======================= Grid point 543 (272/336) ======================= q-point: (-0.09 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( -0.228 18.853 -4.550) 19.396 2.632 ( -2.430 -1.223 6.611) 7.149 3.353 ( 32.720 35.503 3.545) 48.411 3.925 ( -1.380 7.708 -2.651) 8.267 5.832 ( 4.091 3.356 -4.467) 6.925 6.084 ( -9.095 2.030 -0.780) 9.352 6.913 ( 1.433 -2.756 -1.231) 3.342 7.052 ( 5.773 -18.197 0.902) 19.112 7.596 ( -14.468 -1.790 4.167) 15.162 7.943 ( -12.166 -1.391 1.127) 12.297 8.145 ( -5.029 2.647 -1.466) 5.869 8.684 ( -2.976 -20.216 -4.688) 20.965 8.968 ( 0.114 1.788 -13.698) 13.815 9.259 ( 14.465 -12.690 14.714) 24.224 9.472 ( -5.430 6.835 -5.240) 10.181 9.990 ( 1.924 3.794 -6.292) 7.595 10.807 ( 12.735 8.325 8.315) 17.338 12.759 ( -18.816 -19.690 1.428) 27.272 14.708 ( 10.346 -4.125 -4.571) 12.039 15.504 ( -0.392 14.786 1.050) 14.829 15.758 ( 11.381 -0.602 2.888) 11.757 16.031 ( 5.766 7.140 -1.691) 9.332 16.460 ( 9.322 1.507 -0.564) 9.460 17.341 ( 5.817 15.499 0.481) 16.561 18.068 ( -2.767 -1.968 1.749) 3.819 18.452 ( -2.865 -2.226 3.919) 5.341 19.050 ( -3.125 1.811 -4.702) 5.929 19.185 ( -5.413 0.984 -3.797) 6.685 19.701 ( -5.964 -11.235 5.223) 13.751 19.987 ( 3.528 3.317 -2.274) 5.350 ======================= Grid point 548 (273/336) ======================= q-point: (-0.64 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.611 ( -3.930 -0.000 17.051) 17.499 3.199 ( 6.876 0.000 5.688) 8.924 3.507 ( -14.602 -0.000 0.656) 14.616 5.031 ( -1.440 -0.000 8.245) 8.370 5.619 ( 13.711 0.000 5.491) 14.770 5.898 ( 4.965 0.000 -8.200) 9.586 6.308 ( 2.329 0.000 -6.416) 6.826 6.891 ( 2.151 0.000 -4.112) 4.641 7.437 ( -3.046 -0.000 -0.986) 3.202 7.793 ( -3.402 -0.000 -1.429) 3.690 8.085 ( 12.910 0.000 -6.378) 14.399 8.527 ( 8.360 0.000 -2.071) 8.613 8.824 ( -2.753 -0.000 2.792) 3.921 9.005 ( -15.688 -0.000 -6.775) 17.089 9.248 ( -0.011 -0.000 7.442) 7.442 9.927 ( 1.429 0.000 -9.132) 9.243 11.020 ( -8.079 -0.000 2.094) 8.346 12.190 ( 1.499 0.000 7.170) 7.325 14.484 ( -6.772 -0.000 0.745) 6.813 15.892 ( -16.309 -0.000 0.300) 16.311 16.372 ( 1.912 0.000 3.172) 3.704 16.560 ( -4.820 -0.000 0.181) 4.823 16.561 ( 4.365 0.000 -2.888) 5.234 17.465 ( 1.871 0.000 20.271) 20.357 17.766 ( -5.736 -0.000 12.774) 14.003 18.543 ( 3.123 0.000 -2.783) 4.183 18.592 ( 6.310 0.000 -8.459) 10.553 19.125 ( 4.725 0.000 -3.640) 5.964 19.901 ( -3.525 -0.000 -9.576) 10.204 20.147 ( 5.749 0.000 -4.712) 7.433 ======================= Grid point 550 (274/336) ======================= q-point: (-0.55 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.628 ( -5.462 4.934 20.413) 21.700 3.071 ( -8.195 17.927 4.381) 20.192 3.444 ( -0.040 -15.134 4.957) 15.926 4.984 ( -0.025 15.285 4.200) 15.852 5.893 ( 9.044 -5.579 6.028) 12.217 6.049 ( 9.848 -5.221 -4.360) 11.969 6.355 ( 5.815 -2.153 -5.980) 8.614 6.874 ( -2.229 1.399 -2.269) 3.475 7.417 ( 3.430 1.432 -4.797) 6.069 7.708 ( -3.647 -0.334 -2.080) 4.211 8.238 ( 5.643 -1.153 -2.250) 6.183 8.573 ( -11.419 8.089 -4.222) 14.617 8.681 ( 7.494 0.902 -3.163) 8.184 8.815 ( -15.084 -15.820 -5.029) 22.430 9.411 ( 11.276 1.240 13.228) 17.426 9.955 ( 5.142 0.517 -5.041) 7.219 10.894 ( -8.157 -2.999 0.667) 8.716 12.212 ( -1.198 -0.213 2.494) 2.775 14.414 ( -1.961 -1.014 1.396) 2.612 15.565 ( -19.383 -1.559 -1.566) 19.509 16.349 ( -2.796 6.817 5.693) 9.311 16.495 ( -0.403 2.663 0.936) 2.852 16.612 ( 2.375 1.155 -3.666) 4.518 17.594 ( 1.814 -0.071 18.291) 18.380 17.781 ( 0.379 -0.935 11.683) 11.726 18.554 ( -0.529 -0.722 -3.981) 4.081 18.704 ( 8.908 -2.306 -6.433) 11.227 19.196 ( 4.812 0.520 -1.621) 5.104 19.783 ( -5.625 -1.225 -9.477) 11.088 20.189 ( 2.677 1.489 -6.243) 6.954 ======================= Grid point 551 (275/336) ======================= q-point: (-0.45 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -13.922 9.535 9.457) 19.344 2.968 ( 5.920 14.894 12.910) 20.581 3.660 ( 5.565 -13.408 5.489) 15.520 4.782 ( -3.024 22.754 0.435) 22.958 6.041 ( 2.000 -0.781 4.891) 5.342 6.244 ( 10.004 1.414 -1.172) 10.171 6.489 ( 7.349 -3.305 -6.399) 10.289 6.735 ( -8.331 6.862 1.947) 10.967 7.521 ( 7.901 -10.143 -9.780) 16.154 7.712 ( 2.266 -5.375 -0.629) 5.867 8.235 ( -8.083 1.553 -0.638) 8.256 8.384 ( -3.885 -4.726 0.989) 6.197 8.627 ( -10.187 -10.944 -6.328) 16.236 8.800 ( 0.404 -1.098 -1.253) 1.714 9.661 ( 11.734 3.810 10.038) 15.905 10.044 ( 8.381 1.881 -4.204) 9.563 10.797 ( -6.721 -3.998 -0.095) 7.821 12.202 ( -2.561 -5.008 0.377) 5.638 14.444 ( 3.678 -0.370 1.000) 3.829 15.258 ( -15.773 -3.207 -1.862) 16.203 16.245 ( -3.672 7.787 7.546) 11.448 16.439 ( -3.055 4.654 1.598) 5.792 16.616 ( 5.452 8.126 -4.336) 10.703 17.680 ( 0.844 2.395 13.461) 13.698 17.882 ( 3.480 -1.062 9.964) 10.607 18.510 ( -3.010 -1.403 -4.726) 5.776 18.889 ( 8.884 -6.609 -2.497) 11.351 19.264 ( 3.909 0.661 -1.197) 4.141 19.637 ( -7.334 -1.376 -8.963) 11.663 20.163 ( 0.104 2.645 -6.040) 6.594 ======================= Grid point 552 (276/336) ======================= q-point: (-0.36 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.218 ( 1.786 10.003 5.085) 11.363 2.975 ( 4.141 14.843 8.996) 17.843 3.915 ( 5.844 -10.178 4.318) 12.505 4.456 ( -2.727 31.634 -1.052) 31.769 6.061 ( -0.498 3.168 3.688) 4.887 6.286 ( -1.448 10.356 1.448) 10.557 6.513 ( -2.495 -3.969 -2.486) 5.306 6.672 ( 7.056 -0.512 -3.344) 7.825 7.736 ( -1.490 -21.112 -7.415) 22.426 7.840 ( 2.025 -8.122 -1.052) 8.437 8.084 ( -1.852 0.044 0.648) 1.963 8.396 ( -1.451 -4.244 4.329) 6.233 8.606 ( -4.327 -14.608 -4.377) 15.852 8.751 ( -3.445 2.595 -0.086) 4.314 9.811 ( 5.581 4.533 5.899) 9.300 10.160 ( 10.085 5.124 -8.400) 14.090 10.725 ( -4.026 -1.189 0.766) 4.267 12.246 ( -2.938 -13.422 1.923) 13.874 14.533 ( 5.589 1.334 -2.142) 6.133 15.100 ( -4.397 -5.680 0.503) 7.201 16.140 ( -4.979 6.880 9.894) 13.039 16.328 ( -1.426 9.432 0.451) 9.550 16.610 ( 6.909 11.569 -5.272) 14.470 17.702 ( 0.919 6.133 8.053) 10.164 17.988 ( 2.815 -0.210 6.983) 7.532 18.447 ( -3.689 -2.571 -3.341) 5.602 19.105 ( 5.522 -10.855 0.453) 12.188 19.300 ( 1.748 1.546 -1.189) 2.619 19.471 ( -7.813 -0.913 -7.974) 11.201 20.101 ( -0.807 3.152 -4.098) 5.232 ======================= Grid point 553 (277/336) ======================= q-point: (-0.27 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( 12.172 12.183 1.195) 17.263 2.894 ( -0.623 15.138 3.669) 15.588 3.973 ( -4.007 6.238 -2.288) 7.759 4.207 ( 10.500 27.749 2.663) 29.788 5.975 ( -2.462 7.618 -1.662) 8.177 6.174 ( -5.632 -0.620 8.289) 10.040 6.563 ( 1.345 -9.466 -4.483) 10.560 6.810 ( 9.380 1.370 -2.997) 9.942 7.665 ( -15.821 -11.720 -3.341) 19.970 7.913 ( -8.076 -15.634 0.028) 17.597 8.195 ( 8.398 -0.029 0.345) 8.405 8.443 ( -6.691 -1.580 1.629) 7.066 8.648 ( 4.816 -10.727 4.517) 12.596 8.774 ( 4.043 -7.869 -4.775) 10.054 9.833 ( -0.421 5.499 2.131) 5.912 10.158 ( 2.448 7.727 -14.878) 16.943 10.736 ( 4.924 0.981 5.244) 7.260 12.350 ( -5.261 -18.328 4.072) 19.498 14.572 ( 2.887 0.392 -5.286) 6.036 15.252 ( 12.583 -6.944 2.591) 14.603 16.011 ( -5.818 9.187 8.950) 14.084 16.236 ( 1.997 11.040 1.225) 11.286 16.590 ( 6.554 11.723 -6.514) 14.927 17.673 ( 1.867 10.224 3.740) 11.046 18.037 ( -0.316 -0.531 3.186) 3.245 18.410 ( -2.858 -3.184 0.696) 4.335 19.187 ( -7.486 -7.088 -7.643) 12.833 19.314 ( -0.068 4.778 -1.461) 4.997 19.371 ( -0.190 -8.422 3.073) 8.967 20.052 ( 0.493 2.973 -2.137) 3.694 ======================= Grid point 554 (278/336) ======================= q-point: (-0.18 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( 2.115 20.016 -3.971) 20.516 2.722 ( -2.903 11.207 1.474) 11.671 3.927 ( 11.991 10.599 -0.014) 16.004 4.135 ( 7.833 25.045 -1.095) 26.264 5.890 ( -0.172 2.503 -3.109) 3.995 6.106 ( -7.204 0.175 5.446) 9.033 6.715 ( 3.987 -15.984 -1.736) 16.564 6.934 ( 8.790 4.581 -2.437) 10.207 7.474 ( -16.732 -10.913 0.604) 19.985 7.847 ( -11.309 -8.425 0.634) 14.117 8.226 ( -8.541 5.023 -1.223) 9.984 8.358 ( 0.899 -11.069 -2.202) 11.321 8.893 ( 2.766 -8.480 -5.589) 10.526 9.018 ( 15.654 -11.676 8.369) 21.247 9.662 ( -8.998 10.299 -4.957) 14.547 10.060 ( 1.396 3.875 -11.078) 11.819 10.905 ( 10.789 1.551 7.760) 13.381 12.404 ( -10.068 -15.943 3.813) 19.237 14.636 ( 6.161 -3.323 -4.912) 8.551 15.624 ( 19.303 -4.603 1.494) 19.901 15.843 ( -4.464 12.406 5.469) 14.274 16.198 ( 4.017 9.570 2.015) 10.573 16.564 ( 4.426 8.012 -5.493) 10.675 17.622 ( 4.369 13.127 1.655) 13.934 18.027 ( -2.979 -2.002 1.375) 3.844 18.402 ( -3.112 -2.889 4.294) 6.039 19.044 ( -7.874 -3.910 -8.459) 12.200 19.214 ( -4.917 2.009 -4.232) 6.791 19.501 ( 0.078 -7.707 7.951) 11.074 20.046 ( 2.816 2.603 -2.020) 4.334 ======================= Grid point 555 (279/336) ======================= q-point: (-0.09 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.025 ( -1.488 17.012 -4.641) 17.696 2.625 ( -1.419 3.884 0.814) 4.215 3.889 ( -7.707 6.413 -5.086) 11.243 4.266 ( 33.555 24.995 1.997) 41.889 5.846 ( -3.994 0.795 -4.498) 6.068 5.989 ( -2.595 3.249 1.696) 4.490 6.971 ( 5.097 -15.042 -0.038) 15.883 7.006 ( 6.224 4.368 -0.041) 7.604 7.280 ( -17.305 -10.247 2.171) 20.228 7.706 ( -9.976 -3.402 -1.638) 10.667 8.029 ( -7.761 0.936 -2.807) 8.306 8.474 ( -0.377 -12.809 -2.129) 12.991 8.907 ( -2.512 1.370 -11.787) 12.129 9.379 ( -7.888 4.934 -4.326) 10.261 9.466 ( 14.203 -12.729 13.380) 23.298 10.013 ( 0.770 1.607 -9.437) 9.604 11.125 ( 11.335 3.271 9.312) 15.030 12.321 ( -14.151 -9.239 1.792) 16.994 14.810 ( 9.199 -6.845 -3.276) 11.925 15.642 ( -2.323 15.346 2.119) 15.665 15.996 ( 14.887 -0.643 -1.029) 14.937 16.219 ( 7.701 7.953 1.344) 11.152 16.553 ( 0.853 0.685 -0.104) 1.099 17.622 ( 8.936 11.912 2.133) 15.043 17.985 ( -4.930 -2.271 1.968) 5.774 18.385 ( -4.671 -3.275 5.678) 8.049 18.939 ( -3.684 -4.558 -9.415) 11.090 19.064 ( -7.240 1.935 -4.557) 8.771 19.578 ( -2.052 -4.862 7.767) 9.390 20.077 ( 4.537 2.639 -3.258) 6.178 ======================= Grid point 561 (280/336) ======================= q-point: (-0.55 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.495 ( -15.633 -0.000 11.099) 19.172 3.206 ( 6.611 0.000 17.551) 18.754 3.435 ( 4.869 0.000 0.590) 4.905 5.017 ( -5.289 -0.000 0.691) 5.333 5.990 ( 3.789 0.000 3.893) 5.433 6.319 ( 18.749 0.000 0.826) 18.767 6.428 ( 6.164 0.000 -5.181) 8.052 6.824 ( -3.224 -0.000 -1.692) 3.641 7.400 ( -5.237 -0.000 -11.111) 12.283 7.670 ( 4.491 0.000 -0.796) 4.561 8.298 ( -18.404 -0.000 -1.567) 18.471 8.298 ( 1.809 0.000 0.593) 1.903 8.480 ( -8.551 -0.000 -4.926) 9.868 8.810 ( 3.205 0.000 0.202) 3.211 9.697 ( 11.762 0.000 9.921) 15.387 10.064 ( 9.465 0.000 -4.210) 10.359 10.752 ( -5.984 -0.000 0.085) 5.984 12.157 ( -4.503 -0.000 -0.822) 4.578 14.441 ( 4.456 0.000 1.241) 4.625 15.226 ( -16.002 -0.000 -1.992) 16.125 16.323 ( -6.816 -0.000 8.497) 10.893 16.488 ( -0.810 -0.000 1.077) 1.347 16.696 ( 6.546 0.000 -5.586) 8.605 17.699 ( 0.773 0.000 17.138) 17.155 17.874 ( 4.245 0.000 11.102) 11.886 18.495 ( -3.261 -0.000 -5.166) 6.109 18.818 ( 7.922 0.000 -5.685) 9.751 19.271 ( 3.823 0.000 -0.990) 3.949 19.627 ( -6.534 -0.000 -8.043) 10.363 20.189 ( 0.027 0.000 -6.430) 6.430 ======================= Grid point 563 (281/336) ======================= q-point: (-0.45 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( 1.570 4.469 6.030) 7.668 3.289 ( 5.514 17.230 9.451) 20.411 3.644 ( 5.343 -16.573 3.926) 17.850 4.870 ( -4.054 10.784 0.498) 11.532 6.047 ( -0.099 -1.603 3.463) 3.817 6.462 ( -0.086 -0.283 -3.989) 4.000 6.605 ( 10.346 13.530 -0.045) 17.033 6.711 ( -0.392 6.484 -0.380) 6.507 7.278 ( -9.364 -21.879 -10.787) 26.129 7.769 ( 1.064 -1.464 -3.190) 3.668 8.098 ( 1.007 0.998 0.998) 1.734 8.320 ( -0.841 -2.605 1.806) 3.279 8.386 ( -4.129 -6.916 -1.750) 8.243 8.795 ( -4.494 1.378 2.556) 5.350 9.865 ( 4.125 1.302 5.204) 6.767 10.237 ( 12.355 2.320 -8.178) 14.997 10.687 ( -2.534 -1.671 0.998) 3.195 12.082 ( -4.739 -3.961 0.244) 6.181 14.551 ( 6.355 0.505 -1.733) 6.607 15.022 ( -5.545 -2.170 0.459) 5.972 16.230 ( -6.537 2.361 10.580) 12.659 16.465 ( -0.135 4.019 0.863) 4.113 16.768 ( 6.862 4.360 -7.048) 10.760 17.772 ( 0.230 1.605 14.235) 14.327 18.004 ( 4.693 1.026 8.788) 10.015 18.405 ( -4.324 -1.384 -4.844) 6.639 18.921 ( 2.719 -5.937 -5.513) 8.546 19.316 ( 1.797 0.270 -1.487) 2.348 19.488 ( -4.686 1.054 -5.078) 6.990 20.143 ( -1.243 1.125 -4.872) 5.152 ======================= Grid point 564 (282/336) ======================= q-point: (-0.36 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.503 ( 16.579 9.993 2.208) 19.484 3.209 ( 1.401 17.058 2.197) 17.256 3.851 ( -0.521 -12.772 -0.804) 12.807 4.722 ( 3.863 19.018 3.076) 19.649 6.056 ( -2.173 -0.314 4.557) 5.058 6.264 ( -13.556 9.320 -0.518) 16.459 6.469 ( -0.570 2.072 -6.504) 6.850 6.869 ( 12.830 3.068 -2.305) 13.392 7.304 ( -12.648 -22.635 -3.779) 26.204 7.726 ( -4.029 -4.554 -1.087) 6.177 8.212 ( 4.779 1.927 0.343) 5.164 8.396 ( 4.570 -4.170 0.406) 6.200 8.441 ( 2.606 -9.239 2.961) 10.046 8.691 ( -4.796 -1.238 1.084) 5.070 9.895 ( -0.706 1.654 2.454) 3.042 10.298 ( 3.667 5.837 -16.510) 17.891 10.715 ( 3.082 -2.328 3.945) 5.521 12.092 ( -2.167 -8.463 4.476) 9.816 14.578 ( 0.127 0.191 -5.328) 5.333 15.141 ( 13.219 -4.162 3.564) 14.309 16.148 ( -4.564 4.845 11.587) 13.363 16.419 ( 0.849 7.261 0.903) 7.366 16.784 ( 5.183 7.610 -8.783) 12.725 17.809 ( 0.808 4.058 10.340) 11.137 18.060 ( -0.027 2.442 2.562) 3.540 18.353 ( -1.926 -2.320 0.104) 3.017 18.951 ( -6.256 -12.239 -7.837) 15.823 19.316 ( -1.223 -0.438 -2.166) 2.526 19.413 ( 1.029 4.229 0.484) 4.379 20.095 ( -0.509 1.431 -2.644) 3.049 ======================= Grid point 565 (283/336) ======================= q-point: (-0.27 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.644 ( 10.526 18.536 -0.838) 21.333 3.022 ( -3.267 17.698 -3.105) 18.263 3.909 ( -0.013 -7.339 -3.084) 7.961 4.667 ( 11.363 23.652 0.783) 26.251 5.940 ( -7.035 3.465 -1.199) 7.933 6.091 ( -5.568 -1.778 8.025) 9.928 6.461 ( -0.558 -10.139 -6.348) 11.976 7.029 ( 7.937 -0.056 -6.152) 10.042 7.217 ( -11.824 -9.532 2.145) 15.338 7.708 ( -3.976 -4.553 -0.007) 6.045 8.186 ( -8.877 -4.825 -0.327) 10.109 8.376 ( -0.204 6.793 0.386) 6.807 8.678 ( 4.302 -12.029 5.773) 14.019 8.828 ( 14.201 -8.586 -1.669) 16.679 9.808 ( -7.555 4.488 -1.678) 8.946 10.150 ( -2.002 5.268 -18.068) 18.927 10.873 ( 7.789 -4.137 6.278) 10.826 12.173 ( -1.821 -8.007 6.260) 10.326 14.581 ( 2.702 -2.403 -4.828) 6.032 15.517 ( 20.490 -5.039 3.002) 21.313 16.066 ( -2.693 9.524 9.044) 13.407 16.374 ( 2.013 8.119 2.310) 8.678 16.727 ( 1.781 8.044 -9.464) 12.547 17.823 ( 2.737 7.119 6.725) 10.168 18.006 ( -3.853 0.200 -0.502) 3.891 18.354 ( -2.145 -1.383 3.793) 4.572 18.880 ( -8.939 -11.765 -9.663) 17.655 19.243 ( -4.849 0.800 -3.994) 6.333 19.452 ( 3.500 1.691 6.498) 7.572 20.081 ( 1.551 1.061 -1.867) 2.649 ======================= Grid point 566 (284/336) ======================= q-point: (-0.18 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.453 ( -4.679 25.799 -2.983) 26.389 2.796 ( -1.628 13.434 -3.799) 14.055 3.923 ( -5.855 -2.568 -4.188) 7.643 4.736 ( 24.258 22.107 -2.447) 32.911 5.833 ( -5.125 -2.147 -1.588) 5.779 6.033 ( -4.182 1.307 5.374) 6.934 6.609 ( 1.917 -20.045 -0.470) 20.142 7.002 ( -15.658 -14.919 -2.590) 21.782 7.206 ( 10.074 11.289 -0.291) 15.134 7.649 ( -5.869 -1.296 -0.587) 6.039 8.025 ( -9.866 -2.263 -2.274) 10.375 8.362 ( 1.607 0.615 0.272) 1.742 8.833 ( 2.012 -7.014 -5.196) 8.958 9.223 ( 14.868 -12.134 9.183) 21.275 9.523 ( -12.615 7.954 -6.412) 16.233 10.029 ( -1.313 0.303 -13.210) 13.279 11.105 ( 9.116 -4.786 8.096) 13.098 12.200 ( -4.576 -3.190 4.818) 7.371 14.688 ( 7.011 -5.571 -3.545) 9.630 15.893 ( 2.845 4.036 2.107) 5.369 15.981 ( 13.466 6.043 4.061) 15.308 16.369 ( 4.800 7.279 2.491) 9.068 16.620 ( -2.069 5.179 -5.659) 7.945 17.837 ( 5.044 9.756 3.944) 11.669 17.939 ( -4.786 -2.360 2.100) 5.734 18.321 ( -5.458 -2.879 3.443) 7.066 18.810 ( -4.629 -8.609 -9.583) 13.688 19.104 ( -6.876 1.945 -4.464) 8.425 19.528 ( 1.685 -0.174 8.152) 8.326 20.110 ( 3.585 0.663 -3.058) 4.759 ======================= Grid point 567 (285/336) ======================= q-point: (-0.09 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -3.381 16.908 -0.433) 17.249 2.665 ( 0.251 7.769 -3.974) 8.730 3.704 ( -13.768 2.079 -7.098) 15.629 5.036 ( 27.687 17.714 -0.194) 32.870 5.743 ( -4.267 -0.453 -3.159) 5.328 6.005 ( 0.115 0.497 2.836) 2.882 6.767 ( -18.620 -20.848 3.235) 28.140 6.924 ( 3.810 -12.632 -1.302) 13.258 7.258 ( 8.298 12.853 -1.948) 15.423 7.525 ( -7.461 -0.669 -1.857) 7.717 7.908 ( -3.423 -0.773 -2.829) 4.508 8.398 ( 0.852 -3.146 -0.643) 3.322 8.796 ( -5.809 1.610 -10.132) 11.789 9.239 ( -7.595 0.847 -3.412) 8.370 9.664 ( 14.033 -10.975 11.643) 21.282 9.946 ( -2.531 -1.323 -11.547) 11.895 11.340 ( 7.898 -3.236 9.051) 12.441 12.111 ( -7.586 2.292 2.725) 8.380 14.886 ( 8.688 -7.376 -2.252) 11.617 15.713 ( -5.152 12.594 -0.346) 13.611 16.234 ( 8.709 4.969 -3.326) 10.564 16.455 ( 10.595 2.117 1.013) 10.852 16.542 ( -1.961 1.231 6.018) 6.448 17.797 ( -4.817 2.640 0.674) 5.534 17.946 ( 2.399 3.018 11.309) 11.948 18.272 ( -3.631 -4.297 -0.744) 5.675 18.789 ( -1.534 -6.174 -10.040) 11.885 18.938 ( -6.200 2.058 -4.559) 7.966 19.587 ( 1.248 -0.218 6.881) 6.997 20.158 ( 4.293 0.925 -4.721) 6.448 ======================= Grid point 574 (286/336) ======================= q-point: ( 0.55 -0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.609 ( 18.957 0.000 3.039) 19.199 3.530 ( -0.910 -0.000 5.865) 5.935 3.563 ( 3.177 0.000 -4.954) 5.886 4.903 ( 1.448 0.000 5.090) 5.292 6.043 ( -1.026 -0.000 2.525) 2.725 6.332 ( -10.165 -0.000 -2.421) 10.450 6.682 ( -17.932 -0.000 -14.266) 22.915 6.803 ( 1.804 0.000 -0.842) 1.991 7.027 ( 11.518 0.000 3.917) 12.166 7.686 ( -3.910 -0.000 -1.250) 4.105 8.253 ( -6.594 -0.000 1.258) 6.713 8.322 ( 17.889 0.000 -2.756) 18.100 8.349 ( 4.053 0.000 3.205) 5.167 8.685 ( -9.339 -0.000 3.288) 9.901 9.910 ( -1.002 -0.000 2.207) 2.424 10.358 ( 4.469 0.000 -16.730) 17.316 10.685 ( 2.053 0.000 3.255) 3.848 12.013 ( -1.020 -0.000 4.716) 4.826 14.580 ( -1.026 -0.000 -5.324) 5.422 15.100 ( 13.639 0.000 3.858) 14.174 16.195 ( -4.197 -0.000 12.485) 13.172 16.492 ( 0.424 0.000 0.732) 0.846 16.860 ( 4.929 0.000 -9.758) 10.932 17.847 ( -0.020 -0.000 14.270) 14.270 18.089 ( -0.873 -0.000 2.230) 2.395 18.333 ( 0.114 0.000 0.449) 0.463 18.818 ( -6.081 -0.000 -10.264) 11.930 19.313 ( -1.166 -0.000 -2.645) 2.891 19.456 ( 0.975 0.000 0.629) 1.160 20.108 ( -0.975 -0.000 -2.940) 3.098 ======================= Grid point 576 (287/336) ======================= q-point: (-0.36 0.55 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.946 ( 18.590 10.179 1.226) 21.229 3.348 ( -3.472 15.860 -4.636) 16.885 3.685 ( -0.789 -14.655 -5.054) 15.522 4.980 ( 8.479 8.292 6.255) 13.408 6.035 ( -3.872 1.806 4.231) 6.013 6.060 ( -13.342 3.340 -3.074) 14.093 6.300 ( -14.491 -7.369 -11.215) 19.750 6.859 ( -2.288 -7.485 -2.373) 8.179 7.243 ( 10.820 3.448 2.731) 11.680 7.665 ( 0.839 -0.573 0.620) 1.190 8.118 ( -10.169 -2.106 1.359) 10.473 8.483 ( -4.421 -2.059 7.534) 8.975 8.521 ( 8.440 3.022 -0.101) 8.966 8.675 ( 13.845 -7.049 -3.423) 15.909 9.853 ( -5.978 0.842 -0.145) 6.039 10.235 ( -5.031 2.739 -21.936) 22.672 10.792 ( 5.909 -2.966 5.673) 8.712 12.082 ( 3.032 -2.034 7.755) 8.571 14.548 ( 0.786 -0.932 -4.582) 4.741 15.450 ( 20.914 -1.797 3.335) 21.254 16.192 ( -1.220 3.331 12.609) 13.099 16.488 ( 0.691 3.252 0.988) 3.468 16.844 ( 0.486 3.433 -11.671) 12.175 17.902 ( 0.263 1.982 13.174) 13.325 18.013 ( -5.480 -0.368 -1.592) 5.718 18.377 ( 2.158 3.341 3.321) 5.181 18.663 ( -8.322 -8.705 -12.141) 17.101 19.251 ( -4.177 0.147 -3.468) 5.431 19.498 ( 3.002 1.845 4.191) 5.475 20.091 ( 0.425 0.097 -1.822) 1.873 ======================= Grid point 577 (288/336) ======================= q-point: (-0.27 0.55 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.948 ( -0.628 23.185 -0.988) 23.214 3.097 ( -2.727 16.636 -7.074) 18.282 3.786 ( -2.467 -11.741 -3.989) 12.643 5.093 ( 16.509 14.801 -1.920) 22.256 5.780 ( -10.377 -2.341 0.263) 10.641 6.037 ( -3.768 -0.900 5.067) 6.378 6.182 ( -10.110 -22.524 -6.359) 25.495 6.829 ( -4.773 -2.899 -1.967) 5.921 7.384 ( 9.961 6.372 -1.185) 11.884 7.684 ( 1.111 4.421 1.746) 4.881 7.957 ( -10.221 -4.069 -0.356) 11.007 8.399 ( -2.994 0.307 2.846) 4.142 8.722 ( 8.317 -1.996 0.512) 8.569 9.011 ( 14.374 -9.653 2.368) 17.476 9.643 ( -13.249 4.117 -5.629) 14.972 10.034 ( -3.944 0.291 -17.178) 17.627 10.988 ( 7.509 -5.874 7.240) 11.971 12.178 ( 1.832 0.066 6.686) 6.933 14.603 ( 5.249 -3.159 -3.291) 6.954 15.855 ( 18.494 -2.541 2.472) 18.830 16.178 ( 0.738 8.789 8.604) 12.322 16.483 ( 2.342 4.076 2.727) 5.435 16.716 ( -4.348 4.054 -10.748) 12.283 17.904 ( -4.998 -0.972 2.320) 5.595 17.964 ( 0.241 2.635 11.937) 12.226 18.311 ( -3.804 2.928 -5.847) 7.565 18.628 ( -1.774 -9.635 -7.268) 12.199 19.133 ( -6.399 1.010 -3.860) 7.541 19.555 ( 2.669 2.215 6.501) 7.368 20.106 ( 2.083 -0.734 -2.819) 3.581 ======================= Grid point 578 (289/336) ======================= q-point: (-0.18 -0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.590 ( -8.379 27.693 1.496) 28.972 2.881 ( -1.242 14.012 -7.149) 15.779 3.694 ( -12.999 -3.602 -6.324) 14.898 5.302 ( 20.472 9.808 -4.387) 23.121 5.680 ( -6.493 -5.426 -1.762) 8.643 6.002 ( -2.370 -2.910 4.201) 5.634 6.263 ( -8.988 -25.675 1.801) 27.262 6.782 ( -0.445 -2.928 -2.606) 3.945 7.442 ( 2.145 5.548 -1.570) 6.151 7.613 ( 0.524 9.038 -1.641) 9.201 7.880 ( -1.912 -1.770 -0.034) 2.606 8.395 ( 0.935 -0.181 0.890) 1.304 8.796 ( -0.385 1.043 -5.826) 5.932 9.251 ( -7.562 -2.313 -0.666) 7.936 9.482 ( 10.961 -5.797 3.893) 12.996 9.922 ( -2.505 -1.163 -11.893) 12.209 11.219 ( 6.623 -7.824 7.730) 12.839 12.182 ( -2.064 4.145 4.155) 6.221 14.757 ( 8.307 -5.540 -2.232) 10.231 15.951 ( -3.846 10.960 -0.010) 11.616 16.290 ( 12.029 1.028 4.331) 12.826 16.483 ( -1.414 2.863 -6.794) 7.507 16.595 ( 1.178 1.936 4.609) 5.136 17.815 ( -7.169 0.035 3.138) 7.826 18.001 ( -3.401 0.537 18.039) 18.365 18.227 ( 3.370 1.008 -12.477) 12.963 18.665 ( 0.354 -6.350 -7.169) 9.583 18.980 ( -6.702 1.988 -3.776) 7.946 19.606 ( 1.958 2.005 6.774) 7.330 20.149 ( 3.179 -1.663 -5.065) 6.207 ======================= Grid point 579 (290/336) ======================= q-point: (-0.09 -0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( -6.911 18.876 5.004) 20.715 2.730 ( -0.239 8.596 -6.042) 10.510 3.419 ( -13.873 -0.057 -6.510) 15.325 5.457 ( 3.859 4.603 0.090) 6.008 5.617 ( -9.095 -9.867 -3.054) 13.763 6.099 ( 10.610 2.458 2.395) 11.151 6.325 ( -3.666 -14.956 -0.466) 15.406 6.886 ( 3.464 -12.122 -0.117) 12.608 7.317 ( -7.779 4.527 -1.104) 9.068 7.580 ( 6.099 11.529 -2.379) 13.258 7.877 ( 0.790 0.781 -1.204) 1.639 8.424 ( 2.628 1.130 -1.086) 3.060 8.647 ( -7.893 2.441 -6.654) 10.608 9.144 ( -1.248 0.836 -2.461) 2.883 9.800 ( 2.596 -7.245 -5.288) 9.338 9.891 ( 8.244 -2.574 4.634) 9.801 11.428 ( 3.896 -8.071 7.594) 11.747 12.066 ( -5.697 7.731 2.534) 9.932 14.962 ( 8.353 -6.348 -1.734) 10.634 15.714 ( -7.360 12.411 -1.919) 14.556 16.273 ( -5.538 2.626 -7.595) 9.760 16.534 ( 2.615 -4.665 7.384) 9.117 16.700 ( 7.302 2.812 4.250) 8.904 17.670 ( -9.530 2.266 4.849) 10.930 17.982 ( -8.132 -2.253 17.484) 19.414 18.312 ( 11.873 2.461 -8.608) 14.870 18.681 ( -0.103 -3.299 -10.080) 10.607 18.853 ( -2.893 0.656 -3.112) 4.299 19.657 ( 2.936 0.884 4.392) 5.357 20.193 ( 2.732 -1.505 -6.851) 7.528 ======================= Grid point 587 (291/336) ======================= q-point: (-0.36 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.183 ( -1.403 -0.000 -6.106) 6.266 3.423 ( 3.689 0.000 1.287) 3.907 3.517 ( -3.558 -0.000 -7.624) 8.414 5.264 ( 16.082 0.000 5.075) 16.863 5.797 ( -17.932 -0.000 -0.785) 17.949 5.861 ( -16.013 -0.000 -13.509) 20.950 6.034 ( -0.280 -0.000 3.784) 3.795 6.817 ( -0.961 -0.000 -1.100) 1.460 7.447 ( 9.242 0.000 -1.652) 9.389 7.747 ( 6.404 0.000 3.284) 7.197 7.905 ( -12.162 -0.000 0.392) 12.169 8.378 ( -6.349 -0.000 5.273) 8.253 8.747 ( 12.351 0.000 4.932) 13.300 8.887 ( 13.676 0.000 -4.243) 14.319 9.681 ( -12.800 -0.000 -4.705) 13.637 10.038 ( -5.474 -0.000 -19.067) 19.837 10.925 ( 7.090 0.000 7.120) 10.048 12.181 ( 3.838 0.000 7.195) 8.155 14.572 ( 4.633 0.000 -3.118) 5.585 15.830 ( 19.757 0.000 2.550) 19.921 16.268 ( 0.931 0.000 11.791) 11.828 16.521 ( 1.193 0.000 1.342) 1.796 16.758 ( -5.447 -0.000 -12.826) 13.935 17.899 ( -5.767 -0.000 1.061) 5.864 17.973 ( -2.110 -0.000 17.880) 18.004 18.397 ( -5.226 -0.000 -20.112) 20.780 18.484 ( 3.219 0.000 3.120) 4.483 19.142 ( -6.139 -0.000 -3.552) 7.092 19.582 ( 2.834 0.000 5.582) 6.260 20.096 ( 1.249 0.000 -2.674) 2.951 ======================= Grid point 588 (292/336) ======================= q-point: (-0.27 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.013 ( -6.020 11.171 -5.220) 13.721 3.213 ( -5.625 20.418 -2.993) 21.389 3.548 ( -9.282 -11.869 -2.600) 15.291 5.432 ( -2.862 4.298 -3.201) 6.075 5.583 ( -8.610 -3.344 -1.642) 9.382 5.725 ( 6.463 -15.556 -3.991) 17.311 6.068 ( 1.567 -1.081 3.772) 4.225 6.770 ( -2.732 0.434 -2.603) 3.798 7.548 ( 4.175 5.155 -2.096) 6.957 7.713 ( -6.267 -0.501 -2.178) 6.653 7.886 ( 7.459 2.834 2.459) 8.349 8.337 ( -2.728 -3.956 3.910) 6.195 8.886 ( 2.605 6.634 0.691) 7.161 9.129 ( 6.805 -7.543 0.438) 10.169 9.454 ( -2.385 0.500 -4.540) 5.153 9.906 ( -2.063 -0.453 -11.985) 12.169 11.094 ( 5.720 -3.938 7.182) 9.990 12.243 ( 0.423 1.773 4.582) 4.931 14.683 ( 7.820 -1.984 -1.942) 8.299 16.094 ( 6.463 3.338 0.810) 7.320 16.315 ( 2.448 1.666 7.093) 7.686 16.545 ( -5.856 2.826 -8.838) 10.972 16.597 ( 1.988 -1.396 1.625) 2.922 17.818 ( -5.613 0.317 6.727) 8.767 17.969 ( -8.353 -2.029 16.876) 18.939 18.293 ( 7.103 3.627 -18.978) 20.586 18.558 ( 1.885 -3.975 -1.969) 4.820 19.008 ( -6.615 0.772 -3.110) 7.350 19.648 ( 2.317 1.629 6.255) 6.866 20.112 ( 1.822 -1.488 -5.378) 5.870 ======================= Grid point 589 (293/336) ======================= q-point: (-0.18 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.685 ( -12.254 24.006 6.900) 27.822 2.936 ( -4.180 12.279 -7.037) 14.756 3.379 ( -12.641 -4.309 -6.376) 14.799 5.319 ( -18.751 -18.619 0.807) 26.437 5.450 ( -4.400 -3.808 -4.700) 7.480 6.118 ( 18.876 -4.792 -1.384) 19.524 6.129 ( 6.288 0.038 2.288) 6.691 6.728 ( -1.497 -4.586 -3.022) 5.693 7.448 ( -4.052 8.459 -0.813) 9.414 7.700 ( 2.865 0.320 -3.532) 4.560 7.961 ( 4.926 7.710 1.540) 9.278 8.375 ( -0.217 -6.516 -0.726) 6.560 8.732 ( -8.582 5.413 -1.600) 10.272 9.193 ( 3.478 3.744 -1.610) 5.358 9.647 ( 10.785 -7.042 -0.281) 12.884 9.871 ( 3.723 -0.393 -2.073) 4.280 11.259 ( 2.644 -7.966 6.386) 10.546 12.195 ( -3.831 4.949 2.130) 6.611 14.857 ( 8.847 -4.035 -1.458) 9.832 15.973 ( -6.576 13.455 -1.372) 15.039 16.311 ( -9.622 1.427 -8.185) 12.713 16.421 ( -0.167 -7.245 3.638) 8.109 16.726 ( 6.132 0.211 4.674) 7.714 17.727 ( -7.100 3.322 9.420) 12.255 17.920 ( -6.887 -3.674 12.727) 14.930 18.379 ( 12.622 3.840 -9.954) 16.527 18.611 ( 2.421 -3.575 -7.139) 8.343 18.877 ( -5.018 1.286 -2.260) 5.652 19.692 ( 2.097 2.368 5.173) 6.064 20.140 ( 2.031 -3.393 -8.217) 9.119 ======================= Grid point 590 (294/336) ======================= q-point: (-0.09 -0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( -14.844 18.214 7.347) 24.618 2.705 ( -9.380 6.918 -2.787) 11.984 3.256 ( 0.519 -0.487 -3.147) 3.226 5.094 ( -26.634 -19.753 -1.675) 33.202 5.449 ( -0.736 -4.876 1.305) 5.101 6.140 ( -0.934 -1.468 -2.473) 3.024 6.587 ( 24.619 -2.091 -0.468) 24.712 6.797 ( 2.421 -9.738 -0.497) 10.047 7.285 ( -3.562 10.438 -0.044) 11.029 7.719 ( 2.828 3.512 -3.785) 5.887 7.932 ( 0.554 6.819 0.427) 6.855 8.432 ( 1.344 -5.349 -4.008) 6.818 8.582 ( -1.700 5.812 1.521) 6.243 9.205 ( 4.445 7.055 -1.875) 8.547 9.738 ( 0.566 -2.333 -6.039) 6.499 10.093 ( 12.069 -1.740 6.470) 13.804 11.394 ( -0.779 -10.801 5.479) 12.136 12.050 ( -5.616 7.589 2.188) 9.691 15.040 ( 6.932 -4.394 -1.903) 8.425 15.677 ( -9.521 12.827 -2.148) 16.118 16.104 ( -9.819 -1.229 -3.569) 10.519 16.469 ( -5.145 -10.062 0.819) 11.331 16.806 ( 0.855 0.978 2.792) 3.080 17.594 ( -7.942 5.466 11.371) 14.908 17.901 ( -4.609 -1.703 11.141) 12.176 18.538 ( 11.449 3.519 -3.498) 12.478 18.649 ( 3.928 0.131 -9.678) 10.445 18.811 ( 0.004 -1.364 -2.718) 3.041 19.739 ( 3.465 0.734 2.132) 4.134 20.164 ( 1.120 -3.425 -9.627) 10.279 ======================= Grid point 599 (295/336) ======================= q-point: (-0.27 -0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.940 ( -9.307 -0.000 2.482) 9.632 3.139 ( -13.616 -0.000 -5.006) 14.507 3.282 ( -8.476 -0.000 -2.663) 8.885 5.088 ( -21.673 -0.000 0.066) 21.673 5.402 ( -5.125 -0.000 -5.054) 7.198 6.090 ( 27.196 0.000 -3.334) 27.400 6.120 ( 2.194 0.000 2.913) 3.647 6.687 ( -4.084 -0.000 -3.649) 5.477 7.571 ( -4.768 -0.000 -1.949) 5.151 7.665 ( 4.393 0.000 -1.571) 4.666 8.080 ( 9.975 0.000 -1.233) 10.051 8.262 ( -5.155 -0.000 2.222) 5.613 8.791 ( -11.308 -0.000 1.170) 11.368 9.244 ( 8.425 0.000 0.364) 8.433 9.569 ( 12.136 0.000 -2.603) 12.412 9.868 ( 3.344 0.000 -2.998) 4.491 11.173 ( 1.803 0.000 6.088) 6.350 12.244 ( -3.180 -0.000 1.893) 3.700 14.817 ( 8.771 0.000 -1.267) 8.863 16.167 ( -1.367 -0.000 -0.055) 1.368 16.290 ( -6.311 -0.000 1.007) 6.391 16.326 ( -11.322 -0.000 -8.358) 14.073 16.725 ( 6.094 0.000 4.589) 7.629 17.773 ( -6.121 -0.000 15.005) 16.205 17.870 ( -5.568 -0.000 7.603) 9.424 18.427 ( 12.824 0.000 -12.877) 18.174 18.567 ( 2.604 0.000 -3.723) 4.543 18.891 ( -5.456 -0.000 -1.947) 5.793 19.722 ( 1.903 0.000 5.839) 6.141 20.098 ( 1.523 0.000 -9.262) 9.387 ======================= Grid point 600 (296/336) ======================= q-point: (-0.18 -0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( -22.746 13.128 10.004) 28.104 2.836 ( -14.064 4.940 -1.087) 14.946 3.232 ( 3.709 -1.310 -5.872) 7.068 4.741 ( -25.480 -12.786 -0.272) 28.510 5.353 ( -0.581 -3.503 -2.063) 4.106 6.128 ( -2.440 -0.145 -1.505) 2.870 6.559 ( 24.065 0.020 -2.334) 24.178 6.663 ( 3.990 -4.442 -1.171) 6.085 7.468 ( -2.413 6.578 -1.154) 7.101 7.732 ( 3.084 -0.628 -1.222) 3.376 8.090 ( -2.111 8.210 -1.209) 8.563 8.292 ( 3.667 -8.133 -3.469) 9.572 8.660 ( -3.696 1.918 5.278) 6.723 9.359 ( 7.300 6.368 0.798) 9.720 9.689 ( 2.851 -2.151 -8.546) 9.262 10.069 ( 15.261 -0.623 8.253) 17.361 11.216 ( -2.642 -5.883 4.480) 7.853 12.155 ( -5.120 2.937 0.910) 5.972 14.970 ( 7.694 -2.100 -1.464) 8.109 15.958 ( -10.340 15.208 -2.412) 18.548 16.091 ( -11.467 -0.241 -4.185) 12.209 16.239 ( -8.337 -13.592 -1.388) 16.005 16.809 ( 1.386 -0.158 3.198) 3.489 17.691 ( -9.348 3.593 15.391) 18.363 17.863 ( -0.985 -1.800 6.932) 7.229 18.598 ( 10.463 2.604 -5.285) 12.008 18.637 ( 8.983 -1.363 -8.477) 12.426 18.800 ( -3.572 -0.052 -1.140) 3.749 19.767 ( 1.601 1.503 4.219) 4.756 20.093 ( 1.851 -2.858 -12.055) 12.526 ======================= Grid point 601 (297/336) ======================= q-point: (-0.09 -0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( -24.553 12.580 6.792) 28.413 2.577 ( -10.392 3.741 6.036) 12.587 3.348 ( 8.880 -0.840 -0.980) 8.974 4.379 ( -31.712 -17.115 -0.663) 36.042 5.422 ( 3.581 -5.667 1.076) 6.790 6.043 ( -5.990 -3.232 -5.069) 8.486 6.715 ( 3.568 -1.579 2.537) 4.654 7.085 ( 25.662 -4.780 -1.399) 26.140 7.356 ( -0.244 9.862 0.974) 9.913 7.771 ( 2.930 2.404 -1.730) 4.166 7.996 ( 0.773 4.895 -2.791) 5.687 8.404 ( 2.979 -5.113 -2.906) 6.593 8.637 ( 0.064 3.453 6.186) 7.085 9.379 ( 4.538 11.246 -1.704) 12.246 9.713 ( 1.119 -3.051 -2.781) 4.277 10.329 ( 9.507 4.829 2.096) 10.867 11.242 ( -6.034 -11.930 2.679) 13.635 12.068 ( 0.689 5.369 5.464) 7.691 15.102 ( 4.600 -2.045 -2.619) 5.675 15.576 ( -14.500 10.702 -2.961) 18.263 15.901 ( -9.619 -1.592 -0.133) 9.750 16.196 ( -10.741 -13.508 -1.166) 17.298 16.814 ( -1.295 1.931 1.141) 2.590 17.510 ( -13.626 2.305 10.742) 17.504 17.905 ( 1.137 0.302 6.417) 6.524 18.698 ( 2.686 2.270 -6.421) 7.321 18.718 ( 4.497 2.068 2.648) 5.614 18.853 ( 10.839 -1.698 -6.505) 12.754 19.806 ( 2.489 -0.143 1.642) 2.986 20.101 ( 1.826 -2.854 -12.250) 12.710 ======================= Grid point 611 (298/336) ======================= q-point: (-0.18 -0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( -28.609 -0.000 9.925) 30.282 2.606 ( -13.905 -0.000 5.527) 14.964 3.340 ( 9.196 0.000 -2.582) 9.552 4.190 ( -29.719 -0.000 -0.536) 29.724 5.359 ( 3.931 0.000 0.075) 3.931 6.010 ( -7.650 -0.000 -4.919) 9.095 6.716 ( 6.010 0.000 2.212) 6.404 7.021 ( 25.591 0.000 -1.725) 25.649 7.459 ( -1.702 -0.000 0.819) 1.889 7.798 ( 4.767 0.000 0.083) 4.768 8.052 ( -1.687 -0.000 -4.710) 5.003 8.340 ( 4.793 0.000 -3.492) 5.930 8.668 ( -0.406 -0.000 8.689) 8.698 9.534 ( 7.036 0.000 2.930) 7.622 9.652 ( -1.349 -0.000 -8.052) 8.164 10.387 ( 14.292 0.000 4.626) 15.023 11.102 ( -8.079 -0.000 2.101) 8.348 12.123 ( 0.756 0.000 4.521) 4.584 15.071 ( 5.642 0.000 -2.018) 5.992 15.753 ( -20.353 -0.000 -7.467) 21.679 15.905 ( -9.646 -0.000 0.144) 9.647 15.985 ( -8.069 -0.000 1.375) 8.186 16.830 ( 0.584 0.000 1.270) 1.398 17.536 ( -16.680 -0.000 10.607) 19.767 17.906 ( 2.524 0.000 5.467) 6.022 18.723 ( 3.659 0.000 -6.306) 7.291 18.738 ( 0.984 0.000 3.451) 3.589 18.835 ( 13.356 0.000 -6.983) 15.071 19.809 ( 0.510 0.000 3.357) 3.395 20.067 ( 3.788 0.000 -13.744) 14.256 ======================= Grid point 612 (299/336) ======================= q-point: (-0.09 -0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 606 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( -26.934 6.419 8.628) 29.002 2.440 ( -10.599 -3.440 11.993) 16.371 3.478 ( 3.431 1.275 -2.293) 4.319 3.679 ( -28.767 -9.920 0.814) 30.441 5.495 ( 8.408 -3.169 3.776) 9.746 5.860 ( -7.187 -2.794 -5.282) 9.347 6.826 ( 5.808 2.630 2.311) 6.781 7.399 ( 5.121 6.153 3.718) 8.827 7.496 ( 15.507 -5.530 0.209) 16.465 7.899 ( 9.455 3.669 -0.356) 10.148 8.034 ( 3.041 0.228 -5.642) 6.414 8.384 ( 0.093 -2.935 -3.115) 4.281 8.711 ( 1.198 2.314 10.086) 10.417 9.498 ( -3.725 9.093 -3.754) 10.519 9.700 ( 3.902 -4.811 1.550) 6.385 10.479 ( -0.570 9.149 -7.076) 11.580 10.979 ( -11.513 -10.497 -0.815) 15.601 12.310 ( 18.273 3.285 13.795) 23.130 15.142 ( 1.071 2.118 -3.601) 4.313 15.312 ( -18.566 1.395 -5.307) 19.359 15.754 ( -6.970 0.547 2.470) 7.415 15.883 ( -10.902 -9.465 1.432) 14.508 16.831 ( -0.501 4.740 -0.015) 4.766 17.227 ( -20.651 -3.800 2.854) 21.191 17.975 ( 2.457 0.683 5.581) 6.136 18.669 ( -2.422 0.339 -2.158) 3.261 18.857 ( 6.756 0.932 0.382) 6.831 19.026 ( 10.799 -0.197 -5.179) 11.979 19.830 ( 0.237 -1.166 1.727) 2.097 20.094 ( 5.102 0.057 -11.467) 12.551 ======================= Grid point 623 (300/336) ======================= q-point: (-0.09 -0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 336 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( -24.625 -0.000 9.471) 26.384 2.218 ( -19.464 -0.000 12.630) 23.203 3.107 ( -23.344 -0.000 4.663) 23.805 3.597 ( 4.897 0.000 -3.855) 6.233 5.694 ( 12.105 0.000 7.833) 14.418 5.716 ( -4.511 -0.000 -4.680) 6.500 6.958 ( 5.924 0.000 1.816) 6.196 7.475 ( -0.810 -0.000 3.514) 3.606 7.709 ( 8.284 0.000 3.599) 9.032 8.073 ( 5.514 0.000 -5.664) 7.905 8.184 ( 18.298 0.000 3.779) 18.684 8.319 ( -2.599 -0.000 -6.682) 7.169 8.815 ( 3.214 0.000 12.001) 12.424 9.368 ( -11.667 -0.000 -2.296) 11.890 9.786 ( 5.618 0.000 1.945) 5.946 10.392 ( -9.011 -0.000 -15.195) 17.666 10.661 ( -15.552 -0.000 -2.891) 15.818 12.878 ( 33.155 0.000 16.443) 37.009 14.898 ( -20.497 -0.000 -6.999) 21.659 15.210 ( 4.303 0.000 -2.599) 5.027 15.647 ( -11.304 -0.000 3.112) 11.725 15.681 ( -3.539 -0.000 3.248) 4.804 16.735 ( -28.761 -0.000 -1.881) 28.822 16.896 ( 2.471 0.000 -0.689) 2.566 18.043 ( 1.929 0.000 5.165) 5.513 18.620 ( -2.000 -0.000 -1.872) 2.739 18.961 ( 4.236 0.000 0.266) 4.244 19.169 ( 7.643 0.000 -3.940) 8.598 19.827 ( -0.210 -0.000 0.595) 0.631 20.153 ( 5.119 0.000 -7.105) 8.757 ======================= Grid point 624 (301/336) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( 0.000 0.000 0.000) 0.000 1.669 ( 0.000 0.000 0.000) 0.000 2.996 ( 0.000 0.000 0.000) 0.000 3.562 ( 0.000 0.000 0.000) 0.000 5.587 ( 0.000 0.000 0.000) 0.000 6.232 ( -0.000 -0.000 0.000) 0.000 7.184 ( -0.000 -0.000 0.000) 0.000 7.405 ( 0.000 0.000 0.000) 0.000 7.873 ( -0.000 -0.000 0.000) 0.000 8.060 ( 0.000 0.000 -0.000) 0.000 8.254 ( 0.000 0.000 0.000) 0.000 8.861 ( -0.000 -0.000 0.000) 0.000 8.942 ( -0.000 -0.000 0.000) 0.000 9.420 ( 0.000 0.000 0.000) 0.000 9.583 ( -0.000 -0.000 -0.000) 0.000 9.867 ( 0.000 0.000 0.000) 0.000 10.155 ( 0.000 0.000 0.000) 0.000 13.936 ( -0.000 -0.000 0.000) 0.000 14.425 ( -0.000 -0.000 0.000) 0.000 15.311 ( -0.000 -0.000 0.000) 0.000 15.405 ( 0.000 0.000 0.000) 0.000 15.707 ( 0.000 0.000 0.000) 0.000 15.963 ( -0.000 -0.000 0.000) 0.000 16.927 ( -0.000 -0.000 0.000) 0.000 18.161 ( 0.000 0.000 0.000) 0.000 18.549 ( 0.000 0.000 0.000) 0.000 19.040 ( -0.000 -0.000 0.000) 0.000 19.260 ( -0.000 -0.000 0.000) 0.000 19.822 ( 0.000 0.000 0.000) 0.000 20.179 ( -0.000 -0.000 0.000) 0.000 ======================= Grid point 626 (302/336) ======================= q-point: ( 0.09 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( 8.287 -18.714 -3.381) 20.745 1.989 ( 28.829 -11.165 -0.673) 30.923 2.953 ( -0.671 6.748 1.936) 7.052 3.610 ( 0.466 -8.022 -0.161) 8.037 5.617 ( 2.730 -1.660 -0.795) 3.292 6.129 ( -9.396 -0.880 -6.277) 11.334 7.102 ( -4.253 4.937 -3.140) 7.233 7.408 ( 5.325 10.634 -0.243) 11.895 7.857 ( -6.687 -4.545 3.433) 8.784 8.095 ( -1.400 -4.309 7.332) 8.619 8.155 ( -8.263 -0.019 -0.037) 8.263 8.717 ( -9.816 -1.084 -11.977) 15.523 9.026 ( 5.616 3.681 -1.580) 6.898 9.299 ( -1.955 0.644 -11.393) 11.578 9.699 ( 10.404 11.897 17.315) 23.443 9.874 ( -1.195 -1.284 0.549) 1.838 10.347 ( 12.817 -10.356 3.988) 16.954 13.635 ( -23.024 11.164 -4.452) 25.973 14.518 ( 11.073 0.615 -0.941) 11.130 15.257 ( -5.344 -5.010 2.339) 7.689 15.537 ( 8.352 -3.942 -0.828) 9.273 15.736 ( 2.710 -2.469 -3.377) 4.984 16.197 ( 22.439 1.163 0.971) 22.490 16.942 ( -1.407 -6.334 1.036) 6.571 18.146 ( -1.119 0.637 -0.970) 1.612 18.551 ( 0.038 0.337 1.615) 1.650 19.025 ( -2.136 -0.920 -0.062) 2.327 19.228 ( -3.651 -0.069 -0.035) 3.652 19.837 ( 1.165 -1.377 -0.867) 2.001 20.121 ( -4.709 4.003 2.475) 6.658 ======================= Grid point 627 (303/336) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.523 ( 12.173 -6.636 -5.928) 15.078 2.619 ( 11.543 -13.968 -7.514) 19.616 3.019 ( 22.844 -1.540 8.344) 24.369 3.700 ( -0.547 -10.215 -1.456) 10.333 5.706 ( 4.689 -2.767 -1.067) 5.548 5.914 ( -12.013 -4.490 -7.311) 14.762 6.954 ( -3.632 5.941 -3.965) 8.014 7.378 ( 5.104 14.119 -1.871) 15.130 7.724 ( -12.585 -0.815 5.573) 13.788 7.998 ( -13.409 -1.877 5.988) 14.805 8.092 ( -6.117 -2.542 2.203) 6.981 8.559 ( -3.840 -7.191 -13.497) 15.768 8.920 ( -2.188 13.150 -7.798) 15.445 9.323 ( 4.122 0.957 -2.871) 5.113 9.844 ( 1.166 2.547 5.337) 6.028 9.875 ( 9.738 8.846 9.982) 16.514 10.747 ( 15.292 -12.218 5.966) 20.462 13.012 ( -27.490 12.503 -8.398) 31.346 14.751 ( 16.249 5.225 0.280) 17.071 15.269 ( -2.724 -11.088 2.269) 11.641 15.726 ( 8.518 -2.826 -2.007) 9.197 15.835 ( 6.423 -6.822 -2.998) 9.838 16.558 ( 18.206 8.764 0.854) 20.224 17.068 ( 6.343 -13.915 1.286) 15.346 18.100 ( -2.350 1.247 -1.671) 3.141 18.560 ( 0.161 0.660 3.578) 3.642 18.976 ( -4.086 -0.437 -1.237) 4.291 19.133 ( -7.019 -0.216 -0.131) 7.023 19.878 ( 1.637 -2.407 -1.774) 3.409 19.980 ( -6.804 5.403 5.434) 10.248 ======================= Grid point 628 (304/336) ======================= q-point: ( 0.27 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.760 ( 14.169 0.464 -5.194) 15.099 2.632 ( -1.404 3.343 -4.163) 5.521 3.569 ( 2.090 -11.559 -3.382) 12.224 3.932 ( 27.302 -16.651 2.279) 32.061 5.686 ( -7.925 -4.530 -5.615) 10.717 5.896 ( 4.271 -6.648 1.038) 7.970 6.860 ( -0.200 0.474 -4.633) 4.661 7.295 ( 2.321 14.395 -3.344) 14.959 7.484 ( -20.440 -1.309 7.421) 21.785 7.768 ( -10.018 4.157 1.856) 11.004 7.994 ( -5.432 0.489 -0.606) 5.488 8.548 ( -2.841 -8.801 -7.343) 11.809 8.718 ( -1.861 14.120 -4.807) 15.031 9.311 ( -1.125 4.696 -1.631) 5.097 9.823 ( -2.316 -2.719 -2.827) 4.555 10.035 ( 11.105 13.077 12.516) 21.236 11.140 ( 12.965 -10.560 5.532) 17.613 12.430 ( -20.562 8.168 -8.203) 23.597 14.934 ( 11.024 8.699 1.223) 14.096 15.393 ( 1.781 -12.084 1.189) 12.273 15.863 ( 7.034 -3.239 -5.418) 9.451 16.081 ( 10.941 -9.978 1.442) 14.878 16.677 ( 5.915 7.134 2.385) 9.569 17.405 ( 15.605 -8.844 -2.030) 18.051 18.027 ( -3.237 1.420 -1.508) 3.843 18.564 ( -1.625 1.709 5.915) 6.368 18.871 ( -5.090 2.142 -3.989) 6.813 18.985 ( -9.579 -0.564 -0.433) 9.606 19.820 ( -6.117 3.169 6.523) 9.488 19.964 ( 2.837 -3.123 -0.487) 4.247 ======================= Grid point 629 (305/336) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.971 ( 12.792 3.097 -2.014) 13.314 2.571 ( 0.794 3.361 -2.549) 4.293 3.476 ( -11.128 -3.994 -7.356) 13.925 4.704 ( 31.238 -19.411 2.436) 36.858 5.605 ( -3.769 -5.518 -4.248) 7.918 6.030 ( 3.286 -2.953 3.040) 5.363 6.916 ( 0.708 -10.798 -3.354) 11.329 7.065 ( -21.731 5.771 2.014) 22.574 7.184 ( 0.189 10.315 -2.967) 10.735 7.625 ( -2.724 7.296 2.439) 8.161 7.899 ( -3.388 2.190 0.238) 4.041 8.529 ( -3.979 -5.567 -4.207) 8.033 8.545 ( -2.549 10.359 -1.364) 10.755 9.210 ( -3.507 4.179 -1.763) 5.734 9.782 ( -2.638 -1.263 -4.421) 5.301 10.111 ( 5.326 10.380 8.167) 14.241 11.444 ( 8.710 -7.240 3.898) 11.978 12.083 ( -9.416 2.832 -4.533) 10.827 15.012 ( 5.843 6.171 1.334) 8.603 15.506 ( 0.535 -5.496 -0.585) 5.553 16.011 ( 6.547 -5.561 -4.179) 9.553 16.391 ( 11.196 -9.831 2.485) 15.105 16.716 ( 3.671 4.613 4.226) 7.254 17.671 ( 8.441 -0.701 -7.254) 11.152 17.986 ( 2.259 -1.009 -0.587) 2.542 18.487 ( -7.711 3.905 8.378) 12.037 18.727 ( -6.080 4.140 -5.378) 9.112 18.841 ( -5.597 -2.021 -0.751) 5.998 19.747 ( -3.346 0.859 6.585) 7.436 20.050 ( 3.041 -3.361 -0.571) 4.569 ======================= Grid point 630 (306/336) ======================= q-point: ( 0.45 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( 4.969 2.102 -0.095) 5.397 2.585 ( 2.784 0.766 -0.413) 2.917 3.286 ( -7.288 -1.023 -4.121) 8.435 5.319 ( 14.698 -11.296 3.026) 18.783 5.613 ( 3.331 -1.277 -5.214) 6.317 6.118 ( 4.147 -2.372 3.455) 5.896 6.541 ( -21.693 6.610 0.496) 22.683 7.105 ( -1.325 -2.584 -1.158) 3.126 7.160 ( 8.506 -5.502 -3.744) 10.801 7.493 ( -3.735 10.197 2.805) 11.215 7.846 ( -0.953 0.851 0.405) 1.341 8.432 ( -1.297 4.113 0.047) 4.313 8.493 ( -2.206 -2.200 -1.687) 3.543 9.122 ( -1.787 1.579 -0.837) 2.528 9.728 ( -1.520 0.103 -2.316) 2.773 10.125 ( 1.453 3.656 2.912) 4.895 11.612 ( 3.104 -2.612 1.420) 4.298 11.963 ( -2.101 0.403 -1.191) 2.448 15.046 ( 2.058 2.225 0.585) 3.087 15.530 ( -0.411 -1.306 -0.574) 1.485 16.124 ( 2.411 -2.704 -1.754) 4.025 16.650 ( 5.906 -7.790 1.003) 9.827 16.746 ( 1.812 4.759 3.162) 5.995 17.662 ( -1.461 1.615 -3.601) 4.209 18.129 ( 9.941 -1.963 -6.943) 12.283 18.345 ( -8.331 2.671 12.428) 15.198 18.550 ( -5.384 1.861 -5.108) 7.651 18.809 ( -0.559 -0.675 -0.312) 0.930 19.729 ( -0.949 0.027 2.602) 2.769 20.114 ( 1.306 -1.425 -0.138) 1.938 ======================= Grid point 637 (307/336) ======================= q-point: ( 0.09 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( 23.110 0.000 -3.121) 23.320 2.417 ( 22.684 0.000 -6.948) 23.725 3.083 ( 13.082 0.000 7.256) 14.960 3.568 ( -0.737 -0.000 -1.539) 1.707 5.678 ( 5.430 0.000 -0.893) 5.503 5.870 ( -13.839 -0.000 -8.786) 16.393 7.023 ( -4.904 -0.000 -4.180) 6.444 7.551 ( 4.216 0.000 -3.736) 5.633 7.684 ( -14.057 -0.000 7.044) 15.723 8.000 ( -7.580 -0.000 1.449) 7.717 8.034 ( -7.313 -0.000 7.425) 10.422 8.482 ( -6.323 -0.000 -12.721) 14.206 9.049 ( -2.972 -0.000 -10.001) 10.433 9.345 ( 8.285 0.000 -1.139) 8.363 9.821 ( -3.480 -0.000 -1.641) 3.847 10.042 ( 11.377 0.000 18.649) 21.845 10.585 ( 16.285 0.000 4.615) 16.926 13.142 ( -31.166 -0.000 -9.477) 32.575 14.812 ( 20.112 0.000 1.163) 20.146 15.150 ( -4.687 -0.000 3.195) 5.673 15.685 ( 9.825 0.000 -0.564) 9.842 15.773 ( 5.099 0.000 -5.718) 7.661 16.709 ( 30.363 0.000 1.030) 30.381 16.869 ( -3.217 -0.000 2.025) 3.801 18.112 ( -2.475 -0.000 -1.488) 2.887 18.566 ( 0.313 0.000 3.309) 3.324 18.971 ( -3.220 -0.000 -0.862) 3.334 19.131 ( -7.155 -0.000 -0.031) 7.155 19.853 ( 2.002 0.000 -2.034) 2.854 20.035 ( -8.435 -0.000 4.757) 9.684 ======================= Grid point 638 (308/336) ======================= q-point: ( 0.18 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( 25.323 7.108 -4.001) 26.604 2.629 ( 4.445 -3.579 -6.054) 8.320 3.460 ( 9.230 3.071 0.430) 9.737 3.648 ( 18.546 -13.067 2.448) 22.819 5.608 ( -11.476 -2.629 -7.000) 13.697 5.806 ( 7.541 -2.411 -0.003) 7.917 6.905 ( -4.233 2.579 -4.771) 6.880 7.398 ( -21.586 -3.240 5.897) 22.610 7.521 ( -1.727 6.030 -4.596) 7.776 7.867 ( -5.296 5.946 2.170) 8.253 7.974 ( -2.981 -3.349 0.712) 4.539 8.393 ( -3.784 -5.323 -3.819) 7.566 8.917 ( -2.993 5.286 -9.723) 11.465 9.436 ( 3.187 6.142 1.579) 7.097 9.754 ( -3.882 -3.505 -3.379) 6.226 10.258 ( 8.544 8.457 14.087) 18.520 10.925 ( 13.431 -8.983 4.456) 16.761 12.554 ( -25.197 3.730 -9.670) 27.245 15.070 ( 1.887 4.065 3.087) 5.442 15.231 ( 16.047 -3.988 2.480) 16.720 15.834 ( 6.985 0.511 -4.450) 8.298 15.904 ( 9.055 -7.118 -1.343) 11.596 16.802 ( -0.574 4.400 2.915) 5.309 17.266 ( 25.800 -4.577 -0.601) 26.210 18.044 ( -4.109 0.406 -1.232) 4.309 18.587 ( -0.401 0.620 5.512) 5.561 18.897 ( -3.684 0.687 -3.555) 5.165 18.977 ( -9.971 -0.289 -0.245) 9.978 19.870 ( -2.596 1.707 0.358) 3.127 19.914 ( -3.315 -1.735 3.816) 5.344 ======================= Grid point 639 (309/336) ======================= q-point: ( 0.27 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( 23.839 15.429 -3.575) 28.620 2.665 ( 2.978 4.307 -2.183) 5.673 3.393 ( -8.852 -3.671 -5.062) 10.837 4.330 ( 30.874 -17.504 3.822) 35.696 5.475 ( -5.258 -6.662 -4.048) 9.403 5.976 ( 7.553 -2.443 1.334) 8.050 6.799 ( -4.304 -1.307 -4.457) 6.332 7.041 ( -24.395 -5.228 2.231) 25.049 7.396 ( -0.901 9.459 -3.243) 10.040 7.749 ( -2.171 5.515 0.533) 5.951 7.957 ( -0.050 3.163 1.168) 3.372 8.375 ( -4.971 -8.507 -0.535) 9.867 8.765 ( -2.367 8.916 -5.944) 10.974 9.352 ( -2.755 10.301 0.378) 10.670 9.724 ( -2.963 -4.885 -3.273) 6.585 10.296 ( 0.067 8.422 5.185) 9.891 11.239 ( 7.955 -11.753 3.088) 14.524 12.159 ( -10.880 3.774 -3.423) 12.014 15.050 ( -3.108 -1.486 2.379) 4.186 15.527 ( 14.943 6.524 1.637) 16.387 15.940 ( 7.163 -1.591 -4.007) 8.360 16.171 ( 9.963 -11.991 1.220) 15.637 16.786 ( 0.743 2.293 3.975) 4.649 17.678 ( 17.691 1.170 -4.654) 18.331 17.964 ( -3.046 -1.210 0.457) 3.309 18.552 ( -6.375 2.605 7.602) 10.257 18.780 ( -10.426 0.796 -2.713) 10.803 18.820 ( -1.509 0.369 -4.404) 4.670 19.781 ( -3.434 2.617 5.687) 7.140 19.966 ( 2.002 -4.865 -0.806) 5.322 ======================= Grid point 640 (310/336) ======================= q-point: ( 0.36 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.366 ( 16.671 21.518 -3.476) 27.441 2.664 ( 3.935 6.895 1.212) 8.031 3.244 ( -7.151 -3.170 -2.022) 8.080 5.022 ( 22.892 -18.115 4.633) 29.558 5.509 ( 2.110 -8.860 -3.906) 9.910 6.098 ( 4.179 0.142 1.687) 4.509 6.573 ( -23.873 -2.553 0.441) 24.013 6.852 ( -2.169 -10.451 -4.975) 11.777 7.305 ( 3.353 9.847 -2.406) 10.676 7.673 ( -1.971 5.840 1.294) 6.298 7.910 ( -1.115 5.728 2.143) 6.216 8.386 ( -1.756 -7.130 0.041) 7.343 8.612 ( -1.709 10.806 -1.402) 11.030 9.200 ( -3.251 7.029 -1.238) 7.843 9.700 ( -2.520 -3.254 -2.133) 4.636 10.184 ( -5.918 2.555 -2.200) 6.811 11.445 ( 1.302 -11.676 0.708) 11.770 12.038 ( 0.428 5.032 2.962) 5.855 15.008 ( -5.700 -4.292 1.190) 7.234 15.649 ( 9.341 11.661 0.511) 14.950 16.076 ( 6.491 -2.003 -1.027) 6.870 16.461 ( 7.594 -11.614 1.348) 13.941 16.806 ( 0.710 1.558 3.238) 3.663 17.726 ( -2.785 4.640 0.076) 5.413 18.081 ( 10.974 -2.914 -7.163) 13.424 18.402 ( -10.188 2.911 11.383) 15.551 18.574 ( -8.629 0.568 -4.581) 9.786 18.814 ( 2.255 0.977 -2.840) 3.755 19.751 ( 0.263 2.304 1.787) 2.927 20.049 ( 1.437 -5.054 0.417) 5.271 ======================= Grid point 641 (311/336) ======================= q-point: ( 0.45 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( 5.168 22.331 -3.800) 23.234 2.639 ( -1.279 6.206 2.467) 6.800 3.283 ( 8.161 -1.308 6.238) 10.354 5.405 ( 1.446 -3.017 4.103) 5.294 5.576 ( -4.821 -4.565 1.511) 6.809 6.173 ( -2.362 2.509 -3.947) 5.240 6.339 ( 7.875 -13.169 -2.432) 15.536 6.904 ( -5.280 -12.793 -1.467) 13.917 7.331 ( 7.856 4.740 -2.604) 9.538 7.524 ( -6.535 10.961 3.430) 13.214 7.863 ( 0.578 2.253 -0.287) 2.344 8.418 ( -0.491 0.142 -0.623) 0.806 8.536 ( 3.201 4.554 3.849) 6.768 9.127 ( 0.751 1.943 -0.464) 2.134 9.699 ( -0.218 -3.074 1.341) 3.361 10.047 ( -7.894 -4.168 -7.111) 11.413 11.518 ( -4.403 -9.630 -1.186) 10.655 12.045 ( 3.773 6.529 4.506) 8.785 14.941 ( -8.015 -6.695 0.316) 10.448 15.681 ( 7.446 12.273 0.953) 14.386 16.170 ( 3.031 1.929 2.375) 4.307 16.625 ( -0.806 -7.673 -1.856) 7.935 16.757 ( -4.906 3.335 -0.770) 5.982 17.667 ( -0.497 1.946 7.243) 7.517 18.145 ( -6.416 -0.638 1.078) 6.537 18.318 ( 3.072 0.291 -7.588) 8.192 18.506 ( 1.693 -2.567 4.232) 5.232 18.838 ( 3.239 2.096 -1.548) 4.157 19.748 ( 1.986 1.933 -3.884) 4.771 20.100 ( -0.626 -2.714 1.232) 3.046 ======================= Grid point 642 (312/336) ======================= q-point: (-0.45 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( -1.220 19.330 -0.825) 19.386 2.579 ( -0.295 4.459 4.306) 6.206 3.530 ( 13.303 1.468 9.408) 16.359 5.023 ( -28.898 12.910 0.884) 31.663 5.659 ( 5.163 -0.153 4.792) 7.046 6.090 ( 0.219 3.184 -5.292) 6.180 6.840 ( 23.474 -18.306 -3.930) 30.026 6.911 ( -6.752 -14.196 0.573) 15.730 7.199 ( -9.106 14.584 3.937) 17.639 7.519 ( 7.522 -1.861 -1.395) 7.873 7.892 ( 4.981 0.955 -1.601) 5.319 8.404 ( -0.105 -2.240 -1.148) 2.520 8.618 ( 4.761 2.488 6.935) 8.772 9.178 ( 4.982 0.406 2.478) 5.579 9.766 ( 1.637 -4.088 5.056) 6.704 9.914 ( -9.451 -8.737 -11.377) 17.179 11.463 ( -8.804 -5.003 -2.932) 10.542 12.093 ( 6.161 3.837 4.435) 8.505 14.860 ( -9.268 -8.232 0.241) 12.399 15.692 ( 6.170 12.186 1.341) 13.725 16.141 ( -3.565 7.512 4.006) 9.229 16.496 ( -13.898 -0.636 -2.662) 14.165 16.660 ( -2.563 0.751 -3.824) 4.664 17.699 ( -1.469 1.944 10.402) 10.684 18.005 ( -6.565 0.877 2.634) 7.128 18.408 ( 8.474 -4.150 -10.779) 14.326 18.638 ( 4.353 -4.853 5.208) 8.344 18.889 ( 6.140 2.828 -0.094) 6.760 19.747 ( 2.706 0.778 -8.580) 9.030 20.086 ( -2.719 0.404 1.581) 3.171 ======================= Grid point 643 (313/336) ======================= q-point: (-0.36 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( -2.091 17.798 4.420) 18.457 2.591 ( 2.231 0.895 4.042) 4.703 3.755 ( 10.081 6.019 7.895) 14.148 4.298 ( -33.088 20.359 -1.032) 38.863 5.758 ( 4.910 2.730 4.116) 6.964 6.035 ( 1.218 6.989 -3.195) 7.781 6.908 ( -6.510 2.044 5.055) 8.491 6.995 ( -6.335 -12.985 1.271) 14.504 7.384 ( 19.219 -11.993 -6.596) 23.594 7.697 ( 12.279 -3.767 -0.501) 12.854 8.002 ( 8.893 2.018 -0.735) 9.148 8.456 ( -0.147 -9.724 -0.294) 9.730 8.688 ( 2.033 4.032 9.184) 10.234 9.283 ( 5.265 1.798 4.660) 7.257 9.762 ( -13.126 -14.440 -14.203) 24.136 9.856 ( 2.302 0.028 5.221) 5.706 11.270 ( -12.446 2.011 -4.770) 13.480 12.285 ( 12.972 -5.722 5.394) 15.169 14.768 ( -10.323 -8.069 0.761) 13.125 15.662 ( 3.897 14.879 0.063) 15.381 15.946 ( -11.203 4.816 3.118) 12.587 16.241 ( -10.369 5.838 -1.064) 11.947 16.580 ( -5.708 -1.697 -1.810) 6.224 17.583 ( -8.500 9.177 5.336) 13.599 17.990 ( 1.687 -2.265 2.005) 3.463 18.523 ( 3.631 -2.583 -6.854) 8.175 18.804 ( 7.001 -5.070 4.207) 9.614 19.004 ( 8.346 1.534 0.892) 8.533 19.761 ( 3.219 -2.583 -10.428) 11.215 20.022 ( -3.283 2.683 1.778) 4.597 ======================= Grid point 644 (314/336) ======================= q-point: (-0.27 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( -0.437 17.825 7.584) 19.376 2.668 ( 3.368 -2.571 3.049) 5.221 3.415 ( -31.444 32.139 -2.651) 45.041 3.874 ( 2.704 6.857 2.884) 7.915 5.773 ( -2.152 3.857 1.461) 4.652 6.033 ( 8.131 7.423 3.288) 11.490 6.849 ( -1.369 -3.697 4.511) 5.991 7.066 ( -5.288 -17.722 -0.229) 18.495 7.675 ( 10.263 -5.465 -2.957) 11.997 8.035 ( 18.822 -2.687 -6.849) 20.209 8.128 ( 8.116 4.440 -0.957) 9.300 8.596 ( 0.793 -17.579 3.761) 17.994 8.696 ( -1.045 4.890 12.819) 13.760 9.353 ( 2.862 4.667 5.839) 8.004 9.581 ( -14.932 -15.093 -16.093) 26.641 9.899 ( 1.433 1.630 2.838) 3.573 10.952 ( -14.407 7.977 -5.841) 17.473 12.716 ( 19.291 -16.698 5.742) 26.153 14.646 ( -11.191 -5.210 1.430) 12.426 15.528 ( -1.545 14.322 -1.450) 14.478 15.764 ( -7.157 1.099 2.366) 7.618 16.011 ( -5.868 10.548 0.065) 12.070 16.446 ( -12.029 -2.061 0.659) 12.222 17.343 ( -5.707 14.154 0.472) 15.268 18.064 ( 2.118 -2.454 2.250) 3.946 18.541 ( 0.177 -1.358 -4.303) 4.516 18.980 ( 6.715 -0.458 2.359) 7.132 19.137 ( 6.649 0.286 0.619) 6.683 19.834 ( 4.027 -8.177 -7.940) 12.089 19.947 ( -2.395 3.568 1.484) 4.547 ======================= Grid point 645 (315/336) ======================= q-point: (-0.18 0.09 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( 5.254 18.984 7.166) 20.960 2.487 ( -28.396 39.245 -1.626) 48.468 2.791 ( 1.345 -7.536 -1.485) 7.798 3.820 ( 0.594 11.487 0.443) 11.511 5.680 ( -2.543 4.758 0.614) 5.430 6.163 ( 7.669 2.641 4.921) 9.487 6.948 ( 2.138 -9.697 2.657) 10.279 7.134 ( -4.724 -15.921 -0.564) 16.617 7.893 ( 10.444 -2.229 -0.995) 10.726 8.163 ( -0.326 1.896 -1.294) 2.319 8.227 ( 8.687 6.963 -8.394) 13.943 8.731 ( 1.584 -1.125 10.801) 10.974 8.849 ( 5.218 -14.874 8.254) 17.793 9.302 ( -8.103 -1.550 -0.191) 8.252 9.451 ( -3.665 -7.267 -8.814) 11.997 9.908 ( 0.821 1.946 -0.067) 2.113 10.585 ( -11.966 11.863 -4.733) 17.502 13.276 ( 16.756 -23.739 3.422) 29.258 14.501 ( -8.101 -0.902 1.599) 8.306 15.382 ( -2.730 5.407 -0.583) 6.085 15.661 ( -0.249 8.329 -0.554) 8.351 15.842 ( -2.814 8.958 1.411) 9.495 16.190 ( -15.921 1.646 0.870) 16.029 17.147 ( -0.876 13.705 -0.721) 13.752 18.122 ( 1.110 -1.817 1.254) 2.471 18.537 ( -0.083 -1.109 -1.998) 2.287 19.060 ( 3.067 2.609 0.491) 4.056 19.230 ( 3.534 0.073 0.208) 3.541 19.886 ( -1.132 3.478 0.726) 3.729 19.974 ( 3.359 -10.841 -3.407) 11.850 ======================= Grid point 646 (316/336) ======================= q-point: (-0.09 0.09 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -0.000 50.736 0.000) 50.736 1.719 ( 0.000 5.452 0.000) 5.452 2.887 ( -0.000 -8.454 0.000) 8.454 3.706 ( 0.000 12.037 0.000) 12.037 5.619 ( 0.000 3.296 0.000) 3.296 6.239 ( -0.000 0.724 0.000) 0.724 7.084 ( -0.000 -9.514 -0.000) 9.514 7.225 ( 0.000 -14.371 0.000) 14.371 7.986 ( -0.000 7.445 0.000) 7.445 8.114 ( 0.000 1.652 -0.000) 1.652 8.234 ( -0.000 1.192 -0.000) 1.192 8.807 ( -0.000 -4.201 0.000) 4.201 8.999 ( -0.000 3.279 0.000) 3.279 9.318 ( 0.000 -21.905 0.000) 21.905 9.425 ( -0.000 1.663 -0.000) 1.663 9.893 ( 0.000 1.883 0.000) 1.883 10.329 ( 0.000 13.135 0.000) 13.135 13.687 ( 0.000 -22.908 0.000) 22.908 14.429 ( -0.000 0.462 0.000) 0.462 15.330 ( -0.000 1.260 0.000) 1.260 15.559 ( 0.000 13.540 0.000) 13.540 15.754 ( 0.000 4.767 0.000) 4.767 15.984 ( -0.000 2.733 0.000) 2.733 17.029 ( -0.000 9.978 0.000) 9.978 18.149 ( 0.000 -1.220 0.000) 1.220 18.541 ( 0.000 -0.785 0.000) 0.785 19.061 ( -0.000 2.275 0.000) 2.275 19.261 ( -0.000 0.069 0.000) 0.069 19.848 ( 0.000 2.597 0.000) 2.597 20.096 ( 0.000 -8.454 0.000) 8.454 ======================= Grid point 650 (317/336) ======================= q-point: ( 0.18 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( 27.816 0.000 -3.989) 28.101 2.686 ( 6.140 0.000 -1.894) 6.426 3.363 ( -9.284 -0.000 -4.777) 10.441 4.134 ( 29.927 0.000 4.637) 30.284 5.402 ( -6.606 -0.000 -4.090) 7.770 5.950 ( 9.178 0.000 0.741) 9.208 6.812 ( -4.573 -0.000 -6.393) 7.860 6.964 ( -25.929 -0.000 3.869) 26.216 7.492 ( -1.555 -0.000 -2.841) 3.239 7.814 ( -4.401 -0.000 -1.387) 4.615 7.998 ( 5.261 0.000 0.738) 5.312 8.268 ( -7.266 -0.000 2.973) 7.850 8.850 ( -2.270 -0.000 -8.718) 9.009 9.522 ( -0.085 -0.000 4.413) 4.414 9.621 ( -5.605 -0.000 -5.280) 7.700 10.394 ( -3.438 -0.000 4.113) 5.360 11.099 ( 9.124 0.000 2.530) 9.468 12.198 ( -11.591 -0.000 -2.984) 11.969 15.025 ( -4.845 -0.000 2.477) 5.442 15.628 ( 21.223 0.000 4.294) 21.653 15.957 ( 7.871 0.000 -5.018) 9.335 15.994 ( 6.804 0.000 0.474) 6.820 16.806 ( -0.843 -0.000 3.706) 3.801 17.695 ( 22.862 0.000 -3.618) 23.146 17.950 ( -6.430 -0.000 0.759) 6.475 18.579 ( -5.676 -0.000 7.642) 9.520 18.780 ( -11.301 -0.000 -1.160) 11.360 18.832 ( -0.627 -0.000 -6.528) 6.558 19.827 ( -3.892 -0.000 9.594) 10.353 19.896 ( 1.815 0.000 -5.193) 5.501 ======================= Grid point 651 (318/336) ======================= q-point: ( 0.27 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.751 ( 20.410 13.219 -2.984) 24.499 2.809 ( 9.432 5.987 0.657) 11.191 3.184 ( -7.858 -1.999 -1.182) 8.194 4.701 ( 25.117 -11.819 3.452) 27.973 5.346 ( -1.299 -5.646 -1.563) 6.000 6.107 ( 7.007 0.458 0.299) 7.028 6.518 ( -25.161 -1.704 1.654) 25.272 6.726 ( -3.192 -3.242 -6.424) 7.872 7.466 ( 2.406 5.187 -1.405) 5.888 7.733 ( -3.035 1.243 -1.227) 3.502 8.046 ( -0.194 8.196 3.348) 8.856 8.221 ( -1.082 -9.404 2.329) 9.748 8.769 ( -0.752 4.213 -5.103) 6.660 9.391 ( -5.232 11.554 -0.892) 12.715 9.592 ( -3.880 -8.058 -0.182) 8.946 10.223 ( -11.634 1.244 -6.118) 13.203 11.252 ( 3.066 -6.359 1.017) 7.132 12.111 ( 0.578 2.062 4.812) 5.267 14.940 ( -6.882 -2.043 1.469) 7.327 15.905 ( 13.250 13.085 2.486) 18.787 16.055 ( 7.580 0.376 -0.788) 7.630 16.214 ( 8.296 -13.452 0.860) 15.828 16.818 ( -0.078 0.069 2.800) 2.802 17.814 ( -6.370 3.456 4.537) 8.550 18.025 ( 14.142 -2.331 -8.988) 16.918 18.445 ( -11.067 1.264 9.991) 14.964 18.578 ( -9.677 -0.007 -3.786) 10.392 18.834 ( 3.518 0.760 -4.510) 5.771 19.818 ( 1.157 4.532 3.380) 5.771 19.936 ( 1.239 -5.998 -1.262) 6.253 ======================= Grid point 652 (319/336) ======================= q-point: ( 0.36 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.778 ( -0.179 13.076 -0.675) 13.094 2.839 ( 7.554 20.029 0.688) 21.418 3.249 ( 11.645 -0.708 5.975) 13.108 5.244 ( 16.919 -12.584 6.311) 22.010 5.416 ( -2.117 -10.354 -0.104) 10.569 6.120 ( -10.966 -6.356 -1.105) 12.723 6.201 ( -2.987 -0.318 -4.366) 5.300 6.732 ( 0.907 -4.865 -3.355) 5.979 7.462 ( 5.389 8.001 -2.519) 9.970 7.662 ( -3.554 2.450 0.598) 4.358 7.932 ( -4.443 4.683 3.319) 7.259 8.357 ( 4.410 -5.249 0.785) 6.901 8.701 ( 1.677 9.412 1.218) 9.638 9.203 ( -3.256 6.304 -1.855) 7.334 9.598 ( -3.985 -7.508 1.034) 8.563 9.982 ( -10.726 -2.164 -9.197) 14.294 11.328 ( -2.895 -8.570 -0.350) 9.052 12.153 ( 3.395 4.128 6.036) 8.063 14.834 ( -8.741 -3.999 0.786) 9.645 15.944 ( 7.242 14.038 1.153) 15.838 16.197 ( 7.096 0.932 2.903) 7.723 16.454 ( 3.203 -9.960 -0.186) 10.464 16.787 ( -4.597 0.269 -0.865) 4.685 17.721 ( -3.392 2.997 11.712) 12.556 18.113 ( -2.526 -2.032 -9.360) 9.906 18.350 ( -1.388 2.457 1.251) 3.086 18.456 ( -1.280 -2.595 1.823) 3.420 18.880 ( 4.662 1.930 -2.544) 5.651 19.802 ( 1.861 3.627 -4.789) 6.289 20.020 ( 0.998 -5.122 2.257) 5.685 ======================= Grid point 653 (320/336) ======================= q-point: (-0.55 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( 0.424 22.426 0.820) 22.445 2.754 ( 2.553 16.125 4.682) 16.984 3.534 ( 13.768 -0.810 8.782) 16.350 5.196 ( -22.721 5.539 5.380) 23.997 5.602 ( 9.366 -5.360 5.087) 11.930 6.123 ( 1.692 -2.387 -7.071) 7.652 6.334 ( 8.249 -26.102 -3.913) 27.653 6.775 ( 2.098 -2.402 -1.900) 3.712 7.421 ( -5.678 7.229 0.935) 9.240 7.585 ( 4.070 8.079 0.518) 9.061 7.900 ( 3.720 -0.531 -2.445) 4.483 8.419 ( 0.306 1.155 -1.450) 1.879 8.673 ( 1.955 5.539 5.932) 8.348 9.199 ( 6.079 0.913 3.123) 6.895 9.588 ( -8.976 -12.161 -2.656) 15.346 9.830 ( -3.392 -1.471 -4.971) 6.195 11.314 ( -7.404 -8.729 -1.566) 11.553 12.186 ( 2.757 4.704 3.843) 6.671 14.723 ( -9.036 -5.609 0.984) 10.681 15.931 ( 4.648 11.618 1.559) 12.610 16.278 ( 1.796 6.143 3.790) 7.438 16.435 ( -10.873 -3.117 -1.874) 11.465 16.690 ( -3.150 0.327 -3.257) 4.542 17.741 ( 0.556 2.462 13.938) 14.164 18.010 ( -7.308 -0.709 3.790) 8.263 18.342 ( 6.441 -2.148 -13.545) 15.151 18.550 ( 3.038 -4.059 4.556) 6.816 18.944 ( 6.137 2.737 -0.592) 6.745 19.772 ( 1.153 1.592 -9.426) 9.629 20.070 ( -0.476 -1.799 2.235) 2.908 ======================= Grid point 654 (321/336) ======================= q-point: (-0.45 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.385 ( 1.359 27.101 3.711) 27.388 2.694 ( 2.196 9.774 5.931) 11.641 3.794 ( 8.904 -1.765 8.126) 12.183 4.669 ( -24.281 17.613 3.745) 30.230 5.785 ( 6.121 0.020 2.975) 6.806 6.143 ( 4.723 3.569 -5.229) 7.898 6.613 ( -5.164 -21.624 -0.588) 22.240 6.955 ( 4.128 -9.318 2.418) 10.474 7.227 ( 2.298 4.644 -2.621) 5.806 7.649 ( 6.754 -0.142 -0.484) 6.773 8.034 ( 11.567 -0.002 -3.611) 12.117 8.381 ( -1.144 1.588 -1.591) 2.522 8.707 ( 0.216 -1.246 6.128) 6.257 9.358 ( 9.459 4.883 9.196) 14.067 9.463 ( -15.172 -16.086 -11.653) 24.995 9.849 ( 2.683 -0.798 3.261) 4.297 11.219 ( -10.356 -6.257 -2.972) 12.459 12.230 ( 4.682 -0.265 2.035) 5.112 14.633 ( -8.156 -5.891 1.843) 10.229 15.895 ( -1.409 5.315 1.613) 5.730 16.053 ( -12.531 9.408 -3.107) 15.975 16.337 ( -2.091 5.595 4.174) 7.287 16.604 ( -3.989 2.441 -2.509) 5.308 17.742 ( -3.624 6.990 10.521) 13.141 17.949 ( -0.732 -1.665 2.455) 3.056 18.465 ( 6.449 -3.354 -8.763) 11.386 18.683 ( 5.988 -6.987 3.352) 9.794 19.042 ( 7.184 2.235 1.169) 7.614 19.727 ( -0.350 -0.977 -11.552) 11.598 20.061 ( -1.417 1.371 1.454) 2.450 ======================= Grid point 655 (322/336) ======================= q-point: (-0.36 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -0.943 22.973 6.160) 23.803 2.694 ( 3.629 6.296 4.169) 8.378 3.908 ( -6.553 2.209 2.406) 7.322 4.082 ( -10.140 29.327 3.505) 31.228 5.846 ( 1.630 3.655 1.333) 4.219 6.175 ( 6.377 6.560 -1.559) 9.281 6.709 ( -4.751 -18.997 -1.007) 19.608 6.842 ( -8.317 2.871 5.828) 10.554 7.520 ( 13.129 -10.983 -3.231) 17.420 7.871 ( 13.325 -11.296 -1.028) 17.499 8.242 ( 14.264 4.522 -3.810) 15.441 8.346 ( -3.462 -5.930 -0.952) 6.932 8.729 ( -3.385 -1.225 8.209) 8.964 9.277 ( -15.360 -16.114 -13.819) 26.202 9.497 ( 7.622 8.966 10.535) 15.795 9.914 ( 1.855 0.009 3.140) 3.647 11.030 ( -12.284 -0.032 -4.426) 13.057 12.425 ( 9.664 -12.417 2.003) 15.861 14.558 ( -6.791 -3.879 2.667) 8.263 15.659 ( -18.858 -2.643 -1.805) 19.127 15.893 ( 5.019 14.271 0.287) 15.130 16.224 ( -2.133 11.308 0.259) 11.511 16.474 ( -7.413 3.937 2.154) 8.665 17.600 ( -3.969 12.232 3.607) 13.356 18.010 ( 2.038 -2.919 3.165) 4.763 18.509 ( 0.524 -1.910 -5.368) 5.721 18.928 ( 10.408 -5.683 3.417) 12.341 19.152 ( 5.872 1.313 1.518) 6.206 19.688 ( -1.497 -6.048 -10.533) 12.238 20.017 ( -1.309 3.368 0.586) 3.661 ======================= Grid point 656 (323/336) ======================= q-point: (-0.27 0.18 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -1.328 15.706 5.501) 16.694 2.728 ( 3.143 2.337 1.316) 4.132 3.328 ( -15.352 43.876 -1.074) 46.497 4.001 ( 1.552 6.741 1.620) 7.105 5.796 ( -1.030 7.114 0.397) 7.199 6.231 ( 5.273 4.386 2.056) 7.160 6.758 ( -3.800 -11.264 1.148) 11.943 6.838 ( -1.457 -12.307 0.808) 12.419 7.799 ( 11.143 -6.565 0.097) 12.933 8.171 ( 1.777 -2.350 -1.029) 3.120 8.315 ( 7.718 -4.275 -8.696) 12.388 8.503 ( 7.690 -10.243 4.439) 13.556 8.700 ( -5.210 -3.699 9.851) 11.742 9.103 ( -13.563 -13.814 -12.658) 23.130 9.561 ( 5.931 11.582 8.501) 15.543 9.938 ( 0.684 1.065 0.296) 1.300 10.764 ( -10.579 6.366 -4.260) 13.061 12.800 ( 9.884 -24.026 1.731) 26.037 14.489 ( -4.323 -0.305 2.340) 4.925 15.399 ( -11.729 -3.338 -1.106) 12.245 15.865 ( 6.085 12.633 0.525) 14.032 16.064 ( -1.815 13.003 -2.950) 13.456 16.277 ( -10.004 6.931 4.264) 12.896 17.428 ( -1.518 14.586 0.483) 14.673 18.079 ( 1.275 -2.431 1.888) 3.332 18.507 ( -0.274 -1.999 -2.710) 3.379 19.114 ( 6.006 2.242 1.911) 6.689 19.230 ( 3.090 0.136 0.750) 3.183 19.727 ( -0.160 -13.724 -5.442) 14.765 19.962 ( -0.799 4.116 0.059) 4.193 ======================= Grid point 657 (324/336) ======================= q-point: (-0.18 0.18 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( -0.000 9.975 0.000) 9.975 2.674 ( -0.000 54.736 0.000) 54.736 2.763 ( 0.000 -2.701 -0.000) 2.701 3.935 ( 0.000 10.135 0.000) 10.135 5.714 ( 0.000 6.647 0.000) 6.647 6.263 ( -0.000 1.956 0.000) 1.956 6.856 ( -0.000 -13.390 -0.000) 13.390 6.948 ( 0.000 -13.346 0.000) 13.346 8.031 ( -0.000 -7.248 -0.000) 7.248 8.081 ( 0.000 2.313 0.000) 2.313 8.362 ( -0.000 7.841 -0.000) 7.841 8.710 ( -0.000 -5.814 0.000) 5.814 8.850 ( 0.000 -24.951 0.000) 24.951 8.985 ( -0.000 -5.629 -0.000) 5.629 9.538 ( -0.000 10.215 -0.000) 10.215 9.928 ( 0.000 1.612 0.000) 1.612 10.563 ( 0.000 10.236 0.000) 10.236 13.169 ( -0.000 -28.728 0.000) 28.728 14.445 ( -0.000 1.292 0.000) 1.292 15.321 ( -0.000 -2.857 0.000) 2.857 15.844 ( -0.000 14.838 -0.000) 14.838 15.891 ( 0.000 9.455 0.000) 9.455 16.092 ( -0.000 8.538 0.000) 8.538 17.275 ( 0.000 14.539 0.000) 14.539 18.116 ( 0.000 -2.070 0.000) 2.070 18.517 ( 0.000 -1.761 0.000) 1.761 19.127 ( -0.000 4.582 -0.000) 4.582 19.261 ( 0.000 -0.124 0.000) 0.124 19.866 ( 0.000 -14.974 0.000) 14.974 19.914 ( -0.000 4.080 0.000) 4.080 ======================= Grid point 663 (325/336) ======================= q-point: ( 0.27 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.919 ( -5.839 -0.000 1.798) 6.109 3.011 ( 9.374 0.000 7.033) 11.719 3.310 ( 17.740 0.000 -2.506) 17.917 5.058 ( 20.757 0.000 2.896) 20.958 5.308 ( -0.494 -0.000 3.361) 3.397 6.070 ( -22.548 -0.000 -0.965) 22.569 6.193 ( 2.193 0.000 -3.670) 4.276 6.690 ( 3.519 0.000 -3.956) 5.295 7.569 ( 7.161 0.000 -2.137) 7.473 7.659 ( -5.179 -0.000 -0.900) 5.257 7.996 ( -8.700 -0.000 5.884) 10.503 8.286 ( 8.210 0.000 -0.085) 8.210 8.801 ( 4.050 0.000 -0.000) 4.050 9.327 ( -8.145 -0.000 -6.727) 10.564 9.464 ( -5.780 -0.000 5.451) 7.945 9.963 ( -10.923 -0.000 -9.624) 14.558 11.237 ( -1.821 -0.000 -0.197) 1.832 12.194 ( 3.188 0.000 6.613) 7.341 14.795 ( -8.728 -0.000 0.912) 8.775 16.155 ( 1.134 0.000 1.082) 1.568 16.206 ( 8.590 0.000 3.194) 9.164 16.286 ( 10.920 0.000 0.623) 10.937 16.786 ( -4.834 -0.000 -0.963) 4.929 17.755 ( -4.915 -0.000 14.871) 15.662 18.089 ( -1.513 -0.000 -14.214) 14.294 18.391 ( 0.521 0.000 12.808) 12.819 18.415 ( -5.180 -0.000 -8.046) 9.569 18.900 ( 5.082 0.000 -2.878) 5.841 19.863 ( -0.468 -0.000 -7.955) 7.969 19.942 ( 3.925 0.000 5.585) 6.826 ======================= Grid point 664 (326/336) ======================= q-point: ( 0.36 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.839 ( -1.547 6.161 9.537) 11.459 3.138 ( 5.801 13.315 5.584) 15.560 3.527 ( 9.667 1.013 -0.224) 9.723 5.275 ( -9.517 3.780 9.949) 14.277 5.469 ( 16.554 -8.050 5.240) 19.138 5.821 ( -4.134 -13.484 -7.430) 15.941 6.181 ( 0.145 -0.411 -6.459) 6.474 6.765 ( 4.813 0.273 -2.146) 5.277 7.526 ( -6.142 3.718 0.285) 7.186 7.715 ( 9.317 3.431 -2.322) 10.196 7.885 ( -3.759 -0.375 1.226) 3.972 8.401 ( 4.134 -1.711 -2.110) 4.947 8.852 ( 0.500 10.370 4.149) 11.180 9.168 ( -3.139 -5.053 -2.295) 6.377 9.393 ( -7.522 -5.594 1.281) 9.461 9.816 ( -1.991 -0.274 -3.834) 4.329 11.181 ( -6.285 -4.041 -1.331) 7.589 12.252 ( 1.264 1.821 3.840) 4.433 14.650 ( -8.662 -1.921 1.194) 8.953 16.095 ( -4.633 4.418 0.709) 6.441 16.358 ( 6.685 1.778 5.627) 8.917 16.421 ( 0.950 1.490 -2.127) 2.765 16.662 ( -6.129 -2.264 -2.834) 7.122 17.791 ( 0.017 2.164 19.953) 20.070 17.977 ( -5.281 -1.998 -1.912) 5.962 18.329 ( 2.262 0.238 -13.323) 13.515 18.489 ( 2.869 -1.926 4.199) 5.438 18.984 ( 6.011 1.210 -0.997) 6.212 19.799 ( -1.338 0.968 -8.660) 8.816 20.035 ( 2.827 -1.329 1.842) 3.627 ======================= Grid point 665 (327/336) ======================= q-point: (-0.55 0.27 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.817 ( 2.297 13.677 11.819) 18.221 2.998 ( -1.090 22.328 2.422) 22.485 3.687 ( 2.048 -9.425 5.412) 11.060 4.989 ( -12.254 16.287 7.287) 21.645 5.764 ( 10.655 -1.755 2.088) 10.998 6.096 ( 7.496 -22.386 0.037) 23.607 6.187 ( 1.730 -5.700 -6.910) 9.123 6.831 ( 4.437 -1.735 -1.824) 5.102 7.368 ( -6.357 6.086 0.185) 8.803 7.707 ( -0.343 5.412 -0.627) 5.459 7.999 ( 11.791 -2.974 -4.717) 13.043 8.451 ( 2.630 3.108 -2.551) 4.804 8.700 ( -5.531 2.893 1.638) 6.454 9.147 ( -14.594 -15.950 -7.994) 23.049 9.446 ( 10.335 3.423 12.773) 16.783 9.834 ( 2.868 -0.631 1.486) 3.291 11.085 ( -8.813 -6.184 -2.237) 10.996 12.246 ( -0.446 1.219 0.146) 1.307 14.545 ( -6.537 -3.096 2.217) 7.565 15.896 ( -16.328 -1.766 -1.276) 16.473 16.293 ( -0.900 12.616 -2.990) 12.997 16.449 ( 3.146 5.099 6.628) 8.934 16.617 ( -2.611 -1.870 -2.210) 3.898 17.844 ( -0.065 3.821 14.426) 14.924 17.932 ( -2.911 -0.517 5.156) 5.943 18.399 ( 9.256 -3.140 -11.704) 15.249 18.562 ( 1.853 -4.809 1.091) 5.268 19.082 ( 6.377 1.640 0.960) 6.654 19.719 ( -2.638 -0.049 -9.575) 9.932 20.077 ( 1.069 0.365 -0.256) 1.159 ======================= Grid point 666 (328/336) ======================= q-point: (-0.45 0.27 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.599 ( -9.460 20.856 4.046) 23.256 2.899 ( 4.985 13.793 8.368) 16.885 3.819 ( -0.036 -9.524 5.558) 11.028 4.638 ( -7.381 26.083 3.282) 27.305 5.918 ( 7.013 4.073 0.921) 8.162 6.258 ( 7.532 0.690 -6.542) 10.000 6.348 ( -2.338 -17.387 2.992) 17.796 6.900 ( -6.204 -0.056 5.597) 8.355 7.310 ( 9.270 -6.196 -5.809) 12.573 7.716 ( 3.332 -4.240 -0.763) 5.446 8.213 ( 9.054 -3.163 -2.991) 10.047 8.397 ( 0.014 5.760 -2.136) 6.143 8.678 ( -1.084 -3.302 2.333) 4.185 8.964 ( -16.280 -15.889 -10.669) 25.126 9.661 ( 10.367 7.289 15.023) 19.654 9.906 ( 2.775 -0.602 2.477) 3.768 10.968 ( -9.386 -5.324 -2.909) 11.176 12.256 ( 1.080 -5.288 -1.640) 5.641 14.497 ( -3.483 -2.470 3.255) 5.369 15.577 ( -19.942 -4.336 -2.720) 20.588 16.176 ( 2.975 13.754 -1.364) 14.138 16.427 ( 0.493 8.913 -0.533) 8.942 16.551 ( -4.610 3.254 4.486) 7.209 17.805 ( -2.672 8.915 7.862) 12.183 17.962 ( 2.268 -1.804 4.090) 5.012 18.472 ( 0.823 -1.608 -6.496) 6.743 18.764 ( 10.927 -10.442 1.694) 15.209 19.181 ( 5.387 1.438 1.944) 5.905 19.618 ( -4.469 -1.389 -9.702) 10.772 20.070 ( -0.035 2.046 -1.050) 2.300 ======================= Grid point 667 (329/336) ======================= q-point: (-0.36 0.27 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( -9.441 13.681 2.843) 16.864 2.883 ( 3.741 12.622 4.334) 13.859 3.915 ( 3.918 4.252 3.528) 6.773 4.235 ( -7.897 28.757 -0.009) 29.822 5.951 ( 3.357 9.061 0.471) 9.674 6.321 ( 4.449 4.317 -2.058) 6.532 6.477 ( -1.351 -15.228 -0.441) 15.295 6.741 ( -7.414 0.501 4.332) 8.601 7.642 ( 13.315 -11.189 -1.143) 17.430 7.917 ( 7.632 -17.911 -0.359) 19.473 8.210 ( -7.719 -0.888 -1.085) 7.845 8.482 ( 9.373 -2.050 -2.806) 9.996 8.651 ( -5.386 -0.485 3.923) 6.680 8.831 ( -9.345 -13.331 -9.215) 18.707 9.787 ( 6.529 10.796 11.390) 16.998 9.950 ( 1.236 0.291 0.159) 1.280 10.822 ( -8.112 -0.271 -3.127) 8.698 12.400 ( 3.466 -16.666 -0.709) 17.038 14.488 ( -0.891 0.068 2.953) 3.085 15.301 ( -13.696 -5.683 -2.249) 14.998 16.117 ( 5.029 12.701 0.001) 13.660 16.303 ( -1.798 10.846 -5.822) 12.440 16.432 ( -5.251 8.641 7.788) 12.763 17.688 ( -1.353 12.068 2.361) 12.371 18.038 ( 1.913 -1.563 2.987) 3.876 18.461 ( -0.817 -2.654 -3.725) 4.646 19.075 ( 10.658 -7.920 3.488) 13.729 19.253 ( 3.028 1.927 2.154) 4.186 19.513 ( -5.776 -6.389 -8.510) 12.108 20.035 ( -0.366 3.229 -0.731) 3.331 ======================= Grid point 668 (330/336) ======================= q-point: (-0.27 0.27 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( 0.000 10.005 0.000) 10.005 2.823 ( -0.000 8.828 0.000) 8.828 3.667 ( 0.000 47.177 0.000) 47.177 4.052 ( 0.000 1.202 0.000) 1.202 5.878 ( 0.000 10.420 -0.000) 10.420 6.319 ( -0.000 3.803 0.000) 3.803 6.590 ( 0.000 -13.601 -0.000) 13.601 6.737 ( -0.000 -7.954 0.000) 7.954 7.885 ( 0.000 -7.728 0.000) 7.728 8.094 ( -0.000 -0.299 0.000) 0.299 8.239 ( 0.000 -24.160 0.000) 24.160 8.584 ( 0.000 -7.173 -0.000) 7.173 8.624 ( -0.000 5.190 0.000) 5.190 8.807 ( -0.000 -11.836 -0.000) 11.836 9.769 ( -0.000 12.321 -0.000) 12.321 9.952 ( 0.000 0.859 0.000) 0.859 10.706 ( 0.000 4.426 0.000) 4.426 12.645 ( -0.000 -24.432 0.000) 24.432 14.476 ( -0.000 1.825 0.000) 1.825 15.226 ( -0.000 -6.333 0.000) 6.333 16.104 ( -0.000 11.883 -0.000) 11.883 16.106 ( 0.000 12.154 0.000) 12.154 16.294 ( -0.000 11.706 0.000) 11.706 17.555 ( 0.000 13.867 0.000) 13.867 18.077 ( 0.000 -1.732 0.000) 1.732 18.473 ( 0.000 -2.857 0.000) 2.857 19.234 ( -0.000 6.243 -0.000) 6.243 19.248 ( 0.000 -1.921 0.000) 1.921 19.547 ( 0.000 -16.925 0.000) 16.925 19.994 ( 0.000 3.935 0.000) 3.935 ======================= Grid point 676 (331/336) ======================= q-point: (-0.64 0.36 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.948 ( 2.916 0.000 15.296) 15.572 3.347 ( 4.359 0.000 8.457) 9.514 3.481 ( -10.489 -0.000 -2.894) 10.881 5.225 ( -7.763 -0.000 8.838) 11.764 5.731 ( 14.872 0.000 5.009) 15.692 5.758 ( 10.172 0.000 -3.688) 10.820 6.161 ( 2.075 0.000 -7.606) 7.884 6.827 ( 2.350 0.000 -2.004) 3.088 7.428 ( -5.784 -0.000 0.172) 5.786 7.781 ( -5.917 -0.000 -0.407) 5.931 7.957 ( 14.324 0.000 -4.924) 15.146 8.468 ( 6.351 0.000 -3.549) 7.275 8.839 ( -11.279 -0.000 -2.758) 11.611 8.888 ( -14.179 -0.000 -3.842) 14.691 9.480 ( 11.014 0.000 14.308) 18.056 9.827 ( 2.984 0.000 0.589) 3.042 11.020 ( -8.321 -0.000 -2.232) 8.615 12.260 ( -1.987 -0.000 -0.345) 2.017 14.515 ( -5.982 -0.000 2.279) 6.402 15.876 ( -18.289 -0.000 -1.744) 18.372 16.463 ( 2.009 0.000 -7.110) 7.388 16.513 ( 4.005 0.000 10.232) 10.988 16.544 ( -2.926 -0.000 -1.118) 3.133 17.903 ( -1.012 -0.000 21.484) 21.507 17.906 ( -0.919 -0.000 1.706) 1.938 18.365 ( 9.464 0.000 -13.467) 16.460 18.514 ( -0.044 -0.000 -0.507) 0.509 19.099 ( 6.032 0.000 0.712) 6.074 19.719 ( -3.398 -0.000 -7.982) 8.675 20.080 ( 2.236 0.000 -1.379) 2.627 ======================= Grid point 678 (332/336) ======================= q-point: (-0.55 0.36 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.911 ( -15.365 9.147 6.437) 19.005 3.196 ( 3.469 17.042 8.459) 19.340 3.562 ( 0.446 -16.265 6.439) 17.498 5.046 ( -5.561 14.025 0.431) 15.093 6.003 ( 15.693 2.895 1.627) 16.040 6.031 ( 4.796 -10.211 5.617) 12.602 6.229 ( 8.909 -4.242 -5.084) 11.101 6.844 ( -0.119 -2.397 -0.586) 2.470 7.320 ( -3.791 2.886 -4.566) 6.599 7.681 ( -3.063 -0.304 -0.886) 3.203 8.168 ( 10.025 -1.359 -3.588) 10.735 8.513 ( -7.290 6.669 -1.080) 9.939 8.625 ( 4.090 -1.902 -3.178) 5.518 8.693 ( -15.213 -11.422 -6.109) 19.980 9.759 ( 11.152 2.599 18.465) 21.728 9.897 ( 3.787 -0.212 0.759) 3.869 10.876 ( -7.958 -3.039 -2.483) 8.873 12.199 ( -3.441 -1.160 -3.517) 5.055 14.464 ( -1.747 -0.880 3.422) 3.941 15.517 ( -20.152 -1.670 -3.042) 20.449 16.395 ( 0.897 8.181 -5.172) 9.720 16.520 ( -0.906 -0.163 -3.336) 3.461 16.599 ( 0.334 2.049 10.776) 10.974 17.931 ( -1.581 3.622 11.949) 12.586 17.944 ( 2.372 -0.113 4.831) 5.383 18.464 ( 0.390 1.314 -5.752) 5.913 18.574 ( 9.810 -7.902 -3.418) 13.052 19.200 ( 4.925 0.511 1.613) 5.208 19.612 ( -4.670 0.201 -7.059) 8.467 20.095 ( 0.876 0.627 -2.532) 2.752 ======================= Grid point 679 (333/336) ======================= q-point: (-0.45 0.36 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 605 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( -15.347 10.809 1.996) 18.877 3.163 ( 3.493 15.747 6.074) 17.236 3.784 ( 4.628 -12.969 5.604) 14.867 4.775 ( -5.307 21.799 -1.593) 22.492 6.114 ( 3.041 2.538 0.716) 4.025 6.252 ( 10.378 -2.256 1.005) 10.668 6.386 ( 5.133 2.508 -1.042) 5.807 6.800 ( -8.798 3.166 4.069) 10.197 7.340 ( 6.780 -16.230 -6.786) 18.852 7.711 ( 3.115 -4.916 0.386) 5.833 8.221 ( -6.929 2.016 -0.600) 7.241 8.388 ( -0.378 -6.039 -0.009) 6.050 8.529 ( -9.610 -10.656 -4.114) 14.927 8.740 ( 6.071 1.826 -3.626) 7.303 9.944 ( 1.919 2.790 14.911) 15.291 9.963 ( 6.774 3.511 -1.779) 7.835 10.777 ( -5.614 -3.361 -2.013) 6.846 12.171 ( -1.549 -7.249 -3.029) 8.008 14.489 ( 1.603 0.031 3.361) 3.723 15.208 ( -14.451 -3.575 -2.951) 15.176 16.326 ( 2.562 8.344 -2.772) 9.158 16.454 ( -2.333 4.762 -3.286) 6.238 16.589 ( -1.185 6.670 7.671) 10.234 17.881 ( -1.177 7.659 4.268) 8.847 18.029 ( 3.347 0.612 4.677) 5.784 18.414 ( -2.195 -1.936 -4.700) 5.537 18.853 ( 9.588 -12.269 0.747) 15.588 19.275 ( 3.088 0.408 1.723) 3.560 19.485 ( -5.420 1.406 -5.889) 8.126 20.081 ( 0.069 1.585 -1.672) 2.305 ======================= Grid point 680 (334/336) ======================= q-point: (-0.36 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.267 ( 0.000 10.208 0.000) 10.208 3.060 ( -0.000 14.615 0.000) 14.615 3.968 ( -0.000 -9.632 0.000) 9.632 4.445 ( 0.000 32.425 0.000) 32.425 6.099 ( -0.000 9.599 0.000) 9.599 6.383 ( -0.000 -4.072 0.000) 4.072 6.388 ( 0.000 2.443 -0.000) 2.443 6.663 ( -0.000 0.580 0.000) 0.580 7.647 ( 0.000 -23.157 0.000) 23.157 7.831 ( 0.000 -9.952 0.000) 9.952 8.091 ( -0.000 0.299 0.000) 0.299 8.444 ( -0.000 -6.947 0.000) 6.947 8.564 ( -0.000 -12.487 0.000) 12.487 8.746 ( -0.000 5.654 0.000) 5.654 9.965 ( 0.000 0.578 -0.000) 0.578 9.978 ( -0.000 8.830 0.000) 8.830 10.735 ( -0.000 -1.038 0.000) 1.038 12.264 ( -0.000 -14.634 0.000) 14.634 14.511 ( 0.000 1.600 0.000) 1.600 15.105 ( -0.000 -5.642 0.000) 5.642 16.292 ( -0.000 7.463 -0.000) 7.463 16.328 ( 0.000 10.168 0.000) 10.168 16.512 ( -0.000 10.042 0.000) 10.042 17.792 ( -0.000 10.405 0.000) 10.405 18.064 ( 0.000 0.702 0.000) 0.702 18.409 ( 0.000 -3.602 -0.000) 3.602 19.097 ( -0.000 -14.599 -0.000) 14.599 19.332 ( -0.000 -3.566 -0.000) 3.566 19.355 ( 0.000 5.824 0.000) 5.824 20.058 ( 0.000 2.519 0.000) 2.519 ======================= Grid point 690 (335/336) ======================= q-point: (-0.55 0.45 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 330 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.621 ( -18.047 -0.000 2.179) 18.178 3.474 ( 0.453 0.000 3.349) 3.379 3.491 ( 7.534 0.000 9.086) 11.803 4.997 ( -5.418 -0.000 -3.228) 6.307 6.058 ( 1.770 0.000 1.890) 2.589 6.333 ( 8.095 0.000 -3.102) 8.669 6.423 ( 20.250 0.000 9.732) 22.467 6.801 ( -1.968 -0.000 -0.563) 2.047 7.176 ( -10.273 -0.000 -10.110) 14.414 7.668 ( 3.166 0.000 0.468) 3.200 8.283 ( 4.878 0.000 -1.563) 5.123 8.288 ( -15.944 -0.000 0.604) 15.956 8.408 ( -6.956 -0.000 -2.674) 7.452 8.763 ( 8.188 0.000 -3.932) 9.084 9.952 ( 1.597 0.000 4.426) 4.706 10.017 ( 7.521 0.000 9.288) 11.952 10.737 ( -4.697 -0.000 -1.669) 4.984 12.105 ( -3.390 -0.000 -3.925) 5.186 14.489 ( 2.531 0.000 3.501) 4.320 15.173 ( -14.754 -0.000 -3.182) 15.093 16.412 ( 0.220 0.000 -5.742) 5.746 16.497 ( -0.548 -0.000 0.100) 0.557 16.657 ( -0.421 -0.000 7.047) 7.060 17.961 ( -1.132 -0.000 5.358) 5.476 18.041 ( 4.616 0.000 5.572) 7.236 18.397 ( -3.966 -0.000 -4.433) 5.948 18.711 ( 9.212 0.000 -1.847) 9.396 19.278 ( 2.715 0.000 1.166) 2.955 19.505 ( -4.318 -0.000 -4.054) 5.923 20.096 ( 0.252 0.000 -2.138) 2.153 ======================= Grid point 692 (336/336) ======================= q-point: (-0.45 0.45 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 6.61e-05 6.61e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 308 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.426 ( 0.000 5.005 0.000) 5.005 3.363 ( -0.000 16.273 0.000) 16.273 3.711 ( 0.000 -15.759 0.000) 15.759 4.877 ( 0.000 11.645 0.000) 11.645 6.095 ( 0.000 -3.687 0.000) 3.687 6.406 ( 0.000 0.090 -0.000) 0.090 6.613 ( -0.000 21.460 -0.000) 21.460 6.718 ( 0.000 2.908 0.000) 2.908 7.141 ( 0.000 -25.913 0.000) 25.913 7.739 ( -0.000 -2.009 0.000) 2.009 8.108 ( -0.000 1.132 0.000) 1.132 8.338 ( -0.000 -3.363 0.000) 3.363 8.370 ( -0.000 -6.213 0.000) 6.213 8.822 ( -0.000 2.053 0.000) 2.053 9.974 ( 0.000 0.339 0.000) 0.339 10.095 ( -0.000 3.152 0.000) 3.152 10.698 ( -0.000 -1.658 0.000) 1.658 12.083 ( -0.000 -4.444 0.000) 4.444 14.533 ( 0.000 0.633 0.000) 0.633 15.026 ( -0.000 -2.195 0.000) 2.195 16.389 ( -0.000 2.522 0.000) 2.522 16.472 ( 0.000 4.158 0.000) 4.158 16.649 ( -0.000 3.755 0.000) 3.755 17.941 ( -0.000 4.481 0.000) 4.481 18.100 ( 0.000 2.199 0.000) 2.199 18.347 ( -0.000 -2.250 0.000) 2.250 18.841 ( -0.000 -8.782 0.000) 8.782 19.307 ( -0.000 -0.337 0.000) 0.337 19.439 ( 0.000 2.448 0.000) 2.448 20.089 ( 0.000 0.789 0.000) 0.789 =================== 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 3/36300 10.0 94.372 114.402 40.446 -0.000 -15.983 0.000 3/36300 20.0 139.380 114.869 55.552 -0.000 -20.954 0.000 3/36300 30.0 134.449 112.378 48.135 -0.000 -17.145 0.000 3/36300 40.0 110.780 99.104 37.807 -0.000 -11.264 0.000 3/36300 50.0 84.395 81.169 28.635 -0.000 -6.514 0.000 3/36300 60.0 63.557 64.871 21.766 -0.000 -3.721 0.000 3/36300 70.0 48.811 52.098 16.921 -0.000 -2.217 0.000 3/36300 80.0 38.601 42.565 13.531 -0.000 -1.397 0.000 3/36300 90.0 31.442 35.492 11.125 -0.000 -0.930 0.000 3/36300 100.0 26.294 30.185 9.376 -0.000 -0.650 0.000 3/36300 110.0 22.485 26.127 8.072 -0.000 -0.474 0.000 3/36300 120.0 19.588 22.961 7.075 -0.000 -0.358 0.000 3/36300 130.0 17.329 20.444 6.295 -0.000 -0.279 0.000 3/36300 140.0 15.528 18.404 5.672 -0.000 -0.223 0.000 3/36300 150.0 14.064 16.726 5.165 -0.000 -0.182 0.000 3/36300 160.0 12.853 15.323 4.745 -0.000 -0.152 0.000 3/36300 170.0 11.837 14.137 4.392 -0.000 -0.129 0.000 3/36300 180.0 10.973 13.121 4.092 -0.000 -0.111 0.000 3/36300 190.0 10.230 12.242 3.833 -0.000 -0.097 0.000 3/36300 200.0 9.584 11.475 3.608 -0.000 -0.086 0.000 3/36300 210.0 9.018 10.800 3.411 -0.000 -0.077 0.000 3/36300 220.0 8.517 10.202 3.236 -0.000 -0.069 0.000 3/36300 230.0 8.071 9.668 3.079 -0.000 -0.063 0.000 3/36300 240.0 7.672 9.188 2.939 -0.000 -0.058 0.000 3/36300 250.0 7.312 8.755 2.812 -0.000 -0.053 0.000 3/36300 260.0 6.985 8.362 2.696 -0.000 -0.050 0.000 3/36300 270.0 6.688 8.004 2.590 -0.000 -0.046 0.000 3/36300 280.0 6.416 7.676 2.493 -0.000 -0.043 0.000 3/36300 290.0 6.166 7.375 2.404 -0.000 -0.041 0.000 3/36300 300.0 5.935 7.097 2.321 -0.000 -0.039 0.000 3/36300 310.0 5.722 6.840 2.244 -0.000 -0.037 0.000 3/36300 320.0 5.525 6.601 2.172 -0.000 -0.035 0.000 3/36300 330.0 5.341 6.379 2.105 -0.000 -0.033 0.000 3/36300 340.0 5.169 6.172 2.043 -0.000 -0.032 0.000 3/36300 350.0 5.008 5.978 1.984 -0.000 -0.031 0.000 3/36300 360.0 4.858 5.797 1.928 -0.000 -0.029 0.000 3/36300 370.0 4.716 5.626 1.876 -0.000 -0.028 0.000 3/36300 380.0 4.583 5.466 1.826 -0.000 -0.027 0.000 3/36300 390.0 4.457 5.314 1.780 -0.000 -0.026 0.000 3/36300 400.0 4.338 5.171 1.735 -0.000 -0.025 0.000 3/36300 410.0 4.226 5.036 1.693 -0.000 -0.025 0.000 3/36300 420.0 4.119 4.908 1.653 -0.000 -0.024 0.000 3/36300 430.0 4.018 4.786 1.615 -0.000 -0.023 0.000 3/36300 440.0 3.922 4.670 1.578 -0.000 -0.022 0.000 3/36300 450.0 3.830 4.560 1.543 -0.000 -0.022 0.000 3/36300 460.0 3.743 4.455 1.510 -0.000 -0.021 0.000 3/36300 470.0 3.660 4.355 1.478 -0.000 -0.021 0.000 3/36300 480.0 3.580 4.260 1.448 -0.000 -0.020 0.000 3/36300 490.0 3.504 4.168 1.419 -0.000 -0.020 0.000 3/36300 500.0 3.431 4.081 1.391 -0.000 -0.019 0.000 3/36300 510.0 3.361 3.997 1.364 -0.000 -0.019 0.000 3/36300 520.0 3.294 3.916 1.338 -0.000 -0.018 0.000 3/36300 530.0 3.230 3.839 1.313 -0.000 -0.018 0.000 3/36300 540.0 3.168 3.765 1.289 -0.000 -0.018 0.000 3/36300 550.0 3.108 3.694 1.266 -0.000 -0.017 0.000 3/36300 560.0 3.051 3.625 1.243 -0.000 -0.017 0.000 3/36300 570.0 2.996 3.559 1.222 -0.000 -0.017 0.000 3/36300 580.0 2.943 3.496 1.201 -0.000 -0.016 0.000 3/36300 590.0 2.891 3.434 1.181 -0.000 -0.016 0.000 3/36300 600.0 2.842 3.375 1.161 -0.000 -0.016 0.000 3/36300 610.0 2.794 3.318 1.142 -0.000 -0.015 0.000 3/36300 620.0 2.748 3.263 1.124 -0.000 -0.015 0.000 3/36300 630.0 2.703 3.209 1.107 -0.000 -0.015 0.000 3/36300 640.0 2.660 3.158 1.090 -0.000 -0.014 0.000 3/36300 650.0 2.618 3.108 1.073 -0.000 -0.014 0.000 3/36300 660.0 2.577 3.059 1.057 -0.000 -0.014 0.000 3/36300 670.0 2.538 3.012 1.041 -0.000 -0.014 0.000 3/36300 680.0 2.500 2.967 1.026 -0.000 -0.014 0.000 3/36300 690.0 2.463 2.923 1.011 -0.000 -0.013 0.000 3/36300 700.0 2.427 2.880 0.997 -0.000 -0.013 0.000 3/36300 710.0 2.392 2.838 0.983 -0.000 -0.013 0.000 3/36300 720.0 2.358 2.798 0.970 -0.000 -0.013 0.000 3/36300 730.0 2.326 2.759 0.957 -0.000 -0.013 0.000 3/36300 740.0 2.294 2.721 0.944 -0.000 -0.012 0.000 3/36300 750.0 2.263 2.684 0.931 -0.000 -0.012 0.000 3/36300 760.0 2.232 2.648 0.919 -0.000 -0.012 0.000 3/36300 770.0 2.203 2.612 0.907 -0.000 -0.012 0.000 3/36300 780.0 2.174 2.578 0.896 -0.000 -0.012 0.000 3/36300 790.0 2.146 2.545 0.885 -0.000 -0.012 0.000 3/36300 800.0 2.119 2.513 0.874 -0.000 -0.011 0.000 3/36300 810.0 2.092 2.481 0.863 -0.000 -0.011 0.000 3/36300 820.0 2.067 2.450 0.853 -0.000 -0.011 0.000 3/36300 830.0 2.041 2.420 0.842 -0.000 -0.011 0.000 3/36300 840.0 2.017 2.391 0.833 -0.000 -0.011 0.000 3/36300 850.0 1.993 2.362 0.823 -0.000 -0.011 0.000 3/36300 860.0 1.969 2.334 0.813 -0.000 -0.011 0.000 3/36300 870.0 1.946 2.307 0.804 -0.000 -0.010 0.000 3/36300 880.0 1.924 2.280 0.795 -0.000 -0.010 0.000 3/36300 890.0 1.902 2.254 0.786 -0.000 -0.010 0.000 3/36300 900.0 1.881 2.229 0.778 -0.000 -0.010 0.000 3/36300 910.0 1.860 2.204 0.769 -0.000 -0.010 0.000 3/36300 920.0 1.839 2.180 0.761 -0.000 -0.010 0.000 3/36300 930.0 1.819 2.156 0.753 -0.000 -0.010 0.000 3/36300 940.0 1.800 2.133 0.745 -0.000 -0.010 0.000 3/36300 950.0 1.781 2.110 0.737 -0.000 -0.009 0.000 3/36300 960.0 1.762 2.088 0.729 -0.000 -0.009 0.000 3/36300 970.0 1.744 2.066 0.722 -0.000 -0.009 0.000 3/36300 980.0 1.726 2.045 0.715 -0.000 -0.009 0.000 3/36300 990.0 1.708 2.024 0.707 -0.000 -0.009 0.000 3/36300 1000.0 1.691 2.003 0.700 -0.000 -0.009 0.000 3/36300 Thermal conductivity related properties were written into "kappa-m111110.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 00:05:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|