# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/2359c450-0660-47e6-9674-cae76d7565e5/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [First-principles lattice thermal conductivity calculation for BeO / P4_2/mnm (136) / materials id 7599](https://mdr.nims.go.jp/datasets/e50a6717-73e1-4e59-a2c3-08897e076b61) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-07 22:28:04]-------------------------Compiled with OpenMP support (max 128 threads).Running in phonopy.load mode.Python version 3.14.2Spglib version 2.6.1Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".Unit of length: angstromSettings: Supercell: [2 2 4] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P4_2/mnm (136)Number of symmetry operations in supercell: 256------------------------------ primitive cell ------------------------------Lattice vectors: a 4.613449720000000 0.000000000000000 0.000000000000000 b 0.000000000000000 4.613449720000000 0.000000000000000 c 0.000000000000000 0.000000000000000 2.690608570000000Atomic positions (fractional): *1 Be 0.82662899841735 0.17337100158266 0.00000000000000 9.012 2 Be 0.32662899841734 0.32662899841734 0.50000000000000 9.012 3 Be 0.67337100158265 0.67337100158265 0.50000000000000 9.012 4 Be 0.17337100158266 0.82662899841735 0.00000000000000 9.012 *5 O 0.81125315509252 0.81125315509252 0.00000000000000 15.999 6 O 0.68874684490748 0.31125315509252 0.50000000000000 15.999 7 O 0.31125315509252 0.68874684490748 0.50000000000000 15.999 8 O 0.18874684490748 0.18874684490748 0.00000000000000 15.999-------------------------------- unit cell ---------------------------------Lattice vectors: a 4.613449720000000 0.000000000000000 0.000000000000000 b 0.000000000000000 4.613449720000000 0.000000000000000 c 0.000000000000000 0.000000000000000 2.690608570000000Atomic positions (fractional): *1 Be 0.82662899841735 0.17337100158266 0.00000000000000 9.012 > 1 2 Be 0.32662899841734 0.32662899841734 0.50000000000000 9.012 > 2 3 Be 0.67337100158265 0.67337100158265 0.50000000000000 9.012 > 3 4 Be 0.17337100158266 0.82662899841735 0.00000000000000 9.012 > 4 *5 O 0.81125315509252 0.81125315509252 0.00000000000000 15.999 > 5 6 O 0.68874684490748 0.31125315509252 0.50000000000000 15.999 > 6 7 O 0.31125315509252 0.68874684490748 0.50000000000000 15.999 > 7 8 O 0.18874684490748 0.18874684490748 0.00000000000000 15.999 > 8-------------------------------- super cell --------------------------------Lattice vectors: a 9.226899440000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.226899440000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.762434280000001Atomic positions (fractional): *1 Be 0.41331449920867 0.08668550079133 0.00000000000000 9.012 > 1 2 Be 0.91331449920867 0.08668550079133 0.00000000000000 9.012 > 1 3 Be 0.41331449920867 0.58668550079133 0.00000000000000 9.012 > 1 4 Be 0.91331449920867 0.58668550079133 0.00000000000000 9.012 > 1 5 Be 0.41331449920867 0.08668550079133 0.25000000000000 9.012 > 1 6 Be 0.91331449920867 0.08668550079133 0.25000000000000 9.012 > 1 7 Be 0.41331449920867 0.58668550079133 0.25000000000000 9.012 > 1 8 Be 0.91331449920867 0.58668550079133 0.25000000000000 9.012 > 1 9 Be 0.41331449920867 0.08668550079133 0.50000000000000 9.012 > 1 10 Be 0.91331449920867 0.08668550079133 0.50000000000000 9.012 > 1 11 Be 0.41331449920867 0.58668550079133 0.50000000000000 9.012 > 1 12 Be 0.91331449920867 0.58668550079133 0.50000000000000 9.012 > 1 13 Be 0.41331449920867 0.08668550079133 0.75000000000000 9.012 > 1 14 Be 0.91331449920867 0.08668550079133 0.75000000000000 9.012 > 1 15 Be 0.41331449920867 0.58668550079133 0.75000000000000 9.012 > 1 16 Be 0.91331449920867 0.58668550079133 0.75000000000000 9.012 > 1 17 Be 0.16331449920867 0.16331449920867 0.12500000000000 9.012 > 2 18 Be 0.66331449920867 0.16331449920867 0.12500000000000 9.012 > 2 19 Be 0.16331449920867 0.66331449920867 0.12500000000000 9.012 > 2 20 Be 0.66331449920867 0.66331449920867 0.12500000000000 9.012 > 2 21 Be 0.16331449920867 0.16331449920867 0.37500000000000 9.012 > 2 22 Be 0.66331449920867 0.16331449920867 0.37500000000000 9.012 > 2 23 Be 0.16331449920867 0.66331449920867 0.37500000000000 9.012 > 2 24 Be 0.66331449920867 0.66331449920867 0.37500000000000 9.012 > 2 25 Be 0.16331449920867 0.16331449920867 0.62500000000000 9.012 > 2 26 Be 0.66331449920867 0.16331449920867 0.62500000000000 9.012 > 2 27 Be 0.16331449920867 0.66331449920867 0.62500000000000 9.012 > 2 28 Be 0.66331449920867 0.66331449920867 0.62500000000000 9.012 > 2 29 Be 0.16331449920867 0.16331449920867 0.87500000000000 9.012 > 2 30 Be 0.66331449920867 0.16331449920867 0.87500000000000 9.012 > 2 31 Be 0.16331449920867 0.66331449920867 0.87500000000000 9.012 > 2 32 Be 0.66331449920867 0.66331449920867 0.87500000000000 9.012 > 2 33 Be 0.33668550079133 0.33668550079133 0.12500000000000 9.012 > 3 34 Be 0.83668550079133 0.33668550079133 0.12500000000000 9.012 > 3 35 Be 0.33668550079133 0.83668550079133 0.12500000000000 9.012 > 3 36 Be 0.83668550079133 0.83668550079133 0.12500000000000 9.012 > 3 37 Be 0.33668550079133 0.33668550079133 0.37500000000000 9.012 > 3 38 Be 0.83668550079133 0.33668550079133 0.37500000000000 9.012 > 3 39 Be 0.33668550079133 0.83668550079133 0.37500000000000 9.012 > 3 40 Be 0.83668550079133 0.83668550079133 0.37500000000000 9.012 > 3 41 Be 0.33668550079133 0.33668550079133 0.62500000000000 9.012 > 3 42 Be 0.83668550079133 0.33668550079133 0.62500000000000 9.012 > 3 43 Be 0.33668550079133 0.83668550079133 0.62500000000000 9.012 > 3 44 Be 0.83668550079133 0.83668550079133 0.62500000000000 9.012 > 3 45 Be 0.33668550079133 0.33668550079133 0.87500000000000 9.012 > 3 46 Be 0.83668550079133 0.33668550079133 0.87500000000000 9.012 > 3 47 Be 0.33668550079133 0.83668550079133 0.87500000000000 9.012 > 3 48 Be 0.83668550079133 0.83668550079133 0.87500000000000 9.012 > 3 49 Be 0.08668550079133 0.41331449920867 0.00000000000000 9.012 > 4 50 Be 0.58668550079133 0.41331449920867 0.00000000000000 9.012 > 4 51 Be 0.08668550079133 0.91331449920867 0.00000000000000 9.012 > 4 52 Be 0.58668550079133 0.91331449920867 0.00000000000000 9.012 > 4 53 Be 0.08668550079133 0.41331449920867 0.25000000000000 9.012 > 4 54 Be 0.58668550079133 0.41331449920867 0.25000000000000 9.012 > 4 55 Be 0.08668550079133 0.91331449920867 0.25000000000000 9.012 > 4 56 Be 0.58668550079133 0.91331449920867 0.25000000000000 9.012 > 4 57 Be 0.08668550079133 0.41331449920867 0.50000000000000 9.012 > 4 58 Be 0.58668550079133 0.41331449920867 0.50000000000000 9.012 > 4 59 Be 0.08668550079133 0.91331449920867 0.50000000000000 9.012 > 4 60 Be 0.58668550079133 0.91331449920867 0.50000000000000 9.012 > 4 61 Be 0.08668550079133 0.41331449920867 0.75000000000000 9.012 > 4 62 Be 0.58668550079133 0.41331449920867 0.75000000000000 9.012 > 4 63 Be 0.08668550079133 0.91331449920867 0.75000000000000 9.012 > 4 64 Be 0.58668550079133 0.91331449920867 0.75000000000000 9.012 > 4 *65 O 0.40562657754626 0.40562657754626 0.00000000000000 15.999 > 5 66 O 0.90562657754626 0.40562657754626 0.00000000000000 15.999 > 5 67 O 0.40562657754626 0.90562657754626 0.00000000000000 15.999 > 5 68 O 0.90562657754626 0.90562657754626 0.00000000000000 15.999 > 5 69 O 0.40562657754626 0.40562657754626 0.25000000000000 15.999 > 5 70 O 0.90562657754626 0.40562657754626 0.25000000000000 15.999 > 5 71 O 0.40562657754626 0.90562657754626 0.25000000000000 15.999 > 5 72 O 0.90562657754626 0.90562657754626 0.25000000000000 15.999 > 5 73 O 0.40562657754626 0.40562657754626 0.50000000000000 15.999 > 5 74 O 0.90562657754626 0.40562657754626 0.50000000000000 15.999 > 5 75 O 0.40562657754626 0.90562657754626 0.50000000000000 15.999 > 5 76 O 0.90562657754626 0.90562657754626 0.50000000000000 15.999 > 5 77 O 0.40562657754626 0.40562657754626 0.75000000000000 15.999 > 5 78 O 0.90562657754626 0.40562657754626 0.75000000000000 15.999 > 5 79 O 0.40562657754626 0.90562657754626 0.75000000000000 15.999 > 5 80 O 0.90562657754626 0.90562657754626 0.75000000000000 15.999 > 5 81 O 0.34437342245374 0.15562657754626 0.12500000000000 15.999 > 6 82 O 0.84437342245374 0.15562657754626 0.12500000000000 15.999 > 6 83 O 0.34437342245374 0.65562657754626 0.12500000000000 15.999 > 6 84 O 0.84437342245374 0.65562657754626 0.12500000000000 15.999 > 6 85 O 0.34437342245374 0.15562657754626 0.37500000000000 15.999 > 6 86 O 0.84437342245374 0.15562657754626 0.37500000000000 15.999 > 6 87 O 0.34437342245374 0.65562657754626 0.37500000000000 15.999 > 6 88 O 0.84437342245374 0.65562657754626 0.37500000000000 15.999 > 6 89 O 0.34437342245374 0.15562657754626 0.62500000000000 15.999 > 6 90 O 0.84437342245374 0.15562657754626 0.62500000000000 15.999 > 6 91 O 0.34437342245374 0.65562657754626 0.62500000000000 15.999 > 6 92 O 0.84437342245374 0.65562657754626 0.62500000000000 15.999 > 6 93 O 0.34437342245374 0.15562657754626 0.87500000000000 15.999 > 6 94 O 0.84437342245374 0.15562657754626 0.87500000000000 15.999 > 6 95 O 0.34437342245374 0.65562657754626 0.87500000000000 15.999 > 6 96 O 0.84437342245374 0.65562657754626 0.87500000000000 15.999 > 6 97 O 0.15562657754626 0.34437342245374 0.12500000000000 15.999 > 7 98 O 0.65562657754626 0.34437342245374 0.12500000000000 15.999 > 7 99 O 0.15562657754626 0.84437342245374 0.12500000000000 15.999 > 7 100 O 0.65562657754626 0.84437342245374 0.12500000000000 15.999 > 7 101 O 0.15562657754626 0.34437342245374 0.37500000000000 15.999 > 7 102 O 0.65562657754626 0.34437342245374 0.37500000000000 15.999 > 7 103 O 0.15562657754626 0.84437342245374 0.37500000000000 15.999 > 7 104 O 0.65562657754626 0.84437342245374 0.37500000000000 15.999 > 7 105 O 0.15562657754626 0.34437342245374 0.62500000000000 15.999 > 7 106 O 0.65562657754626 0.34437342245374 0.62500000000000 15.999 > 7 107 O 0.15562657754626 0.84437342245374 0.62500000000000 15.999 > 7 108 O 0.65562657754626 0.84437342245374 0.62500000000000 15.999 > 7 109 O 0.15562657754626 0.34437342245374 0.87500000000000 15.999 > 7 110 O 0.65562657754626 0.34437342245374 0.87500000000000 15.999 > 7 111 O 0.15562657754626 0.84437342245374 0.87500000000000 15.999 > 7 112 O 0.65562657754626 0.84437342245374 0.87500000000000 15.999 > 7 113 O 0.09437342245374 0.09437342245374 0.00000000000000 15.999 > 8 114 O 0.59437342245374 0.09437342245374 0.00000000000000 15.999 > 8 115 O 0.09437342245374 0.59437342245374 0.00000000000000 15.999 > 8 116 O 0.59437342245374 0.59437342245374 0.00000000000000 15.999 > 8 117 O 0.09437342245374 0.09437342245374 0.25000000000000 15.999 > 8 118 O 0.59437342245374 0.09437342245374 0.25000000000000 15.999 > 8 119 O 0.09437342245374 0.59437342245374 0.25000000000000 15.999 > 8 120 O 0.59437342245374 0.59437342245374 0.25000000000000 15.999 > 8 121 O 0.09437342245374 0.09437342245374 0.50000000000000 15.999 > 8 122 O 0.59437342245374 0.09437342245374 0.50000000000000 15.999 > 8 123 O 0.09437342245374 0.59437342245374 0.50000000000000 15.999 > 8 124 O 0.59437342245374 0.59437342245374 0.50000000000000 15.999 > 8 125 O 0.09437342245374 0.09437342245374 0.75000000000000 15.999 > 8 126 O 0.59437342245374 0.09437342245374 0.75000000000000 15.999 > 8 127 O 0.09437342245374 0.59437342245374 0.75000000000000 15.999 > 8 128 O 0.59437342245374 0.59437342245374 0.75000000000000 15.999 > 8----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 3.0570842 0.0000000 0.0000000 0.0000000 3.0570842 0.0000000 0.0000000 0.0000000 3.0036100-------------------------- Born effective charges -------------------------- 1 Be 1.8018240 -0.1246269 0.0000000 -0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 2 Be 1.8018240 0.1246269 0.0000000 0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 3 Be 1.8018240 0.1246269 0.0000000 0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 4 Be 1.8018240 -0.1246269 0.0000000 -0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 5 O -1.8018240 -0.2111086 0.0000000 -0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 6 O -1.8018240 0.2111086 0.0000000 0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 7 O -1.8018240 0.2111086 0.0000000 0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 8 O -1.8018240 -0.2111086 0.0000000 -0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096----------------------------------------------------------------------------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: 384/384Permutation basis: 5136/5136Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 360Number of blocks in projector: 360Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 4--- Eigsh_solver_block: 1 / 4 ---Block_size: 104Use standard eigh solver.--- Eigsh_solver_block: 2 / 4 ---Block_size: 96Use standard eigh solver.--- Eigsh_solver_block: 3 / 4 ---Block_size: 92Use standard eigh solver.--- Eigsh_solver_block: 4 / 4 ---Block_size: 68Use standard eigh solver.Tree of FC basis block matrices:- (360, 354), data: False|-- (68, 66), data: True|-- (92, 90), data: True|-- (96, 96), data: True|-- (104, 102), data: True-----Solver_atoms: 1 -- 128 / 128Time (Solver_compr_matrix_reshape): 0.004Solver_block: 80 / 80 - Time: 0.274Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.280--------------------------------- Symfc end --------------------------------Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 384/384Permutation basis: 5136/5136Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 360Number of blocks in projector: 360Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 4--- Eigsh_solver_block: 1 / 4 ---Block_size: 104Use standard eigh solver.--- Eigsh_solver_block: 2 / 4 ---Block_size: 96Use standard eigh solver.--- Eigsh_solver_block: 3 / 4 ---Block_size: 92Use standard eigh solver.--- Eigsh_solver_block: 4 / 4 ---Block_size: 68Use standard eigh solver.Tree of FC basis block matrices:- (360, 354), data: False|-- (68, 66), data: True|-- (92, 90), data: True|-- (96, 96), data: True|-- (104, 102), data: TrueMax drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5".---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d)----------------------------------------------------------------------------Summary of calculation was written in "phonopy.yaml".-------------------------[time 2026-01-07 22:28:08]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-07 22:28:08]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: force constantsHDF5 data compression filter: gzipCrystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz".Supercell (dim): [2 2 4]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P4_2/mnm (136)------------------------------ primitive cell ------------------------------Lattice vectors: a 4.613449720000000 0.000000000000000 0.000000000000000 b 0.000000000000000 4.613449720000000 0.000000000000000 c 0.000000000000000 0.000000000000000 2.690608570000000Atomic positions (fractional): 1 Be 0.82662899841735 0.17337100158266 0.00000000000000 9.012 2 Be 0.32662899841734 0.32662899841734 0.50000000000000 9.012 3 Be 0.67337100158265 0.67337100158265 0.50000000000000 9.012 4 Be 0.17337100158266 0.82662899841735 0.00000000000000 9.012 5 O 0.81125315509252 0.81125315509252 0.00000000000000 15.999 6 O 0.68874684490748 0.31125315509252 0.50000000000000 15.999 7 O 0.31125315509252 0.68874684490748 0.50000000000000 15.999 8 O 0.18874684490748 0.18874684490748 0.00000000000000 15.999-------------------------------- supercell ---------------------------------Lattice vectors: a 9.226899440000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.226899440000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.762434280000001Atomic positions (fractional): 1 Be 0.41331449920867 0.08668550079133 0.00000000000000 9.012 > 1 2 Be 0.91331449920867 0.08668550079133 0.00000000000000 9.012 > 1 3 Be 0.41331449920867 0.58668550079133 0.00000000000000 9.012 > 1 4 Be 0.91331449920867 0.58668550079133 0.00000000000000 9.012 > 1 5 Be 0.41331449920867 0.08668550079133 0.25000000000000 9.012 > 1 6 Be 0.91331449920867 0.08668550079133 0.25000000000000 9.012 > 1 7 Be 0.41331449920867 0.58668550079133 0.25000000000000 9.012 > 1 8 Be 0.91331449920867 0.58668550079133 0.25000000000000 9.012 > 1 9 Be 0.41331449920867 0.08668550079133 0.50000000000000 9.012 > 1 10 Be 0.91331449920867 0.08668550079133 0.50000000000000 9.012 > 1 11 Be 0.41331449920867 0.58668550079133 0.50000000000000 9.012 > 1 12 Be 0.91331449920867 0.58668550079133 0.50000000000000 9.012 > 1 13 Be 0.41331449920867 0.08668550079133 0.75000000000000 9.012 > 1 14 Be 0.91331449920867 0.08668550079133 0.75000000000000 9.012 > 1 15 Be 0.41331449920867 0.58668550079133 0.75000000000000 9.012 > 1 16 Be 0.91331449920867 0.58668550079133 0.75000000000000 9.012 > 1 17 Be 0.16331449920867 0.16331449920867 0.12500000000000 9.012 > 17 18 Be 0.66331449920867 0.16331449920867 0.12500000000000 9.012 > 17 19 Be 0.16331449920867 0.66331449920867 0.12500000000000 9.012 > 17 20 Be 0.66331449920867 0.66331449920867 0.12500000000000 9.012 > 17 21 Be 0.16331449920867 0.16331449920867 0.37500000000000 9.012 > 17 22 Be 0.66331449920867 0.16331449920867 0.37500000000000 9.012 > 17 23 Be 0.16331449920867 0.66331449920867 0.37500000000000 9.012 > 17 24 Be 0.66331449920867 0.66331449920867 0.37500000000000 9.012 > 17 25 Be 0.16331449920867 0.16331449920867 0.62500000000000 9.012 > 17 26 Be 0.66331449920867 0.16331449920867 0.62500000000000 9.012 > 17 27 Be 0.16331449920867 0.66331449920867 0.62500000000000 9.012 > 17 28 Be 0.66331449920867 0.66331449920867 0.62500000000000 9.012 > 17 29 Be 0.16331449920867 0.16331449920867 0.87500000000000 9.012 > 17 30 Be 0.66331449920867 0.16331449920867 0.87500000000000 9.012 > 17 31 Be 0.16331449920867 0.66331449920867 0.87500000000000 9.012 > 17 32 Be 0.66331449920867 0.66331449920867 0.87500000000000 9.012 > 17 33 Be 0.33668550079133 0.33668550079133 0.12500000000000 9.012 > 33 34 Be 0.83668550079133 0.33668550079133 0.12500000000000 9.012 > 33 35 Be 0.33668550079133 0.83668550079133 0.12500000000000 9.012 > 33 36 Be 0.83668550079133 0.83668550079133 0.12500000000000 9.012 > 33 37 Be 0.33668550079133 0.33668550079133 0.37500000000000 9.012 > 33 38 Be 0.83668550079133 0.33668550079133 0.37500000000000 9.012 > 33 39 Be 0.33668550079133 0.83668550079133 0.37500000000000 9.012 > 33 40 Be 0.83668550079133 0.83668550079133 0.37500000000000 9.012 > 33 41 Be 0.33668550079133 0.33668550079133 0.62500000000000 9.012 > 33 42 Be 0.83668550079133 0.33668550079133 0.62500000000000 9.012 > 33 43 Be 0.33668550079133 0.83668550079133 0.62500000000000 9.012 > 33 44 Be 0.83668550079133 0.83668550079133 0.62500000000000 9.012 > 33 45 Be 0.33668550079133 0.33668550079133 0.87500000000000 9.012 > 33 46 Be 0.83668550079133 0.33668550079133 0.87500000000000 9.012 > 33 47 Be 0.33668550079133 0.83668550079133 0.87500000000000 9.012 > 33 48 Be 0.83668550079133 0.83668550079133 0.87500000000000 9.012 > 33 49 Be 0.08668550079133 0.41331449920867 0.00000000000000 9.012 > 49 50 Be 0.58668550079133 0.41331449920867 0.00000000000000 9.012 > 49 51 Be 0.08668550079133 0.91331449920867 0.00000000000000 9.012 > 49 52 Be 0.58668550079133 0.91331449920867 0.00000000000000 9.012 > 49 53 Be 0.08668550079133 0.41331449920867 0.25000000000000 9.012 > 49 54 Be 0.58668550079133 0.41331449920867 0.25000000000000 9.012 > 49 55 Be 0.08668550079133 0.91331449920867 0.25000000000000 9.012 > 49 56 Be 0.58668550079133 0.91331449920867 0.25000000000000 9.012 > 49 57 Be 0.08668550079133 0.41331449920867 0.50000000000000 9.012 > 49 58 Be 0.58668550079133 0.41331449920867 0.50000000000000 9.012 > 49 59 Be 0.08668550079133 0.91331449920867 0.50000000000000 9.012 > 49 60 Be 0.58668550079133 0.91331449920867 0.50000000000000 9.012 > 49 61 Be 0.08668550079133 0.41331449920867 0.75000000000000 9.012 > 49 62 Be 0.58668550079133 0.41331449920867 0.75000000000000 9.012 > 49 63 Be 0.08668550079133 0.91331449920867 0.75000000000000 9.012 > 49 64 Be 0.58668550079133 0.91331449920867 0.75000000000000 9.012 > 49 65 O 0.40562657754626 0.40562657754626 0.00000000000000 15.999 > 65 66 O 0.90562657754626 0.40562657754626 0.00000000000000 15.999 > 65 67 O 0.40562657754626 0.90562657754626 0.00000000000000 15.999 > 65 68 O 0.90562657754626 0.90562657754626 0.00000000000000 15.999 > 65 69 O 0.40562657754626 0.40562657754626 0.25000000000000 15.999 > 65 70 O 0.90562657754626 0.40562657754626 0.25000000000000 15.999 > 65 71 O 0.40562657754626 0.90562657754626 0.25000000000000 15.999 > 65 72 O 0.90562657754626 0.90562657754626 0.25000000000000 15.999 > 65 73 O 0.40562657754626 0.40562657754626 0.50000000000000 15.999 > 65 74 O 0.90562657754626 0.40562657754626 0.50000000000000 15.999 > 65 75 O 0.40562657754626 0.90562657754626 0.50000000000000 15.999 > 65 76 O 0.90562657754626 0.90562657754626 0.50000000000000 15.999 > 65 77 O 0.40562657754626 0.40562657754626 0.75000000000000 15.999 > 65 78 O 0.90562657754626 0.40562657754626 0.75000000000000 15.999 > 65 79 O 0.40562657754626 0.90562657754626 0.75000000000000 15.999 > 65 80 O 0.90562657754626 0.90562657754626 0.75000000000000 15.999 > 65 81 O 0.34437342245374 0.15562657754626 0.12500000000000 15.999 > 81 82 O 0.84437342245374 0.15562657754626 0.12500000000000 15.999 > 81 83 O 0.34437342245374 0.65562657754626 0.12500000000000 15.999 > 81 84 O 0.84437342245374 0.65562657754626 0.12500000000000 15.999 > 81 85 O 0.34437342245374 0.15562657754626 0.37500000000000 15.999 > 81 86 O 0.84437342245374 0.15562657754626 0.37500000000000 15.999 > 81 87 O 0.34437342245374 0.65562657754626 0.37500000000000 15.999 > 81 88 O 0.84437342245374 0.65562657754626 0.37500000000000 15.999 > 81 89 O 0.34437342245374 0.15562657754626 0.62500000000000 15.999 > 81 90 O 0.84437342245374 0.15562657754626 0.62500000000000 15.999 > 81 91 O 0.34437342245374 0.65562657754626 0.62500000000000 15.999 > 81 92 O 0.84437342245374 0.65562657754626 0.62500000000000 15.999 > 81 93 O 0.34437342245374 0.15562657754626 0.87500000000000 15.999 > 81 94 O 0.84437342245374 0.15562657754626 0.87500000000000 15.999 > 81 95 O 0.34437342245374 0.65562657754626 0.87500000000000 15.999 > 81 96 O 0.84437342245374 0.65562657754626 0.87500000000000 15.999 > 81 97 O 0.15562657754626 0.34437342245374 0.12500000000000 15.999 > 97 98 O 0.65562657754626 0.34437342245374 0.12500000000000 15.999 > 97 99 O 0.15562657754626 0.84437342245374 0.12500000000000 15.999 > 97 100 O 0.65562657754626 0.84437342245374 0.12500000000000 15.999 > 97 101 O 0.15562657754626 0.34437342245374 0.37500000000000 15.999 > 97 102 O 0.65562657754626 0.34437342245374 0.37500000000000 15.999 > 97 103 O 0.15562657754626 0.84437342245374 0.37500000000000 15.999 > 97 104 O 0.65562657754626 0.84437342245374 0.37500000000000 15.999 > 97 105 O 0.15562657754626 0.34437342245374 0.62500000000000 15.999 > 97 106 O 0.65562657754626 0.34437342245374 0.62500000000000 15.999 > 97 107 O 0.15562657754626 0.84437342245374 0.62500000000000 15.999 > 97 108 O 0.65562657754626 0.84437342245374 0.62500000000000 15.999 > 97 109 O 0.15562657754626 0.34437342245374 0.87500000000000 15.999 > 97 110 O 0.65562657754626 0.34437342245374 0.87500000000000 15.999 > 97 111 O 0.15562657754626 0.84437342245374 0.87500000000000 15.999 > 97 112 O 0.65562657754626 0.84437342245374 0.87500000000000 15.999 > 97 113 O 0.09437342245374 0.09437342245374 0.00000000000000 15.999 > 113 114 O 0.59437342245374 0.09437342245374 0.00000000000000 15.999 > 113 115 O 0.09437342245374 0.59437342245374 0.00000000000000 15.999 > 113 116 O 0.59437342245374 0.59437342245374 0.00000000000000 15.999 > 113 117 O 0.09437342245374 0.09437342245374 0.25000000000000 15.999 > 113 118 O 0.59437342245374 0.09437342245374 0.25000000000000 15.999 > 113 119 O 0.09437342245374 0.59437342245374 0.25000000000000 15.999 > 113 120 O 0.59437342245374 0.59437342245374 0.25000000000000 15.999 > 113 121 O 0.09437342245374 0.09437342245374 0.50000000000000 15.999 > 113 122 O 0.59437342245374 0.09437342245374 0.50000000000000 15.999 > 113 123 O 0.09437342245374 0.59437342245374 0.50000000000000 15.999 > 113 124 O 0.59437342245374 0.59437342245374 0.50000000000000 15.999 > 113 125 O 0.09437342245374 0.09437342245374 0.75000000000000 15.999 > 113 126 O 0.59437342245374 0.09437342245374 0.75000000000000 15.999 > 113 127 O 0.09437342245374 0.59437342245374 0.75000000000000 15.999 > 113 128 O 0.59437342245374 0.59437342245374 0.75000000000000 15.999 > 113----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 3.0570842 0.0000000 0.0000000 0.0000000 3.0570842 0.0000000 0.0000000 0.0000000 3.0036100-------------------------- Born effective charges -------------------------- 1 Be 1.8018240 -0.1246269 0.0000000 -0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 2 Be 1.8018240 0.1246269 0.0000000 0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 3 Be 1.8018240 0.1246269 0.0000000 0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 4 Be 1.8018240 -0.1246269 0.0000000 -0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 5 O -1.8018240 -0.2111086 0.0000000 -0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 6 O -1.8018240 0.2111086 0.0000000 0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 7 O -1.8018240 0.2111086 0.0000000 0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 8 O -1.8018240 -0.2111086 0.0000000 -0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096----------------------------------------------------------------------------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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 65, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Expanding fc3.Symmetrizing fc3 by traditional approach (N=3).Symmetrizing fc2 by traditional approach (N=3).Max drift of fc3: 0.00000005 (zyz) 0.00000005 (zyz) 0.00000005 (zzy)fc3 was written into "fc3.hdf5".Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) fc2 was written into "fc2.hdf5".--------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperatures: 0.0 300.0 Cutoff frequency: 0.01Frequency conversion factor to THz: 15.63330----------- None of ph-ph interaction calculation was performed. -----------Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-07 22:28:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-07 22:28:15]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: conductivity-RTAHDF5 data compression filter: gzipCrystal structure was read from "phono3py.yaml".Supercell (dim): [2 2 4]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P4_2/mnm (136)------------------------------ primitive cell ------------------------------Lattice vectors: a 4.613449720000000 0.000000000000000 0.000000000000000 b 0.000000000000000 4.613449720000000 0.000000000000000 c 0.000000000000000 0.000000000000000 2.690608570000000Atomic positions (fractional): 1 Be 0.82662899841735 0.17337100158266 0.00000000000000 9.012 2 Be 0.32662899841734 0.32662899841734 0.50000000000000 9.012 3 Be 0.67337100158265 0.67337100158265 0.50000000000000 9.012 4 Be 0.17337100158266 0.82662899841735 0.00000000000000 9.012 5 O 0.81125315509252 0.81125315509252 0.00000000000000 15.999 6 O 0.68874684490748 0.31125315509252 0.50000000000000 15.999 7 O 0.31125315509252 0.68874684490748 0.50000000000000 15.999 8 O 0.18874684490748 0.18874684490748 0.00000000000000 15.999-------------------------------- supercell ---------------------------------Lattice vectors: a 9.226899440000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.226899440000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.762434280000001Atomic positions (fractional): 1 Be 0.41331449920867 0.08668550079133 0.00000000000000 9.012 > 1 2 Be 0.91331449920867 0.08668550079133 0.00000000000000 9.012 > 1 3 Be 0.41331449920867 0.58668550079133 0.00000000000000 9.012 > 1 4 Be 0.91331449920867 0.58668550079133 0.00000000000000 9.012 > 1 5 Be 0.41331449920867 0.08668550079133 0.25000000000000 9.012 > 1 6 Be 0.91331449920867 0.08668550079133 0.25000000000000 9.012 > 1 7 Be 0.41331449920867 0.58668550079133 0.25000000000000 9.012 > 1 8 Be 0.91331449920867 0.58668550079133 0.25000000000000 9.012 > 1 9 Be 0.41331449920867 0.08668550079133 0.50000000000000 9.012 > 1 10 Be 0.91331449920867 0.08668550079133 0.50000000000000 9.012 > 1 11 Be 0.41331449920867 0.58668550079133 0.50000000000000 9.012 > 1 12 Be 0.91331449920867 0.58668550079133 0.50000000000000 9.012 > 1 13 Be 0.41331449920867 0.08668550079133 0.75000000000000 9.012 > 1 14 Be 0.91331449920867 0.08668550079133 0.75000000000000 9.012 > 1 15 Be 0.41331449920867 0.58668550079133 0.75000000000000 9.012 > 1 16 Be 0.91331449920867 0.58668550079133 0.75000000000000 9.012 > 1 17 Be 0.16331449920867 0.16331449920867 0.12500000000000 9.012 > 17 18 Be 0.66331449920867 0.16331449920867 0.12500000000000 9.012 > 17 19 Be 0.16331449920867 0.66331449920867 0.12500000000000 9.012 > 17 20 Be 0.66331449920867 0.66331449920867 0.12500000000000 9.012 > 17 21 Be 0.16331449920867 0.16331449920867 0.37500000000000 9.012 > 17 22 Be 0.66331449920867 0.16331449920867 0.37500000000000 9.012 > 17 23 Be 0.16331449920867 0.66331449920867 0.37500000000000 9.012 > 17 24 Be 0.66331449920867 0.66331449920867 0.37500000000000 9.012 > 17 25 Be 0.16331449920867 0.16331449920867 0.62500000000000 9.012 > 17 26 Be 0.66331449920867 0.16331449920867 0.62500000000000 9.012 > 17 27 Be 0.16331449920867 0.66331449920867 0.62500000000000 9.012 > 17 28 Be 0.66331449920867 0.66331449920867 0.62500000000000 9.012 > 17 29 Be 0.16331449920867 0.16331449920867 0.87500000000000 9.012 > 17 30 Be 0.66331449920867 0.16331449920867 0.87500000000000 9.012 > 17 31 Be 0.16331449920867 0.66331449920867 0.87500000000000 9.012 > 17 32 Be 0.66331449920867 0.66331449920867 0.87500000000000 9.012 > 17 33 Be 0.33668550079133 0.33668550079133 0.12500000000000 9.012 > 33 34 Be 0.83668550079133 0.33668550079133 0.12500000000000 9.012 > 33 35 Be 0.33668550079133 0.83668550079133 0.12500000000000 9.012 > 33 36 Be 0.83668550079133 0.83668550079133 0.12500000000000 9.012 > 33 37 Be 0.33668550079133 0.33668550079133 0.37500000000000 9.012 > 33 38 Be 0.83668550079133 0.33668550079133 0.37500000000000 9.012 > 33 39 Be 0.33668550079133 0.83668550079133 0.37500000000000 9.012 > 33 40 Be 0.83668550079133 0.83668550079133 0.37500000000000 9.012 > 33 41 Be 0.33668550079133 0.33668550079133 0.62500000000000 9.012 > 33 42 Be 0.83668550079133 0.33668550079133 0.62500000000000 9.012 > 33 43 Be 0.33668550079133 0.83668550079133 0.62500000000000 9.012 > 33 44 Be 0.83668550079133 0.83668550079133 0.62500000000000 9.012 > 33 45 Be 0.33668550079133 0.33668550079133 0.87500000000000 9.012 > 33 46 Be 0.83668550079133 0.33668550079133 0.87500000000000 9.012 > 33 47 Be 0.33668550079133 0.83668550079133 0.87500000000000 9.012 > 33 48 Be 0.83668550079133 0.83668550079133 0.87500000000000 9.012 > 33 49 Be 0.08668550079133 0.41331449920867 0.00000000000000 9.012 > 49 50 Be 0.58668550079133 0.41331449920867 0.00000000000000 9.012 > 49 51 Be 0.08668550079133 0.91331449920867 0.00000000000000 9.012 > 49 52 Be 0.58668550079133 0.91331449920867 0.00000000000000 9.012 > 49 53 Be 0.08668550079133 0.41331449920867 0.25000000000000 9.012 > 49 54 Be 0.58668550079133 0.41331449920867 0.25000000000000 9.012 > 49 55 Be 0.08668550079133 0.91331449920867 0.25000000000000 9.012 > 49 56 Be 0.58668550079133 0.91331449920867 0.25000000000000 9.012 > 49 57 Be 0.08668550079133 0.41331449920867 0.50000000000000 9.012 > 49 58 Be 0.58668550079133 0.41331449920867 0.50000000000000 9.012 > 49 59 Be 0.08668550079133 0.91331449920867 0.50000000000000 9.012 > 49 60 Be 0.58668550079133 0.91331449920867 0.50000000000000 9.012 > 49 61 Be 0.08668550079133 0.41331449920867 0.75000000000000 9.012 > 49 62 Be 0.58668550079133 0.41331449920867 0.75000000000000 9.012 > 49 63 Be 0.08668550079133 0.91331449920867 0.75000000000000 9.012 > 49 64 Be 0.58668550079133 0.91331449920867 0.75000000000000 9.012 > 49 65 O 0.40562657754626 0.40562657754626 0.00000000000000 15.999 > 65 66 O 0.90562657754626 0.40562657754626 0.00000000000000 15.999 > 65 67 O 0.40562657754626 0.90562657754626 0.00000000000000 15.999 > 65 68 O 0.90562657754626 0.90562657754626 0.00000000000000 15.999 > 65 69 O 0.40562657754626 0.40562657754626 0.25000000000000 15.999 > 65 70 O 0.90562657754626 0.40562657754626 0.25000000000000 15.999 > 65 71 O 0.40562657754626 0.90562657754626 0.25000000000000 15.999 > 65 72 O 0.90562657754626 0.90562657754626 0.25000000000000 15.999 > 65 73 O 0.40562657754626 0.40562657754626 0.50000000000000 15.999 > 65 74 O 0.90562657754626 0.40562657754626 0.50000000000000 15.999 > 65 75 O 0.40562657754626 0.90562657754626 0.50000000000000 15.999 > 65 76 O 0.90562657754626 0.90562657754626 0.50000000000000 15.999 > 65 77 O 0.40562657754626 0.40562657754626 0.75000000000000 15.999 > 65 78 O 0.90562657754626 0.40562657754626 0.75000000000000 15.999 > 65 79 O 0.40562657754626 0.90562657754626 0.75000000000000 15.999 > 65 80 O 0.90562657754626 0.90562657754626 0.75000000000000 15.999 > 65 81 O 0.34437342245374 0.15562657754626 0.12500000000000 15.999 > 81 82 O 0.84437342245374 0.15562657754626 0.12500000000000 15.999 > 81 83 O 0.34437342245374 0.65562657754626 0.12500000000000 15.999 > 81 84 O 0.84437342245374 0.65562657754626 0.12500000000000 15.999 > 81 85 O 0.34437342245374 0.15562657754626 0.37500000000000 15.999 > 81 86 O 0.84437342245374 0.15562657754626 0.37500000000000 15.999 > 81 87 O 0.34437342245374 0.65562657754626 0.37500000000000 15.999 > 81 88 O 0.84437342245374 0.65562657754626 0.37500000000000 15.999 > 81 89 O 0.34437342245374 0.15562657754626 0.62500000000000 15.999 > 81 90 O 0.84437342245374 0.15562657754626 0.62500000000000 15.999 > 81 91 O 0.34437342245374 0.65562657754626 0.62500000000000 15.999 > 81 92 O 0.84437342245374 0.65562657754626 0.62500000000000 15.999 > 81 93 O 0.34437342245374 0.15562657754626 0.87500000000000 15.999 > 81 94 O 0.84437342245374 0.15562657754626 0.87500000000000 15.999 > 81 95 O 0.34437342245374 0.65562657754626 0.87500000000000 15.999 > 81 96 O 0.84437342245374 0.65562657754626 0.87500000000000 15.999 > 81 97 O 0.15562657754626 0.34437342245374 0.12500000000000 15.999 > 97 98 O 0.65562657754626 0.34437342245374 0.12500000000000 15.999 > 97 99 O 0.15562657754626 0.84437342245374 0.12500000000000 15.999 > 97 100 O 0.65562657754626 0.84437342245374 0.12500000000000 15.999 > 97 101 O 0.15562657754626 0.34437342245374 0.37500000000000 15.999 > 97 102 O 0.65562657754626 0.34437342245374 0.37500000000000 15.999 > 97 103 O 0.15562657754626 0.84437342245374 0.37500000000000 15.999 > 97 104 O 0.65562657754626 0.84437342245374 0.37500000000000 15.999 > 97 105 O 0.15562657754626 0.34437342245374 0.62500000000000 15.999 > 97 106 O 0.65562657754626 0.34437342245374 0.62500000000000 15.999 > 97 107 O 0.15562657754626 0.84437342245374 0.62500000000000 15.999 > 97 108 O 0.65562657754626 0.84437342245374 0.62500000000000 15.999 > 97 109 O 0.15562657754626 0.34437342245374 0.87500000000000 15.999 > 97 110 O 0.65562657754626 0.34437342245374 0.87500000000000 15.999 > 97 111 O 0.15562657754626 0.84437342245374 0.87500000000000 15.999 > 97 112 O 0.65562657754626 0.84437342245374 0.87500000000000 15.999 > 97 113 O 0.09437342245374 0.09437342245374 0.00000000000000 15.999 > 113 114 O 0.59437342245374 0.09437342245374 0.00000000000000 15.999 > 113 115 O 0.09437342245374 0.59437342245374 0.00000000000000 15.999 > 113 116 O 0.59437342245374 0.59437342245374 0.00000000000000 15.999 > 113 117 O 0.09437342245374 0.09437342245374 0.25000000000000 15.999 > 113 118 O 0.59437342245374 0.09437342245374 0.25000000000000 15.999 > 113 119 O 0.09437342245374 0.59437342245374 0.25000000000000 15.999 > 113 120 O 0.59437342245374 0.59437342245374 0.25000000000000 15.999 > 113 121 O 0.09437342245374 0.09437342245374 0.50000000000000 15.999 > 113 122 O 0.59437342245374 0.09437342245374 0.50000000000000 15.999 > 113 123 O 0.09437342245374 0.59437342245374 0.50000000000000 15.999 > 113 124 O 0.59437342245374 0.59437342245374 0.50000000000000 15.999 > 113 125 O 0.09437342245374 0.09437342245374 0.75000000000000 15.999 > 113 126 O 0.59437342245374 0.09437342245374 0.75000000000000 15.999 > 113 127 O 0.09437342245374 0.59437342245374 0.75000000000000 15.999 > 113 128 O 0.59437342245374 0.59437342245374 0.75000000000000 15.999 > 113----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 3.0570842 0.0000000 0.0000000 0.0000000 3.0570842 0.0000000 0.0000000 0.0000000 3.0036100-------------------------- Born effective charges -------------------------- 1 Be 1.8018240 -0.1246269 0.0000000 -0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 2 Be 1.8018240 0.1246269 0.0000000 0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 3 Be 1.8018240 0.1246269 0.0000000 0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 4 Be 1.8018240 -0.1246269 0.0000000 -0.1246269 1.8018240 0.0000000 0.0000000 0.0000000 1.7802096 5 O -1.8018240 -0.2111086 0.0000000 -0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 6 O -1.8018240 0.2111086 0.0000000 0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 7 O -1.8018240 0.2111086 0.0000000 0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096 8 O -1.8018240 -0.2111086 0.0000000 -0.2111086 -1.8018240 0.0000000 0.0000000 0.0000000 -1.7802096----------------------------------------------------------------------------fc3 was read from "fc3.hdf5".fc2 was read from "fc2.hdf5".----------------------------- Force constants ------------------------------Max drift of fc3: 0.00000005 (zyz) 0.00000005 (zyz) 0.00000005 (zzy)Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0Cutoff frequency: 0.01Frequency conversion factor to THz: 15.63330Length for sampling mesh generation: 50.00Generating grid system ... [ 11 11 19 ]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: 1.08, Number of G-points: 281, Lambda: 0.20Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/210) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 5.367 ( 0.000 0.000 0.000) 0.000 8.814 ( 0.000 0.000 0.000) 0.000 8.814 ( 0.000 0.000 0.000) 0.000 14.233 ( 0.000 0.000 0.000) 0.000 15.584 ( 0.000 0.000 0.000) 0.000 15.711 ( 0.000 0.000 0.000) 0.000 16.958 ( 0.000 0.000 0.000) 0.000 17.190 ( 0.000 0.000 0.000) 0.000 17.190 ( 0.000 0.000 0.000) 0.000 19.702 ( 0.000 0.000 0.000) 0.000 20.986 ( 0.000 0.000 0.000) 0.000 20.986 ( 0.000 0.000 0.000) 0.000 21.505 ( 0.000 0.000 0.000) 0.000 22.819 ( 0.000 0.000 0.000) 0.000 23.128 ( 0.000 0.000 0.000) 0.000 23.128 ( 0.000 0.000 0.000) 0.000 23.712 ( 0.000 0.000 0.000) 0.000 23.712 ( 0.000 0.000 0.000) 0.000 24.020 ( 0.000 0.000 0.000) 0.000 24.629 ( 0.000 0.000 0.000) 0.000 29.042 ( 0.000 0.000 0.000) 0.000======================= Grid point 1 (2/210) =======================q-point: ( 0.09 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.305 ( 65.712 0.000 0.000) 65.712 1.399 ( 70.566 0.000 0.000) 70.566 2.230 ( 112.210 0.000 0.000) 112.210 5.606 ( 23.205 0.000 0.000) 23.205 8.734 ( -8.148 0.000 0.000) 8.148 8.956 ( 14.194 0.000 0.000) 14.194 14.141 ( -9.284 0.000 0.000) 9.284 15.182 ( -34.962 0.000 0.000) 34.962 15.752 ( 4.166 0.000 0.000) 4.166 16.745 ( -23.721 0.000 0.000) 23.721 17.082 ( -8.558 0.000 0.000) 8.558 18.103 ( 29.953 0.000 0.000) 29.953 19.337 ( -33.558 0.000 0.000) 33.558 20.813 ( -18.050 0.000 0.000) 18.050 21.601 ( 12.622 0.000 0.000) 12.622 22.823 ( 0.377 0.000 0.000) 0.377 23.121 ( -0.769 0.000 0.000) 0.769 23.136 ( -29.063 0.000 0.000) 29.063 23.165 ( 3.690 0.000 0.000) 3.690 24.153 ( 38.618 0.000 0.000) 38.618 24.562 ( 35.958 0.000 0.000) 35.958 24.603 ( -2.650 0.000 0.000) 2.650 29.072 ( 3.007 0.000 0.000) 3.007 31.550 ( -6.210 0.000 0.000) 6.210======================= Grid point 2 (3/210) =======================q-point: ( 0.18 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.580 ( 63.372 0.000 0.000) 63.372 2.772 ( 68.500 0.000 0.000) 68.500 4.401 ( 107.368 0.000 0.000) 107.368 6.216 ( 36.712 0.000 0.000) 36.712 8.493 ( -16.351 0.000 0.000) 16.351 9.358 ( 26.011 0.000 0.000) 26.011 13.871 ( -18.021 0.000 0.000) 18.021 14.409 ( -40.026 0.000 0.000) 40.026 15.870 ( 7.676 0.000 0.000) 7.676 16.029 ( -47.352 0.000 0.000) 47.352 16.863 ( -15.053 0.000 0.000) 15.053 18.515 ( -46.546 0.000 0.000) 46.546 18.749 ( 32.911 0.000 0.000) 32.911 20.450 ( -15.892 0.000 0.000) 15.892 21.894 ( 14.301 0.000 0.000) 14.301 22.609 ( -23.748 0.000 0.000) 23.748 22.835 ( 0.858 0.000 0.000) 0.858 23.098 ( -1.456 0.000 0.000) 1.456 23.270 ( 6.823 0.000 0.000) 6.823 24.526 ( -5.158 0.000 0.000) 5.158 25.022 ( 46.291 0.000 0.000) 46.291 25.285 ( 36.551 0.000 0.000) 36.551 29.159 ( 5.778 0.000 0.000) 5.778 31.368 ( -12.195 0.000 0.000) 12.195======================= Grid point 3 (4/210) =======================q-point: ( 0.27 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.793 ( 59.533 0.000 0.000) 59.533 4.087 ( 64.608 0.000 0.000) 64.608 6.362 ( 81.944 0.000 0.000) 81.944 7.029 ( 52.188 0.000 0.000) 52.188 8.089 ( -24.597 0.000 0.000) 24.597 9.956 ( 34.087 0.000 0.000) 34.087 13.438 ( -25.743 0.000 0.000) 25.743 13.711 ( -28.226 0.000 0.000) 28.226 14.935 ( -62.559 0.000 0.000) 62.559 16.048 ( 10.179 0.000 0.000) 10.179 16.406 ( -33.819 0.000 0.000) 33.819 17.653 ( -36.952 0.000 0.000) 36.952 19.339 ( 26.101 0.000 0.000) 26.101 20.212 ( -8.587 0.000 0.000) 8.587 22.110 ( 7.115 0.000 0.000) 7.115 22.220 ( -15.288 0.000 0.000) 15.288 22.857 ( 1.383 0.000 0.000) 1.383 23.064 ( -1.987 0.000 0.000) 1.987 23.428 ( 9.111 0.000 0.000) 9.111 24.402 ( -7.380 0.000 0.000) 7.380 25.893 ( 40.585 0.000 0.000) 40.585 25.973 ( 32.530 0.000 0.000) 32.530 29.300 ( 8.715 0.000 0.000) 8.715 31.073 ( -17.554 0.000 0.000) 17.554======================= Grid point 4 (5/210) =======================q-point: ( 0.36 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.917 ( 54.318 0.000 0.000) 54.318 5.299 ( 57.803 0.000 0.000) 57.803 7.155 ( 11.113 0.000 0.000) 11.113 7.524 ( -32.769 0.000 0.000) 32.769 8.613 ( 92.938 0.000 0.000) 92.938 10.675 ( 38.204 0.000 0.000) 38.204 12.865 ( -32.056 0.000 0.000) 32.056 13.400 ( -1.170 0.000 0.000) 1.170 13.596 ( -72.798 0.000 0.000) 72.798 15.532 ( -51.647 0.000 0.000) 51.647 16.265 ( 11.791 0.000 0.000) 11.791 17.110 ( -20.112 0.000 0.000) 20.112 19.751 ( 15.419 0.000 0.000) 15.419 20.092 ( -4.044 0.000 0.000) 4.044 22.021 ( -4.772 0.000 0.000) 4.772 22.173 ( -0.468 0.000 0.000) 0.468 22.889 ( 1.863 0.000 0.000) 1.863 23.022 ( -2.304 0.000 0.000) 2.304 23.623 ( 10.448 0.000 0.000) 10.448 24.238 ( -9.168 0.000 0.000) 9.168 26.537 ( 23.948 0.000 0.000) 23.948 26.569 ( 26.846 0.000 0.000) 26.846 29.512 ( 13.188 0.000 0.000) 13.188 30.685 ( -21.465 0.000 0.000) 21.465======================= Grid point 5 (6/210) =======================q-point: ( 0.45 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.926 ( 47.930 0.000 0.000) 47.930 6.329 ( 45.462 0.000 0.000) 45.462 6.800 ( -40.645 0.000 0.000) 40.645 7.023 ( -22.902 0.000 0.000) 22.902 10.410 ( 88.345 0.000 0.000) 88.345 11.439 ( 38.816 0.000 0.000) 38.816 12.079 ( -80.952 0.000 0.000) 80.952 12.186 ( -36.571 0.000 0.000) 36.571 13.697 ( 30.346 0.000 0.000) 30.346 14.508 ( -49.305 0.000 0.000) 49.305 16.509 ( 12.965 0.000 0.000) 12.965 16.779 ( -14.661 0.000 0.000) 14.661 19.956 ( 6.122 0.000 0.000) 6.122 20.033 ( -2.641 0.000 0.000) 2.641 22.017 ( 3.489 0.000 0.000) 3.489 22.112 ( -4.947 0.000 0.000) 4.947 22.929 ( 2.217 0.000 0.000) 2.217 22.975 ( -2.378 0.000 0.000) 2.378 23.834 ( 10.839 0.000 0.000) 10.839 24.044 ( -10.369 0.000 0.000) 10.369 26.884 ( 10.395 0.000 0.000) 10.395 26.915 ( 7.840 0.000 0.000) 7.840 29.830 ( 19.056 0.000 0.000) 19.056 30.246 ( -22.434 0.000 0.000) 22.434======================= Grid point 12 (7/210) =======================q-point: ( 0.09 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.850 ( 46.813 46.813 0.000) 66.203 1.957 ( 48.903 48.903 0.000) 69.159 3.156 ( 79.172 79.172 0.000) 111.967 5.799 ( 21.144 21.144 0.000) 29.903 8.853 ( 1.907 1.907 0.000) 2.697 8.900 ( 4.215 4.215 0.000) 5.961 14.050 ( -9.195 -9.195 0.000) 13.003 14.767 ( -36.346 -36.346 0.000) 51.401 15.730 ( 0.893 0.893 0.000) 1.264 16.693 ( -11.275 -11.275 0.000) 15.945 17.179 ( -3.488 -3.488 0.000) 4.933 17.918 ( 5.279 5.279 0.000) 7.466 19.092 ( -23.757 -23.757 0.000) 33.597 21.162 ( 5.530 5.530 0.000) 7.821 21.216 ( -15.198 -15.198 0.000) 21.494 22.827 ( 0.404 0.404 0.000) 0.571 23.121 ( -0.342 -0.342 0.000) 0.483 23.162 ( -7.275 -7.275 0.000) 10.288 23.192 ( 3.102 3.102 0.000) 4.387 24.266 ( 25.108 25.108 0.000) 35.508 24.578 ( -2.580 -2.580 0.000) 3.649 24.948 ( 30.384 30.384 0.000) 42.969 29.109 ( 3.730 3.730 0.000) 5.275 31.532 ( -3.900 -3.900 0.000) 5.516======================= Grid point 13 (8/210) =======================q-point: ( 0.18 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.902 ( 56.881 30.699 0.000) 64.636 3.073 ( 60.929 28.981 0.000) 67.471 4.926 ( 95.011 50.111 0.000) 107.416 6.394 ( 36.971 18.666 0.000) 41.415 8.633 ( -16.194 13.940 0.000) 21.368 9.282 ( 25.997 -7.601 0.000) 27.085 13.782 ( -17.869 -8.953 0.000) 19.986 13.950 ( -43.282 -39.663 0.000) 58.707 15.799 ( 4.760 -5.500 0.000) 7.274 16.206 ( -37.926 8.640 0.000) 38.898 16.882 ( -19.510 2.078 0.000) 19.620 18.264 ( 0.229 -21.420 0.000) 21.421 18.563 ( -8.128 -11.473 0.000) 14.061 20.648 ( -23.077 6.634 0.000) 24.012 21.486 ( 10.886 -23.148 0.000) 25.580 22.839 ( 0.890 0.459 0.000) 1.002 22.902 ( -14.730 14.478 0.000) 20.654 23.104 ( -1.354 0.341 0.000) 1.397 23.288 ( 6.448 1.989 0.000) 6.748 24.502 ( -5.021 -2.373 0.000) 5.553 25.012 ( 43.746 8.521 0.000) 44.568 25.608 ( 34.872 25.087 0.000) 42.958 29.215 ( 6.905 5.564 0.000) 8.867 31.381 ( -11.070 -0.003 0.000) 11.070======================= Grid point 14 (9/210) =======================q-point: ( 0.27 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.029 ( 56.596 23.068 0.000) 61.117 4.288 ( 61.445 19.685 0.000) 64.521 6.695 ( 71.682 32.704 0.000) 78.790 7.237 ( 56.591 21.137 0.000) 60.410 8.233 ( -24.401 14.330 0.000) 28.298 9.881 ( 34.094 -7.657 0.000) 34.944 13.158 ( -35.022 -44.771 0.000) 56.841 13.352 ( -25.566 -8.625 0.000) 26.982 15.262 ( -53.339 20.841 0.000) 57.266 15.863 ( -5.872 -15.979 0.000) 17.024 16.465 ( -19.532 4.961 0.000) 20.152 17.684 ( -31.891 2.980 0.000) 32.030 18.976 ( 24.786 -27.804 0.000) 37.248 20.291 ( -13.924 -2.296 0.000) 14.112 21.644 ( 6.174 -19.503 0.000) 20.457 22.642 ( -11.720 16.820 0.000) 20.501 22.862 ( 1.413 0.517 0.000) 1.505 23.071 ( -1.961 0.562 0.000) 2.040 23.439 ( 8.747 1.160 0.000) 8.823 24.382 ( -7.179 -2.034 0.000) 7.461 25.853 ( 39.908 5.283 0.000) 40.256 26.271 ( 31.377 21.291 0.000) 37.918 29.379 ( 9.738 7.672 0.000) 12.397 31.106 ( -16.605 2.536 0.000) 16.797======================= Grid point 15 (10/210) =======================q-point: ( 0.36 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.110 ( 52.771 19.132 0.000) 56.132 5.463 ( 56.969 15.926 0.000) 59.153 7.381 ( 9.768 22.759 0.000) 24.767 7.673 ( -32.451 14.826 0.000) 35.677 8.818 ( 88.311 20.670 0.000) 90.698 10.599 ( 38.176 -7.685 0.000) 38.942 12.603 ( -23.752 -47.483 0.000) 53.093 12.784 ( -31.891 -8.285 0.000) 32.949 14.213 ( -47.305 28.970 0.000) 55.471 15.309 ( -44.666 -19.957 0.000) 48.922 16.381 ( 7.369 9.883 0.000) 12.327 17.182 ( -19.888 6.916 0.000) 21.056 19.393 ( 17.327 -27.593 0.000) 32.582 20.064 ( -9.943 -10.375 0.000) 14.370 21.773 ( 7.822 -11.156 0.000) 13.625 22.422 ( -11.082 10.964 0.000) 15.589 22.895 ( 1.889 0.570 0.000) 1.973 23.028 ( -2.303 0.629 0.000) 2.387 23.626 ( 10.083 0.394 0.000) 10.090 24.222 ( -8.907 -1.571 0.000) 9.045 26.539 ( 28.854 6.321 0.000) 29.538 26.799 ( 20.930 16.954 0.000) 26.935 29.605 ( 13.543 9.012 0.000) 16.268 30.738 ( -20.428 4.756 0.000) 20.974======================= Grid point 16 (11/210) =======================q-point: ( 0.45 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.096 ( 47.047 16.921 0.000) 49.997 6.495 ( 46.420 16.085 0.000) 49.128 6.957 ( -40.119 15.617 0.000) 43.051 7.219 ( -24.763 19.316 0.000) 31.406 10.493 ( 80.017 8.658 0.000) 80.484 11.362 ( 38.738 -7.791 0.000) 39.514 11.881 ( -56.533 -17.945 0.000) 59.313 12.107 ( -36.443 -7.995 0.000) 37.309 13.788 ( 10.065 7.267 0.000) 12.414 14.391 ( -43.761 -11.551 0.000) 45.259 16.587 ( 12.264 7.602 0.000) 14.429 16.851 ( -14.638 7.052 0.000) 16.248 19.673 ( 11.695 -23.615 0.000) 26.353 19.877 ( -9.496 -17.637 0.000) 20.031 21.963 ( 11.150 -3.098 0.000) 11.572 22.195 ( -11.960 3.779 0.000) 12.542 22.935 ( 2.238 0.612 0.000) 2.320 22.981 ( -2.391 0.636 0.000) 2.474 23.830 ( 10.492 -0.334 0.000) 10.497 24.034 ( -10.059 -0.998 0.000) 10.109 26.962 ( 13.547 9.156 0.000) 16.351 27.055 ( 4.379 12.632 0.000) 13.369 29.921 ( 18.481 8.717 0.000) 20.434 30.320 ( -21.390 6.971 0.000) 22.497======================= Grid point 24 (12/210) =======================q-point: ( 0.18 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.683 ( 46.096 46.096 0.000) 65.189 3.832 ( 46.084 46.084 0.000) 65.173 6.199 ( 74.668 74.668 0.000) 105.596 6.941 ( 35.449 35.449 0.000) 50.133 8.956 ( 3.182 3.182 0.000) 4.499 9.128 ( 7.011 7.011 0.000) 9.914 13.060 ( -47.329 -47.329 0.000) 66.933 13.521 ( -17.454 -17.454 0.000) 24.684 15.684 ( -7.469 -7.469 0.000) 10.563 16.129 ( -17.020 -17.020 0.000) 24.069 16.822 ( -11.559 -11.559 0.000) 16.347 18.052 ( 1.610 1.610 0.000) 2.277 18.285 ( -14.400 -14.400 0.000) 20.364 20.414 ( -23.297 -23.297 0.000) 32.947 21.339 ( 3.538 3.538 0.000) 5.004 22.853 ( 0.964 0.964 0.000) 1.364 22.984 ( -4.943 -4.943 0.000) 6.991 23.103 ( -0.573 -0.573 0.000) 0.810 23.355 ( 4.910 4.910 0.000) 6.944 24.433 ( -4.611 -4.611 0.000) 6.521 25.442 ( 32.249 32.249 0.000) 45.607 26.167 ( 30.312 30.312 0.000) 42.867 29.368 ( 9.646 9.646 0.000) 13.642 31.323 ( -6.356 -6.356 0.000) 8.989======================= Grid point 25 (13/210) =======================q-point: ( 0.27 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.647 ( 50.452 38.101 0.000) 63.223 4.824 ( 53.244 33.703 0.000) 63.015 7.556 ( 43.044 50.362 0.000) 66.250 7.868 ( 72.459 43.790 0.000) 84.663 8.633 ( -23.555 25.376 0.000) 34.624 9.658 ( 33.786 -14.611 0.000) 36.810 12.186 ( -38.798 -51.313 0.000) 64.330 13.100 ( -25.081 -16.885 0.000) 30.235 15.360 ( -30.088 -19.052 0.000) 35.612 15.599 ( -33.006 -4.868 0.000) 33.363 16.596 ( -6.103 7.979 0.000) 10.045 17.776 ( -22.652 6.843 0.000) 23.663 18.439 ( 19.786 -25.052 0.000) 31.923 19.985 ( -18.747 -24.717 0.000) 31.022 21.449 ( 7.069 -2.738 0.000) 7.581 22.792 ( -12.947 -1.157 0.000) 12.999 22.877 ( 1.483 1.047 0.000) 1.815 23.081 ( -1.577 0.327 0.000) 1.611 23.478 ( 7.407 2.910 0.000) 7.958 24.322 ( -6.576 -3.937 0.000) 7.664 26.143 ( 36.220 23.036 0.000) 42.925 26.748 ( 27.317 26.062 0.000) 37.754 29.584 ( 12.062 12.563 0.000) 17.416 31.133 ( -12.611 -0.614 0.000) 12.626======================= Grid point 26 (14/210) =======================q-point: ( 0.36 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.635 ( 49.198 33.044 0.000) 59.266 5.890 ( 54.102 26.551 0.000) 60.266 8.025 ( 5.319 41.440 0.000) 41.780 8.088 ( -31.586 26.644 0.000) 41.323 9.409 ( 76.721 38.424 0.000) 85.805 10.374 ( 38.044 -15.128 0.000) 40.942 11.643 ( -14.419 -49.112 0.000) 51.185 12.541 ( -31.435 -16.290 0.000) 35.405 14.568 ( -43.897 0.103 0.000) 43.897 14.869 ( -41.381 -17.605 0.000) 44.970 16.613 ( 6.269 13.276 0.000) 14.682 17.361 ( -18.629 10.610 0.000) 21.439 18.822 ( 17.923 -28.598 0.000) 33.750 19.667 ( -14.153 -26.730 0.000) 30.246 21.625 ( 10.980 -5.272 0.000) 12.180 22.506 ( -15.659 -2.490 0.000) 15.856 22.911 ( 1.942 1.112 0.000) 2.238 23.044 ( -2.147 0.837 0.000) 2.304 23.640 ( 8.882 1.106 0.000) 8.951 24.177 ( -8.125 -3.012 0.000) 8.665 26.797 ( 28.850 19.052 0.000) 34.573 27.195 ( 16.961 22.388 0.000) 28.087 29.841 ( 14.120 14.107 0.000) 19.960 30.840 ( -16.749 4.746 0.000) 17.409======================= Grid point 27 (15/210) =======================q-point: ( 0.45 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.566 ( 44.902 29.910 0.000) 53.952 6.917 ( 48.894 25.426 0.000) 55.110 7.393 ( -38.796 27.946 0.000) 47.814 7.740 ( -31.694 31.878 0.000) 44.953 10.763 ( 57.038 19.020 0.000) 60.126 11.133 ( 38.509 -15.394 0.000) 41.472 11.472 ( -13.761 -21.256 0.000) 25.322 11.872 ( -36.085 -15.773 0.000) 39.382 13.888 ( -16.732 -0.495 0.000) 16.739 14.088 ( -32.270 -16.697 0.000) 36.334 16.792 ( 11.127 12.576 0.000) 16.791 17.041 ( -14.202 11.583 0.000) 18.327 19.138 ( 14.419 -28.738 0.000) 32.152 19.404 ( -13.021 -27.890 0.000) 30.780 21.880 ( 14.665 -5.852 0.000) 15.790 22.189 ( -16.240 -4.736 0.000) 16.916 22.953 ( 2.258 1.132 0.000) 2.525 22.999 ( -2.349 1.064 0.000) 2.578 23.822 ( 9.411 -0.476 0.000) 9.423 24.006 ( -9.116 -1.852 0.000) 9.302 27.240 ( 15.374 18.275 0.000) 23.882 27.381 ( 1.313 19.584 0.000) 19.628 30.144 ( 16.680 13.080 0.000) 21.197 30.491 ( -18.125 9.559 0.000) 20.492======================= Grid point 36 (16/210) =======================q-point: ( 0.27 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.474 ( 44.653 44.653 0.000) 63.149 5.584 ( 42.787 42.787 0.000) 60.510 8.485 ( 41.577 41.577 0.000) 58.799 8.976 ( 64.879 64.879 0.000) 91.752 9.090 ( 3.425 3.425 0.000) 4.844 9.422 ( 7.535 7.535 0.000) 10.656 11.221 ( -43.709 -43.709 0.000) 61.814 12.692 ( -24.408 -24.408 0.000) 34.518 14.809 ( -33.484 -33.484 0.000) 47.354 15.357 ( -22.372 -22.372 0.000) 31.639 16.744 ( 6.823 6.823 0.000) 9.649 17.891 ( -7.510 -7.510 0.000) 10.621 18.079 ( 0.144 0.144 0.000) 0.204 19.496 ( -22.438 -22.438 0.000) 31.733 21.449 ( 2.101 2.101 0.000) 2.971 22.646 ( -12.323 -12.323 0.000) 17.427 22.903 ( 1.552 1.552 0.000) 2.195 23.079 ( -0.621 -0.621 0.000) 0.878 23.556 ( 5.022 5.022 0.000) 7.102 24.228 ( -5.577 -5.577 0.000) 7.886 26.682 ( 29.539 29.539 0.000) 41.775 27.251 ( 23.731 23.731 0.000) 33.561 29.852 ( 14.194 14.194 0.000) 20.073 31.067 ( -6.060 -6.060 0.000) 8.569======================= Grid point 37 (17/210) =======================q-point: ( 0.36 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.369 ( 45.373 40.349 0.000) 60.719 6.483 ( 47.838 33.219 0.000) 58.241 8.688 ( -29.711 32.984 0.000) 44.393 8.957 ( -4.148 51.364 0.000) 51.531 10.011 ( 37.080 -21.170 0.000) 42.698 10.255 ( 60.777 38.344 0.000) 71.862 10.727 ( 3.651 -35.527 0.000) 35.714 12.146 ( -30.790 -23.689 0.000) 38.849 14.100 ( -36.231 -34.262 0.000) 49.866 14.736 ( -39.146 -8.924 0.000) 40.151 16.882 ( 7.580 13.177 0.000) 15.202 17.569 ( -16.887 9.294 0.000) 19.276 18.316 ( 14.885 -21.335 0.000) 26.014 19.127 ( -15.467 -25.942 0.000) 30.203 21.538 ( 7.228 -3.453 0.000) 8.010 22.353 ( -16.446 -11.950 0.000) 20.329 22.938 ( 1.956 1.564 0.000) 2.504 23.057 ( -1.537 0.403 0.000) 1.589 23.673 ( 6.681 2.277 0.000) 7.058 24.105 ( -6.812 -4.188 0.000) 7.997 27.237 ( 25.396 24.116 0.000) 35.022 27.636 ( 14.284 21.128 0.000) 25.504 30.132 ( 14.062 14.758 0.000) 20.385 30.901 ( -10.474 1.208 0.000) 10.544======================= Grid point 38 (18/210) =======================q-point: ( 0.45 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.238 ( 42.420 37.394 0.000) 56.549 7.446 ( 49.247 27.270 0.000) 56.293 8.025 ( -37.091 35.301 0.000) 51.204 8.383 ( -43.791 30.279 0.000) 53.240 10.759 ( 38.065 -22.431 0.000) 44.183 11.125 ( 29.148 -10.416 0.000) 30.953 11.247 ( 23.923 28.370 0.000) 37.110 11.489 ( -35.555 -23.035 0.000) 42.364 13.568 ( -9.192 -25.553 0.000) 27.156 13.924 ( -38.200 -6.230 0.000) 38.705 17.052 ( 9.844 13.024 0.000) 16.326 17.275 ( -12.944 11.251 0.000) 17.150 18.598 ( 13.556 -24.790 0.000) 28.255 18.855 ( -12.872 -26.303 0.000) 29.284 21.736 ( 12.725 -8.160 0.000) 15.117 22.026 ( -16.192 -10.945 0.000) 19.544 22.979 ( 2.156 1.444 0.000) 2.595 23.021 ( -2.048 1.094 0.000) 2.322 23.814 ( 7.500 -0.254 0.000) 7.504 23.963 ( -7.501 -2.414 0.000) 7.880 27.639 ( 14.469 20.905 0.000) 25.424 27.783 ( 0.142 19.991 0.000) 19.992 30.405 ( 13.678 12.709 0.000) 18.671 30.668 ( -12.869 7.876 0.000) 15.088======================= Grid point 48 (19/210) =======================q-point: ( 0.36 0.36 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.186 ( 37.821 37.821 0.000) 53.486 7.190 ( 42.203 42.203 0.000) 59.684 9.212 ( 2.590 2.590 0.000) 3.663 9.621 ( -30.805 -30.805 0.000) 43.565 9.690 ( 5.703 5.703 0.000) 8.066 10.125 ( 40.636 40.636 0.000) 57.468 11.343 ( 48.454 48.454 0.000) 68.524 11.614 ( -30.067 -30.067 0.000) 42.521 13.385 ( -36.149 -36.149 0.000) 51.123 14.383 ( -26.791 -26.791 0.000) 37.888 17.107 ( 9.563 9.563 0.000) 13.524 17.628 ( -5.815 -5.815 0.000) 8.223 18.083 ( 0.153 0.153 0.000) 0.217 18.694 ( -17.650 -17.650 0.000) 24.961 21.508 ( 0.969 0.969 0.000) 1.370 22.078 ( -15.004 -15.004 0.000) 21.218 22.972 ( 1.823 1.823 0.000) 2.578 23.056 ( -0.472 -0.472 0.000) 0.667 23.732 ( 3.653 3.653 0.000) 5.167 24.014 ( -4.956 -4.956 0.000) 7.008 27.692 ( 20.808 20.808 0.000) 29.427 27.983 ( 13.121 13.121 0.000) 18.556 30.405 ( 12.695 12.695 0.000) 17.953 30.883 ( -2.994 -2.994 0.000) 4.235======================= Grid point 49 (20/210) =======================q-point: ( 0.45 0.36 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 610Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.965 ( 41.066 24.966 0.000) 48.059 8.006 ( 40.070 39.699 0.000) 56.405 8.746 ( -34.270 36.602 0.000) 50.142 8.798 ( -43.244 9.169 0.000) 44.206 10.262 ( 36.375 -27.343 0.000) 45.506 10.971 ( -34.811 -29.251 0.000) 45.469 11.126 ( 50.113 12.886 0.000) 51.744 11.878 ( -12.658 33.010 0.000) 35.354 13.020 ( 16.363 -28.720 0.000) 33.055 13.712 ( -39.626 -15.832 0.000) 42.672 17.273 ( 7.908 8.735 0.000) 11.783 17.444 ( -9.784 4.893 0.000) 10.939 18.210 ( 9.412 -13.344 0.000) 16.330 18.415 ( -11.582 -17.596 0.000) 21.066 21.590 ( 7.458 -5.867 0.000) 9.489 21.795 ( -12.962 -11.498 0.000) 17.327 23.008 ( 1.767 1.417 0.000) 2.265 23.039 ( -1.303 0.632 0.000) 1.448 23.815 ( 4.726 0.401 0.000) 4.743 23.914 ( -5.171 -2.540 0.000) 5.761 28.018 ( 11.554 16.614 0.000) 20.236 28.126 ( 0.941 13.856 0.000) 13.888 30.626 ( 9.738 9.451 0.000) 13.570 30.788 ( -6.601 4.060 0.000) 7.749======================= Grid point 60 (21/210) =======================q-point: ( 0.45 0.45 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.418 ( 20.640 20.640 0.000) 29.189 8.750 ( -11.730 -11.730 0.000) 16.589 8.770 ( 36.780 36.780 0.000) 52.015 9.284 ( 0.960 0.960 0.000) 1.358 9.848 ( 2.118 2.118 0.000) 2.995 10.352 ( -32.726 -32.726 0.000) 46.282 11.590 ( 30.905 30.905 0.000) 43.707 12.181 ( -20.443 -20.443 0.000) 28.910 12.765 ( 20.251 20.251 0.000) 28.640 13.297 ( -25.941 -25.941 0.000) 36.686 17.393 ( 4.073 4.073 0.000) 5.760 17.458 ( -2.401 -2.401 0.000) 3.395 18.090 ( 0.132 0.132 0.000) 0.187 18.170 ( -7.746 -7.746 0.000) 10.954 21.530 ( 0.238 0.238 0.000) 0.336 21.605 ( -7.159 -7.159 0.000) 10.125 23.032 ( 0.965 0.965 0.000) 1.365 23.043 ( -0.176 -0.176 0.000) 0.248 23.832 ( 1.327 1.327 0.000) 1.876 23.867 ( -2.148 -2.148 0.000) 3.038 28.262 ( 7.550 7.550 0.000) 10.677 28.302 ( 3.618 3.618 0.000) 5.117 30.770 ( 5.047 5.047 0.000) 7.138 30.824 ( -0.426 -0.426 0.000) 0.602======================= Grid point 121 (22/210) =======================q-point: ( 0.00 0.00 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.301 ( 0.000 0.000 66.664) 66.664 1.301 ( -0.000 -0.000 66.664) 66.664 2.460 ( 0.000 0.000 124.727) 124.727 5.565 ( 0.000 0.000 19.805) 19.805 9.173 ( 0.000 0.000 35.578) 35.578 9.173 ( -0.000 -0.000 35.578) 35.578 14.490 ( -0.000 -0.000 25.864) 25.864 15.626 ( 0.000 0.000 4.343) 4.343 15.716 ( -0.000 -0.000 0.553) 0.553 16.937 ( 0.000 0.000 -2.194) 2.194 17.152 ( 0.000 0.000 -3.819) 3.819 17.152 ( 0.000 0.000 -3.819) 3.819 19.649 ( -0.000 -0.000 -5.440) 5.440 20.960 ( 0.000 0.000 -2.616) 2.616 20.960 ( 0.000 0.000 -2.616) 2.616 21.391 ( 0.000 0.000 -10.643) 10.643 22.939 ( -0.000 -0.000 11.263) 11.263 23.008 ( 0.000 -0.000 -11.463) 11.463 23.008 ( -0.000 -0.000 -11.463) 11.463 23.821 ( 0.000 0.000 10.124) 10.124 23.821 ( 0.000 0.000 10.124) 10.124 24.002 ( 0.000 0.000 -1.789) 1.789 28.924 ( -0.000 -0.000 -11.960) 11.960 34.180 ( 0.000 0.000 -5.559) 5.559======================= Grid point 122 (23/210) =======================q-point: ( 0.09 0.00 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.910 ( 51.648 0.000 45.355) 68.736 1.988 ( 52.722 0.000 47.315) 70.840 3.221 ( 70.279 0.000 91.533) 115.401 5.778 ( 21.504 0.000 17.770) 27.897 9.092 ( -8.167 0.000 35.539) 36.465 9.320 ( 14.298 0.000 35.777) 38.528 14.396 ( -9.550 0.000 25.570) 27.295 15.124 ( -36.030 0.000 -2.303) 36.103 15.747 ( 3.683 0.000 -0.029) 3.683 16.719 ( -23.988 0.000 -2.649) 24.134 17.050 ( -8.095 0.000 -3.187) 8.700 17.934 ( 42.904 0.000 -12.285) 44.628 19.287 ( -33.315 0.000 -5.039) 33.694 20.771 ( -18.452 0.000 -4.242) 18.933 21.512 ( 13.847 0.000 -8.280) 16.134 22.330 ( 57.115 0.000 -71.584) 91.578 22.924 ( -0.268 0.000 8.641) 8.645 23.035 ( 12.550 0.000 -22.282) 25.573 23.108 ( 6.644 0.000 -5.214) 8.445 23.472 ( -10.429 0.000 2.649) 10.760 24.208 ( 35.628 0.000 5.790) 36.095 24.558 ( 34.498 0.000 -0.508) 34.502 28.956 ( 3.237 0.000 -11.729) 12.168 32.995 ( -70.833 0.000 57.962) 91.526======================= Grid point 123 (24/210) =======================q-point: ( 0.18 0.00 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.061 ( 61.972 0.000 28.210) 68.091 3.089 ( 57.537 0.000 41.330) 70.843 4.879 ( 91.249 0.000 49.979) 104.040 6.359 ( 35.759 0.000 14.832) 38.713 8.851 ( -16.352 0.000 35.455) 39.044 9.718 ( 25.513 0.000 35.492) 43.711 14.117 ( -18.671 0.000 24.539) 30.834 14.363 ( -38.892 0.000 -3.385) 39.039 15.860 ( 7.601 0.000 -0.716) 7.635 16.006 ( -46.778 0.000 -2.242) 46.832 16.838 ( -14.801 0.000 -2.490) 15.009 18.471 ( -46.165 0.000 -4.480) 46.382 18.690 ( 34.853 0.000 -5.572) 35.295 20.414 ( -15.257 0.000 -3.531) 15.660 21.818 ( 14.621 0.000 -7.218) 16.306 22.418 ( -15.271 0.000 -17.742) 23.409 22.927 ( 0.437 0.000 8.431) 8.442 23.193 ( -2.935 0.000 6.135) 6.801 23.243 ( 7.382 0.000 -2.791) 7.892 23.783 ( 23.107 0.000 -52.919) 57.744 25.040 ( 45.166 0.000 2.020) 45.211 25.256 ( 35.444 0.000 -2.829) 35.556 29.050 ( 6.339 0.000 -10.936) 12.641 31.966 ( -37.850 0.000 43.199) 57.435======================= Grid point 124 (25/210) =======================q-point: ( 0.27 0.00 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.222 ( 56.803 0.000 38.096) 68.395 4.287 ( 61.518 0.000 20.018) 64.693 6.569 ( 67.710 0.000 21.298) 70.981 7.201 ( 57.670 0.000 18.907) 60.690 8.448 ( -24.535 0.000 35.392) 43.065 10.298 ( 32.701 0.000 33.742) 46.988 13.665 ( -27.120 0.000 22.197) 35.046 13.688 ( -26.981 0.000 -1.644) 27.031 14.933 ( -60.861 0.000 0.322) 60.862 16.037 ( 10.170 0.000 -0.917) 10.212 16.387 ( -33.414 0.000 -1.881) 33.467 17.620 ( -36.261 0.000 -3.300) 36.411 19.301 ( 26.556 0.000 -3.903) 26.841 20.187 ( -8.198 0.000 -2.493) 8.569 22.040 ( 7.472 0.000 -6.660) 10.010 22.123 ( -12.671 0.000 -9.160) 15.635 22.940 ( 0.866 0.000 7.794) 7.842 23.135 ( -2.699 0.000 6.451) 6.993 23.403 ( 8.781 0.000 -2.810) 9.219 24.041 ( 5.024 0.000 -32.012) 32.404 25.894 ( 39.793 0.000 0.135) 39.793 25.925 ( 31.763 0.000 -4.782) 32.121 29.208 ( 9.846 0.000 -9.234) 13.499 31.341 ( -28.075 0.000 22.942) 36.257======================= Grid point 125 (26/210) =======================q-point: ( 0.36 0.00 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.308 ( 53.036 0.000 36.411) 64.332 5.453 ( 56.071 0.000 15.577) 58.195 7.254 ( 11.098 0.000 10.297) 15.139 7.884 ( -32.613 0.000 35.389) 48.125 8.762 ( 88.012 0.000 16.161) 89.484 10.980 ( 36.029 0.000 29.955) 46.855 13.044 ( -36.751 0.000 15.657) 39.947 13.403 ( 0.256 0.000 0.964) 0.997 13.654 ( -67.249 0.000 7.904) 67.712 15.528 ( -50.555 0.000 -0.190) 50.556 16.254 ( 11.737 0.000 -1.043) 11.784 17.088 ( -19.720 0.000 -2.183) 19.840 19.719 ( 15.698 0.000 -3.290) 16.039 20.072 ( -3.969 0.000 -2.069) 4.476 21.957 ( -3.802 0.000 -6.128) 7.212 22.111 ( -0.060 0.000 -5.985) 5.985 22.962 ( 1.374 0.000 6.967) 7.101 23.084 ( -2.506 0.000 5.982) 6.486 23.585 ( 9.514 0.000 -4.083) 10.353 24.046 ( -3.357 0.000 -18.345) 18.650 26.479 ( 23.713 0.000 -5.898) 24.436 26.552 ( 25.758 0.000 -1.860) 25.825 29.450 ( 15.156 0.000 -6.084) 16.332 30.807 ( -26.640 0.000 11.238) 28.914======================= Grid point 126 (27/210) =======================q-point: ( 0.45 0.00 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.299 ( 47.317 0.000 35.701) 59.274 6.456 ( 44.387 0.000 12.910) 46.226 7.133 ( -22.147 0.000 11.181) 24.809 7.165 ( -40.333 0.000 35.468) 53.709 10.468 ( 83.915 0.000 6.853) 84.195 11.712 ( 38.341 0.000 26.435) 46.571 12.023 ( -71.022 0.000 -0.405) 71.023 12.506 ( -44.337 0.000 26.711) 51.761 13.722 ( 30.785 0.000 3.154) 30.946 14.526 ( -48.341 0.000 2.320) 48.396 16.497 ( 12.838 0.000 -1.257) 12.900 16.763 ( -14.447 0.000 -1.606) 14.536 19.930 ( 6.418 0.000 -2.705) 6.965 20.011 ( -2.811 0.000 -2.199) 3.569 21.963 ( 3.638 0.000 -5.212) 6.356 22.057 ( -4.695 0.000 -5.373) 7.136 22.994 ( 1.923 0.000 6.293) 6.580 23.037 ( -2.314 0.000 5.951) 6.386 23.771 ( 9.154 0.000 -6.559) 11.261 23.936 ( -7.356 0.000 -10.824) 13.087 26.828 ( 10.854 0.000 -5.782) 12.298 26.875 ( 6.755 0.000 -4.226) 7.968 29.815 ( 21.704 0.000 -1.447) 21.753 30.288 ( -25.715 0.000 4.068) 26.035======================= Grid point 133 (28/210) =======================q-point: ( 0.09 0.09 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.327 ( 39.993 39.993 34.923) 66.471 2.442 ( 39.579 39.579 44.849) 71.725 3.886 ( 61.296 61.296 72.223) 112.830 5.964 ( 19.585 19.585 16.723) 32.354 9.216 ( 2.182 2.182 35.978) 36.110 9.261 ( 4.036 4.036 35.531) 35.987 14.296 ( -10.501 -10.501 24.026) 28.245 14.714 ( -34.615 -34.615 -2.357) 49.010 15.738 ( 0.977 0.977 0.802) 1.598 16.672 ( -11.191 -11.191 -2.248) 15.986 17.144 ( -3.447 -3.447 -3.566) 6.040 17.858 ( 9.162 9.162 -5.317) 14.005 19.045 ( -23.529 -23.529 -4.716) 33.608 21.111 ( -13.627 -13.627 -10.307) 21.855 21.129 ( 5.345 5.345 -3.252) 8.228 22.621 ( 13.620 13.620 -49.931) 53.518 22.921 ( 1.025 1.025 5.532) 5.719 23.060 ( 1.193 1.193 -6.553) 6.766 23.254 ( 8.993 8.993 -9.061) 15.616 23.658 ( 13.866 13.866 -23.795) 30.834 24.312 ( 23.442 23.442 4.938) 33.517 24.945 ( 29.643 29.643 -0.998) 41.934 28.995 ( 3.931 3.931 -11.527) 12.798 32.509 ( -36.491 -36.491 55.708) 75.937======================= Grid point 134 (29/210) =======================q-point: ( 0.18 0.09 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.311 ( 56.247 24.950 23.540) 65.881 3.372 ( 52.224 27.254 39.681) 71.026 5.363 ( 83.026 46.181 45.398) 105.295 6.522 ( 35.461 16.997 13.372) 41.536 8.996 ( -16.072 14.405 35.844) 41.840 9.641 ( 25.608 -7.631 35.474) 44.412 13.856 ( -37.987 -35.130 -0.931) 51.750 14.083 ( -22.426 -12.798 22.649) 34.347 15.801 ( 4.344 -4.850 0.250) 6.515 16.185 ( -37.784 8.916 -2.089) 38.878 16.855 ( -18.981 1.877 -2.677) 19.260 18.228 ( -0.845 -19.939 -3.552) 20.271 18.527 ( -6.304 -11.273 -3.607) 13.410 20.590 ( -21.921 5.416 -5.714) 23.291 21.434 ( 10.940 -21.481 -5.106) 24.641 22.652 ( -5.674 12.149 -20.524) 24.515 22.932 ( 0.133 0.545 6.711) 6.735 23.125 ( 2.815 -4.264 -2.498) 5.688 23.328 ( 2.265 5.963 3.773) 7.411 23.949 ( 12.373 12.353 -39.623) 43.309 25.028 ( 42.369 8.271 1.640) 43.200 25.586 ( 34.000 25.128 -2.421) 42.347 29.108 ( 7.407 5.678 -10.824) 14.292 31.853 ( -29.076 -10.427 36.213) 47.598======================= Grid point 135 (30/210) =======================q-point: ( 0.27 0.09 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.424 ( 54.392 19.697 32.645) 66.424 4.467 ( 58.917 18.219 20.813) 65.087 6.882 ( 56.059 30.133 18.563) 66.297 7.401 ( 63.535 20.754 19.010) 69.489 8.603 ( -23.750 15.369 36.133) 45.890 10.224 ( 32.709 -7.526 33.821) 47.649 13.108 ( -33.973 -44.014 -2.913) 55.677 13.623 ( -25.978 -8.492 25.235) 37.199 15.253 ( -52.575 20.778 -0.693) 56.536 15.852 ( -6.585 -16.085 -1.090) 17.415 16.452 ( -18.531 5.385 -1.256) 19.338 17.651 ( -31.304 3.027 -3.305) 31.623 18.951 ( 24.896 -27.088 -2.491) 36.875 20.252 ( -13.253 -3.008 -3.925) 14.146 21.593 ( 6.344 -18.414 -4.928) 20.090 22.510 ( -7.929 14.945 -11.563) 20.492 22.940 ( 0.756 0.027 6.973) 7.014 23.129 ( -1.626 -1.372 3.932) 4.470 23.428 ( 7.394 3.119 -0.884) 8.073 24.086 ( 2.031 3.647 -26.107) 26.438 25.844 ( 38.716 5.616 -0.858) 39.130 26.238 ( 31.001 21.236 -3.433) 37.734 29.286 ( 10.765 7.632 -9.287) 16.136 31.329 ( -25.113 -1.424 19.486) 31.818======================= Grid point 136 (31/210) =======================q-point: ( 0.36 0.09 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.469 ( 51.283 16.243 32.014) 62.599 5.609 ( 55.976 15.106 16.255) 60.214 7.445 ( 7.817 19.146 8.193) 22.244 8.053 ( -30.342 16.852 35.920) 49.949 8.972 ( 83.341 20.999 16.565) 87.527 10.902 ( 35.621 -7.895 29.611) 46.990 12.562 ( -24.000 -43.815 -0.807) 49.964 13.067 ( -29.625 -10.403 25.229) 40.278 14.221 ( -46.672 28.427 1.205) 54.661 15.300 ( -43.666 -20.219 -0.656) 48.124 16.376 ( 7.207 10.249 -0.457) 12.537 17.160 ( -19.448 6.885 -2.227) 20.750 19.369 ( 17.371 -27.165 -2.362) 32.330 20.034 ( -9.609 -10.729 -2.991) 14.711 21.727 ( 7.934 -10.465 -4.579) 13.908 22.342 ( -9.375 10.277 -7.473) 15.791 22.962 ( 1.435 0.029 6.351) 6.511 23.086 ( -2.393 -0.173 5.150) 5.682 23.594 ( 9.029 1.255 -3.398) 9.728 24.058 ( -4.239 0.875 -15.744) 16.328 26.508 ( 27.870 7.088 -3.228) 28.938 26.759 ( 20.682 16.676 -3.944) 26.859 29.540 ( 15.335 8.708 -6.424) 18.768 30.839 ( -24.931 2.843 9.401) 26.796======================= Grid point 137 (32/210) =======================q-point: ( 0.45 0.09 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.426 ( 45.267 13.447 29.119) 55.478 6.633 ( 46.640 16.323 16.339) 52.045 7.210 ( -30.488 12.159 18.001) 37.435 7.420 ( -33.433 20.906 26.661) 47.599 10.555 ( 75.259 8.913 7.263) 76.132 11.596 ( 25.937 -11.795 18.855) 34.167 11.897 ( -39.782 -11.393 8.679) 42.281 12.414 ( -38.280 -8.787 27.345) 47.857 13.805 ( 10.562 6.719 2.161) 12.703 14.404 ( -42.868 -12.007 1.716) 44.551 16.577 ( 12.008 7.848 -0.934) 14.375 16.836 ( -14.331 7.135 -1.500) 16.079 19.649 ( 11.664 -23.447 -2.341) 26.292 19.851 ( -9.338 -17.705 -2.526) 20.175 21.915 ( 10.908 -2.736 -4.648) 12.168 22.138 ( -11.191 3.776 -5.496) 13.027 22.996 ( 1.998 0.114 5.775) 6.112 23.039 ( -2.346 0.091 5.421) 5.907 23.773 ( 8.975 0.423 -5.888) 10.742 23.938 ( -7.520 0.203 -9.598) 12.195 26.918 ( 13.213 9.790 -4.618) 17.081 27.011 ( 4.152 12.684 -4.578) 14.109 29.898 ( 20.914 8.037 -2.171) 22.510 30.350 ( -24.380 5.847 2.928) 25.241======================= Grid point 145 (33/210) =======================q-point: ( 0.18 0.18 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.997 ( 42.997 42.997 16.595) 63.030 4.085 ( 43.066 43.066 35.795) 70.644 6.542 ( 69.296 69.296 35.743) 104.314 7.022 ( 32.735 32.735 8.916) 47.144 9.342 ( 4.173 4.173 37.654) 38.113 9.474 ( 6.537 6.537 34.271) 35.496 13.004 ( -46.290 -46.290 -4.133) 65.595 13.799 ( -17.866 -17.866 26.820) 36.847 15.687 ( -7.982 -7.982 0.267) 11.291 16.114 ( -16.787 -16.787 -1.576) 23.792 16.797 ( -10.917 -10.917 -2.570) 15.651 18.039 ( 1.854 1.854 -1.212) 2.889 18.247 ( -14.246 -14.246 -3.894) 20.520 20.355 ( -22.423 -22.423 -5.802) 32.237 21.301 ( 3.450 3.450 -3.808) 6.189 22.769 ( -0.367 -0.367 -16.581) 16.589 22.939 ( -0.180 -0.180 4.969) 4.975 23.074 ( -0.230 -0.230 -3.183) 3.199 23.428 ( 4.110 4.110 5.215) 7.809 24.119 ( 4.197 4.197 -25.542) 26.222 25.448 ( 31.677 31.677 0.835) 44.806 26.140 ( 29.817 29.817 -3.090) 42.280 29.265 ( 9.982 9.982 -10.381) 17.522 31.596 ( -15.072 -15.072 23.073) 31.412======================= Grid point 146 (34/210) =======================q-point: ( 0.27 0.18 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.936 ( 50.617 31.661 13.113) 61.126 5.007 ( 49.531 35.251 31.546) 68.491 7.628 ( 32.002 41.360 7.051) 52.768 8.057 ( 74.939 46.723 22.490) 91.130 9.030 ( -21.234 27.197 37.704) 51.109 10.007 ( 32.622 -14.227 34.223) 49.374 12.148 ( -37.723 -50.830 -2.920) 63.366 13.372 ( -25.340 -16.895 26.566) 40.414 15.352 ( -30.070 -19.581 -0.802) 35.892 15.587 ( -33.089 -4.258 -1.212) 33.384 16.589 ( -5.313 8.161 -0.673) 9.762 17.746 ( -22.526 7.106 -2.945) 23.803 18.423 ( 19.996 -24.823 -1.578) 31.915 19.944 ( -18.003 -24.270 -4.102) 30.496 21.410 ( 7.064 -2.636 -3.944) 8.509 22.661 ( -9.547 0.598 -11.572) 15.014 22.942 ( 0.731 0.239 5.787) 5.838 23.083 ( 0.082 -2.354 -1.029) 2.570 23.515 ( 5.245 4.853 3.417) 7.921 24.138 ( -1.732 0.889 -16.878) 16.990 26.137 ( 35.538 22.970 -0.496) 42.318 26.712 ( 26.935 25.839 -3.893) 37.527 29.491 ( 12.817 12.628 -9.292) 20.251 31.270 ( -17.847 -4.878 12.442) 22.296======================= Grid point 147 (35/210) =======================q-point: ( 0.36 0.18 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.923 ( 48.424 28.372 19.904) 59.548 6.022 ( 52.861 26.649 20.329) 62.592 7.981 ( -0.532 34.020 3.916) 34.249 8.531 ( -25.561 31.147 35.756) 53.870 9.566 ( 72.098 38.280 16.798) 83.341 10.670 ( 33.793 -15.587 28.329) 46.771 11.646 ( -10.806 -47.233 2.041) 48.496 12.812 ( -31.061 -16.369 26.279) 43.856 14.571 ( -43.196 -0.463 0.564) 43.202 14.858 ( -40.860 -17.013 -0.975) 44.271 16.612 ( 6.170 13.278 -0.099) 14.642 17.338 ( -18.183 10.626 -2.231) 21.178 18.806 ( 17.866 -28.208 -1.520) 33.424 19.638 ( -13.690 -26.370 -2.931) 29.856 21.586 ( 10.966 -5.134 -3.879) 12.715 22.426 ( -13.770 -1.805 -7.427) 15.749 22.965 ( 1.473 0.305 5.033) 5.253 23.069 ( -1.376 -1.377 1.603) 2.521 23.640 ( 7.247 3.150 0.003) 7.902 24.067 ( -5.219 -0.271 -10.730) 11.935 26.776 ( 28.104 19.348 -2.054) 34.182 27.154 ( 16.834 22.329 -4.333) 28.297 29.769 ( 15.487 13.762 -7.142) 21.914 30.896 ( -19.975 2.366 5.351) 20.814======================= Grid point 148 (36/210) =======================q-point: ( 0.45 0.18 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.827 ( 42.727 26.471 20.850) 54.416 7.038 ( 48.067 23.677 16.233) 55.987 7.609 ( -31.058 27.293 16.740) 44.606 7.934 ( -37.202 29.908 23.370) 53.148 10.823 ( 50.941 17.934 7.604) 54.539 11.279 ( 18.056 -18.445 8.169) 27.073 11.629 ( 8.205 -15.064 22.951) 28.653 12.173 ( -33.130 -15.540 28.264) 46.238 13.898 ( -16.768 -0.605 1.324) 16.831 14.092 ( -31.553 -16.945 0.625) 35.821 16.785 ( 10.781 12.624 -0.597) 16.612 17.027 ( -13.787 11.607 -1.360) 18.073 19.120 ( 14.256 -28.350 -1.753) 31.781 19.382 ( -12.736 -27.534 -2.201) 30.416 21.838 ( 14.342 -5.632 -4.105) 15.946 22.135 ( -15.330 -4.374 -5.121) 16.744 22.998 ( 1.846 0.096 4.145) 4.539 23.035 ( -1.891 -0.429 3.125) 3.678 23.791 ( 7.888 1.311 -3.109) 8.580 23.942 ( -7.202 0.065 -6.411) 9.642 27.207 ( 14.809 18.671 -3.496) 24.086 27.340 ( 1.496 19.781 -4.280) 20.294 30.105 ( 18.606 12.191 -3.814) 22.569 30.494 ( -20.484 8.066 0.317) 22.017======================= Grid point 157 (37/210) =======================q-point: ( 0.27 0.27 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.659 ( 41.002 41.002 7.694) 58.494 5.791 ( 43.117 43.117 29.778) 67.859 8.406 ( 34.785 34.785 -2.111) 49.238 9.165 ( 61.251 61.251 20.196) 88.945 9.569 ( 8.668 8.668 42.009) 43.760 9.754 ( 7.865 7.865 32.539) 34.388 11.190 ( -43.184 -43.184 -2.568) 61.126 12.962 ( -24.477 -24.477 26.697) 43.715 14.795 ( -33.539 -33.539 -1.438) 47.453 15.354 ( -21.929 -21.929 -0.232) 31.013 16.740 ( 6.901 6.901 -0.484) 9.771 17.858 ( -7.355 -7.355 -3.321) 10.919 18.074 ( 0.403 0.403 -0.246) 0.621 19.467 ( -21.767 -21.767 -2.803) 30.911 21.409 ( 2.121 2.121 -3.935) 4.948 22.553 ( -10.489 -10.489 -8.594) 17.143 22.953 ( 0.862 0.862 4.667) 4.823 23.056 ( -0.576 -0.576 -2.476) 2.606 23.607 ( 4.666 4.666 4.546) 8.013 24.118 ( -2.620 -2.620 -10.559) 11.190 26.672 ( 29.230 29.230 -0.878) 41.347 27.210 ( 23.562 23.562 -4.309) 33.599 29.763 ( 14.566 14.566 -8.879) 22.432 31.132 ( -9.171 -9.171 6.041) 14.307======================= Grid point 158 (38/210) =======================q-point: ( 0.36 0.27 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.522 ( 45.716 32.125 5.340) 56.129 6.668 ( 45.171 37.819 27.278) 64.921 8.718 ( -9.815 38.643 3.597) 40.032 9.253 ( -24.391 40.720 28.801) 55.521 10.288 ( 26.055 -22.045 23.848) 41.636 10.396 ( 56.197 33.576 15.046) 67.171 10.791 ( 15.762 -27.905 10.216) 33.637 12.417 ( -30.386 -23.518 26.761) 46.824 14.091 ( -35.736 -34.407 -0.911) 49.615 14.743 ( -38.595 -8.323 0.831) 39.491 16.877 ( 7.493 12.896 -0.462) 14.922 17.546 ( -16.484 9.179 -2.271) 19.004 18.309 ( 14.878 -20.705 -0.478) 25.500 19.109 ( -15.042 -25.204 -1.680) 29.399 21.500 ( 7.283 -3.426 -3.819) 8.908 22.291 ( -15.274 -11.025 -5.932) 19.749 22.974 ( 1.267 0.660 3.325) 3.619 23.046 ( -0.681 -0.792 -1.479) 1.810 23.706 ( 5.401 3.390 3.059) 7.073 24.044 ( -4.750 -1.989 -6.105) 7.987 27.219 ( 24.908 24.101 -1.736) 34.703 27.594 ( 14.365 21.168 -4.361) 25.951 30.054 ( 14.906 14.639 -7.662) 22.253 30.914 ( -12.680 -0.779 1.252) 12.765======================= Grid point 159 (39/210) =======================q-point: ( 0.45 0.27 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.411 ( 42.479 30.086 7.698) 52.620 7.554 ( 43.498 29.695 19.652) 56.215 8.235 ( -31.435 34.815 15.906) 49.530 8.525 ( -44.381 27.733 18.284) 55.436 10.888 ( 33.877 -17.124 10.066) 39.271 11.214 ( 20.265 4.625 9.751) 22.960 11.400 ( 25.809 4.839 20.831) 33.518 11.818 ( -26.222 -18.456 30.276) 44.100 13.572 ( -8.356 -25.446 0.489) 26.787 13.939 ( -38.150 -5.465 1.723) 38.578 17.044 ( 9.570 12.800 -0.810) 16.002 17.260 ( -12.558 11.124 -1.470) 16.841 18.590 ( 13.425 -24.138 -0.627) 27.628 18.844 ( -12.621 -25.588 -1.019) 28.550 21.697 ( 12.576 -8.024 -3.824) 15.400 21.980 ( -15.613 -10.540 -4.409) 19.347 23.001 ( 1.402 0.262 1.841) 2.329 23.027 ( -1.195 -0.294 0.201) 1.247 23.819 ( 6.024 1.413 0.453) 6.204 23.938 ( -5.857 -0.532 -2.576) 6.421 27.611 ( 13.935 21.087 -2.859) 25.437 27.745 ( 0.510 20.183 -3.855) 20.554 30.349 ( 15.009 12.004 -5.464) 19.980 30.643 ( -14.588 6.570 -2.451) 16.186======================= Grid point 169 (40/210) =======================q-point: ( 0.36 0.36 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.196 ( 36.222 36.222 1.467) 51.247 7.453 ( 40.745 40.745 25.180) 62.884 9.334 ( 10.109 10.109 10.420) 17.690 9.612 ( -30.487 -30.487 -0.424) 43.118 9.982 ( 5.268 5.268 28.831) 29.778 10.352 ( 32.100 32.100 23.919) 51.312 11.446 ( 42.787 42.787 11.565) 61.606 11.905 ( -25.452 -25.452 28.300) 45.787 13.377 ( -35.863 -35.863 -0.786) 50.723 14.403 ( -26.050 -26.050 2.188) 36.905 17.097 ( 9.329 9.329 -1.035) 13.234 17.602 ( -5.628 -5.628 -2.610) 8.376 18.089 ( 0.424 0.424 0.906) 1.087 18.690 ( -17.084 -17.084 -0.247) 24.162 21.471 ( 1.041 1.041 -3.725) 4.006 22.031 ( -14.399 -14.399 -4.572) 20.871 22.990 ( 0.901 0.901 1.483) 1.955 23.035 ( -0.462 -0.462 -2.359) 2.448 23.773 ( 3.509 3.509 3.860) 6.287 23.991 ( -3.224 -3.224 -2.335) 5.123 27.671 ( 20.587 20.587 -1.971) 29.181 27.944 ( 13.342 13.342 -4.055) 19.300 30.329 ( 12.966 12.966 -7.540) 19.826 30.862 ( -4.515 -4.515 -2.090) 6.718======================= Grid point 170 (41/210) =======================q-point: ( 0.45 0.36 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.935 ( 37.825 23.709 -1.548) 44.668 8.215 ( 31.980 34.345 18.109) 50.301 8.827 ( -33.448 15.772 6.837) 37.607 9.035 ( -31.510 31.282 24.909) 50.911 10.496 ( 36.150 -23.406 22.254) 48.476 11.159 ( -3.110 -8.653 16.212) 18.638 11.294 ( 15.499 -8.728 19.689) 26.534 11.989 ( -15.841 27.882 12.157) 34.295 13.042 ( 19.327 -26.504 2.528) 32.900 13.747 ( -38.994 -14.577 3.844) 41.807 17.259 ( 7.726 8.445 -1.401) 11.531 17.425 ( -9.453 4.680 -1.884) 10.715 18.216 ( 9.315 -12.648 0.884) 15.733 18.418 ( -11.345 -16.891 0.558) 20.355 21.554 ( 7.443 -5.756 -3.622) 10.082 21.756 ( -12.695 -11.231 -3.823) 17.376 23.008 ( 0.909 0.438 -0.276) 1.046 23.024 ( -0.678 -0.071 -1.709) 1.839 23.845 ( 3.804 1.249 2.834) 4.905 23.921 ( -3.811 -1.119 0.653) 4.025 27.992 ( 11.197 16.652 -2.593) 20.233 28.092 ( 1.303 14.067 -3.392) 14.529 30.560 ( 10.457 9.109 -6.549) 15.337 30.740 ( -7.733 3.115 -4.690) 9.566======================= Grid point 181 (42/210) =======================q-point: ( 0.45 0.45 0.05)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.357 ( 18.743 18.743 -4.386) 26.868 8.613 ( -2.569 -2.569 -4.706) 5.945 9.130 ( 26.898 26.898 26.597) 46.415 9.554 ( 3.122 3.122 24.509) 24.903 10.126 ( 1.905 1.905 27.439) 27.571 10.618 ( -32.201 -32.201 25.927) 52.403 11.640 ( 28.002 28.002 5.286) 39.952 12.186 ( -20.182 -20.182 0.484) 28.546 12.868 ( 19.702 19.702 11.135) 30.006 13.362 ( -24.090 -24.090 7.143) 34.809 17.376 ( 3.954 3.954 -1.812) 5.878 17.438 ( -2.312 -2.312 -2.021) 3.844 18.104 ( 0.252 0.252 1.764) 1.800 18.183 ( -7.476 -7.476 1.599) 10.692 21.496 ( 0.278 0.278 -3.476) 3.498 21.570 ( -7.056 -7.056 -3.512) 10.579 23.017 ( 0.383 0.383 -1.747) 1.829 23.022 ( -0.168 -0.168 -2.306) 2.318 23.870 ( 1.287 1.287 3.561) 4.000 23.896 ( -1.347 -1.347 2.766) 3.359 28.235 ( 7.461 7.461 -2.627) 10.874 28.272 ( 3.804 3.804 -2.932) 6.127 30.701 ( 5.139 5.139 -6.818) 9.966 30.762 ( -0.961 -0.961 -6.184) 6.331======================= Grid point 242 (43/210) =======================q-point: ( 0.00 0.00 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.610 ( 0.000 0.000 67.282) 67.282 2.610 ( -0.000 -0.000 67.282) 67.282 4.860 ( 0.000 0.000 120.201) 120.201 6.117 ( 0.000 0.000 35.811) 35.811 10.135 ( -0.000 -0.000 60.557) 60.557 10.135 ( 0.000 -0.000 60.557) 60.557 15.211 ( 0.000 0.000 46.625) 46.625 15.733 ( -0.000 -0.000 1.158) 1.158 15.755 ( 0.000 0.000 8.854) 8.854 16.872 ( 0.000 0.000 -4.369) 4.369 17.040 ( 0.000 0.000 -7.744) 7.744 17.040 ( 0.000 0.000 -7.744) 7.744 19.490 ( 0.000 0.000 -10.756) 10.756 20.889 ( 0.000 0.000 -4.555) 4.555 20.889 ( -0.000 -0.000 -4.555) 4.555 21.131 ( 0.000 0.000 -15.133) 15.133 22.709 ( 0.000 0.000 -18.590) 18.590 22.709 ( 0.000 0.000 -18.590) 18.590 23.214 ( 0.000 0.000 15.834) 15.834 23.953 ( 0.000 0.000 -3.142) 3.142 24.073 ( -0.000 -0.000 15.009) 15.009 24.073 ( 0.000 0.000 15.009) 15.009 28.584 ( 0.000 0.000 -22.373) 22.373 34.015 ( 0.000 0.000 -11.286) 11.286======================= Grid point 243 (44/210) =======================q-point: ( 0.09 0.00 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.961 ( 33.232 0.000 59.269) 67.950 2.993 ( 36.216 0.000 55.354) 66.149 5.271 ( 39.273 0.000 110.767) 117.523 6.287 ( 17.626 0.000 33.692) 38.024 10.052 ( -8.411 0.000 60.307) 60.891 10.280 ( 14.212 0.000 60.228) 61.882 15.104 ( -10.956 0.000 45.320) 46.625 15.151 ( -42.240 0.000 4.752) 42.507 15.757 ( 2.843 0.000 1.023) 3.021 16.642 ( -24.225 0.000 -5.084) 24.753 16.960 ( -6.597 0.000 -5.861) 8.824 17.718 ( 46.144 0.000 -9.799) 47.173 19.140 ( -32.544 0.000 -9.961) 34.035 20.654 ( -18.838 0.000 -7.490) 20.272 21.312 ( 15.930 0.000 -11.511) 19.654 21.430 ( 43.011 0.000 -26.430) 50.483 22.663 ( -2.526 0.000 -19.102) 19.269 22.859 ( 10.773 0.000 -14.288) 17.895 23.216 ( 0.364 0.000 14.475) 14.480 23.630 ( -13.889 0.000 8.280) 16.170 24.379 ( 29.407 0.000 11.289) 31.499 24.566 ( 30.446 0.000 1.927) 30.507 28.624 ( 4.007 0.000 -21.837) 22.202 33.524 ( -42.696 0.000 6.519) 43.191======================= Grid point 244 (45/210) =======================q-point: ( 0.18 0.00 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.804 ( 49.710 0.000 45.986) 67.719 3.906 ( 53.427 0.000 41.277) 67.515 6.250 ( 54.192 0.000 80.858) 97.339 6.824 ( 38.205 0.000 36.217) 52.643 9.804 ( -16.808 0.000 59.545) 61.871 10.667 ( 24.197 0.000 59.216) 63.969 14.335 ( -38.961 0.000 1.486) 38.990 14.775 ( -22.588 0.000 40.086) 46.012 15.853 ( 6.896 0.000 0.182) 6.898 15.960 ( -43.161 0.000 -1.097) 43.175 16.770 ( -13.894 0.000 -4.272) 14.536 18.343 ( -44.818 0.000 -8.569) 45.630 18.550 ( 37.514 0.000 -8.314) 38.425 20.320 ( -13.540 0.000 -5.763) 14.715 21.637 ( 15.199 0.000 -10.765) 18.626 21.982 ( 5.171 0.000 -24.469) 25.009 22.828 ( 22.215 0.000 -32.672) 39.510 23.032 ( 6.217 0.000 -4.978) 7.964 23.240 ( 2.550 0.000 8.508) 8.882 23.442 ( -5.681 0.000 7.860) 9.698 25.111 ( 41.408 0.000 5.270) 41.742 25.189 ( 31.984 0.000 -3.528) 32.178 28.743 ( 8.226 0.000 -19.981) 21.608 32.615 ( -45.498 0.000 20.784) 50.021======================= Grid point 245 (46/210) =======================q-point: ( 0.27 0.00 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.842 ( 54.247 0.000 35.895) 65.048 5.013 ( 57.444 0.000 38.241) 69.008 7.126 ( 33.078 0.000 31.937) 45.980 7.894 ( 67.583 0.000 55.262) 87.300 9.389 ( -25.232 0.000 58.169) 63.406 11.197 ( 28.501 0.000 55.586) 62.467 13.688 ( -24.287 0.000 2.705) 24.438 14.197 ( -36.849 0.000 26.398) 45.329 15.016 ( -50.612 0.000 12.407) 52.110 16.020 ( 9.761 0.000 -0.653) 9.783 16.343 ( -31.393 0.000 -1.990) 31.456 17.528 ( -34.175 0.000 -5.928) 34.685 19.192 ( 27.471 0.000 -7.028) 28.355 20.120 ( -7.256 0.000 -4.115) 8.342 21.871 ( 8.153 0.000 -10.167) 13.032 21.900 ( -7.072 0.000 -12.777) 14.603 23.106 ( 1.832 0.000 5.467) 5.765 23.203 ( 7.978 0.000 -14.044) 16.152 23.328 ( 6.140 0.000 -2.202) 6.523 23.430 ( 7.013 0.000 -13.313) 15.048 25.798 ( 29.183 0.000 -7.773) 30.201 25.901 ( 36.699 0.000 0.533) 36.703 28.955 ( 13.567 0.000 -16.051) 21.016 31.783 ( -39.037 0.000 19.104) 43.461======================= Grid point 246 (47/210) =======================q-point: ( 0.36 0.00 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.895 ( 51.564 0.000 29.149) 59.232 6.128 ( 55.027 0.000 41.847) 69.132 7.564 ( 9.713 0.000 21.469) 23.565 8.809 ( -33.679 0.000 55.905) 65.266 9.304 ( 73.271 0.000 40.943) 83.934 11.756 ( 28.272 0.000 45.945) 53.947 13.295 ( -54.615 0.000 7.780) 55.167 13.484 ( 5.424 0.000 9.198) 10.678 14.039 ( -47.587 0.000 31.529) 57.084 15.552 ( -45.798 0.000 4.223) 45.993 16.230 ( 11.362 0.000 -1.321) 11.438 17.028 ( -18.613 0.000 -3.843) 19.005 19.625 ( 16.444 0.000 -6.214) 17.579 20.015 ( -3.884 0.000 -3.599) 5.295 21.804 ( -1.780 0.000 -8.911) 9.087 21.957 ( 0.742 0.000 -9.347) 9.377 23.129 ( 0.931 0.000 8.533) 8.584 23.221 ( -1.747 0.000 5.788) 6.046 23.460 ( 6.719 0.000 -7.988) 10.438 23.597 ( 5.929 0.000 -24.445) 25.153 26.314 ( 22.552 0.000 -10.617) 24.927 26.491 ( 21.994 0.000 -4.566) 22.463 29.293 ( 21.044 0.000 -9.421) 23.057 31.058 ( -35.093 0.000 12.672) 37.310======================= Grid point 247 (48/210) =======================q-point: ( 0.45 0.00 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.826 ( 41.432 0.000 24.621) 48.195 7.159 ( 48.716 0.000 46.754) 67.522 7.459 ( -19.634 0.000 22.450) 29.824 8.064 ( -41.883 0.000 52.411) 67.091 10.735 ( 71.277 0.000 22.274) 74.676 12.093 ( -65.921 0.000 8.277) 66.438 12.364 ( 35.012 0.000 36.020) 50.232 13.143 ( -43.219 0.000 35.163) 55.717 13.879 ( 32.069 0.000 15.584) 35.655 14.648 ( -44.087 0.000 12.495) 45.823 16.464 ( 12.365 0.000 -1.980) 12.522 16.720 ( -13.794 0.000 -2.755) 14.066 19.852 ( 7.314 0.000 -5.128) 8.932 19.949 ( -3.396 0.000 -4.050) 5.285 21.830 ( 3.807 0.000 -7.951) 8.815 21.918 ( -4.064 0.000 -8.443) 9.371 23.151 ( 1.355 0.000 8.565) 8.671 23.183 ( -1.874 0.000 7.827) 8.048 23.579 ( 5.004 0.000 -12.532) 13.494 23.642 ( -0.958 0.000 -18.142) 18.167 26.659 ( 11.686 0.000 -11.359) 16.297 26.744 ( 3.746 0.000 -9.264) 9.993 29.784 ( 28.412 0.000 -1.469) 28.450 30.390 ( -32.609 0.000 5.827) 33.126======================= Grid point 254 (49/210) =======================q-point: ( 0.09 0.09 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.198 ( 26.684 26.684 51.646) 63.964 3.371 ( 32.921 32.921 50.454) 68.653 5.674 ( 38.577 38.577 102.769) 116.352 6.440 ( 15.949 15.949 31.441) 38.695 10.184 ( 2.504 2.504 60.665) 60.768 10.212 ( 3.540 3.540 59.510) 59.720 14.642 ( -38.035 -38.035 4.110) 53.947 15.054 ( -10.008 -10.008 43.280) 45.535 15.761 ( 1.140 1.140 1.464) 2.178 16.605 ( -10.914 -10.914 -4.567) 16.096 17.040 ( -3.291 -3.291 -7.010) 8.414 17.743 ( 13.979 13.979 -5.880) 20.625 18.908 ( -22.817 -22.817 -9.301) 33.582 20.841 ( -10.112 -10.112 -16.203) 21.611 21.040 ( 4.821 4.821 -5.694) 8.882 21.725 ( 23.609 23.609 -32.837) 46.830 22.853 ( 8.458 8.458 -14.768) 19.005 22.855 ( 4.620 4.620 -14.463) 15.870 23.230 ( 1.816 1.816 11.631) 11.911 23.644 ( -1.820 -1.820 5.613) 6.176 24.463 ( 19.634 19.634 10.340) 29.629 24.931 ( 27.138 27.138 0.111) 38.379 28.669 ( 4.614 4.614 -21.358) 22.333 33.164 ( -32.228 -32.228 14.608) 47.861======================= Grid point 255 (50/210) =======================q-point: ( 0.18 0.09 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.942 ( 46.385 16.563 39.634) 63.220 4.192 ( 48.294 25.913 42.323) 69.246 6.617 ( 48.608 35.128 71.789) 93.544 6.958 ( 40.877 14.196 37.858) 57.495 9.954 ( -16.379 14.803 59.571) 63.530 10.590 ( 24.444 -7.752 59.117) 64.439 13.828 ( -41.806 -40.871 -0.081) 58.466 14.757 ( -20.051 -6.252 43.395) 48.210 15.811 ( 3.231 -3.976 0.795) 5.185 16.131 ( -36.245 8.832 -3.085) 37.433 16.781 ( -17.157 1.199 -4.673) 17.822 18.131 ( -5.619 -15.700 -6.283) 17.819 18.428 ( 0.211 -10.928 -6.296) 12.614 20.435 ( -18.677 1.943 -9.732) 21.150 21.300 ( 10.853 -17.856 -8.203) 22.447 22.145 ( 13.159 10.801 -28.133) 32.883 22.936 ( 8.140 3.950 -17.125) 19.368 23.033 ( 5.403 1.214 -2.811) 6.211 23.310 ( 6.545 6.793 -0.202) 9.436 23.574 ( -3.082 10.835 2.167) 11.471 25.085 ( 37.987 8.472 4.326) 39.160 25.524 ( 31.939 23.643 -3.401) 39.883 28.804 ( 9.101 6.088 -19.692) 22.532 32.440 ( -38.098 -16.537 20.564) 46.345======================= Grid point 256 (51/210) =======================q-point: ( 0.27 0.09 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.939 ( 53.059 10.661 31.155) 62.446 5.211 ( 53.885 19.333 39.123) 69.339 7.339 ( 28.508 20.106 26.168) 43.609 8.122 ( 68.684 23.536 56.485) 91.989 9.552 ( -24.325 16.039 58.201) 65.087 11.122 ( 28.262 -7.486 55.415) 62.655 13.083 ( -31.515 -45.519 1.151) 55.376 14.270 ( -28.993 -2.859 37.986) 47.871 15.261 ( -48.434 18.125 3.142) 51.810 15.826 ( -8.319 -16.761 -1.275) 18.755 16.424 ( -15.408 6.379 -1.202) 16.720 17.559 ( -29.507 3.186 -5.941) 30.268 18.884 ( 25.129 -24.727 -4.197) 35.503 20.145 ( -11.527 -5.007 -6.750) 14.265 21.464 ( 6.863 -16.003 -7.880) 19.113 22.239 ( -0.984 12.529 -15.347) 19.836 23.079 ( 3.011 -2.819 -0.383) 4.142 23.109 ( 4.691 -4.508 -4.525) 7.925 23.430 ( 3.895 7.282 -0.343) 8.265 23.590 ( 4.994 12.022 -15.658) 20.362 25.818 ( 34.476 7.585 -1.965) 35.355 26.148 ( 30.117 19.389 -5.262) 36.203 29.031 ( 14.134 7.523 -16.147) 22.740 31.717 ( -35.063 -6.577 17.243) 39.623======================= Grid point 257 (52/210) =======================q-point: ( 0.36 0.09 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.977 ( 51.080 8.575 26.248) 58.065 6.278 ( 53.779 14.912 40.350) 68.866 7.719 ( 7.295 15.681 19.705) 26.218 8.969 ( -31.157 15.899 54.687) 64.917 9.522 ( 67.971 21.474 41.155) 82.310 11.646 ( 23.729 -11.564 41.384) 49.086 12.642 ( -15.212 -39.800 12.085) 44.289 13.669 ( -29.001 -2.560 31.939) 43.217 14.308 ( -44.552 22.303 10.373) 50.891 15.306 ( -39.245 -21.502 2.567) 44.823 16.368 ( 6.576 11.193 -0.113) 12.982 17.099 ( -18.174 6.862 -3.839) 19.802 19.304 ( 17.461 -25.568 -4.076) 31.229 19.952 ( -8.741 -11.624 -5.244) 15.460 21.608 ( 8.288 -8.966 -7.191) 14.170 22.162 ( -6.392 9.495 -10.339) 15.424 23.108 ( 1.040 -1.704 6.712) 7.002 23.166 ( 0.623 -5.272 -0.046) 5.309 23.508 ( 4.844 5.669 -3.770) 8.355 23.681 ( 2.655 6.442 -19.642) 20.841 26.406 ( 24.736 10.122 -7.351) 27.719 26.651 ( 19.424 14.867 -6.967) 25.433 29.372 ( 20.721 7.767 -10.110) 24.329 31.052 ( -32.684 -0.720 10.914) 34.465======================= Grid point 258 (53/210) =======================q-point: ( 0.45 0.09 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.904 ( 41.564 8.437 23.408) 48.443 7.295 ( 45.763 12.389 41.525) 63.024 7.577 ( -18.087 12.843 23.453) 32.282 8.233 ( -42.243 16.071 49.552) 67.068 10.834 ( 62.432 9.990 23.040) 67.294 11.831 ( -26.775 -19.605 9.990) 34.656 12.442 ( 14.711 1.651 39.632) 42.306 13.078 ( -37.178 -6.638 37.401) 53.151 13.913 ( 13.205 3.059 10.730) 17.287 14.500 ( -39.183 -14.267 10.333) 42.961 16.554 ( 11.183 8.595 -1.261) 14.160 16.796 ( -13.412 7.454 -2.439) 15.537 19.585 ( 11.556 -22.660 -4.101) 25.765 19.782 ( -8.899 -17.693 -4.456) 20.300 21.795 ( 10.442 -1.850 -7.184) 12.809 22.000 ( -9.745 4.095 -8.164) 13.356 23.130 ( 1.248 -2.003 6.425) 6.845 23.155 ( -1.180 -3.019 4.600) 5.627 23.609 ( 4.902 3.662 -9.760) 11.520 23.683 ( -2.175 3.790 -15.003) 15.626 26.777 ( 12.421 11.778 -9.856) 19.752 26.875 ( 3.002 12.712 -9.321) 16.046 29.848 ( 27.198 6.186 -2.676) 28.020 30.425 ( -30.866 3.253 4.330) 31.337======================= Grid point 266 (54/210) =======================q-point: ( 0.18 0.18 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.464 ( 35.428 35.428 30.579) 58.698 4.860 ( 40.579 40.579 40.277) 70.110 7.311 ( 27.176 27.176 20.726) 43.666 7.600 ( 55.494 55.494 70.691) 105.623 10.331 ( 4.961 4.961 60.908) 61.311 10.391 ( 5.303 5.303 57.073) 57.564 12.941 ( -46.283 -46.283 -1.723) 65.477 14.517 ( -17.608 -17.608 45.293) 51.687 15.690 ( -9.641 -9.641 -0.091) 13.635 16.069 ( -15.987 -15.987 -2.977) 22.804 16.724 ( -8.922 -8.922 -4.753) 13.483 18.017 ( 2.810 2.810 -0.568) 4.014 18.135 ( -13.739 -13.739 -7.484) 20.822 20.199 ( -20.013 -20.013 -9.757) 29.937 21.196 ( 3.198 3.198 -6.721) 8.101 22.345 ( 7.577 7.577 -24.077) 26.353 22.961 ( 1.019 1.019 -8.777) 8.894 23.061 ( 0.876 0.876 3.566) 3.775 23.460 ( 7.288 7.288 -4.309) 11.171 23.736 ( 4.570 4.570 -7.042) 9.558 25.486 ( 29.779 29.779 3.300) 42.244 26.047 ( 28.315 28.315 -6.155) 40.513 28.976 ( 11.117 11.117 -18.618) 24.368 32.028 ( -23.858 -23.858 17.912) 38.200======================= Grid point 267 (55/210) =======================q-point: ( 0.27 0.18 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.285 ( 46.421 24.507 23.097) 57.350 5.740 ( 47.590 33.429 38.681) 69.846 7.851 ( 25.532 30.493 16.168) 42.931 8.811 ( 64.151 44.966 54.329) 95.335 9.992 ( -21.949 27.695 57.939) 67.866 10.909 ( 27.752 -13.791 55.168) 63.276 12.113 ( -33.711 -51.051 0.424) 61.179 14.077 ( -26.732 -15.547 43.638) 53.485 15.331 ( -28.974 -21.979 -1.205) 36.387 15.558 ( -32.879 -2.488 -1.455) 33.005 16.572 ( -3.046 8.289 -0.914) 8.878 17.665 ( -22.039 7.809 -5.229) 23.959 18.388 ( 20.469 -23.574 -1.555) 31.259 19.835 ( -15.942 -22.729 -6.680) 28.555 21.302 ( 7.173 -2.586 -6.825) 10.233 22.390 ( -3.074 2.853 -15.234) 15.801 23.003 ( 2.806 -3.209 -7.536) 8.658 23.070 ( 0.251 -1.105 5.208) 5.329 23.574 ( 4.298 6.884 0.062) 8.116 23.789 ( 1.678 7.113 -13.491) 15.343 26.131 ( 33.001 23.104 -0.012) 40.284 26.594 ( 26.042 24.802 -7.940) 36.829 29.236 ( 15.267 12.838 -16.138) 25.658 31.535 ( -25.715 -11.590 12.623) 30.902======================= Grid point 268 (56/210) =======================q-point: ( 0.36 0.18 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.239 ( 49.091 17.953 18.678) 55.508 6.700 ( 49.062 27.344 38.369) 68.021 8.171 ( 3.185 29.588 14.940) 33.299 9.405 ( -30.926 27.153 50.793) 65.372 10.111 ( 58.138 37.074 39.985) 79.708 11.268 ( 7.090 -27.472 23.372) 36.759 11.905 ( 16.307 -32.729 32.891) 49.183 13.488 ( -31.961 -14.281 39.883) 53.067 14.609 ( -40.142 -3.405 4.498) 40.536 14.843 ( -38.639 -15.545 -0.005) 41.649 16.612 ( 5.927 13.055 0.196) 14.339 17.278 ( -16.877 10.691 -3.756) 20.328 18.771 ( 17.617 -26.636 -1.671) 31.978 19.561 ( -12.395 -24.955 -4.569) 28.236 21.482 ( 11.103 -5.006 -6.491) 13.801 22.250 ( -10.319 -0.651 -9.877) 14.299 23.051 ( 1.843 -4.813 -4.309) 6.717 23.074 ( 0.214 -2.306 4.090) 4.700 23.645 ( 3.386 7.179 0.317) 7.944 23.805 ( -0.261 5.647 -13.480) 14.617 26.717 ( 25.413 20.737 -4.029) 33.046 27.025 ( 16.514 21.858 -8.754) 28.760 29.579 ( 19.630 12.650 -11.620) 26.084 31.022 ( -26.286 -2.538 6.637) 27.229======================= Grid point 269 (57/210) =======================q-point: ( 0.45 0.18 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.162 ( 42.801 17.164 17.079) 49.175 7.611 ( 32.888 19.778 32.676) 50.403 7.974 ( -11.224 26.422 23.902) 37.355 8.637 ( -44.104 23.416 42.906) 65.836 11.114 ( 38.080 17.184 23.262) 47.817 11.444 ( 5.472 -17.387 12.190) 21.928 12.360 ( 24.232 -9.769 47.550) 54.255 12.885 ( -28.209 -12.720 41.781) 51.992 13.960 ( -17.031 -1.271 5.842) 18.049 14.136 ( -29.038 -19.579 5.161) 35.400 16.772 ( 9.811 12.674 -0.667) 16.042 16.992 ( -12.592 11.665 -2.088) 17.291 19.077 ( 13.724 -26.818 -2.265) 30.210 19.326 ( -11.893 -26.104 -3.199) 28.863 21.732 ( 13.839 -5.246 -6.480) 16.156 22.008 ( -13.684 -3.639 -7.405) 15.979 23.074 ( 0.548 -4.144 -0.330) 4.193 23.078 ( 0.064 -3.506 1.750) 3.919 23.714 ( 3.542 6.207 -3.922) 8.152 23.777 ( -2.524 5.260 -9.102) 10.811 27.101 ( 12.969 20.212 -7.349) 25.114 27.212 ( 1.998 20.403 -8.824) 22.320 30.009 ( 23.808 9.652 -5.555) 26.284 30.504 ( -26.017 4.380 0.663) 26.391======================= Grid point 278 (58/210) =======================q-point: ( 0.27 0.27 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.890 ( 36.196 36.196 16.040) 53.643 6.487 ( 41.324 41.324 37.542) 69.460 8.479 ( 30.472 30.472 9.413) 44.109 9.805 ( 52.616 52.616 45.629) 87.286 10.584 ( 8.216 8.216 59.462) 60.586 10.616 ( 6.209 6.209 53.207) 53.927 11.148 ( -41.730 -41.730 -1.012) 59.023 13.679 ( -24.590 -24.590 44.836) 56.741 14.751 ( -33.562 -33.562 -3.055) 47.562 15.353 ( -20.386 -20.386 0.420) 28.833 16.725 ( 7.059 7.059 -1.050) 10.037 17.763 ( -6.894 -6.894 -6.254) 11.583 18.085 ( 1.282 1.282 1.938) 2.654 19.398 ( -19.665 -19.665 -3.765) 28.065 21.301 ( 2.171 2.171 -6.990) 7.635 22.349 ( -6.787 -6.787 -11.439) 14.932 22.969 ( -0.292 -0.292 -6.761) 6.774 23.051 ( -0.922 -0.922 3.646) 3.872 23.691 ( 4.878 4.878 1.848) 7.142 23.875 ( 2.207 2.207 -10.969) 11.405 26.656 ( 28.199 28.199 -0.546) 39.884 27.079 ( 23.183 23.183 -9.119) 34.031 29.521 ( 15.719 15.719 -15.282) 26.976 31.270 ( -15.139 -15.139 7.053) 22.542======================= Grid point 279 (59/210) =======================q-point: ( 0.36 0.27 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.678 ( 42.929 26.349 11.140) 51.588 7.329 ( 43.074 35.622 36.363) 66.682 8.849 ( 0.715 37.812 9.977) 39.113 9.935 ( -41.121 18.421 33.390) 56.081 10.664 ( 8.051 -24.109 20.883) 32.896 10.916 ( 46.902 39.961 37.212) 71.982 11.374 ( 37.372 -19.334 47.854) 63.722 13.127 ( -30.251 -22.022 43.601) 57.456 14.071 ( -33.550 -35.474 -0.741) 48.832 14.779 ( -36.465 -6.456 3.381) 37.186 16.864 ( 7.355 11.916 -0.924) 14.034 17.483 ( -15.203 8.595 -4.060) 17.930 18.312 ( 14.665 -18.313 1.309) 23.497 19.074 ( -13.757 -22.705 -1.430) 26.586 21.395 ( 7.553 -3.472 -6.702) 10.678 22.146 ( -12.964 -9.290 -8.210) 17.938 22.979 ( 0.948 -2.346 -5.856) 6.379 23.033 ( -0.832 -1.930 1.238) 2.439 23.770 ( 3.359 5.326 2.362) 6.725 23.893 ( -0.204 3.177 -7.585) 8.226 27.175 ( 23.140 24.288 -2.658) 33.652 27.463 ( 14.803 21.406 -9.035) 27.549 29.848 ( 17.449 14.190 -12.822) 25.889 30.945 ( -17.672 -5.379 1.597) 18.542======================= Grid point 280 (60/210) =======================q-point: ( 0.45 0.27 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.541 ( 43.078 20.297 8.441) 48.362 8.070 ( 17.573 25.726 24.902) 39.884 8.564 ( -10.382 31.813 21.735) 39.903 9.105 ( -40.546 23.458 34.889) 58.408 11.132 ( 31.639 -8.545 17.133) 36.981 11.527 ( 4.399 16.865 23.062) 28.907 12.093 ( 32.433 -15.323 46.825) 58.985 12.593 ( -21.354 -15.870 47.284) 54.255 13.598 ( -5.671 -25.594 2.636) 26.347 14.007 ( -37.975 -2.710 5.886) 38.524 17.022 ( 8.880 11.984 -1.368) 14.978 17.221 ( -11.482 10.605 -2.480) 15.826 18.587 ( 12.967 -21.763 0.769) 25.345 18.828 ( -11.856 -23.063 -0.088) 25.932 21.595 ( 12.476 -7.882 -6.377) 16.076 21.868 ( -14.617 -9.847 -6.690) 18.851 22.999 ( 1.000 -2.990 -3.942) 5.047 23.017 ( -0.850 -2.694 -1.416) 3.160 23.828 ( 2.623 5.022 0.294) 5.673 23.872 ( -1.744 4.134 -3.423) 5.643 27.529 ( 12.045 21.978 -5.443) 25.646 27.632 ( 1.809 20.998 -7.775) 22.464 30.206 ( 18.772 9.877 -8.674) 22.917 30.581 ( -19.001 3.088 -3.644) 19.592======================= Grid point 290 (61/210) =======================q-point: ( 0.36 0.36 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.262 ( 32.474 32.474 5.677) 46.274 8.058 ( 36.653 36.653 33.094) 61.499 9.548 ( 21.465 21.465 10.937) 32.267 9.627 ( -28.139 -28.139 2.416) 39.868 10.751 ( 4.301 4.301 47.572) 47.959 11.046 ( 16.318 16.318 44.686) 50.293 11.836 ( 35.430 35.430 29.213) 58.000 12.655 ( -22.251 -22.251 46.559) 56.196 13.355 ( -34.956 -34.956 -1.427) 49.456 14.485 ( -23.223 -23.223 6.948) 33.569 17.067 ( 8.672 8.672 -2.133) 12.448 17.528 ( -5.106 -5.106 -4.929) 8.743 18.136 ( 1.300 1.300 4.512) 4.872 18.700 ( -15.240 -15.240 1.827) 21.629 21.368 ( 1.239 1.239 -6.654) 6.880 21.915 ( -13.300 -13.300 -6.824) 20.009 22.954 ( -0.370 -0.370 -6.174) 6.196 22.999 ( -1.500 -1.500 -1.591) 2.652 23.855 ( 3.386 3.386 3.407) 5.878 23.932 ( 0.948 0.948 -2.899) 3.194 27.622 ( 19.894 19.894 -2.911) 28.285 27.824 ( 14.256 14.256 -8.159) 21.749 30.125 ( 13.716 13.716 -12.744) 23.209 30.808 ( -8.420 -8.420 -3.223) 12.336======================= Grid point 291 (62/210) =======================q-point: ( 0.45 0.36 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.936 ( 35.111 19.466 2.076) 40.199 8.511 ( -9.434 14.303 9.092) 19.397 9.158 ( 7.412 28.593 27.216) 40.164 9.610 ( -21.040 29.502 29.931) 46.999 11.032 ( 32.042 -5.798 30.854) 44.858 11.610 ( 10.098 -4.746 30.335) 32.322 11.840 ( -6.676 -16.135 32.743) 37.108 12.398 ( -27.834 -1.577 29.228) 40.392 13.161 ( 30.267 -13.790 12.429) 35.507 13.889 ( -36.095 -9.758 12.015) 39.274 17.218 ( 7.265 7.538 -2.736) 10.821 17.372 ( -8.499 3.948 -3.584) 10.033 18.263 ( 8.944 -10.313 4.464) 14.362 18.453 ( -10.540 -14.541 3.651) 18.327 21.454 ( 7.561 -5.598 -6.354) 11.352 21.655 ( -12.325 -10.823 -6.269) 17.559 22.957 ( 0.581 -1.302 -5.491) 5.673 22.974 ( -1.078 -1.667 -3.890) 4.367 23.907 ( 1.981 2.987 2.821) 4.562 23.934 ( -0.703 2.113 0.620) 2.311 27.922 ( 9.921 16.971 -4.380) 20.140 27.995 ( 2.660 14.983 -6.405) 16.510 30.385 ( 12.548 8.012 -10.905) 18.454 30.617 ( -10.885 0.417 -7.522) 13.238======================= Grid point 302 (63/210) =======================q-point: ( 0.45 0.45 0.11)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.295 ( 16.471 16.471 -1.494) 23.342 8.551 ( -7.975 -7.975 -1.680) 11.402 9.751 ( 30.260 30.260 34.218) 54.792 10.103 ( 7.389 7.389 28.208) 30.081 10.858 ( 1.344 1.344 45.349) 45.388 11.291 ( -30.069 -30.069 40.674) 58.844 11.801 ( 17.362 17.362 10.971) 26.893 12.201 ( -19.467 -19.467 1.105) 27.553 13.241 ( 17.600 17.600 28.313) 37.698 13.617 ( -17.634 -17.634 20.505) 32.286 17.323 ( 3.624 3.624 -3.525) 6.220 17.380 ( -2.071 -2.071 -3.891) 4.870 18.178 ( 0.638 0.638 6.388) 6.451 18.251 ( -6.570 -6.570 5.993) 11.057 21.399 ( 0.385 0.385 -6.241) 6.265 21.473 ( -6.949 -6.949 -6.156) 11.596 22.944 ( -0.130 -0.130 -5.937) 5.939 22.950 ( -0.759 -0.759 -5.384) 5.490 23.948 ( 1.243 1.243 3.706) 4.102 23.957 ( 0.328 0.328 2.967) 3.003 28.166 ( 7.194 7.194 -4.246) 11.024 28.193 ( 4.555 4.555 -5.043) 8.181 30.517 ( 5.379 5.379 -11.550) 13.830 30.596 ( -2.553 -2.553 -10.336) 10.949======================= Grid point 363 (64/210) =======================q-point: ( 0.00 0.00 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.933 ( -0.000 -0.000 67.859) 67.859 3.933 ( -0.000 -0.000 67.859) 67.859 6.933 ( 0.000 0.000 46.868) 46.868 7.145 ( 0.000 0.000 112.972) 112.972 11.453 ( -0.000 -0.000 72.044) 72.044 11.453 ( 0.000 -0.000 72.044) 72.044 15.762 ( 0.000 0.000 1.861) 1.861 15.974 ( -0.000 -0.000 13.635) 13.635 16.258 ( 0.000 0.000 58.706) 58.706 16.766 ( 0.000 0.000 -6.552) 6.552 16.849 ( 0.000 0.000 -11.804) 11.804 16.849 ( -0.000 -0.000 -11.804) 11.804 19.229 ( 0.000 0.000 -15.838) 15.838 20.790 ( -0.000 -0.000 -5.306) 5.306 20.790 ( 0.000 0.000 -5.306) 5.306 20.822 ( 0.000 0.000 -15.991) 15.991 22.300 ( -0.000 -0.000 -22.646) 22.646 22.300 ( 0.000 0.000 -22.646) 22.646 23.532 ( -0.000 -0.000 16.199) 16.199 23.884 ( 0.000 0.000 -3.695) 3.695 24.382 ( 0.000 0.000 15.823) 15.823 24.382 ( 0.000 0.000 15.823) 15.823 28.069 ( -0.000 -0.000 -29.654) 29.654 33.736 ( 0.000 0.000 -17.310) 17.310======================= Grid point 364 (65/210) =======================q-point: ( 0.09 0.00 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.130 ( 20.419 0.000 60.339) 63.700 4.172 ( 23.474 0.000 63.892) 68.068 7.044 ( 10.872 0.000 46.024) 47.291 7.452 ( 30.220 0.000 107.705) 111.865 11.361 ( -9.396 0.000 71.230) 71.847 11.590 ( 13.381 0.000 71.522) 72.763 15.285 ( -46.088 0.000 8.270) 46.824 15.785 ( 2.518 0.000 1.843) 3.120 16.053 ( -21.527 0.000 42.531) 47.669 16.562 ( -16.803 0.000 2.296) 16.959 16.841 ( -3.237 0.000 -4.177) 5.285 17.540 ( 45.760 0.000 -8.457) 46.535 18.900 ( -31.086 0.000 -14.615) 34.350 20.488 ( -17.650 0.000 -9.243) 19.924 21.069 ( 24.960 0.000 -13.204) 28.238 21.081 ( 16.426 0.000 -11.698) 20.166 22.262 ( -2.824 0.000 -21.657) 21.840 22.510 ( 15.950 0.000 -20.517) 25.987 23.519 ( -1.095 0.000 15.797) 15.835 23.743 ( -9.406 0.000 2.921) 9.850 24.625 ( 23.733 0.000 13.139) 27.127 24.653 ( 22.044 0.000 6.992) 23.127 28.123 ( 5.535 0.000 -28.688) 29.217 33.462 ( -26.091 0.000 -10.563) 28.149======================= Grid point 365 (66/210) =======================q-point: ( 0.18 0.00 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.739 ( 40.699 0.000 44.524) 60.322 4.804 ( 39.134 0.000 55.280) 67.730 7.352 ( 19.759 0.000 41.602) 46.056 8.253 ( 48.764 0.000 96.311) 107.953 11.081 ( -18.995 0.000 68.550) 71.133 11.947 ( 21.618 0.000 69.592) 72.873 14.424 ( -39.451 0.000 7.031) 40.073 15.415 ( -41.681 0.000 14.242) 44.047 15.868 ( 5.970 0.000 1.305) 6.111 16.148 ( -25.685 0.000 26.401) 36.834 16.707 ( -10.697 0.000 1.555) 10.809 18.142 ( -41.868 0.000 -11.758) 43.488 18.380 ( 38.332 0.000 -8.740) 39.315 20.199 ( -11.176 0.000 -6.434) 12.896 21.410 ( 15.481 0.000 -12.199) 19.710 21.544 ( 16.238 0.000 -19.441) 25.331 22.288 ( 9.511 0.000 -24.060) 25.872 22.790 ( 11.676 0.000 -16.966) 20.596 23.494 ( -1.418 0.000 14.567) 14.636 23.590 ( -5.887 0.000 6.020) 8.420 25.138 ( 25.936 0.000 -1.281) 25.967 25.234 ( 35.176 0.000 6.715) 35.811 28.293 ( 11.975 0.000 -25.329) 28.017 32.807 ( -37.939 0.000 0.362) 37.940======================= Grid point 366 (67/210) =======================q-point: ( 0.27 0.00 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.657 ( 46.075 0.000 46.589) 65.525 5.688 ( 54.166 0.000 32.064) 62.945 7.773 ( 21.070 0.000 34.976) 40.832 9.294 ( 55.198 0.000 83.067) 99.734 10.608 ( -29.121 0.000 63.291) 69.669 12.365 ( 17.903 0.000 60.595) 63.184 13.829 ( -16.949 0.000 12.818) 21.250 14.482 ( -51.402 0.000 5.121) 51.656 15.519 ( -38.494 0.000 30.581) 49.163 16.016 ( 8.804 0.000 0.263) 8.808 16.385 ( -22.854 0.000 11.573) 25.617 17.398 ( -30.732 0.000 -6.954) 31.510 19.035 ( 28.029 0.000 -8.703) 29.349 20.033 ( -6.213 0.000 -4.670) 7.773 21.647 ( -1.176 0.000 -12.666) 12.720 21.654 ( 8.892 0.000 -11.738) 14.726 22.633 ( 20.343 0.000 -30.368) 36.552 22.977 ( 7.615 0.000 -14.931) 16.761 23.467 ( -1.200 0.000 12.384) 12.442 23.504 ( -3.124 0.000 6.786) 7.471 25.642 ( 24.569 0.000 -7.634) 25.728 25.901 ( 30.225 0.000 -1.010) 30.242 28.608 ( 20.438 0.000 -18.598) 27.633 32.031 ( -39.874 0.000 5.966) 40.318======================= Grid point 367 (68/210) =======================q-point: ( 0.36 0.00 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.573 ( 45.688 0.000 39.524) 60.412 6.816 ( 58.899 0.000 28.116) 65.266 8.084 ( 7.662 0.000 30.994) 31.927 9.930 ( -39.766 0.000 54.735) 67.656 10.378 ( 53.902 0.000 67.240) 86.178 12.592 ( 8.973 0.000 34.411) 35.562 13.439 ( -53.507 0.000 9.963) 54.427 13.880 ( 20.322 0.000 34.504) 40.044 14.654 ( -47.786 0.000 23.948) 53.452 15.822 ( -32.790 0.000 27.873) 43.036 16.207 ( 10.466 0.000 -0.878) 10.503 16.945 ( -17.069 0.000 -4.413) 17.630 19.482 ( 17.362 0.000 -8.252) 19.223 19.935 ( -4.077 0.000 -4.422) 6.015 21.625 ( 0.233 0.000 -9.081) 9.084 21.758 ( 1.779 0.000 -10.720) 10.866 22.966 ( 12.528 0.000 -27.363) 30.095 23.096 ( 4.482 0.000 -14.163) 14.855 23.450 ( -0.478 0.000 9.033) 9.046 23.461 ( -1.331 0.000 6.442) 6.578 26.084 ( 19.752 0.000 -12.302) 23.270 26.361 ( 15.633 0.000 -8.925) 18.002 29.105 ( 29.751 0.000 -9.381) 31.194 31.252 ( -39.131 0.000 6.363) 39.645======================= Grid point 368 (69/210) =======================q-point: ( 0.45 0.00 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.405 ( 37.135 0.000 34.077) 50.401 7.883 ( 19.075 0.000 28.265) 34.099 8.072 ( 20.012 0.000 36.007) 41.195 9.046 ( -49.632 0.000 43.819) 66.208 11.403 ( 50.505 0.000 46.395) 68.580 12.401 ( -51.501 0.000 24.659) 57.100 12.945 ( 29.361 0.000 21.291) 36.268 13.711 ( -45.823 0.000 20.283) 50.111 14.448 ( 33.865 0.000 43.188) 54.882 15.141 ( -35.554 0.000 39.436) 53.097 16.424 ( 11.453 0.000 -1.992) 11.625 16.660 ( -12.749 0.000 -3.121) 13.126 19.733 ( 8.736 0.000 -6.966) 11.173 19.856 ( -4.513 0.000 -5.372) 7.016 21.667 ( 3.603 0.000 -8.439) 9.176 21.740 ( -3.011 0.000 -9.414) 9.884 23.125 ( 4.116 0.000 -20.125) 20.542 23.151 ( 1.000 0.000 -15.023) 15.057 23.447 ( 0.013 0.000 5.489) 5.489 23.448 ( -0.179 0.000 4.931) 4.935 26.398 ( 11.536 0.000 -14.734) 18.713 26.515 ( 0.348 0.000 -13.922) 13.927 29.758 ( 35.788 0.000 -1.412) 35.816 30.490 ( -38.118 0.000 3.703) 38.298======================= Grid point 375 (70/210) =======================q-point: ( 0.09 0.09 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.287 ( 17.028 17.028 58.779) 63.521 4.417 ( 23.404 23.404 56.073) 65.113 7.169 ( 11.718 11.718 42.392) 45.517 7.733 ( 28.215 28.215 105.557) 112.847 11.498 ( 2.278 2.278 71.442) 71.514 11.502 ( 2.285 2.285 70.186) 70.260 14.730 ( -42.493 -42.493 5.222) 60.320 15.795 ( 1.157 1.157 1.950) 2.545 16.051 ( -9.549 -9.549 55.333) 56.957 16.492 ( -10.267 -10.267 -6.979) 16.110 16.871 ( -2.968 -2.968 -10.177) 11.009 17.653 ( 17.667 17.667 -2.250) 25.086 18.683 ( -21.542 -21.542 -13.626) 33.374 20.517 ( -8.966 -8.966 -16.339) 20.682 20.916 ( 4.045 4.045 -6.692) 8.804 21.267 ( 15.112 15.112 -16.750) 27.153 22.508 ( 7.604 7.604 -20.386) 23.048 22.511 ( 10.408 10.408 -19.252) 24.234 23.506 ( -1.027 -1.027 14.933) 15.004 23.732 ( -2.169 -2.169 2.745) 4.116 24.696 ( 16.047 16.047 12.721) 26.016 24.964 ( 22.127 22.127 3.303) 31.467 28.181 ( 5.987 5.987 -27.819) 29.079 33.226 ( -22.566 -22.566 -5.864) 32.447======================= Grid point 376 (71/210) =======================q-point: ( 0.18 0.09 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 4.809 ( 35.413 10.162 47.759) 60.318 5.050 ( 39.650 22.058 46.377) 64.881 7.485 ( 19.827 12.707 37.684) 44.437 8.500 ( 47.268 24.707 95.095) 109.031 11.229 ( -18.474 14.525 68.307) 72.237 11.865 ( 22.075 -8.248 69.159) 73.064 13.866 ( -42.261 -43.864 3.760) 61.026 15.622 ( -32.178 6.559 33.557) 46.953 15.838 ( 2.208 -3.289 3.187) 5.084 16.131 ( -25.195 -1.676 9.828) 27.095 16.694 ( -12.276 -1.665 -2.428) 12.625 17.987 ( -16.725 -8.950 -8.445) 20.764 18.300 ( 13.254 -9.911 -5.923) 17.578 20.224 ( -14.220 -3.143 -11.465) 18.535 21.127 ( 10.544 -13.869 -9.169) 19.688 21.654 ( 20.416 9.419 -21.124) 30.850 22.549 ( 4.729 16.140 -20.674) 26.651 22.805 ( 11.729 2.054 -16.475) 20.328 23.488 ( -0.719 -0.019 12.924) 12.944 23.662 ( -4.091 5.344 4.264) 7.967 25.188 ( 29.955 10.585 5.673) 32.272 25.472 ( 28.757 18.861 -1.584) 34.427 28.362 ( 12.467 6.932 -24.810) 28.618 32.650 ( -33.891 -15.266 1.878) 37.218======================= Grid point 377 (72/210) =======================q-point: ( 0.27 0.09 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.634 ( 46.664 3.596 38.461) 60.579 5.936 ( 49.454 19.797 36.748) 64.716 7.904 ( 20.745 12.818 31.930) 40.177 9.513 ( 53.704 21.808 81.597) 100.088 10.765 ( -28.751 15.408 62.638) 70.623 12.266 ( 13.133 -10.185 56.667) 59.054 13.203 ( -18.798 -44.541 14.234) 50.397 14.858 ( -42.340 17.423 15.343) 48.287 15.511 ( -37.455 0.629 20.988) 42.939 15.845 ( -5.271 -16.598 7.920) 19.131 16.440 ( -10.881 4.843 5.274) 13.026 17.427 ( -26.401 3.357 -7.339) 27.607 18.799 ( 25.098 -19.933 -4.046) 32.304 19.998 ( -9.268 -7.771 -7.985) 14.493 21.300 ( 7.745 -13.435 -8.603) 17.734 21.931 ( 6.643 10.216 -15.773) 19.931 22.715 ( 11.238 5.588 -24.283) 27.334 22.984 ( 6.742 0.784 -14.571) 16.074 23.482 ( 0.147 1.970 9.630) 9.831 23.590 ( -2.991 7.315 4.975) 9.338 25.760 ( 26.791 12.528 -4.030) 29.849 26.049 ( 27.761 14.116 -4.733) 31.501 28.682 ( 20.339 7.330 -18.774) 28.634 31.946 ( -36.721 -8.452 5.728) 38.114======================= Grid point 378 (73/210) =======================q-point: ( 0.36 0.09 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.577 ( 47.317 1.627 34.250) 58.435 6.970 ( 54.646 14.961 30.263) 64.233 8.200 ( 6.473 11.758 28.774) 31.751 10.057 ( -38.831 12.371 52.386) 66.372 10.585 ( 49.391 20.125 65.881) 84.763 12.263 ( -5.160 -29.194 21.088) 36.382 13.219 ( 6.418 -15.145 45.374) 48.264 14.126 ( -23.190 11.998 17.374) 31.362 14.676 ( -45.106 4.051 19.838) 49.442 15.523 ( -25.823 -24.185 24.228) 42.880 16.386 ( 4.531 12.321 2.843) 13.432 17.017 ( -16.188 7.002 -4.269) 18.146 19.218 ( 17.400 -21.880 -4.417) 28.302 19.837 ( -7.576 -12.497 -6.215) 15.881 21.459 ( 8.800 -7.501 -7.715) 13.901 21.952 ( -3.355 9.427 -10.944) 14.829 22.927 ( 9.047 -3.206 -21.934) 23.942 23.078 ( 2.903 -2.004 -13.354) 13.812 23.494 ( 0.958 4.353 5.155) 6.815 23.546 ( -1.545 7.539 4.242) 8.787 26.227 ( 20.274 14.171 -10.507) 26.875 26.489 ( 15.621 12.504 -9.707) 22.240 29.168 ( 28.807 6.242 -10.304) 31.225 31.220 ( -36.827 -3.260 5.462) 37.373======================= Grid point 379 (74/210) =======================q-point: ( 0.45 0.09 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.439 ( 38.523 3.649 31.158) 49.680 7.940 ( 12.456 6.123 27.183) 30.521 8.196 ( 23.294 12.319 33.949) 42.975 9.156 ( -50.426 10.395 40.561) 65.544 11.508 ( 42.046 10.055 45.652) 62.873 12.146 ( -16.924 -18.357 23.692) 34.420 13.157 ( 6.545 13.853 29.151) 32.932 13.712 ( -40.110 0.065 24.303) 46.899 14.338 ( 24.778 -10.054 35.499) 44.443 14.937 ( -31.919 -19.377 36.158) 51.978 16.536 ( 9.564 10.049 -0.227) 13.875 16.747 ( -11.876 8.268 -2.257) 14.645 19.496 ( 11.309 -20.401 -4.710) 23.796 19.684 ( -8.258 -16.920 -5.244) 19.544 21.647 ( 9.935 -0.809 -7.738) 12.619 21.831 ( -8.272 4.956 -8.787) 13.046 23.056 ( 4.218 -5.649 -16.672) 18.101 23.101 ( -0.503 -4.629 -13.471) 14.253 23.512 ( 0.820 6.030 2.269) 6.495 23.526 ( -0.668 7.041 2.605) 7.537 26.542 ( 11.257 14.136 -13.638) 22.639 26.649 ( 0.914 13.212 -13.434) 18.864 29.797 ( 34.350 3.830 -2.619) 34.662 30.498 ( -36.341 0.675 2.558) 36.438======================= Grid point 387 (75/210) =======================q-point: ( 0.18 0.18 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.169 ( 26.410 26.410 40.873) 55.368 5.636 ( 36.572 36.572 39.648) 65.169 7.822 ( 20.860 20.860 31.105) 42.870 9.184 ( 43.004 43.004 88.012) 106.981 11.616 ( 3.314 3.314 65.943) 66.109 11.627 ( 4.117 4.117 69.174) 69.418 12.940 ( -47.119 -47.119 1.346) 66.650 15.507 ( -18.078 -18.078 53.927) 59.681 15.676 ( -12.746 -12.746 -1.621) 18.098 16.003 ( -14.153 -14.153 -3.476) 20.315 16.616 ( -5.430 -5.430 -6.079) 9.794 17.957 ( -12.766 -12.766 -10.540) 20.905 18.042 ( 4.733 4.733 4.036) 7.817 19.992 ( -16.285 -16.285 -10.975) 25.511 21.048 ( 2.784 2.784 -8.093) 9.001 21.901 ( 13.516 13.516 -20.349) 27.918 22.726 ( 3.089 3.089 -15.143) 15.761 22.905 ( 6.692 6.692 -16.862) 19.336 23.501 ( 1.457 1.457 9.553) 9.773 23.735 ( 1.480 1.480 1.831) 2.781 25.577 ( 26.760 26.760 5.685) 38.269 25.913 ( 24.954 24.954 -7.261) 36.030 28.562 ( 13.334 13.334 -22.930) 29.687 32.246 ( -24.696 -24.696 4.245) 35.182======================= Grid point 388 (76/210) =======================q-point: ( 0.27 0.18 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.829 ( 39.539 16.523 32.049) 53.511 6.452 ( 45.271 32.075 34.361) 65.261 8.259 ( 21.374 22.691 25.217) 40.095 10.114 ( 49.020 37.711 76.093) 98.057 11.181 ( -29.426 25.588 59.450) 71.098 11.926 ( -15.834 -27.156 31.677) 44.627 12.339 ( 11.980 -38.249 39.248) 56.097 14.927 ( -37.806 -8.168 31.935) 50.159 15.375 ( -18.397 -30.621 13.672) 38.249 15.552 ( -30.788 -0.234 2.571) 30.896 16.559 ( 0.487 6.872 -0.183) 6.892 17.547 ( -20.600 8.281 -6.805) 23.222 18.385 ( 20.372 -19.607 2.028) 28.347 19.699 ( -12.825 -19.378 -6.619) 24.162 21.153 ( 7.504 -3.012 -8.146) 11.478 22.091 ( 4.122 5.840 -14.928) 16.551 22.778 ( 3.383 0.959 -15.113) 15.517 22.999 ( 2.683 0.247 -14.131) 14.385 23.545 ( 2.891 4.368 4.371) 6.822 23.734 ( -0.934 6.170 1.670) 6.460 26.135 ( 27.626 24.477 0.126) 36.910 26.414 ( 24.597 21.771 -10.001) 34.337 28.887 ( 19.690 13.158 -18.860) 30.274 31.712 ( -28.860 -14.922 4.746) 32.834======================= Grid point 389 (77/210) =======================q-point: ( 0.36 0.18 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.679 ( 45.390 9.432 25.929) 53.118 7.383 ( 48.090 26.400 30.807) 62.918 8.546 ( 4.523 23.331 22.947) 33.036 10.353 ( -43.920 13.890 39.968) 60.987 11.115 ( 40.940 31.464 60.554) 79.580 11.641 ( -0.597 -27.888 24.464) 37.102 12.875 ( 30.076 -20.168 58.218) 68.561 14.148 ( -37.506 -8.200 19.799) 43.196 14.833 ( -39.530 8.038 12.839) 42.333 14.952 ( -24.927 -32.722 23.399) 47.325 16.625 ( 5.672 11.727 1.429) 13.105 17.199 ( -14.712 10.671 -4.192) 18.652 18.758 ( 16.885 -22.729 0.970) 28.332 19.475 ( -10.434 -21.483 -3.743) 24.174 21.342 ( 11.550 -5.361 -7.582) 14.820 22.055 ( -6.849 0.885 -9.803) 11.991 22.861 ( 4.517 -3.231 -14.803) 15.810 23.020 ( -0.250 -3.560 -12.065) 12.581 23.606 ( 3.027 6.698 0.344) 7.358 23.713 ( -1.134 8.329 1.419) 8.525 26.614 ( 20.384 24.016 -6.703) 32.206 26.823 ( 15.653 20.446 -11.288) 28.115 29.339 ( 26.038 10.705 -12.453) 30.784 31.123 ( -30.665 -6.555 3.034) 31.504======================= Grid point 390 (78/210) =======================q-point: ( 0.45 0.18 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.556 ( 41.609 8.245 23.088) 48.295 8.137 ( 0.796 13.804 23.623) 27.372 8.545 ( 23.274 22.726 29.688) 44.040 9.409 ( -48.930 14.161 32.119) 60.219 11.704 ( 20.813 0.568 32.655) 38.728 11.886 ( 10.008 1.773 36.875) 38.251 13.332 ( 14.186 1.980 44.877) 47.107 13.664 ( -12.082 -7.570 37.104) 39.749 14.162 ( -15.401 -3.425 15.097) 21.837 14.432 ( -26.418 -30.765 30.488) 50.734 16.766 ( 8.353 12.290 0.306) 14.863 16.952 ( -10.699 11.580 -1.705) 15.858 19.047 ( 12.682 -23.075 -0.305) 26.332 19.272 ( -10.508 -22.548 -1.820) 24.943 21.595 ( 13.675 -5.100 -7.241) 16.292 21.858 ( -12.371 -2.807 -7.718) 14.849 22.941 ( 3.491 -5.457 -13.120) 14.632 22.996 ( -2.048 -5.399 -11.859) 13.190 23.657 ( 2.077 8.089 -0.537) 8.369 23.690 ( -1.292 8.739 0.404) 8.843 26.920 ( 10.239 23.033 -10.988) 27.498 27.002 ( 2.285 21.459 -12.234) 24.807 29.899 ( 30.252 6.138 -5.692) 31.389 30.510 ( -31.374 0.340 -0.452) 31.379======================= Grid point 399 (79/210) =======================q-point: ( 0.27 0.27 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.286 ( 29.440 29.440 24.281) 48.197 7.171 ( 39.979 39.979 31.852) 64.894 8.756 ( 25.662 25.662 18.411) 40.695 10.882 ( 24.386 24.386 53.246) 63.439 11.182 ( -24.749 -24.749 15.061) 38.103 11.765 ( 5.097 5.097 60.831) 61.257 11.804 ( 4.556 4.556 62.598) 62.928 14.643 ( -25.184 -25.184 51.736) 62.810 14.674 ( -33.221 -33.221 -4.947) 47.242 15.392 ( -16.726 -16.726 4.438) 24.066 16.698 ( 7.124 7.124 -1.678) 10.213 17.617 ( -6.136 -6.136 -8.523) 12.163 18.176 ( 2.934 2.934 8.112) 9.112 19.341 ( -15.839 -15.839 -1.346) 22.440 21.145 ( 2.174 2.174 -8.676) 9.205 22.128 ( -2.766 -2.766 -10.899) 11.579 22.785 ( 0.424 0.424 -12.098) 12.113 22.986 ( -1.389 -1.389 -12.294) 12.450 23.644 ( 5.294 5.294 -0.179) 7.489 23.820 ( 2.697 2.697 0.772) 3.891 26.655 ( 26.404 26.404 0.363) 37.342 26.861 ( 22.404 22.404 -12.811) 34.176 29.191 ( 17.600 17.600 -17.732) 30.560 31.372 ( -19.265 -19.265 2.712) 27.379======================= Grid point 400 (80/210) =======================q-point: ( 0.36 0.27 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.962 ( 38.359 19.267 17.803) 46.471 7.983 ( 40.694 33.596 29.382) 60.399 9.104 ( 3.377 32.447 15.891) 36.287 10.301 ( -34.200 -23.292 7.534) 42.058 11.398 ( -3.560 12.957 49.398) 51.193 11.847 ( 32.293 34.104 56.475) 73.453 12.438 ( 34.332 -21.996 56.916) 70.013 13.879 ( -35.590 -18.951 14.324) 42.790 14.233 ( -24.070 -37.459 34.255) 56.178 14.911 ( -31.010 -2.345 11.718) 33.233 16.841 ( 7.402 9.938 -1.410) 12.471 17.390 ( -12.813 6.947 -5.458) 15.564 18.388 ( 13.764 -13.102 7.262) 20.343 19.076 ( -11.557 -17.776 2.391) 21.337 21.246 ( 8.106 -3.813 -8.338) 12.238 21.985 ( -10.966 -7.732 -8.030) 15.636 22.807 ( 1.842 -1.985 -11.656) 11.967 22.950 ( -2.204 -3.392 -10.987) 11.708 23.741 ( 4.353 6.603 -1.740) 8.098 23.850 ( 0.555 5.431 0.539) 5.486 27.117 ( 19.482 25.456 -3.525) 32.249 27.249 ( 15.780 21.556 -12.323) 29.420 29.577 ( 21.412 13.197 -14.402) 28.983 30.961 ( -22.246 -9.861 -0.360) 24.336======================= Grid point 401 (81/210) =======================q-point: ( 0.45 0.27 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.758 ( 41.178 12.094 13.717) 45.056 8.445 ( -15.963 15.293 15.820) 27.184 9.075 ( 20.704 30.495 26.343) 45.305 9.696 ( -31.697 15.697 23.170) 42.284 11.614 ( 25.187 -1.306 31.300) 40.197 12.112 ( -13.811 11.408 34.669) 39.024 13.102 ( 31.660 -25.303 52.587) 66.393 13.566 ( 4.323 1.888 42.071) 42.335 13.744 ( -17.484 -37.334 22.288) 46.864 14.224 ( -36.740 5.538 18.996) 41.729 16.992 ( 8.068 10.141 -1.690) 13.068 17.166 ( -9.862 9.206 -3.035) 13.828 18.645 ( 11.982 -16.640 5.949) 21.351 18.864 ( -10.520 -17.828 4.474) 21.178 21.456 ( 12.864 -8.130 -7.622) 17.020 21.730 ( -14.170 -9.504 -7.259) 18.543 22.852 ( 2.509 -3.582 -11.205) 12.028 22.902 ( -2.562 -4.039 -10.785) 11.798 23.810 ( 2.624 7.033 -1.210) 7.604 23.846 ( -0.994 6.741 -0.157) 6.815 27.399 ( 8.706 24.207 -7.942) 26.923 27.448 ( 3.903 22.561 -10.601) 25.231 30.027 ( 23.910 6.606 -9.405) 26.529 30.503 ( -24.037 -1.225 -4.429) 24.472======================= Grid point 411 (82/210) =======================q-point: ( 0.36 0.36 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.427 ( 27.441 27.441 11.197) 40.391 8.632 ( 27.576 27.576 23.953) 45.767 9.718 ( -19.858 -19.858 6.874) 28.913 9.767 ( 24.481 24.481 11.721) 36.552 11.756 ( 2.948 2.948 53.165) 53.328 11.960 ( 3.036 3.036 44.463) 44.670 12.598 ( 23.594 23.594 47.653) 58.174 13.322 ( -33.285 -33.285 -1.835) 47.108 13.659 ( -17.823 -17.823 54.576) 60.116 14.729 ( -16.046 -16.046 20.089) 30.307 17.014 ( 7.703 7.703 -3.244) 11.366 17.413 ( -4.351 -4.351 -6.726) 9.116 18.293 ( 2.872 2.872 12.217) 12.874 18.787 ( -11.862 -11.862 7.816) 18.507 21.218 ( 1.465 1.465 -8.521) 8.769 21.776 ( -12.692 -12.692 -7.234) 19.351 22.787 ( -0.098 -0.098 -10.907) 10.908 22.888 ( -2.883 -2.883 -10.296) 11.074 23.855 ( 4.727 4.727 -1.644) 6.884 23.927 ( 2.418 2.418 0.393) 3.442 27.563 ( 18.752 18.752 -3.026) 26.692 27.630 ( 16.060 16.060 -11.467) 25.443 29.853 ( 14.703 14.703 -14.641) 25.430 30.736 ( -12.923 -12.923 -4.306) 18.776======================= Grid point 412 (83/210) =======================q-point: ( 0.45 0.36 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.021 ( 32.140 14.208 6.560) 35.747 8.636 ( -26.341 2.303 5.528) 27.013 9.717 ( 23.760 33.841 26.090) 48.892 10.093 ( -4.174 25.362 18.715) 31.795 11.692 ( 13.257 8.053 35.074) 38.351 12.210 ( -20.914 -3.403 26.848) 34.202 12.529 ( 10.674 -28.189 35.739) 46.753 12.947 ( -19.137 -41.154 25.103) 51.866 13.733 ( 25.914 12.524 47.976) 55.947 14.296 ( -27.012 0.652 32.012) 41.890 17.152 ( 6.644 6.049 -4.001) 9.836 17.286 ( -7.067 2.695 -5.094) 9.119 18.419 ( 8.191 -6.120 12.306) 16.000 18.588 ( -8.945 -10.232 10.840) 17.384 21.312 ( 8.024 -5.699 -8.064) 12.724 21.520 ( -12.482 -10.861 -7.427) 18.137 22.800 ( 1.346 -1.665 -10.596) 10.810 22.837 ( -2.284 -2.648 -10.298) 10.876 23.925 ( 2.386 4.481 -0.739) 5.130 23.949 ( -0.076 3.741 0.043) 3.742 27.826 ( 7.427 18.058 -5.507) 20.287 27.847 ( 5.302 16.933 -8.559) 19.700 30.153 ( 15.606 6.117 -12.422) 20.863 30.458 ( -15.084 -3.354 -8.538) 17.654======================= Grid point 423 (84/210) =======================q-point: ( 0.45 0.45 0.16)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.303 ( 14.006 14.006 2.360) 19.947 8.547 ( -9.780 -9.780 1.281) 13.891 10.358 ( 28.320 28.320 25.692) 47.582 10.563 ( 13.496 13.496 17.918) 26.179 11.812 ( 0.549 0.549 50.009) 50.015 12.030 ( 0.629 0.629 10.848) 10.885 12.137 ( -25.409 -25.409 44.416) 57.132 12.231 ( -18.519 -18.519 2.065) 26.271 14.009 ( 13.842 13.842 49.901) 53.603 14.229 ( -7.646 -7.646 42.882) 44.224 17.239 ( 3.153 3.153 -5.015) 6.710 17.288 ( -1.737 -1.737 -5.461) 5.988 18.382 ( 1.328 1.328 15.165) 15.281 18.445 ( -4.889 -4.889 14.513) 16.076 21.257 ( 0.513 0.513 -8.170) 8.202 21.335 ( -7.163 -7.163 -7.865) 12.824 22.784 ( -0.040 -0.040 -10.441) 10.441 22.797 ( -1.359 -1.359 -10.314) 10.492 23.986 ( 1.753 1.753 -0.103) 2.482 23.994 ( 0.910 0.910 0.179) 1.300 28.076 ( 6.770 6.770 -4.859) 10.736 28.081 ( 6.209 6.209 -6.247) 10.777 30.268 ( 5.656 5.656 -13.470) 15.666 30.374 ( -4.978 -4.978 -11.934) 13.856======================= Grid point 484 (85/210) =======================q-point: ( 0.00 0.00 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.262 ( -0.000 -0.000 67.992) 67.992 5.262 ( 0.000 0.000 67.992) 67.992 7.923 ( 0.000 0.000 53.743) 53.743 9.265 ( 0.000 0.000 103.493) 103.493 12.874 ( 0.000 0.000 71.202) 71.202 12.874 ( 0.000 -0.000 71.202) 71.202 15.806 ( 0.000 0.000 2.703) 2.703 16.290 ( 0.000 0.000 18.675) 18.675 16.581 ( 0.000 0.000 -15.198) 15.198 16.581 ( 0.000 0.000 -15.198) 15.198 16.615 ( -0.000 -0.000 -8.893) 8.893 17.431 ( 0.000 0.000 58.803) 58.803 18.873 ( 0.000 0.000 -20.520) 20.520 20.525 ( 0.000 0.000 -13.617) 13.617 20.691 ( 0.000 0.000 -4.557) 4.557 20.691 ( 0.000 0.000 -4.557) 4.557 21.848 ( 0.000 0.000 -22.877) 22.877 21.848 ( 0.000 0.000 -22.877) 22.877 23.815 ( 0.000 0.000 -3.231) 3.231 23.833 ( 0.000 0.000 14.308) 14.308 24.666 ( -0.000 -0.000 12.655) 12.655 24.666 ( 0.000 0.000 12.655) 12.655 27.457 ( 0.000 0.000 -31.851) 31.851 33.336 ( -0.000 -0.000 -23.688) 23.688======================= Grid point 485 (86/210) =======================q-point: ( 0.09 0.00 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.337 ( 8.586 0.000 62.653) 63.239 5.442 ( 17.843 0.000 65.640) 68.022 7.997 ( 7.397 0.000 51.666) 52.193 9.513 ( 24.218 0.000 101.554) 104.402 12.753 ( -12.406 0.000 68.757) 69.868 13.002 ( 12.509 0.000 70.996) 72.090 15.444 ( -47.800 0.000 6.993) 48.309 15.829 ( 2.390 0.000 2.729) 3.628 16.203 ( -31.648 0.000 -9.432) 33.024 16.596 ( -5.338 0.000 -8.659) 10.173 17.403 ( 45.443 0.000 -4.592) 45.675 17.434 ( -2.293 0.000 55.347) 55.394 18.572 ( -28.531 0.000 -18.704) 34.115 20.304 ( -14.401 0.000 -9.170) 17.073 20.863 ( 16.052 0.000 -8.403) 18.118 20.868 ( 14.052 0.000 -9.679) 17.063 21.834 ( -0.935 0.000 -21.511) 21.532 22.087 ( 18.297 0.000 -21.963) 28.586 23.756 ( -4.861 0.000 -0.942) 4.952 23.816 ( -1.665 0.000 14.127) 14.225 24.814 ( 13.543 0.000 8.426) 15.950 24.863 ( 19.089 0.000 10.541) 21.806 27.534 ( 8.022 0.000 -30.445) 31.484 33.154 ( -17.790 0.000 -20.321) 27.008======================= Grid point 486 (87/210) =======================q-point: ( 0.18 0.00 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.653 ( 24.534 0.000 48.797) 54.617 5.936 ( 31.339 0.000 59.863) 67.570 8.208 ( 13.669 0.000 46.344) 48.317 10.158 ( 39.416 0.000 96.149) 103.914 12.377 ( -25.924 0.000 60.668) 65.975 13.318 ( 16.761 0.000 68.932) 70.941 14.581 ( -36.838 0.000 8.149) 37.729 15.448 ( -42.649 0.000 -2.524) 42.724 15.904 ( 5.205 0.000 2.363) 5.716 16.383 ( -18.174 0.000 -4.569) 18.739 17.272 ( -14.455 0.000 47.577) 49.724 17.906 ( -33.982 0.000 -9.933) 35.404 18.225 ( 37.401 0.000 -6.482) 37.958 20.076 ( -8.637 0.000 -5.979) 10.504 21.172 ( 15.207 0.000 -11.793) 19.244 21.220 ( 16.552 0.000 -13.962) 21.654 21.857 ( 5.421 0.000 -19.974) 20.697 22.412 ( 13.544 0.000 -20.884) 24.892 23.663 ( -4.065 0.000 1.505) 4.334 23.771 ( -2.729 0.000 13.323) 13.599 25.142 ( 18.618 0.000 1.333) 18.665 25.347 ( 27.461 0.000 4.320) 27.799 27.786 ( 17.939 0.000 -25.604) 31.263 32.674 ( -29.776 0.000 -13.137) 32.546======================= Grid point 487 (88/210) =======================q-point: ( 0.27 0.00 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.314 ( 42.141 0.000 32.706) 53.344 6.637 ( 38.707 0.000 52.975) 65.609 8.509 ( 15.612 0.000 40.123) 43.053 10.996 ( 44.064 0.000 88.568) 98.924 11.723 ( -40.513 0.000 46.485) 61.661 13.380 ( -15.824 0.000 37.398) 40.608 14.286 ( 13.052 0.000 37.246) 39.467 14.588 ( -43.515 0.000 9.168) 44.470 15.809 ( -39.615 0.000 2.023) 39.667 16.032 ( 7.666 0.000 1.484) 7.808 16.931 ( -17.505 0.000 27.855) 32.899 17.343 ( -24.163 0.000 12.209) 27.072 18.867 ( 27.590 0.000 -8.031) 28.735 19.943 ( -5.413 0.000 -4.439) 7.001 21.411 ( 3.778 0.000 -11.453) 12.060 21.424 ( 9.766 0.000 -11.494) 15.083 22.101 ( 17.442 0.000 -23.581) 29.331 22.621 ( 8.022 0.000 -20.475) 21.990 23.602 ( -2.138 0.000 2.930) 3.627 23.712 ( -3.192 0.000 11.808) 12.232 25.515 ( 18.654 0.000 -5.180) 19.360 25.847 ( 21.343 0.000 -4.561) 21.824 28.254 ( 29.575 0.000 -17.184) 34.204 32.021 ( -35.741 0.000 -6.746) 36.372======================= Grid point 488 (89/210) =======================q-point: ( 0.36 0.00 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.278 ( 54.448 0.000 20.702) 58.251 7.419 ( 39.536 0.000 46.450) 60.998 8.749 ( 6.519 0.000 36.546) 37.123 10.794 ( -53.038 0.000 30.558) 61.212 11.830 ( 38.475 0.000 78.247) 87.195 13.067 ( -6.829 0.000 17.243) 18.546 13.761 ( -40.065 0.000 22.683) 46.041 14.789 ( 31.674 0.000 53.193) 61.909 14.931 ( -46.593 0.000 9.876) 47.629 16.201 ( 9.303 0.000 0.435) 9.313 16.576 ( -20.792 0.000 34.924) 40.644 16.914 ( -18.738 0.000 10.275) 21.370 19.313 ( 17.934 0.000 -8.565) 19.874 19.846 ( -4.715 0.000 -4.569) 6.565 21.456 ( 2.146 0.000 -8.071) 8.352 21.550 ( 3.162 0.000 -10.195) 10.674 22.436 ( 14.958 0.000 -25.341) 29.427 22.736 ( 3.578 0.000 -20.917) 21.221 23.576 ( -0.593 0.000 4.256) 4.297 23.651 ( -2.871 0.000 9.822) 10.233 25.856 ( 15.547 0.000 -10.448) 18.731 26.150 ( 9.342 0.000 -11.918) 15.143 28.929 ( 37.951 0.000 -8.882) 38.977 31.287 ( -38.513 0.000 -3.097) 38.637======================= Grid point 489 (90/210) =======================q-point: ( 0.45 0.00 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.140 ( 31.769 0.000 40.518) 51.488 8.361 ( 42.909 0.000 18.904) 46.889 8.737 ( 2.790 0.000 34.561) 34.673 9.673 ( -59.343 0.000 20.091) 62.652 12.452 ( 26.583 0.000 54.053) 60.236 13.029 ( -33.502 0.000 34.508) 48.095 13.297 ( 29.279 0.000 21.179) 36.136 14.040 ( -42.902 0.000 19.855) 47.273 15.439 ( 33.282 0.000 53.472) 62.984 16.069 ( -29.850 0.000 49.232) 57.574 16.395 ( 10.443 0.000 -0.315) 10.447 16.617 ( -12.375 0.000 0.621) 12.390 19.587 ( 10.349 0.000 -7.650) 12.869 19.744 ( -6.103 0.000 -5.912) 8.497 21.510 ( 3.102 0.000 -7.385) 8.011 21.561 ( -1.532 0.000 -8.561) 8.697 22.664 ( 8.052 0.000 -24.178) 25.483 22.757 ( -1.593 0.000 -22.259) 22.316 23.577 ( 0.701 0.000 5.833) 5.875 23.603 ( -1.915 0.000 7.724) 7.958 26.110 ( 9.760 0.000 -13.937) 17.015 26.224 ( -1.429 0.000 -14.831) 14.899 29.711 ( 40.654 0.000 -3.947) 40.845 30.510 ( -40.148 0.000 -2.200) 40.208======================= Grid point 496 (91/210) =======================q-point: ( 0.09 0.09 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.473 ( 10.373 10.373 62.009) 63.720 5.549 ( 14.878 14.878 59.319) 62.940 8.073 ( 7.545 7.545 49.502) 50.639 9.750 ( 23.245 23.245 99.786) 105.061 12.877 ( 0.145 0.145 68.267) 68.267 12.895 ( 1.008 1.008 69.083) 69.098 14.827 ( -44.623 -44.623 4.306) 63.253 15.836 ( 0.708 0.708 2.317) 2.524 16.335 ( -8.535 -8.535 -8.731) 14.896 16.647 ( -2.534 -2.534 -12.525) 13.028 17.044 ( -5.980 -5.980 37.725) 38.661 17.775 ( 17.024 17.024 21.959) 32.586 18.378 ( -19.585 -19.585 -17.464) 32.743 20.214 ( -10.230 -10.230 -14.455) 20.451 20.791 ( 3.174 3.174 -5.759) 7.302 21.009 ( 11.578 11.578 -10.200) 19.290 22.084 ( 9.292 9.292 -22.241) 25.833 22.121 ( 11.871 11.871 -20.022) 26.128 23.728 ( -2.348 -2.348 1.408) 3.606 23.811 ( -0.960 -0.960 11.619) 11.698 24.931 ( 13.507 13.507 10.626) 21.858 25.045 ( 15.999 15.999 4.452) 23.060 27.614 ( 8.200 8.200 -29.209) 31.426 32.989 ( -16.244 -16.244 -17.568) 28.920======================= Grid point 497 (92/210) =======================q-point: ( 0.18 0.09 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 5.772 ( 22.393 10.644 50.189) 55.979 6.025 ( 31.184 11.078 53.203) 62.655 8.286 ( 13.780 7.811 44.069) 46.830 10.372 ( 38.156 21.087 94.581) 104.145 12.519 ( -25.884 13.910 60.016) 66.823 13.218 ( 17.055 -9.980 67.280) 70.122 13.963 ( -37.864 -46.593 6.435) 60.382 15.771 ( -26.235 7.657 -2.115) 27.412 15.900 ( -11.985 6.658 1.077) 13.752 16.402 ( -15.730 2.615 -1.121) 15.985 17.057 ( -4.388 -22.485 41.763) 47.634 17.793 ( -27.353 -2.997 -11.492) 29.820 18.260 ( 23.369 -2.398 4.667) 23.951 19.999 ( -9.513 -8.309 -11.254) 16.917 20.956 ( 10.116 -10.115 -7.885) 16.335 21.316 ( 18.150 9.032 -13.819) 24.535 22.147 ( 3.601 18.570 -20.181) 27.660 22.441 ( 13.335 2.928 -20.016) 24.229 23.677 ( -2.525 0.971 2.238) 3.511 23.774 ( -2.520 0.281 10.801) 11.094 25.283 ( 19.846 14.670 3.500) 24.926 25.464 ( 25.404 11.315 0.580) 27.816 27.866 ( 17.740 8.175 -24.984) 31.714 32.548 ( -27.542 -12.510 -11.632) 32.409======================= Grid point 498 (93/210) =======================q-point: ( 0.27 0.09 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.377 ( 38.503 5.224 36.555) 53.349 6.731 ( 39.547 11.317 45.483) 61.325 8.588 ( 15.550 8.001 37.817) 41.664 11.180 ( 41.212 17.958 85.947) 96.994 11.848 ( -41.332 11.346 43.404) 61.000 13.052 ( -27.006 -29.981 25.458) 47.711 13.881 ( 22.503 -22.221 52.840) 61.581 15.012 ( -39.494 19.944 5.205) 44.549 15.659 ( -27.074 -9.520 1.295) 28.728 16.141 ( -5.127 6.127 8.619) 11.752 16.853 ( -13.597 -10.886 35.521) 39.561 17.298 ( -20.700 0.075 -3.142) 20.937 18.752 ( 23.519 -10.792 0.296) 25.878 19.845 ( -6.674 -10.025 -7.394) 14.132 21.141 ( 8.846 -11.207 -7.202) 15.991 21.632 ( 11.608 8.974 -14.580) 20.684 22.256 ( 8.032 11.589 -21.663) 25.848 22.638 ( 7.042 1.247 -19.728) 20.985 23.636 ( -1.584 2.876 2.599) 4.187 23.719 ( -2.904 0.949 9.914) 10.374 25.672 ( 19.134 15.710 -4.616) 25.184 25.953 ( 21.907 10.554 -5.221) 24.871 28.323 ( 28.604 6.924 -17.503) 34.241 31.939 ( -33.567 -8.203 -6.297) 35.123======================= Grid point 499 (94/210) =======================q-point: ( 0.36 0.09 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.242 ( 47.081 -2.426 30.194) 55.984 7.558 ( 44.310 13.499 34.186) 57.570 8.821 ( 5.689 7.424 34.325) 35.577 10.847 ( -54.247 3.842 25.581) 60.099 12.000 ( 34.349 16.094 75.526) 84.516 12.680 ( -6.397 -26.225 24.467) 36.432 14.015 ( -25.306 12.250 26.196) 38.428 14.645 ( 16.595 -13.298 40.807) 46.016 14.948 ( -38.191 3.030 13.924) 40.763 16.084 ( -6.470 -12.748 19.124) 23.877 16.608 ( -8.794 2.891 24.598) 26.282 16.961 ( -14.081 5.505 1.443) 15.187 19.149 ( 16.586 -14.464 -2.089) 22.106 19.721 ( -6.215 -12.140 -5.287) 14.627 21.318 ( 9.232 -6.424 -6.402) 12.941 21.738 ( -0.222 9.749 -10.875) 14.607 22.453 ( 10.697 1.988 -24.125) 26.465 22.729 ( 2.285 -1.116 -20.290) 20.448 23.615 ( -0.570 3.601 3.288) 4.910 23.666 ( -2.380 1.730 8.235) 8.745 26.019 ( 15.646 16.044 -10.126) 24.591 26.276 ( 10.492 12.398 -11.459) 19.877 28.975 ( 36.639 4.537 -9.707) 38.174 31.244 ( -36.671 -4.292 -3.302) 37.068======================= Grid point 500 (95/210) =======================q-point: ( 0.45 0.09 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.099 ( 36.526 -3.257 34.937) 50.650 8.434 ( 29.470 6.738 22.645) 37.771 8.808 ( 7.854 7.656 31.129) 33.005 9.726 ( -57.801 4.821 17.828) 60.680 12.466 ( 17.946 -1.738 42.147) 45.842 12.760 ( -2.056 -11.148 39.206) 40.812 13.626 ( 3.753 19.061 23.588) 30.558 14.143 ( -37.347 11.278 27.150) 47.530 15.216 ( 30.013 -20.965 48.187) 60.517 15.766 ( -24.250 -23.870 41.061) 53.328 16.581 ( 4.752 12.127 7.032) 14.802 16.730 ( -9.656 9.704 1.987) 13.833 19.414 ( 10.722 -15.181 -3.275) 18.872 19.589 ( -7.453 -14.100 -4.132) 16.475 21.502 ( 9.196 0.024 -6.778) 11.424 21.663 ( -6.588 5.954 -8.295) 12.151 22.635 ( 7.209 -2.245 -23.409) 24.596 22.729 ( -2.351 -2.740 -21.649) 21.947 23.613 ( 0.322 3.468 4.482) 5.676 23.629 ( -1.341 2.696 6.233) 6.922 26.270 ( 9.343 15.643 -13.463) 22.655 26.371 ( -0.531 14.365 -14.207) 20.211 29.730 ( 39.280 1.857 -4.757) 39.611 30.501 ( -38.612 -0.997 -2.786) 38.725======================= Grid point 508 (96/210) =======================q-point: ( 0.18 0.18 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.041 ( 17.857 17.857 47.736) 54.005 6.431 ( 29.120 29.120 41.756) 58.647 8.507 ( 14.292 14.292 38.379) 43.376 10.941 ( 34.927 34.927 89.512) 102.235 12.852 ( -10.336 -10.336 43.291) 45.692 12.937 ( 0.736 0.736 61.713) 61.722 13.020 ( -36.780 -36.780 21.968) 56.463 15.614 ( -17.355 -17.355 -5.025) 25.053 15.958 ( -9.715 -9.715 0.182) 13.741 16.499 ( -0.631 -0.631 -5.382) 5.455 16.535 ( -18.760 -18.760 48.481) 55.266 17.727 ( -11.217 -11.217 -12.856) 20.419 18.219 ( 6.421 6.421 15.355) 17.839 19.792 ( -10.850 -10.850 -8.815) 17.696 20.893 ( 2.168 2.168 -7.378) 7.990 21.562 ( 14.534 14.534 -14.291) 25.034 22.386 ( 5.162 5.162 -18.953) 20.310 22.541 ( 6.931 6.931 -19.187) 21.546 23.686 ( -0.033 -0.033 4.720) 4.720 23.775 ( -0.397 -0.397 5.354) 5.384 25.689 ( 23.599 23.599 5.165) 33.771 25.771 ( 20.140 20.140 -6.936) 29.314 28.109 ( 16.549 16.549 -22.693) 32.599 32.202 ( -21.938 -21.938 -8.332) 32.125======================= Grid point 509 (97/210) =======================q-point: ( 0.27 0.18 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.519 ( 30.801 10.506 37.951) 49.993 7.115 ( 39.186 26.895 34.185) 58.545 8.821 ( 16.170 15.552 31.854) 38.961 11.620 ( 15.741 17.512 62.259) 66.563 11.967 ( -30.062 -6.731 30.429) 43.301 12.572 ( -19.392 -1.150 47.886) 51.677 13.434 ( 28.769 -24.508 57.368) 68.698 15.053 ( -37.905 -16.005 -5.338) 41.490 15.613 ( -22.085 3.478 10.095) 24.531 16.104 ( -19.777 -15.682 36.734) 44.570 16.605 ( 3.998 -5.280 8.367) 10.671 17.401 ( -17.039 7.104 -8.056) 20.142 18.505 ( 17.997 -11.541 11.223) 24.146 19.601 ( -8.654 -12.784 -2.676) 15.668 20.996 ( 7.895 -4.117 -7.552) 11.675 21.814 ( 9.073 8.826 -13.281) 18.347 22.439 ( 2.019 6.111 -18.627) 19.707 22.649 ( 3.486 -0.353 -19.339) 19.654 23.683 ( -0.114 1.662 5.490) 5.737 23.759 ( -1.158 2.804 2.173) 3.731 26.101 ( 19.214 26.244 -5.125) 32.927 26.243 ( 23.686 18.154 -5.705) 30.383 28.523 ( 25.494 13.308 -17.929) 33.890 31.707 ( -27.866 -15.085 -5.374) 32.139======================= Grid point 510 (98/210) =======================q-point: ( 0.36 0.18 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.231 ( 40.399 2.495 29.792) 50.258 7.934 ( 42.804 24.178 26.953) 56.064 9.051 ( 4.155 16.158 28.291) 32.844 10.818 ( -51.270 -10.960 10.071) 53.387 12.207 ( -2.906 -2.893 42.164) 42.363 12.525 ( 26.295 21.433 66.869) 74.982 13.965 ( 15.864 -17.781 44.947) 50.873 14.336 ( -20.952 -17.089 9.630) 28.701 15.101 ( -29.682 11.019 21.540) 38.294 15.691 ( -22.337 -25.715 39.121) 51.871 16.689 ( 4.829 5.358 6.160) 9.486 17.122 ( -11.346 9.532 -3.358) 15.194 18.838 ( 15.020 -15.040 7.994) 22.709 19.440 ( -7.939 -14.319 0.919) 16.398 21.196 ( 12.111 -6.480 -7.070) 15.449 21.869 ( -3.520 2.990 -9.343) 10.423 22.504 ( 4.673 2.533 -20.289) 20.973 22.684 ( 0.300 -3.058 -19.620) 19.859 23.685 ( 0.320 3.208 4.481) 5.520 23.735 ( -1.148 5.029 0.902) 5.237 26.448 ( 15.388 25.892 -10.157) 31.786 26.613 ( 13.161 21.039 -9.452) 26.555 29.102 ( 32.669 8.302 -11.764) 35.701 31.118 ( -31.633 -8.461 -3.960) 32.983======================= Grid point 511 (99/210) =======================q-point: ( 0.45 0.18 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.048 ( 40.132 -1.189 26.414) 48.059 8.597 ( 1.911 8.991 23.312) 25.059 9.060 ( 18.652 18.185 24.146) 35.519 9.842 ( -47.062 6.859 13.379) 49.405 12.319 ( 16.878 -8.496 28.730) 34.387 12.722 ( -14.321 1.893 38.822) 41.422 13.940 ( 14.930 13.504 29.616) 35.810 14.474 ( -31.668 19.717 36.432) 52.143 14.678 ( 27.676 -32.047 43.344) 60.594 15.217 ( -25.922 -30.569 42.237) 58.228 16.798 ( 6.215 9.558 3.497) 11.925 16.936 ( -7.964 10.190 0.420) 12.940 19.091 ( 10.866 -15.598 5.502) 19.790 19.279 ( -8.586 -15.264 3.279) 17.817 21.456 ( 13.744 -5.449 -6.779) 16.265 21.711 ( -11.372 -1.958 -7.245) 13.625 22.599 ( 4.376 -1.284 -20.304) 20.810 22.665 ( -2.202 -3.192 -19.876) 20.250 23.696 ( 0.774 4.755 2.614) 5.481 23.714 ( -1.003 5.598 1.167) 5.806 26.686 ( 8.244 25.196 -12.398) 29.266 26.756 ( 1.508 23.601 -12.245) 26.631 29.779 ( 35.229 2.922 -6.940) 36.025 30.467 ( -34.241 -2.529 -4.416) 34.617======================= Grid point 520 (100/210) =======================q-point: ( 0.27 0.27 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.833 ( 21.739 21.739 31.402) 43.946 7.746 ( 36.058 36.058 27.589) 57.979 9.181 ( 19.563 19.563 24.604) 37.025 11.131 ( -41.618 -41.618 2.429) 58.907 12.369 ( 29.540 29.540 72.838) 83.968 12.902 ( -3.319 -3.319 45.663) 45.903 12.946 ( 5.264 5.264 59.027) 59.495 14.555 ( -32.180 -32.180 -7.287) 46.089 15.594 ( -8.261 -8.261 18.576) 21.945 15.621 ( -26.265 -26.265 46.223) 59.298 16.662 ( 6.897 6.897 -1.734) 9.906 17.435 ( -5.079 -5.079 -9.955) 12.276 18.428 ( 5.157 5.157 18.092) 19.507 19.377 ( -9.974 -9.974 5.780) 15.244 20.973 ( 1.933 1.933 -8.592) 9.016 21.925 ( 1.079 1.079 -9.891) 10.008 22.505 ( 1.432 1.432 -16.041) 16.169 22.638 ( -0.290 -0.290 -20.414) 20.418 23.714 ( 1.741 1.741 4.721) 5.324 23.808 ( 1.915 1.915 -1.880) 3.297 26.598 ( 21.241 21.241 -13.404) 32.894 26.662 ( 24.227 24.227 -0.026) 34.263 28.848 ( 19.737 19.737 -17.058) 32.712 31.355 ( -20.367 -20.367 -4.797) 29.200======================= Grid point 521 (101/210) =======================q-point: ( 0.36 0.27 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.370 ( 32.231 11.907 23.682) 41.731 8.481 ( 35.963 30.050 22.171) 51.845 9.459 ( 2.726 24.871 20.144) 32.121 10.394 ( -27.800 -28.386 3.452) 39.881 12.334 ( -18.980 15.170 41.602) 48.178 12.997 ( 13.678 16.230 55.104) 59.050 13.491 ( 28.657 -21.663 49.920) 61.503 13.928 ( -22.140 -25.359 1.515) 33.699 15.105 ( -24.465 -23.046 44.015) 55.381 15.334 ( -18.820 3.014 34.064) 39.034 16.810 ( 7.641 6.664 -1.540) 10.255 17.271 ( -9.342 4.112 -6.624) 12.167 18.626 ( 12.088 -5.213 17.538) 21.929 19.198 ( -8.462 -10.103 10.730) 16.995 21.078 ( 8.729 -4.628 -8.500) 13.033 21.836 ( -9.571 -6.434 -7.270) 13.632 22.532 ( 1.802 0.301 -16.044) 16.148 22.635 ( -0.381 -1.563 -19.224) 19.292 23.754 ( 2.209 3.813 1.695) 4.721 23.831 ( 0.408 4.204 -2.693) 5.009 26.964 ( 15.901 24.751 -12.720) 32.051 27.072 ( 15.591 24.330 -4.597) 29.261 29.299 ( 25.729 11.668 -13.906) 31.488 30.912 ( -24.485 -12.469 -5.167) 27.959======================= Grid point 522 (102/210) =======================q-point: ( 0.45 0.27 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.070 ( 37.728 3.698 17.910) 41.927 8.749 ( -22.923 5.100 15.641) 28.215 9.518 ( 23.163 27.778 19.186) 40.941 10.020 ( -19.855 12.521 11.622) 26.193 12.228 ( 11.774 -0.619 27.521) 29.940 12.710 ( -30.978 -3.961 21.802) 38.088 13.949 ( 20.725 -37.072 31.001) 52.582 14.078 ( 17.155 -12.419 32.977) 39.192 14.691 ( -12.612 -6.604 54.203) 56.042 14.897 ( -23.593 15.455 49.981) 57.390 16.957 ( 7.266 6.666 -1.829) 10.029 17.103 ( -7.744 6.215 -3.440) 10.509 18.849 ( 10.268 -8.253 15.527) 20.362 19.033 ( -8.570 -9.438 13.405) 18.499 21.304 ( 13.678 -8.920 -7.707) 18.057 21.589 ( -14.400 -9.635 -6.983) 18.681 22.575 ( 2.290 -1.347 -16.428) 16.641 22.615 ( -1.639 -1.938 -17.427) 17.610 23.796 ( 1.922 5.115 -0.847) 5.529 23.825 ( -0.937 5.257 -2.259) 5.798 27.203 ( 7.850 25.929 -11.515) 29.437 27.255 ( 3.058 25.762 -8.834) 27.406 29.840 ( 28.500 3.209 -9.865) 30.329 30.397 ( -27.532 -4.698 -6.802) 28.747======================= Grid point 532 (103/210) =======================q-point: ( 0.36 0.36 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.700 ( 21.351 21.351 16.707) 34.508 8.992 ( 13.349 13.349 13.788) 23.377 9.883 ( -7.127 -7.127 9.446) 13.814 10.012 ( 21.973 21.973 13.362) 33.826 12.631 ( -10.401 -10.401 22.116) 26.560 12.759 ( 0.082 0.082 47.753) 47.753 13.283 ( -30.616 -30.616 -2.302) 43.359 13.604 ( 6.487 6.487 51.713) 52.521 14.750 ( -7.337 -7.337 56.689) 57.631 15.348 ( -4.019 -4.019 43.616) 43.985 16.942 ( 6.508 6.508 -3.970) 10.024 17.269 ( -3.480 -3.480 -7.779) 9.205 18.636 ( 5.069 5.069 23.158) 24.242 19.032 ( -7.137 -7.137 17.642) 20.326 21.042 ( 1.519 1.519 -9.150) 9.399 21.637 ( -12.793 -12.793 -6.863) 19.350 22.534 ( 0.317 0.317 -14.622) 14.629 22.611 ( -1.264 -1.264 -16.983) 17.077 23.829 ( 3.549 3.549 -1.430) 5.218 23.893 ( 2.021 2.021 -3.931) 4.860 27.392 ( 18.269 18.269 -12.315) 28.621 27.501 ( 17.392 17.392 -3.542) 24.850 29.566 ( 15.562 15.562 -14.471) 26.340 30.629 ( -16.153 -16.153 -7.036) 23.902======================= Grid point 533 (104/210) =======================q-point: ( 0.45 0.36 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.192 ( 27.886 8.398 10.866) 31.084 8.757 ( -27.261 -4.408 7.064) 28.504 10.126 ( 23.464 32.804 15.954) 43.372 10.373 ( 4.690 22.905 11.067) 25.868 12.265 ( -4.813 2.560 20.535) 21.246 12.560 ( -29.084 -10.978 9.558) 32.522 13.183 ( 19.148 -37.048 32.391) 52.805 13.531 ( -13.628 -33.403 33.688) 49.359 14.863 ( 14.901 15.485 63.708) 67.235 15.169 ( -13.623 9.873 55.245) 57.750 17.064 ( 5.846 4.242 -4.979) 8.773 17.175 ( -5.454 1.290 -6.219) 8.372 18.767 ( 7.156 -0.653 23.522) 24.595 18.901 ( -6.484 -4.361 21.506) 22.881 21.146 ( 8.804 -6.273 -8.724) 13.892 21.370 ( -13.305 -11.530 -7.635) 19.190 22.550 ( 1.291 -0.958 -14.583) 14.671 22.581 ( -1.689 -1.605 -15.258) 15.435 23.886 ( 2.164 3.825 -3.290) 5.490 23.910 ( -0.202 3.241 -4.041) 5.184 27.664 ( 8.744 19.858 -9.572) 23.715 27.715 ( 3.993 19.494 -6.124) 20.820 29.908 ( 18.706 3.841 -12.594) 22.875 30.282 ( -18.738 -6.858 -9.631) 22.156======================= Grid point 544 (105/210) =======================q-point: ( 0.45 0.45 0.21)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.387 ( 10.983 10.983 6.213) 16.729 8.603 ( -10.220 -10.220 4.451) 15.123 10.728 ( 24.029 24.029 12.566) 36.231 10.817 ( 16.087 16.087 8.878) 24.421 12.186 ( -9.054 -9.054 5.119) 13.790 12.283 ( -17.649 -17.649 2.996) 25.138 12.740 ( -0.442 -0.442 43.356) 43.360 12.975 ( -20.883 -20.883 39.853) 49.603 15.139 ( 10.956 10.956 63.663) 65.522 15.260 ( -0.864 -0.864 60.414) 60.426 17.129 ( 2.597 2.597 -6.099) 7.120 17.169 ( -1.397 -1.397 -6.561) 6.852 18.791 ( 2.299 2.299 26.909) 27.105 18.839 ( -2.484 -2.484 26.033) 26.269 21.085 ( 0.583 0.583 -9.226) 9.263 21.171 ( -7.854 -7.854 -8.677) 14.094 22.541 ( 0.083 0.083 -14.080) 14.080 22.553 ( -1.101 -1.101 -14.259) 14.344 23.941 ( 1.661 1.661 -4.431) 5.016 23.950 ( 0.781 0.781 -4.651) 4.781 27.952 ( 8.555 8.555 -6.962) 13.959 27.977 ( 6.280 6.280 -5.399) 10.394 30.001 ( 5.857 5.857 -13.712) 16.019 30.136 ( -7.543 -7.543 -12.361) 16.328======================= Grid point 605 (106/210) =======================q-point: ( 0.00 0.00 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.588 ( 0.000 0.000 67.383) 67.383 6.588 ( 0.000 0.000 67.383) 67.383 9.016 ( 0.000 0.000 57.523) 57.523 11.183 ( 0.000 0.000 92.367) 92.367 14.139 ( 0.000 0.000 54.284) 54.284 14.139 ( 0.000 0.000 54.284) 54.284 15.869 ( 0.000 0.000 3.719) 3.719 16.294 ( -0.000 -0.000 -11.617) 11.617 16.294 ( 0.000 0.000 -11.617) 11.617 16.414 ( 0.000 0.000 -11.816) 11.816 16.706 ( -0.000 -0.000 23.821) 23.821 18.427 ( 0.000 0.000 38.406) 38.406 18.432 ( 0.000 0.000 -24.387) 24.387 20.347 ( 0.000 0.000 -2.080) 2.080 20.620 ( 0.000 0.000 -2.634) 2.634 20.620 ( -0.000 -0.000 -2.634) 2.634 21.435 ( 0.000 0.000 -18.411) 18.411 21.435 ( 0.000 0.000 -18.411) 18.411 23.765 ( -0.000 -0.000 -1.743) 1.743 24.081 ( 0.000 0.000 10.801) 10.801 24.856 ( 0.000 0.000 6.344) 6.344 24.856 ( 0.000 0.000 6.344) 6.344 26.877 ( 0.000 0.000 -25.688) 25.688 32.807 ( 0.000 0.000 -30.381) 30.381======================= Grid point 606 (107/210) =======================q-point: ( 0.09 0.00 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.570 ( -0.534 0.000 63.233) 63.236 6.730 ( 14.189 0.000 65.798) 67.310 9.050 ( 3.502 0.000 55.538) 55.649 11.403 ( 21.401 0.000 91.308) 93.783 13.926 ( -21.747 0.000 46.347) 51.195 14.272 ( 13.105 0.000 54.618) 56.168 15.543 ( -46.047 0.000 4.800) 46.297 15.892 ( 2.281 0.000 3.689) 4.337 16.032 ( -23.295 0.000 -4.372) 23.701 16.396 ( -2.921 0.000 -10.829) 11.216 17.407 ( 41.144 0.000 6.132) 41.598 18.166 ( -25.959 0.000 -20.823) 33.278 18.443 ( -0.116 0.000 40.855) 40.855 20.158 ( -12.709 0.000 -4.443) 13.463 20.721 ( 9.857 0.000 -4.736) 10.935 20.732 ( 10.665 0.000 -5.144) 11.840 21.450 ( 1.738 0.000 -16.813) 16.903 21.682 ( 18.355 0.000 -18.647) 26.165 23.730 ( -3.080 0.000 -1.249) 3.324 24.059 ( -2.181 0.000 10.445) 10.670 24.947 ( 8.695 0.000 4.572) 9.824 25.022 ( 15.846 0.000 5.666) 16.829 26.980 ( 10.808 0.000 -24.745) 27.002 32.677 ( -12.981 0.000 -28.360) 31.190======================= Grid point 607 (108/210) =======================q-point: ( 0.18 0.00 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.637 ( 9.141 0.000 51.555) 52.359 7.128 ( 25.578 0.000 61.627) 66.724 9.156 ( 7.372 0.000 50.278) 50.816 11.969 ( 34.368 0.000 88.228) 94.685 13.287 ( -42.548 0.000 27.640) 50.738 14.573 ( -10.534 0.000 52.399) 53.447 14.714 ( -9.929 0.000 9.967) 14.069 15.488 ( -30.159 0.000 8.147) 31.240 15.962 ( 4.824 0.000 3.678) 6.066 16.264 ( -11.953 0.000 -3.884) 12.569 17.526 ( -34.425 0.000 -13.481) 36.971 18.156 ( 34.220 0.000 0.231) 34.221 18.360 ( -8.928 0.000 43.877) 44.776 19.968 ( -6.774 0.000 -5.094) 8.476 20.970 ( 14.055 0.000 -8.006) 16.175 20.988 ( 13.460 0.000 -10.056) 16.802 21.523 ( 6.511 0.000 -13.431) 14.925 22.002 ( 13.160 0.000 -20.332) 24.219 23.666 ( -2.983 0.000 -0.693) 3.062 23.997 ( -4.035 0.000 9.289) 10.128 25.169 ( 13.017 0.000 0.809) 13.042 25.405 ( 20.552 0.000 2.412) 20.693 27.322 ( 24.395 0.000 -21.176) 32.304 32.313 ( -23.362 0.000 -23.441) 33.095======================= Grid point 608 (109/210) =======================q-point: ( 0.27 0.00 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.980 ( 26.203 0.000 35.412) 44.053 7.708 ( 32.432 0.000 56.089) 64.790 9.333 ( 9.942 0.000 43.860) 44.973 12.294 ( -56.701 0.000 11.237) 57.804 12.694 ( 37.741 0.000 83.781) 91.889 13.843 ( -35.526 0.000 14.545) 38.388 14.857 ( -34.275 0.000 13.450) 36.819 15.171 ( 28.853 0.000 45.933) 54.243 15.874 ( -26.996 0.000 11.107) 29.192 16.083 ( 7.424 0.000 4.249) 8.553 16.975 ( -19.776 0.000 -7.405) 21.117 18.093 ( -17.893 0.000 44.510) 47.972 18.745 ( 25.495 0.000 -3.764) 25.771 19.860 ( -4.792 0.000 -4.082) 6.295 21.199 ( 7.581 0.000 -10.232) 12.735 21.224 ( 10.686 0.000 -8.374) 13.576 21.729 ( 13.827 0.000 -13.817) 19.547 22.204 ( 7.746 0.000 -21.533) 22.884 23.623 ( -1.240 0.000 -0.409) 1.306 23.906 ( -5.101 0.000 7.480) 9.054 25.436 ( 13.634 0.000 -3.146) 13.993 25.755 ( 13.915 0.000 -3.240) 14.287 27.937 ( 37.174 0.000 -15.530) 40.288 31.778 ( -30.508 0.000 -17.891) 35.366======================= Grid point 609 (110/210) =======================q-point: ( 0.36 0.00 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.667 ( 42.938 0.000 19.732) 47.255 8.369 ( 33.474 0.000 50.105) 60.258 9.499 ( 5.036 0.000 39.765) 40.083 11.108 ( -62.350 0.000 3.522) 62.450 13.208 ( -10.494 0.000 34.824) 36.371 13.499 ( 26.713 0.000 53.954) 60.205 14.141 ( -37.368 0.000 9.702) 38.607 15.299 ( -29.323 0.000 32.220) 43.566 15.755 ( 29.124 0.000 39.275) 48.895 16.262 ( 11.454 0.000 9.365) 14.796 16.691 ( -11.206 0.000 -3.528) 11.748 17.670 ( -24.587 0.000 44.512) 50.851 19.166 ( 17.507 0.000 -5.963) 18.495 19.762 ( -5.488 0.000 -3.910) 6.738 21.311 ( 4.436 0.000 -6.939) 8.236 21.375 ( 4.643 0.000 -7.310) 8.659 22.012 ( 13.512 0.000 -17.105) 21.798 22.315 ( 3.394 0.000 -21.413) 21.680 23.618 ( 0.689 0.000 0.181) 0.713 23.804 ( -5.047 0.000 5.344) 7.351 25.689 ( 11.678 0.000 -6.466) 13.349 25.944 ( 5.435 0.000 -7.574) 9.322 28.737 ( 42.699 0.000 -11.351) 44.182 31.126 ( -35.444 0.000 -13.391) 37.890======================= Grid point 610 (111/210) =======================q-point: ( 0.45 0.00 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.625 ( 51.580 0.000 9.466) 52.442 8.962 ( 23.354 0.000 42.334) 48.348 9.467 ( -7.845 0.000 39.605) 40.374 9.897 ( -57.797 0.000 5.403) 58.049 13.097 ( 6.374 0.000 13.279) 14.730 13.463 ( -28.903 0.000 8.620) 30.161 14.137 ( 31.801 0.000 61.312) 69.069 14.731 ( -28.914 0.000 49.535) 57.356 16.229 ( 16.936 0.000 12.402) 20.992 16.482 ( -10.761 0.000 0.004) 10.761 16.601 ( 24.329 0.000 33.905) 41.730 17.143 ( -28.321 0.000 43.857) 52.207 19.448 ( 11.535 0.000 -6.064) 13.032 19.634 ( -7.689 0.000 -4.894) 9.114 21.383 ( 2.877 0.000 -5.598) 6.294 21.416 ( -0.115 0.000 -6.137) 6.138 22.230 ( 8.228 0.000 -19.190) 20.880 22.330 ( -2.006 0.000 -20.458) 20.556 23.649 ( 2.459 0.000 1.411) 2.835 23.713 ( -4.015 0.000 3.217) 5.145 25.882 ( 7.610 0.000 -8.650) 11.521 25.977 ( -1.781 0.000 -9.213) 9.383 29.581 ( 42.295 0.000 -9.863) 43.429 30.388 ( -39.338 0.000 -10.641) 40.752======================= Grid point 617 (112/210) =======================q-point: ( 0.09 0.09 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.699 ( 5.589 5.589 63.111) 63.604 6.724 ( 7.781 7.781 60.472) 61.465 9.085 ( 3.583 3.583 53.534) 53.773 11.612 ( 20.433 20.433 90.120) 94.640 14.029 ( -7.014 -7.014 41.558) 42.725 14.081 ( -3.018 -3.018 47.552) 47.743 14.947 ( -40.095 -40.095 14.069) 58.422 15.883 ( -0.989 -0.989 2.273) 2.669 16.188 ( -4.437 -4.437 -4.810) 7.906 16.404 ( -0.792 -0.792 -10.543) 10.602 17.454 ( 10.550 10.550 14.161) 20.571 18.007 ( -16.784 -16.784 -20.259) 31.207 18.519 ( 4.585 4.585 41.512) 42.015 19.963 ( -13.016 -13.016 -10.512) 21.198 20.704 ( 2.523 2.523 -2.804) 4.539 20.865 ( 10.522 10.522 -4.290) 15.486 21.666 ( 9.635 9.635 -19.815) 24.048 21.753 ( 12.161 12.161 -16.970) 24.161 23.712 ( -1.681 -1.681 -1.251) 2.686 24.039 ( -2.063 -2.063 9.961) 10.380 25.089 ( 11.818 11.818 5.019) 17.451 25.122 ( 11.578 11.578 3.379) 16.719 27.082 ( 10.590 10.590 -23.942) 28.240 32.555 ( -12.141 -12.141 -26.575) 31.639======================= Grid point 618 (113/210) =======================q-point: ( 0.18 0.09 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 6.765 ( 8.239 12.258 51.271) 53.356 7.111 ( 25.531 -0.156 57.255) 62.690 9.193 ( 7.427 3.722 48.230) 48.941 12.150 ( 32.158 17.547 85.823) 93.314 13.357 ( -45.987 3.622 20.091) 50.315 14.169 ( -31.301 -34.048 17.787) 49.552 14.441 ( 18.467 -16.614 54.234) 59.653 15.707 ( -25.278 1.227 -4.864) 25.771 15.959 ( -6.484 6.760 6.436) 11.365 16.345 ( -4.771 6.319 0.603) 7.941 17.534 ( -27.870 0.086 -13.835) 31.116 17.730 ( 9.995 -24.952 21.684) 34.535 18.613 ( 7.709 7.551 30.718) 32.558 19.794 ( -4.686 -11.344 -9.536) 15.543 20.835 ( 9.588 -7.234 -4.126) 12.700 21.107 ( 13.486 10.266 -7.557) 18.557 21.775 ( 5.160 16.763 -17.325) 24.653 22.048 ( 12.888 4.563 -19.545) 23.852 23.672 ( -2.090 0.471 -1.285) 2.499 23.980 ( -3.832 -1.740 8.660) 9.629 25.320 ( 12.996 14.901 0.707) 19.784 25.486 ( 21.158 8.173 1.605) 22.739 27.413 ( 23.323 9.233 -20.904) 32.653 32.214 ( -22.003 -9.952 -22.202) 32.804======================= Grid point 619 (114/210) =======================q-point: ( 0.27 0.09 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.082 ( 24.456 9.513 36.143) 44.664 7.691 ( 32.511 -0.105 51.703) 61.075 9.370 ( 9.856 3.790 41.758) 43.072 12.249 ( -53.750 -6.285 7.924) 54.693 12.901 ( 31.660 18.811 80.389) 88.423 13.537 ( -29.792 -20.585 22.852) 42.820 14.871 ( 7.361 -13.666 36.928) 40.058 15.096 ( -18.471 -1.934 6.871) 19.803 15.808 ( -13.683 1.008 17.407) 22.164 16.251 ( -2.481 11.704 6.937) 13.830 17.061 ( -17.734 7.357 -6.143) 20.158 17.723 ( -9.413 -29.656 32.026) 44.651 18.866 ( 16.023 4.249 12.694) 20.878 19.724 ( -3.309 -9.201 -4.522) 10.773 21.034 ( 9.933 -9.605 -3.449) 14.241 21.370 ( 11.961 9.592 -12.044) 19.497 21.886 ( 6.300 11.661 -15.827) 20.644 22.240 ( 6.855 2.841 -20.376) 21.685 23.640 ( -0.986 1.592 -1.263) 2.258 23.893 ( -4.791 -1.220 6.768) 8.382 25.591 ( 13.927 15.073 -3.336) 20.791 25.860 ( 15.498 10.732 -3.354) 19.147 28.000 ( 35.598 6.337 -15.830) 39.472 31.707 ( -29.009 -7.125 -17.228) 34.483======================= Grid point 620 (115/210) =======================q-point: ( 0.36 0.09 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.727 ( 40.427 5.061 21.725) 46.173 8.357 ( 33.954 0.543 45.254) 56.578 9.529 ( 4.262 3.221 37.668) 38.045 11.085 ( -60.822 -3.749 1.493) 60.956 13.047 ( -16.234 -14.528 21.221) 30.413 13.545 ( 24.180 9.093 67.369) 72.152 14.272 ( -30.162 7.096 6.265) 31.612 15.416 ( -21.644 9.091 34.577) 41.793 15.507 ( 25.337 -20.579 39.063) 50.905 16.261 ( 1.910 1.186 5.682) 6.111 16.831 ( -6.553 10.186 1.922) 12.263 17.437 ( -18.146 -21.029 35.278) 44.900 19.166 ( 13.488 -1.426 4.583) 14.317 19.648 ( -4.518 -8.387 -1.595) 9.659 21.222 ( 9.185 -5.625 -3.079) 11.202 21.526 ( 3.250 9.578 -10.822) 14.812 22.035 ( 8.782 3.040 -17.656) 19.952 22.325 ( 1.842 0.243 -20.196) 20.281 23.636 ( 0.556 1.782 -0.772) 2.020 23.799 ( -4.619 -0.472 4.557) 6.505 25.850 ( 11.952 15.698 -6.667) 20.826 26.078 ( 6.701 13.458 -7.551) 16.824 28.770 ( 41.340 3.322 -11.762) 43.109 31.084 ( -34.040 -4.264 -13.178) 36.750======================= Grid point 621 (116/210) =======================q-point: ( 0.45 0.09 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.621 ( 47.107 -1.633 14.575) 49.338 8.963 ( 23.307 1.656 35.266) 42.304 9.475 ( -8.270 1.145 36.680) 37.618 9.925 ( -53.513 2.845 5.195) 53.840 12.961 ( 8.773 -11.364 13.766) 19.890 13.354 ( -27.738 -8.359 12.451) 31.533 14.381 ( 27.212 20.109 55.938) 65.375 14.922 ( -26.564 17.327 49.742) 58.992 15.989 ( 20.307 -23.369 25.154) 39.889 16.247 ( -5.586 -13.728 9.360) 17.529 16.810 ( 5.732 10.006 16.177) 19.867 17.063 ( -18.098 -6.380 31.766) 37.112 19.389 ( 9.303 -5.226 1.286) 10.748 19.542 ( -6.413 -7.399 -0.165) 9.793 21.391 ( 7.702 0.545 -4.450) 8.911 21.511 ( -4.031 6.355 -7.224) 10.431 22.204 ( 7.534 -1.523 -19.495) 20.956 22.312 ( -3.165 -1.830 -19.934) 20.266 23.662 ( 2.070 1.314 0.459) 2.495 23.717 ( -3.530 0.451 2.338) 4.258 26.045 ( 7.462 15.902 -8.785) 19.640 26.132 ( -1.076 15.197 -9.250) 17.823 29.589 ( 41.088 0.780 -10.160) 42.333 30.372 ( -38.081 -1.645 -10.735) 39.599======================= Grid point 629 (117/210) =======================q-point: ( 0.18 0.18 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.018 ( 10.423 10.423 51.788) 53.845 7.269 ( 20.176 20.176 43.830) 52.300 9.305 ( 7.709 7.709 42.775) 44.143 12.545 ( 10.349 10.349 58.098) 59.914 13.053 ( -24.356 -24.356 23.339) 41.607 13.883 ( -7.396 -7.396 30.587) 32.326 14.068 ( -6.443 -6.443 53.081) 53.857 15.464 ( -21.808 -21.808 -10.644) 32.626 16.072 ( -0.351 -0.351 11.224) 11.235 16.457 ( 4.177 4.177 4.756) 7.583 17.316 ( -16.663 -16.663 30.609) 38.630 17.461 ( -9.093 -9.093 -14.099) 19.083 18.660 ( 3.315 3.315 28.086) 28.475 19.674 ( -2.212 -2.212 -2.554) 4.038 20.776 ( 1.334 1.334 -4.137) 4.547 21.341 ( 12.775 12.775 -8.175) 19.830 22.009 ( 6.560 6.560 -19.028) 21.169 22.174 ( 7.151 7.151 -18.004) 20.650 23.677 ( -0.004 -0.004 -2.365) 2.365 23.931 ( -3.178 -3.178 7.018) 8.334 25.666 ( 15.846 15.846 -2.716) 22.574 25.757 ( 21.067 21.067 1.301) 29.821 27.694 ( 19.568 19.568 -19.552) 33.884 31.931 ( -18.402 -18.402 -19.126) 32.297======================= Grid point 630 (118/210) =======================q-point: ( 0.27 0.18 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.289 ( 19.499 9.874 40.085) 45.656 7.813 ( 32.349 15.012 37.545) 51.783 9.489 ( 10.200 8.506 36.019) 38.389 11.899 ( -50.451 -30.493 -0.851) 58.956 13.290 ( 1.322 12.588 58.463) 59.817 13.428 ( -1.462 17.785 48.690) 51.857 14.392 ( 22.583 -29.690 39.673) 54.455 14.894 ( -33.296 -19.566 -10.197) 39.943 15.969 ( -8.807 11.523 24.441) 28.420 16.471 ( -4.243 9.859 11.160) 15.484 17.030 ( -12.068 -28.654 23.559) 39.009 17.248 ( -9.653 -0.276 -4.956) 10.854 18.839 ( 12.961 -2.998 22.226) 25.903 19.626 ( -3.449 -1.665 5.743) 6.903 20.874 ( 8.131 -5.863 -4.500) 10.988 21.578 ( 10.103 10.562 -10.595) 18.052 22.081 ( 1.875 7.373 -17.405) 18.995 22.278 ( 3.095 0.362 -18.021) 18.288 23.676 ( 0.056 1.868 -3.060) 3.586 23.860 ( -3.801 -2.042 4.790) 6.447 25.969 ( 15.419 21.092 -5.534) 26.707 26.180 ( 18.946 21.532 -2.521) 28.791 28.189 ( 30.531 13.083 -16.353) 37.023 31.501 ( -24.943 -13.612 -15.565) 32.399======================= Grid point 631 (119/210) =======================q-point: ( 0.36 0.18 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.809 ( 32.845 2.646 28.353) 43.470 8.488 ( 34.862 14.170 30.574) 48.486 9.641 ( 2.582 8.688 31.747) 33.015 10.890 ( -50.071 -17.030 -0.677) 52.892 12.846 ( -18.278 -3.029 22.726) 29.321 13.734 ( -10.425 4.565 38.279) 39.935 14.360 ( 2.315 4.265 27.327) 27.755 14.898 ( 22.831 -34.387 31.060) 51.657 15.743 ( -13.764 17.034 39.503) 45.168 16.260 ( -15.814 -4.507 19.416) 25.444 16.903 ( -1.264 -10.415 13.369) 16.994 17.098 ( -6.089 -0.997 3.561) 7.124 19.091 ( 11.562 -4.342 17.706) 21.588 19.538 ( -5.275 -2.666 9.366) 11.075 21.080 ( 12.408 -8.355 -4.271) 15.557 21.687 ( -0.131 5.620 -9.288) 10.857 22.122 ( 3.191 4.854 -17.678) 18.608 22.304 ( -0.208 -2.254 -18.441) 18.580 23.682 ( 0.559 2.706 -2.986) 4.068 23.788 ( -3.342 -0.502 2.300) 4.088 26.256 ( 13.140 23.784 -7.950) 28.311 26.458 ( 9.122 24.407 -6.590) 26.877 28.866 ( 37.047 6.424 -12.838) 39.731 30.957 ( -30.118 -8.574 -12.657) 33.776======================= Grid point 632 (120/210) =======================q-point: ( 0.45 0.18 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.538 ( 38.990 -5.760 22.028) 45.151 9.043 ( 7.607 4.344 22.621) 24.258 9.552 ( -0.789 8.458 26.955) 28.262 10.014 ( -36.488 6.618 6.460) 37.641 12.745 ( 9.446 -9.155 14.494) 19.573 13.172 ( -30.875 -10.127 9.170) 33.762 14.773 ( 25.606 14.583 51.410) 59.257 15.165 ( -6.808 -11.551 33.804) 36.366 15.579 ( 7.706 -0.052 43.619) 44.295 15.909 ( -19.037 -17.209 27.131) 37.345 16.926 ( 2.713 0.641 9.835) 10.223 16.996 ( -4.332 1.953 7.248) 8.667 19.283 ( 8.127 -4.268 14.182) 16.893 19.423 ( -6.326 -3.743 11.567) 13.705 21.341 ( 13.391 -6.243 -4.628) 15.483 21.578 ( -9.818 -0.955 -6.230) 11.667 22.205 ( 4.407 1.543 -18.827) 19.397 22.276 ( -2.587 -1.278 -18.884) 19.103 23.699 ( 1.226 2.386 -1.973) 3.330 23.733 ( -2.236 1.151 -0.100) 2.517 26.466 ( 7.684 25.385 -9.195) 28.071 26.545 ( -0.077 25.689 -8.864) 27.175 29.608 ( 37.440 1.043 -10.990) 39.034 30.320 ( -34.442 -3.732 -11.024) 36.356======================= Grid point 641 (121/210) =======================q-point: ( 0.27 0.27 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.503 ( 13.857 13.857 36.764) 41.660 8.270 ( 29.212 29.212 26.226) 48.934 9.703 ( 12.567 12.567 28.472) 33.563 11.166 ( -40.368 -40.368 1.007) 57.098 13.475 ( -13.383 -13.383 12.766) 22.830 13.659 ( 5.247 5.247 53.788) 54.297 14.118 ( 17.959 17.959 63.392) 68.291 14.383 ( -30.316 -30.316 -10.404) 44.118 16.143 ( 3.751 3.751 32.466) 32.897 16.393 ( -25.698 -25.698 32.245) 48.584 16.671 ( 5.871 5.871 6.540) 10.569 17.237 ( -3.570 -3.570 -9.880) 11.095 18.881 ( 7.478 7.478 27.431) 29.399 19.588 ( -2.988 -2.988 15.620) 16.181 20.824 ( 1.212 1.212 -6.137) 6.372 21.738 ( 4.297 4.297 -9.199) 11.025 22.176 ( 2.369 2.369 -17.143) 17.468 22.260 ( -1.075 -1.075 -17.067) 17.135 23.710 ( 1.526 1.526 -4.461) 4.956 23.818 ( -2.087 -2.087 1.963) 3.544 26.374 ( 19.795 19.795 -8.284) 29.195 26.639 ( 22.281 22.281 -2.602) 31.618 28.526 ( 21.380 21.380 -15.974) 34.196 31.176 ( -19.294 -19.294 -13.629) 30.500======================= Grid point 642 (122/210) =======================q-point: ( 0.36 0.27 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.877 ( 24.318 5.875 27.828) 37.420 8.878 ( 29.381 22.995 18.921) 41.833 9.882 ( -0.663 15.518 22.825) 27.608 10.455 ( -25.162 -24.224 2.889) 35.046 12.907 ( -27.706 6.295 16.350) 32.781 13.606 ( -32.651 -15.583 4.530) 36.462 14.103 ( 16.979 -35.983 23.774) 46.349 14.573 ( 19.835 4.328 54.371) 58.037 15.901 ( -16.741 -6.425 37.542) 41.605 16.174 ( -5.879 6.750 46.592) 47.444 16.804 ( 6.867 2.060 2.890) 7.730 17.142 ( -5.080 0.956 -5.535) 7.574 19.073 ( 10.366 3.156 27.513) 29.570 19.505 ( -5.171 -1.352 20.100) 20.798 20.928 ( 9.179 -6.147 -6.388) 12.762 21.701 ( -8.068 -4.820 -6.462) 11.405 22.202 ( 1.498 2.848 -16.936) 17.239 22.264 ( 0.753 -0.953 -17.559) 17.601 23.735 ( 1.008 2.513 -4.922) 5.618 23.783 ( -1.408 0.037 -1.064) 1.765 26.734 ( 16.229 23.922 -9.472) 30.420 26.981 ( 11.521 26.405 -5.195) 29.274 29.028 ( 28.896 10.261 -14.069) 33.738 30.745 ( -24.349 -12.973 -12.125) 30.136======================= Grid point 643 (123/210) =======================q-point: ( 0.45 0.27 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.444 ( 32.263 -2.909 19.810) 37.971 9.050 ( -21.875 -3.984 14.697) 26.653 9.856 ( 16.280 21.943 16.139) 31.733 10.211 ( -12.064 13.860 9.098) 20.504 12.613 ( 1.315 -4.813 12.034) 13.027 12.947 ( -29.090 -12.944 4.803) 32.200 14.486 ( 18.500 -37.410 24.169) 48.227 14.744 ( -4.419 -25.641 30.902) 40.397 15.774 ( 5.016 14.843 55.081) 57.266 15.983 ( -12.397 19.601 56.089) 60.694 16.935 ( 6.195 1.315 0.788) 6.382 17.045 ( -5.038 1.608 -1.076) 5.397 19.255 ( 7.923 1.553 25.174) 26.437 19.392 ( -6.245 0.241 22.610) 23.457 21.168 ( 14.510 -10.162 -5.676) 18.601 21.465 ( -14.602 -9.772 -5.361) 18.370 22.239 ( 1.921 1.289 -17.011) 17.167 22.267 ( -0.670 0.098 -17.237) 17.250 23.751 ( 0.606 2.644 -4.575) 5.319 23.763 ( -0.717 1.815 -3.404) 3.924 26.992 ( 9.455 26.868 -9.365) 29.983 27.090 ( -0.093 28.045 -7.900) 29.136 29.628 ( 31.029 0.991 -12.196) 33.354 30.221 ( -28.660 -6.355 -11.543) 31.544======================= Grid point 653 (124/210) =======================q-point: ( 0.36 0.36 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.075 ( 14.472 14.472 21.411) 29.619 9.210 ( 2.077 2.077 9.250) 9.705 10.070 ( 1.141 1.141 9.453) 9.590 10.287 ( 16.657 16.657 14.543) 27.684 12.855 ( -17.239 -17.239 3.143) 24.581 13.222 ( -27.229 -27.229 -4.308) 38.747 13.579 ( -3.566 -3.566 35.534) 35.890 14.486 ( -13.686 -13.686 36.131) 40.989 15.893 ( 8.900 8.900 60.558) 61.852 16.331 ( 5.130 5.130 50.139) 50.661 16.881 ( 4.488 4.488 0.233) 6.351 17.122 ( -2.546 -2.546 -6.031) 7.024 19.191 ( 7.580 7.580 32.777) 34.485 19.472 ( -2.103 -2.103 26.477) 26.644 20.872 ( 1.134 1.134 -7.891) 8.052 21.515 ( -12.953 -12.953 -5.187) 19.039 22.231 ( 0.731 0.731 -15.990) 16.023 22.270 ( 0.607 0.607 -16.820) 16.842 23.776 ( 1.513 1.513 -5.407) 5.815 23.790 ( 0.612 0.612 -4.895) 4.971 27.171 ( 19.659 19.659 -9.670) 29.435 27.416 ( 16.194 16.194 -5.279) 23.502 29.285 ( 16.097 16.097 -14.443) 26.959 30.446 ( -17.287 -17.287 -11.926) 27.201======================= Grid point 654 (125/210) =======================q-point: ( 0.45 0.36 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.441 ( 22.167 2.680 14.414) 26.577 8.913 ( -24.021 -9.084 8.769) 27.137 10.367 ( 20.053 28.397 9.399) 36.012 10.557 ( 4.454 20.462 8.144) 22.469 12.500 ( -9.165 -9.049 5.457) 13.988 12.662 ( -23.183 -15.646 2.064) 28.045 13.785 ( 16.727 -29.424 27.646) 43.702 14.144 ( -18.887 -30.354 26.962) 44.777 16.138 ( 12.907 18.369 64.734) 68.517 16.330 ( -5.423 13.814 58.926) 60.766 16.971 ( 4.575 1.984 -3.356) 6.011 17.056 ( -3.951 -0.308 -4.500) 5.996 19.330 ( 5.860 5.246 33.013) 33.937 19.419 ( -3.423 2.094 30.460) 30.723 20.983 ( 9.916 -7.618 -7.392) 14.526 21.234 ( -14.537 -12.622 -5.728) 20.086 22.248 ( 1.060 -0.085 -15.837) 15.873 22.268 ( -0.741 -0.248 -16.045) 16.064 23.796 ( 0.619 1.846 -5.917) 6.229 23.800 ( 0.220 1.805 -6.700) 6.942 27.482 ( 11.236 21.776 -8.723) 26.011 27.587 ( 1.182 20.881 -6.927) 22.032 29.655 ( 20.764 2.129 -13.467) 24.840 30.070 ( -20.608 -8.833 -12.358) 25.601======================= Grid point 665 (126/210) =======================q-point: ( 0.45 0.45 0.26)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.544 ( 7.483 7.483 9.714) 14.366 8.720 ( -9.879 -9.879 7.421) 15.820 10.881 ( 19.470 19.470 3.856) 27.804 10.936 ( 13.669 13.669 3.683) 19.678 12.258 ( -10.011 -10.011 2.940) 14.460 12.333 ( -16.028 -16.028 1.893) 22.745 13.472 ( -1.522 -1.522 31.074) 31.149 13.653 ( -18.147 -18.147 28.846) 38.610 16.424 ( 9.658 9.658 66.023) 67.421 16.496 ( 2.585 2.585 62.954) 63.060 17.007 ( 1.690 1.690 -6.016) 6.473 17.038 ( -1.407 -1.407 -6.193) 6.505 19.425 ( 3.595 3.595 37.033) 37.380 19.453 ( 0.675 0.675 36.009) 36.021 20.906 ( 0.489 0.489 -8.782) 8.809 21.008 ( -9.284 -9.284 -7.551) 15.146 22.248 ( 0.194 0.194 -15.555) 15.557 22.257 ( -0.674 -0.674 -15.578) 15.608 23.823 ( 0.794 0.794 -7.290) 7.376 23.825 ( 0.594 0.594 -7.670) 7.716 27.810 ( 10.480 10.480 -7.530) 16.625 27.860 ( 5.862 5.862 -6.633) 10.617 29.731 ( 5.954 5.954 -14.051) 16.380 29.886 ( -9.266 -9.266 -13.410) 18.750======================= Grid point 726 (127/210) =======================q-point: ( 0.00 0.00 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.892 ( -0.000 -0.000 65.858) 65.858 7.892 ( -0.000 -0.000 65.858) 65.858 10.158 ( 0.000 0.000 58.954) 58.954 12.873 ( 0.000 0.000 80.325) 80.325 14.739 ( 0.000 -0.000 1.431) 1.431 14.739 ( 0.000 0.000 1.431) 1.431 15.953 ( 0.000 0.000 4.943) 4.943 16.143 ( 0.000 0.000 -16.287) 16.287 16.341 ( 0.000 0.000 20.990) 20.990 16.341 ( 0.000 0.000 20.990) 20.990 17.221 ( 0.000 0.000 28.774) 28.774 17.931 ( 0.000 0.000 -26.427) 26.427 18.785 ( 0.000 0.000 -1.096) 1.096 20.498 ( 0.000 0.000 14.302) 14.302 20.576 ( 0.000 -0.000 -2.658) 2.658 20.576 ( 0.000 0.000 -2.658) 2.658 21.172 ( -0.000 -0.000 -6.998) 6.998 21.172 ( 0.000 0.000 -6.998) 6.998 23.752 ( 0.000 0.000 0.518) 0.518 24.241 ( 0.000 0.000 5.162) 5.162 24.905 ( 0.000 0.000 -1.436) 1.436 24.905 ( 0.000 0.000 -1.436) 1.436 26.540 ( 0.000 0.000 -6.215) 6.215 32.146 ( -0.000 -0.000 -37.216) 37.216======================= Grid point 727 (128/210) =======================q-point: ( 0.09 0.00 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.801 ( -7.936 0.000 62.416) 62.919 8.008 ( 11.545 0.000 64.657) 65.680 10.155 ( -0.242 0.000 57.048) 57.049 13.073 ( 19.379 0.000 79.084) 81.424 14.348 ( -36.706 0.000 -4.173) 36.943 14.798 ( 3.668 0.000 -4.630) 5.907 15.903 ( -26.916 0.000 31.990) 41.808 15.982 ( 0.505 0.000 9.231) 9.244 15.999 ( -15.753 0.000 -10.933) 19.175 16.383 ( 4.670 0.000 21.216) 21.723 17.658 ( 31.432 0.000 18.871) 36.662 17.724 ( -20.032 0.000 -23.114) 30.586 18.907 ( 9.655 0.000 4.570) 10.682 20.168 ( -19.413 0.000 3.705) 19.763 20.645 ( 6.705 0.000 -4.390) 8.015 20.712 ( 7.207 0.000 4.427) 8.458 21.221 ( 4.933 0.000 -5.312) 7.250 21.388 ( 15.219 0.000 -10.749) 18.632 23.719 ( -2.953 0.000 0.375) 2.976 24.206 ( -3.365 0.000 4.137) 5.333 24.976 ( 6.887 0.000 -1.767) 7.110 25.095 ( 17.690 0.000 1.992) 17.801 26.635 ( 10.150 0.000 -8.419) 13.187 32.048 ( -9.841 0.000 -35.858) 37.184======================= Grid point 728 (129/210) =======================q-point: ( 0.18 0.00 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.658 ( -4.467 0.000 52.507) 52.697 8.334 ( 21.056 0.000 61.347) 64.860 10.160 ( 1.157 0.000 51.944) 51.957 13.417 ( -55.202 0.000 -10.837) 56.256 13.576 ( 29.736 0.000 74.054) 79.801 14.651 ( -22.823 0.000 -5.994) 23.597 15.556 ( -28.607 0.000 -8.231) 29.767 15.615 ( 4.228 0.000 43.221) 43.427 16.060 ( 6.286 0.000 7.555) 9.828 16.457 ( 1.186 0.000 26.168) 26.195 17.233 ( -26.405 0.000 -15.242) 30.488 18.256 ( 27.901 0.000 9.887) 29.601 19.015 ( -2.013 0.000 19.669) 19.772 19.875 ( -9.171 0.000 -4.537) 10.232 20.817 ( 9.964 0.000 -7.666) 12.572 20.893 ( 11.107 0.000 0.631) 11.125 21.365 ( 9.536 0.000 -1.982) 9.740 21.641 ( 10.036 0.000 -16.051) 18.930 23.654 ( -3.256 0.000 -0.176) 3.260 24.116 ( -5.663 0.000 2.576) 6.222 25.156 ( 10.768 0.000 -2.341) 11.020 25.495 ( 19.769 0.000 7.909) 21.293 26.976 ( 25.343 0.000 -13.575) 28.750 31.766 ( -18.512 0.000 -32.321) 37.247======================= Grid point 729 (130/210) =======================q-point: ( 0.27 0.00 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.696 ( 9.611 0.000 37.631) 38.839 8.814 ( 26.909 0.000 56.538) 62.615 10.211 ( 3.934 0.000 45.480) 45.650 12.248 ( -61.978 0.000 -12.861) 63.299 13.969 ( -18.747 0.000 9.025) 20.806 14.294 ( 19.221 0.000 68.346) 70.998 14.891 ( -37.845 0.000 -9.572) 39.036 15.867 ( 15.018 0.000 21.158) 25.946 16.267 ( 16.345 0.000 17.608) 24.025 16.363 ( -11.839 0.000 33.782) 35.797 16.825 ( -12.885 0.000 -6.521) 14.441 18.740 ( 21.231 0.000 3.347) 21.493 18.805 ( -17.614 0.000 26.073) 31.465 19.776 ( -2.897 0.000 -4.758) 5.571 21.012 ( 9.346 0.000 -8.747) 12.801 21.117 ( 10.441 0.000 -2.329) 10.697 21.582 ( 11.852 0.000 -0.988) 11.893 21.802 ( 6.928 0.000 -18.965) 20.191 23.604 ( -1.559 0.000 -1.061) 1.886 23.990 ( -6.932 0.000 1.096) 7.018 25.382 ( 11.832 0.000 -2.456) 12.085 25.796 ( 10.420 0.000 9.166) 13.878 27.629 ( 39.542 0.000 -16.358) 42.792 31.329 ( -25.630 0.000 -27.817) 37.824======================= Grid point 730 (131/210) =======================q-point: ( 0.36 0.00 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.064 ( 27.790 0.000 20.949) 34.801 9.357 ( 26.757 0.000 50.177) 56.865 10.291 ( 2.956 0.000 40.827) 40.933 11.027 ( -60.473 0.000 -9.658) 61.239 13.469 ( -21.593 0.000 6.692) 22.606 14.129 ( -37.476 0.000 -7.958) 38.312 14.847 ( 27.895 0.000 67.110) 72.677 16.059 ( -16.827 0.000 36.535) 40.224 16.115 ( 10.775 0.000 6.504) 12.586 16.658 ( -6.803 0.000 3.885) 7.834 16.711 ( 27.065 0.000 27.246) 38.404 18.379 ( -24.787 0.000 25.819) 35.791 19.101 ( 15.798 0.000 -0.287) 15.801 19.705 ( -4.953 0.000 -1.500) 5.176 21.173 ( 6.785 0.000 -7.504) 10.117 21.270 ( 4.832 0.000 -3.710) 6.092 21.804 ( 10.036 0.000 -3.516) 10.634 21.925 ( 5.347 0.000 -17.625) 18.419 23.597 ( 0.888 0.000 -1.816) 2.022 23.852 ( -6.855 0.000 -0.293) 6.861 25.608 ( 10.771 0.000 -1.664) 10.899 25.919 ( 2.480 0.000 6.361) 6.828 28.464 ( 43.741 0.000 -16.901) 46.892 30.764 ( -31.607 0.000 -23.515) 39.395======================= Grid point 731 (132/210) =======================q-point: ( 0.45 0.00 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.774 ( 43.329 0.000 6.506) 43.815 9.624 ( -24.532 0.000 14.445) 28.469 10.100 ( -9.189 0.000 26.977) 28.499 10.262 ( -7.251 0.000 41.024) 41.659 13.242 ( 0.375 0.000 3.758) 3.777 13.498 ( -24.444 0.000 -2.801) 24.604 15.338 ( 21.866 0.000 56.012) 60.129 15.722 ( -17.694 0.000 44.564) 47.948 16.319 ( 10.140 0.000 5.303) 11.443 16.508 ( -8.716 0.000 6.535) 10.894 17.277 ( 29.481 0.000 27.433) 40.270 17.851 ( -28.355 0.000 26.209) 38.612 19.373 ( 11.891 0.000 -1.125) 11.944 19.573 ( -8.442 0.000 -0.763) 8.477 21.276 ( 3.639 0.000 -6.116) 7.117 21.314 ( -0.083 0.000 -5.008) 5.008 21.956 ( 4.955 0.000 -7.921) 9.343 21.993 ( 1.071 0.000 -13.047) 13.091 23.639 ( 3.380 0.000 -1.978) 3.916 23.728 ( -5.520 0.000 -1.411) 5.698 25.794 ( 7.863 0.000 0.176) 7.865 25.907 ( -3.373 0.000 2.970) 4.494 29.311 ( 41.571 0.000 -17.932) 45.273 30.087 ( -36.980 0.000 -20.128) 42.103======================= Grid point 738 (133/210) =======================q-point: ( 0.09 0.09 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.904 ( 1.722 1.722 59.930) 59.980 7.931 ( 1.992 1.992 62.635) 62.699 10.152 ( -0.195 -0.195 55.123) 55.123 13.247 ( 16.080 16.080 74.772) 78.154 14.252 ( -23.782 -23.782 -8.466) 34.682 14.541 ( -9.110 -9.110 -2.054) 13.047 15.595 ( -20.748 -20.748 43.448) 52.428 15.873 ( -9.420 -9.420 -8.130) 15.607 16.070 ( 1.160 1.160 -5.052) 5.312 16.525 ( 7.977 7.977 25.739) 28.103 17.599 ( -13.009 -13.009 -21.005) 27.923 17.779 ( 12.624 12.624 19.412) 26.373 19.058 ( 11.832 11.832 9.130) 19.062 19.857 ( -20.173 -20.173 0.810) 28.541 20.682 ( 2.999 2.999 0.104) 4.242 20.855 ( 9.437 9.437 3.299) 13.748 21.342 ( 7.985 7.985 -12.118) 16.564 21.485 ( 10.279 10.279 -9.803) 17.533 23.699 ( -1.955 -1.955 0.156) 2.769 24.174 ( -3.181 -3.181 3.420) 5.651 25.117 ( 10.768 10.768 -2.200) 15.386 25.196 ( 12.313 12.313 4.512) 17.988 26.731 ( 10.159 10.159 -10.195) 17.617 31.956 ( -9.297 -9.297 -34.602) 37.016======================= Grid point 739 (134/210) =======================q-point: ( 0.18 0.09 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.773 ( -4.680 11.464 51.580) 53.045 8.244 ( 21.028 -7.909 58.158) 62.346 10.157 ( 1.153 -0.154 49.961) 49.974 13.248 ( -42.763 -15.005 -3.492) 45.453 13.845 ( 15.438 20.789 61.807) 67.012 14.381 ( -16.585 -18.918 2.383) 25.271 15.375 ( 3.211 -21.268 41.331) 46.592 15.519 ( -26.825 -8.683 -14.855) 31.869 16.085 ( 1.680 5.286 4.026) 6.854 16.648 ( 4.132 13.905 30.714) 33.967 17.245 ( -20.376 0.080 -14.950) 25.272 18.065 ( 12.535 -14.540 15.117) 24.435 19.196 ( 0.199 9.280 22.703) 24.528 19.635 ( -0.605 -12.030 -6.250) 13.570 20.798 ( 8.950 -4.784 -0.106) 10.149 21.021 ( 7.656 12.491 -1.315) 14.710 21.496 ( 8.137 9.814 -10.333) 16.410 21.705 ( 10.126 6.397 -14.567) 18.859 23.651 ( -2.630 -0.424 -0.557) 2.722 24.087 ( -5.460 -2.846 2.071) 6.497 25.320 ( 10.933 16.024 -1.534) 19.459 25.556 ( 19.831 6.062 7.258) 21.970 27.063 ( 24.323 9.089 -14.199) 29.594 31.689 ( -17.580 -7.823 -31.316) 36.755======================= Grid point 740 (135/210) =======================q-point: ( 0.27 0.09 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 7.801 ( 8.716 10.261 37.341) 39.694 8.724 ( 26.905 -7.890 53.284) 60.210 10.207 ( 3.772 -0.247 43.390) 43.554 12.170 ( -59.343 -9.399 -12.191) 61.307 13.808 ( -26.952 -12.594 5.073) 30.179 14.427 ( 23.886 13.331 70.558) 75.675 14.881 ( -33.590 -3.584 -10.523) 35.382 15.632 ( 18.361 -24.658 26.642) 40.681 16.139 ( 3.329 0.269 10.009) 10.552 16.612 ( -10.211 15.959 27.081) 33.050 16.954 ( -4.878 9.338 0.284) 10.539 18.164 ( -3.339 -33.465 13.978) 36.421 19.206 ( 3.591 13.217 18.249) 22.817 19.680 ( 1.846 -2.430 0.065) 3.053 21.009 ( 11.221 -8.874 0.264) 14.308 21.171 ( 7.822 12.480 -7.756) 16.646 21.649 ( 6.976 5.698 -8.601) 12.454 21.874 ( 7.156 5.862 -15.544) 18.088 23.609 ( -1.424 0.330 -1.563) 2.140 23.966 ( -6.640 -2.367 0.643) 7.079 25.548 ( 11.835 16.143 -1.590) 20.079 25.878 ( 12.005 8.259 7.151) 16.232 27.688 ( 37.919 6.051 -16.346) 41.733 31.272 ( -24.522 -5.795 -27.104) 37.007======================= Grid point 741 (136/210) =======================q-point: ( 0.36 0.09 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.143 ( 26.185 7.654 21.330) 34.630 9.268 ( 26.926 -7.723 46.835) 54.573 10.279 ( 2.242 -0.856 38.571) 38.646 10.999 ( -58.002 -3.856 -8.409) 58.735 13.312 ( -19.856 -12.373 7.545) 24.582 14.063 ( -37.200 -6.837 -6.457) 38.370 15.044 ( 26.643 17.041 63.209) 70.680 15.983 ( 15.555 -20.198 14.041) 29.104 16.147 ( -6.373 2.990 30.297) 31.104 16.396 ( -5.829 2.735 6.576) 9.203 17.000 ( 7.610 12.168 19.357) 24.097 17.968 ( -15.010 -32.051 17.930) 39.674 19.326 ( 7.366 13.161 10.374) 18.305 19.674 ( -2.412 -0.075 4.230) 4.870 21.200 ( 7.875 -4.273 0.435) 8.971 21.316 ( 5.824 9.092 -10.456) 15.030 21.778 ( 6.615 0.158 -9.258) 11.380 21.981 ( 3.323 3.068 -13.205) 13.958 23.601 ( 0.730 0.368 -2.361) 2.499 23.834 ( -6.465 -1.688 -0.741) 6.723 25.772 ( 10.563 15.987 -1.428) 19.214 26.032 ( 3.976 11.358 4.312) 12.783 28.495 ( 42.450 3.048 -16.764) 45.742 30.729 ( -30.491 -3.590 -23.045) 38.389======================= Grid point 742 (137/210) =======================q-point: ( 0.45 0.09 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.815 ( 40.936 3.636 7.513) 41.779 9.577 ( -16.127 -4.777 17.720) 24.432 10.087 ( -14.315 -0.889 22.011) 26.271 10.230 ( -8.422 -2.402 37.986) 38.982 13.125 ( 2.590 -10.036 4.226) 11.193 13.419 ( -25.828 -7.572 -2.150) 27.000 15.523 ( 21.487 16.209 54.493) 60.778 15.894 ( -16.444 14.508 43.706) 48.899 16.223 ( 9.061 -12.833 5.908) 16.784 16.346 ( -3.319 -12.005 3.974) 13.073 17.248 ( 17.001 -1.739 24.263) 29.678 17.619 ( -19.376 -19.371 22.115) 35.209 19.470 ( 7.025 7.657 6.534) 12.275 19.595 ( -5.381 2.797 5.454) 8.157 21.323 ( 4.535 1.896 -3.242) 5.888 21.372 ( -0.150 5.965 -7.419) 9.521 21.909 ( 6.115 -2.663 -10.119) 12.119 21.994 ( -2.017 -0.871 -11.143) 11.358 23.638 ( 3.034 -0.094 -2.496) 3.930 23.719 ( -5.092 -0.864 -1.883) 5.497 25.950 ( 7.232 15.288 -0.483) 16.919 26.046 ( -2.272 13.755 1.470) 14.019 29.319 ( 40.488 0.693 -17.729) 44.205 30.074 ( -35.913 -1.431 -19.825) 41.047======================= Grid point 750 (138/210) =======================q-point: ( 0.18 0.18 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.052 ( 4.132 4.132 53.502) 53.820 8.136 ( 11.018 11.018 44.550) 47.196 10.164 ( 1.198 1.198 44.607) 44.640 12.712 ( -39.185 -39.185 -9.729) 56.264 14.084 ( -13.612 -13.612 -7.167) 20.541 14.322 ( 24.236 24.236 74.338) 81.859 14.982 ( -10.937 -10.937 40.373) 43.235 15.193 ( -23.686 -23.686 -17.090) 37.604 16.198 ( 4.704 4.704 1.444) 6.808 16.890 ( 9.280 9.280 35.614) 37.955 17.186 ( -6.228 -6.228 -13.579) 16.185 17.761 ( -16.001 -16.001 15.814) 27.607 19.195 ( -0.109 -0.109 24.148) 24.149 19.695 ( 9.403 9.403 3.486) 13.748 20.745 ( 0.542 0.542 1.173) 1.401 21.240 ( 9.535 9.535 -2.666) 13.746 21.665 ( 6.886 6.886 -15.567) 18.362 21.858 ( 7.713 7.713 -13.244) 17.158 23.634 ( -1.157 -1.157 -1.599) 2.288 24.009 ( -4.896 -4.896 0.907) 6.984 25.720 ( 13.858 13.858 9.371) 21.724 25.728 ( 19.415 19.415 -4.315) 27.794 27.348 ( 20.295 20.295 -15.571) 32.653 31.462 ( -15.030 -15.030 -28.658) 35.680======================= Grid point 751 (139/210) =======================q-point: ( 0.27 0.18 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.064 ( 5.655 14.345 38.724) 41.681 8.591 ( 26.998 -2.266 41.885) 49.884 10.214 ( 3.772 1.492 37.684) 37.901 11.812 ( -49.671 -27.234 -7.768) 57.177 13.636 ( -28.894 -4.232 -0.102) 29.202 14.555 ( -28.128 -11.685 2.059) 30.528 14.829 ( 14.920 -3.990 40.679) 43.512 15.109 ( 19.464 -12.483 39.983) 46.187 16.252 ( 0.611 8.960 4.095) 9.871 16.897 ( -10.520 10.167 12.626) 19.325 17.122 ( 2.785 8.250 17.661) 19.691 17.485 ( -10.573 -33.568 14.677) 38.131 19.309 ( 9.325 3.570 23.919) 25.919 19.805 ( 1.426 9.796 10.796) 14.647 20.835 ( 8.294 -7.588 0.774) 11.268 21.406 ( 7.277 10.508 -7.106) 14.624 21.768 ( 3.757 5.617 -14.511) 16.007 21.975 ( 3.845 3.567 -11.756) 12.873 23.613 ( -0.749 0.155 -2.879) 2.979 23.902 ( -5.779 -3.953 -0.498) 7.020 25.950 ( 12.161 21.542 3.147) 24.937 26.130 ( 16.632 18.039 -1.001) 24.557 27.872 ( 32.481 12.948 -16.280) 38.571 31.102 ( -21.449 -11.455 -25.185) 35.008======================= Grid point 752 (140/210) =======================q-point: ( 0.36 0.18 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.324 ( 20.980 8.975 24.518) 33.494 9.139 ( 27.106 -2.617 35.358) 44.630 10.278 ( 0.807 1.349 32.885) 32.922 10.830 ( -47.770 -13.709 -4.720) 49.921 13.110 ( -21.060 -6.603 5.299) 22.698 13.860 ( -36.240 -13.642 -7.417) 39.427 15.220 ( 20.313 -21.566 31.253) 43.063 15.529 ( 19.847 -2.362 44.016) 48.342 16.220 ( -3.567 6.264 7.835) 10.647 16.641 ( -13.571 13.834 11.684) 22.629 17.185 ( 2.781 4.526 26.467) 26.995 17.350 ( -3.898 -23.283 18.944) 30.268 19.486 ( 7.735 5.824 20.732) 22.882 19.779 ( -3.268 8.432 13.622) 16.350 21.045 ( 12.253 -9.944 0.896) 15.806 21.507 ( 2.148 8.150 -8.919) 12.271 21.828 ( 2.930 3.844 -12.890) 13.767 22.008 ( -0.350 -0.223 -10.125) 10.134 23.611 ( 0.582 0.652 -3.787) 3.887 23.790 ( -5.331 -2.623 -1.932) 6.247 26.181 ( 10.759 23.313 0.324) 25.678 26.363 ( 7.255 22.258 -2.039) 23.499 28.583 ( 38.283 5.997 -16.373) 42.067 30.620 ( -27.323 -7.460 -21.757) 35.715======================= Grid point 753 (141/210) =======================q-point: ( 0.45 0.18 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.873 ( 33.497 0.729 12.698) 35.831 9.457 ( -9.888 -6.578 16.713) 20.503 10.064 ( -8.628 -0.555 22.309) 23.926 10.241 ( -12.047 4.966 22.626) 26.110 12.917 ( 3.184 -10.049 3.925) 11.248 13.224 ( -26.162 -11.685 -1.800) 28.709 15.586 ( 15.923 -28.484 22.258) 39.501 15.772 ( 0.829 -18.986 29.858) 35.393 16.187 ( 4.244 14.291 17.775) 23.199 16.382 ( -12.555 17.868 19.945) 29.575 17.239 ( 2.861 -1.327 25.827) 26.018 17.293 ( -2.579 -7.251 24.795) 25.962 19.609 ( 5.109 6.760 17.353) 19.311 19.700 ( -4.364 7.257 15.152) 17.358 21.287 ( 11.471 -5.964 -0.942) 12.963 21.467 ( -6.121 1.527 -5.363) 8.280 21.898 ( 4.006 1.592 -12.065) 12.812 21.971 ( -3.105 -0.674 -10.746) 11.206 23.638 ( 2.194 0.155 -3.873) 4.454 23.698 ( -3.906 -1.102 -3.158) 5.143 26.356 ( 6.582 24.383 -1.655) 25.310 26.427 ( -0.445 24.198 -2.444) 24.325 29.335 ( 37.170 0.881 -17.150) 40.945 30.027 ( -32.787 -3.382 -18.976) 38.033======================= Grid point 762 (142/210) =======================q-point: ( 0.27 0.27 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.257 ( 6.230 6.230 39.979) 40.938 8.777 ( 20.440 20.440 25.553) 38.581 10.279 ( 5.016 5.016 29.961) 30.789 11.160 ( -36.586 -36.586 -1.867) 51.774 13.489 ( -16.376 -16.376 -8.691) 24.736 14.145 ( -27.772 -27.772 -13.921) 41.669 14.477 ( -9.200 -9.200 32.708) 35.201 15.337 ( 14.593 14.593 55.978) 59.661 16.428 ( 6.659 6.659 0.969) 9.466 16.924 ( -16.778 -16.778 24.943) 34.426 16.971 ( -2.134 -2.134 -4.243) 5.207 17.312 ( 8.372 8.372 38.238) 40.028 19.451 ( 9.955 9.955 28.914) 32.159 19.935 ( 2.711 2.711 17.896) 18.302 20.751 ( -0.011 -0.011 -0.841) 0.841 21.569 ( 5.486 5.486 -7.973) 11.125 21.853 ( 2.926 2.926 -15.474) 16.017 22.005 ( -0.214 -0.214 -8.250) 8.255 23.617 ( 0.285 0.285 -4.420) 4.438 23.818 ( -4.348 -4.348 -1.987) 6.462 26.321 ( 16.959 16.959 3.856) 24.291 26.551 ( 20.999 20.999 -6.484) 30.397 28.215 ( 22.159 22.159 -16.044) 35.206 30.821 ( -17.005 -17.005 -22.602) 33.003======================= Grid point 763 (143/210) =======================q-point: ( 0.36 0.27 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.441 ( 14.096 3.297 29.209) 32.600 9.235 ( 21.604 11.055 17.784) 30.087 10.333 ( -10.225 1.363 21.827) 24.141 10.514 ( -16.661 -12.976 4.174) 21.527 13.028 ( -24.205 -4.228 -1.863) 24.642 13.533 ( -32.046 -19.279 -8.015) 38.247 14.564 ( 12.976 -32.403 21.043) 40.757 15.439 ( -5.371 -16.412 30.227) 34.812 16.465 ( 1.696 16.652 11.411) 20.258 16.816 ( -2.372 5.341 14.584) 15.711 16.984 ( 7.594 -5.025 19.048) 21.113 17.421 ( 2.114 10.633 43.421) 44.754 19.642 ( 8.344 10.086 28.185) 31.076 19.925 ( -2.895 6.066 21.049) 22.096 20.852 ( 9.993 -8.641 -0.616) 13.225 21.586 ( -4.625 -1.089 -5.333) 7.143 21.895 ( 1.940 2.466 -14.490) 14.826 21.992 ( -0.610 -0.599 -8.556) 8.598 23.627 ( 0.705 0.901 -5.441) 5.560 23.738 ( -3.567 -2.467 -3.533) 5.594 26.631 ( 14.142 22.029 -0.385) 26.181 26.864 ( 10.066 25.942 -6.676) 28.616 28.738 ( 30.000 9.990 -15.814) 35.353 30.432 ( -22.519 -11.783 -19.962) 32.318======================= Grid point 764 (144/210) =======================q-point: ( 0.45 0.27 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.824 ( 24.136 -4.674 18.384) 30.699 9.307 ( -19.076 -9.468 11.289) 24.103 10.165 ( 10.246 12.167 15.453) 22.177 10.416 ( -8.382 12.202 12.628) 19.458 12.738 ( -1.897 -8.554 1.840) 8.953 12.967 ( -22.893 -14.340 -1.821) 27.074 14.873 ( 17.028 -37.411 15.282) 43.853 15.204 ( -15.866 -34.188 16.150) 41.004 16.566 ( 7.155 17.331 13.140) 22.895 16.710 ( -6.944 12.621 7.916) 16.437 17.209 ( 11.782 4.857 39.299) 41.313 17.387 ( -5.590 10.065 44.189) 45.664 19.768 ( 4.833 9.580 24.796) 27.018 19.852 ( -4.036 8.168 22.357) 24.142 21.111 ( 15.076 -10.904 0.620) 18.616 21.400 ( -13.140 -7.869 -0.851) 15.340 21.939 ( 2.304 1.598 -13.254) 13.547 21.976 ( -1.326 0.723 -11.312) 11.412 23.646 ( 1.300 0.620 -5.553) 5.737 23.681 ( -2.297 -0.605 -4.827) 5.380 26.859 ( 8.604 25.762 -3.732) 27.416 26.953 ( -0.536 27.502 -5.821) 28.116 29.351 ( 31.176 0.762 -16.309) 35.192 29.936 ( -27.692 -6.017 -17.754) 33.440======================= Grid point 774 (145/210) =======================q-point: ( 0.36 0.36 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.528 ( 7.122 7.122 24.562) 26.547 9.370 ( -4.058 -4.058 7.261) 9.255 10.246 ( 3.614 3.614 8.393) 9.826 10.571 ( 9.616 9.616 14.186) 19.652 12.828 ( -16.381 -16.381 -4.853) 23.669 13.110 ( -23.708 -23.708 -6.963) 34.244 14.150 ( -6.866 -6.866 23.409) 25.343 15.000 ( -24.302 -24.302 17.377) 38.511 16.688 ( 6.024 6.024 -2.534) 8.889 16.912 ( -0.934 -0.934 -6.761) 6.889 17.090 ( 17.500 17.500 60.294) 65.175 17.591 ( 5.376 5.376 50.479) 51.048 19.842 ( 8.752 8.752 29.572) 32.058 20.021 ( 3.524 3.524 29.647) 30.063 20.753 ( 0.147 0.147 -3.604) 3.610 21.460 ( -10.952 -10.952 0.340) 15.493 21.924 ( 1.013 1.013 -14.989) 15.057 21.994 ( 0.127 0.127 -10.345) 10.347 23.645 ( 0.876 0.876 -6.571) 6.687 23.698 ( -1.574 -1.574 -5.117) 5.580 27.036 ( 18.480 18.480 -3.627) 26.385 27.289 ( 15.467 15.467 -7.789) 23.219 28.995 ( 16.413 16.413 -15.332) 27.818 30.154 ( -16.396 -16.396 -18.056) 29.389======================= Grid point 775 (146/210) =======================q-point: ( 0.45 0.36 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.746 ( 14.986 -2.095 16.509) 22.395 9.093 ( -18.845 -11.399 9.461) 23.970 10.512 ( 16.652 21.186 5.774) 27.559 10.700 ( -0.029 15.748 6.436) 17.012 12.543 ( -6.946 -12.043 -0.064) 13.903 12.665 ( -17.856 -16.071 -1.367) 24.062 14.233 ( 12.150 -24.902 18.157) 33.127 14.557 ( -19.951 -29.363 15.497) 38.735 16.785 ( 4.385 6.141 -3.217) 8.203 16.863 ( -3.437 3.624 -4.795) 6.924 17.424 ( 13.986 14.162 58.069) 61.385 17.605 ( -4.192 10.094 54.473) 55.559 19.969 ( 4.734 10.041 28.329) 30.426 20.039 ( -1.904 10.978 31.511) 33.423 20.891 ( 12.882 -10.559 -0.505) 16.664 21.189 ( -15.672 -12.886 2.646) 20.461 21.949 ( 1.598 -0.173 -14.233) 14.323 21.981 ( -1.353 -0.449 -12.520) 12.601 23.660 ( 0.722 0.745 -6.844) 6.922 23.675 ( -0.861 -0.017 -6.299) 6.357 27.333 ( 11.065 21.327 -6.182) 24.809 27.444 ( 0.512 20.722 -7.612) 22.081 29.373 ( 21.136 1.912 -15.445) 26.248 29.790 ( -20.326 -8.700 -16.430) 27.546======================= Grid point 786 (147/210) =======================q-point: ( 0.45 0.45 0.32)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.761 ( 3.724 3.724 12.283) 13.364 8.888 ( -8.840 -8.840 9.589) 15.756 10.902 ( 14.900 14.900 -1.275) 21.110 10.968 ( 8.325 8.325 -0.334) 11.778 12.310 ( -7.941 -7.941 2.366) 11.476 12.361 ( -12.457 -12.457 1.254) 17.662 13.960 ( -2.542 -2.542 19.352) 19.683 14.102 ( -15.946 -15.946 17.467) 28.525 16.863 ( 2.451 2.451 -6.181) 7.087 16.890 ( -0.253 -0.253 -6.807) 6.816 17.661 ( 8.416 8.416 58.993) 60.182 17.729 ( 1.689 1.689 57.109) 57.159 20.153 ( 8.194 8.194 33.843) 35.772 20.220 ( 4.003 4.003 41.180) 41.567 20.760 ( 0.140 0.140 -5.435) 5.438 20.921 ( -13.177 -13.177 1.172) 18.672 21.947 ( 0.261 0.261 -14.785) 14.790 21.963 ( -1.128 -1.128 -14.050) 14.140 23.672 ( 0.414 0.414 -7.391) 7.414 23.676 ( 0.002 0.002 -7.187) 7.187 27.659 ( 10.625 10.625 -7.825) 16.941 27.714 ( 5.626 5.626 -8.335) 11.523 29.447 ( 6.015 6.015 -14.990) 17.236 29.605 ( -9.410 -9.410 -15.364) 20.327======================= Grid point 847 (148/210) =======================q-point: ( 0.00 0.00 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.157 ( -0.000 -0.000 63.275) 63.275 9.157 ( 0.000 0.000 63.275) 63.275 11.309 ( 0.000 0.000 58.398) 58.398 14.325 ( 0.000 0.000 68.176) 68.176 14.366 ( 0.000 0.000 -32.415) 32.415 14.366 ( -0.000 -0.000 -32.415) 32.415 15.757 ( 0.000 0.000 -23.804) 23.804 16.064 ( -0.000 -0.000 6.429) 6.429 16.918 ( 0.000 0.000 30.660) 30.660 16.918 ( 0.000 0.000 30.660) 30.660 17.421 ( 0.000 0.000 -25.002) 25.002 17.827 ( 0.000 0.000 33.085) 33.085 18.538 ( 0.000 0.000 -20.845) 20.845 20.491 ( -0.000 -0.000 -5.697) 5.697 20.491 ( -0.000 -0.000 -5.697) 5.697 20.678 ( 0.000 0.000 -0.003) 0.003 21.198 ( 0.000 0.000 9.063) 9.063 21.198 ( 0.000 0.000 9.063) 9.063 23.787 ( 0.000 0.000 3.040) 3.040 24.276 ( 0.000 0.000 -1.347) 1.347 24.805 ( 0.000 0.000 -8.358) 8.358 24.805 ( 0.000 -0.000 -8.358) 8.358 26.704 ( 0.000 0.000 23.226) 23.226 31.353 ( 0.000 0.000 -43.847) 43.847======================= Grid point 848 (149/210) =======================q-point: ( 0.09 0.00 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.004 ( -14.200 0.000 60.307) 61.956 9.251 ( 9.384 0.000 62.225) 62.928 11.268 ( -3.914 0.000 56.469) 56.605 13.957 ( -38.092 0.000 -30.877) 49.034 14.256 ( -1.642 0.000 -4.575) 4.861 14.644 ( 20.617 0.000 40.900) 45.802 15.633 ( -13.407 0.000 -24.284) 27.739 16.073 ( 0.865 0.000 6.113) 6.174 16.677 ( -16.888 0.000 36.329) 40.062 16.953 ( 3.132 0.000 28.286) 28.458 17.289 ( -12.691 0.000 -20.064) 23.741 18.097 ( 20.914 0.000 24.805) 32.445 18.740 ( 18.213 0.000 -18.004) 25.609 20.170 ( -21.445 0.000 -4.531) 21.918 20.544 ( 5.277 0.000 -5.554) 7.661 20.834 ( 7.384 0.000 3.460) 8.154 21.268 ( 6.897 0.000 9.506) 11.745 21.281 ( 6.610 0.000 1.086) 6.699 23.748 ( -3.546 0.000 2.571) 4.380 24.221 ( -4.673 0.000 -2.146) 5.142 24.883 ( 7.507 0.000 -7.378) 10.526 25.075 ( 25.020 0.000 -5.097) 25.534 26.737 ( 3.548 0.000 20.075) 20.386 31.277 ( -7.618 0.000 -42.859) 43.531======================= Grid point 849 (150/210) =======================q-point: ( 0.18 0.00 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.681 ( -16.269 0.000 51.803) 54.298 9.516 ( 17.082 0.000 59.175) 61.591 11.174 ( -4.956 0.000 51.389) 51.627 13.012 ( -54.832 0.000 -27.958) 61.548 14.182 ( -8.091 0.000 -18.784) 20.452 15.115 ( 25.556 0.000 59.878) 65.104 15.220 ( -27.897 0.000 -23.646) 36.570 16.086 ( 0.360 0.000 9.351) 9.358 16.480 ( 0.207 0.000 32.189) 32.190 16.933 ( -14.023 0.000 -10.569) 17.560 17.061 ( -0.406 0.000 25.302) 25.305 18.507 ( 19.428 0.000 14.402) 24.185 19.111 ( 14.628 0.000 -7.850) 16.601 19.771 ( -16.695 0.000 -6.990) 18.099 20.686 ( 8.611 0.000 -5.548) 10.243 20.966 ( 6.901 0.000 4.185) 8.071 21.399 ( 5.079 0.000 -7.058) 8.695 21.452 ( 11.129 0.000 10.159) 15.069 23.666 ( -4.283 0.000 1.545) 4.553 24.108 ( -6.627 0.000 -2.706) 7.158 25.082 ( 12.233 0.000 -4.696) 13.104 25.667 ( 30.962 0.000 5.284) 31.410 26.875 ( 12.209 0.000 7.393) 14.273 31.055 ( -14.806 0.000 -40.189) 42.830======================= Grid point 850 (151/210) =======================q-point: ( 0.27 0.00 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.444 ( -6.096 0.000 38.596) 39.074 9.901 ( 21.117 0.000 53.945) 57.931 11.098 ( -2.347 0.000 44.891) 44.952 11.882 ( -58.044 0.000 -22.845) 62.378 13.907 ( -18.817 0.000 -11.491) 22.049 14.580 ( -35.454 0.000 -20.791) 41.101 15.587 ( 20.736 0.000 55.118) 58.889 16.137 ( 6.345 0.000 15.753) 16.983 16.617 ( -15.031 0.000 -6.370) 16.325 16.684 ( 18.498 0.000 21.260) 28.181 17.091 ( 0.689 0.000 28.767) 28.775 18.853 ( 15.982 0.000 7.288) 17.565 19.081 ( -16.892 0.000 2.461) 17.070 19.667 ( 4.156 0.000 -6.560) 7.766 20.864 ( 8.940 0.000 -6.242) 10.904 21.106 ( 6.481 0.000 -0.714) 6.520 21.503 ( 6.345 0.000 -9.630) 11.533 21.677 ( 10.851 0.000 9.496) 14.419 23.594 ( -2.826 0.000 0.187) 2.832 23.964 ( -7.801 0.000 -3.078) 8.387 25.349 ( 14.489 0.000 -0.367) 14.494 26.122 ( 12.854 0.000 21.992) 25.473 27.311 ( 32.756 0.000 -14.308) 35.745 30.697 ( -21.462 0.000 -36.549) 42.384======================= Grid point 851 (152/210) =======================q-point: ( 0.36 0.00 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.488 ( 11.303 0.000 22.417) 25.105 10.248 ( 3.934 0.000 32.854) 33.089 10.846 ( -36.713 0.000 -0.320) 36.715 11.081 ( 0.049 0.000 39.608) 39.608 13.515 ( -18.714 0.000 -2.543) 18.886 13.895 ( -32.131 0.000 -15.298) 35.587 15.884 ( 9.770 0.000 27.743) 29.413 16.361 ( -11.059 0.000 -0.115) 11.060 16.367 ( 16.096 0.000 30.014) 34.057 17.065 ( -3.621 0.000 29.674) 29.894 17.131 ( 25.231 0.000 16.919) 30.379 18.655 ( -24.197 0.000 3.396) 24.434 19.148 ( 14.153 0.000 4.522) 14.858 19.714 ( -1.118 0.000 2.128) 2.404 21.023 ( 6.954 0.000 -7.302) 10.083 21.189 ( 1.786 0.000 -5.853) 6.120 21.666 ( 9.633 0.000 -7.691) 12.326 21.852 ( 6.357 0.000 6.581) 9.150 23.563 ( -0.192 0.000 -1.392) 1.405 23.810 ( -7.571 0.000 -3.380) 8.291 25.639 ( 14.595 0.000 5.441) 15.577 26.216 ( -1.322 0.000 23.726) 23.763 28.072 ( 41.561 0.000 -22.988) 47.495 30.212 ( -27.798 0.000 -32.712) 42.928======================= Grid point 852 (153/210) =======================q-point: ( 0.45 0.00 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.897 ( 29.833 0.000 6.283) 30.488 9.631 ( -43.069 0.000 -5.825) 43.461 10.857 ( 14.030 0.000 42.538) 44.792 11.051 ( -4.758 0.000 39.168) 39.456 13.262 ( -4.621 0.000 -1.857) 4.980 13.389 ( -17.369 0.000 -8.124) 19.175 16.033 ( 6.695 0.000 11.936) 13.685 16.175 ( -8.029 0.000 5.068) 9.495 16.692 ( 15.309 0.000 34.010) 37.297 16.938 ( -9.422 0.000 31.978) 33.337 17.642 ( 26.262 0.000 12.046) 28.893 18.158 ( -25.919 0.000 6.788) 26.793 19.411 ( 12.331 0.000 4.859) 13.254 19.618 ( -8.194 0.000 5.217) 9.714 21.133 ( 4.181 0.000 -8.035) 9.058 21.189 ( -1.536 0.000 -7.896) 8.044 21.838 ( 6.854 0.000 -3.404) 7.653 21.912 ( -0.383 0.000 1.853) 1.893 23.589 ( 2.928 0.000 -2.734) 4.006 23.676 ( -5.786 0.000 -3.382) 6.702 25.909 ( 12.466 0.000 12.026) 17.322 26.116 ( -8.190 0.000 18.530) 20.260 28.878 ( 39.350 0.000 -26.198) 47.273 29.603 ( -33.954 0.000 -29.212) 44.791======================= Grid point 859 (154/210) =======================q-point: ( 0.09 0.09 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.059 ( -3.674 -3.674 57.889) 58.122 9.140 ( -0.831 -0.831 60.715) 60.727 11.227 ( -3.932 -3.932 54.479) 54.762 13.708 ( -27.188 -27.188 -25.364) 46.062 14.178 ( -8.789 -8.789 -30.052) 32.521 14.791 ( 18.935 18.935 63.533) 68.945 15.518 ( -12.557 -12.557 -24.777) 30.483 16.097 ( 1.981 1.981 4.652) 5.430 16.389 ( -18.885 -18.885 36.048) 44.864 17.108 ( 5.327 5.327 17.355) 18.919 17.229 ( -3.911 -3.911 -5.652) 7.908 18.182 ( 7.699 7.699 20.578) 23.281 18.945 ( 18.314 18.314 -16.040) 30.465 19.897 ( -18.241 -18.241 0.134) 25.796 20.661 ( 6.069 6.069 -3.453) 9.252 20.931 ( 6.996 6.996 0.782) 9.925 21.253 ( 3.127 3.127 4.110) 6.037 21.399 ( 7.447 7.447 2.603) 10.848 23.723 ( -2.517 -2.517 2.268) 4.220 24.178 ( -4.017 -4.017 -2.376) 6.158 25.008 ( 10.272 10.272 -8.575) 16.869 25.254 ( 18.951 18.951 -0.708) 26.810 26.775 ( 4.171 4.171 16.844) 17.847 31.206 ( -7.202 -7.202 -41.912) 43.132======================= Grid point 860 (155/210) =======================q-point: ( 0.18 0.09 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.774 ( -15.950 9.300 50.530) 53.798 9.372 ( 16.898 -13.378 56.756) 60.711 11.132 ( -5.116 -4.087 49.199) 49.633 12.903 ( -50.420 -12.991 -25.159) 57.827 14.013 ( -9.952 -14.427 -23.365) 29.208 15.125 ( -26.002 -10.144 -22.877) 36.088 15.275 ( 26.246 15.979 62.502) 69.647 16.062 ( -7.313 -12.519 23.986) 28.028 16.190 ( 3.106 -9.702 12.993) 16.511 16.963 ( -13.237 0.482 -13.598) 18.983 17.303 ( 6.078 17.212 31.338) 36.266 18.326 ( 4.886 -15.883 10.691) 19.760 19.335 ( 17.700 18.426 -8.192) 26.831 19.620 ( -7.768 -8.561 4.106) 12.267 20.784 ( 7.326 3.631 -2.573) 8.572 21.032 ( 3.911 7.733 0.770) 8.700 21.369 ( 6.590 0.472 -3.274) 7.373 21.562 ( 9.358 7.603 2.800) 12.378 23.658 ( -3.737 -1.047 1.306) 4.095 24.074 ( -6.338 -3.375 -2.754) 7.690 25.238 ( 12.910 14.899 -6.419) 20.733 25.754 ( 27.673 8.857 8.712) 30.333 26.931 ( 13.178 5.866 4.577) 15.133 30.996 ( -14.067 -6.048 -39.342) 42.216======================= Grid point 861 (156/210) =======================q-point: ( 0.27 0.09 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.537 ( -6.414 9.320 37.805) 39.462 9.754 ( 21.027 -13.685 51.417) 57.211 11.048 ( -3.228 -4.710 41.719) 42.108 11.844 ( -54.624 -5.238 -19.568) 58.259 13.728 ( -18.490 -14.823 -12.427) 26.758 14.513 ( -34.281 -7.826 -20.864) 40.887 15.755 ( 20.394 15.265 54.912) 60.533 16.035 ( 4.313 -17.326 17.306) 24.866 16.337 ( 11.033 -12.721 14.022) 21.912 16.703 ( -11.850 5.640 -6.082) 14.464 17.413 ( 5.325 20.364 30.711) 37.232 18.336 ( -3.802 -33.057 4.838) 33.625 19.461 ( 0.038 18.861 6.642) 19.997 19.698 ( 9.118 6.181 0.496) 11.027 20.957 ( 9.724 3.210 -5.807) 11.773 21.112 ( 4.315 3.974 0.058) 5.866 21.483 ( 5.627 0.057 -7.631) 9.481 21.754 ( 9.154 5.929 4.091) 11.648 23.591 ( -2.741 -0.405 -0.094) 2.773 23.935 ( -7.505 -2.848 -3.131) 8.616 25.509 ( 14.333 15.743 -1.951) 21.379 26.177 ( 12.936 5.464 21.720) 25.864 27.372 ( 32.043 6.217 -14.403) 35.677 30.654 ( -20.534 -4.386 -35.808) 41.511======================= Grid point 862 (157/210) =======================q-point: ( 0.36 0.09 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.569 ( 10.279 7.926 22.163) 25.684 10.115 ( 8.227 -12.547 34.207) 37.352 10.804 ( -33.485 -3.801 0.281) 33.701 11.061 ( -5.896 -2.922 34.844) 35.460 13.353 ( -17.321 -13.520 -3.549) 22.258 13.842 ( -32.010 -6.190 -14.664) 35.749 16.030 ( 7.605 12.955 19.651) 24.735 16.213 ( 12.477 -19.529 22.366) 32.207 16.449 ( -4.414 3.662 3.994) 6.989 16.632 ( 7.582 -13.752 21.801) 26.868 17.531 ( 7.304 18.981 29.171) 35.561 18.194 ( -10.041 -29.752 7.851) 32.367 19.500 ( 4.027 20.664 6.293) 21.973 19.791 ( 0.327 7.976 6.678) 10.407 21.126 ( 6.544 7.641 -8.588) 13.227 21.191 ( 3.299 0.789 -3.061) 4.569 21.622 ( 8.645 -2.573 -5.711) 10.676 21.891 ( 4.206 2.831 3.126) 5.956 23.559 ( -0.326 -0.386 -1.654) 1.730 23.788 ( -7.197 -2.186 -3.459) 8.278 25.790 ( 13.814 14.873 3.708) 20.634 26.289 ( 0.074 7.321 21.953) 23.142 28.111 ( 40.337 3.910 -22.232) 46.223 30.188 ( -26.802 -2.473 -32.035) 41.841======================= Grid point 863 (158/210) =======================q-point: ( 0.45 0.09 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.950 ( 28.070 5.103 6.608) 29.285 9.638 ( -39.644 0.300 -4.298) 39.878 10.755 ( 14.186 -9.403 39.359) 42.881 10.978 ( -6.923 -7.148 37.466) 38.765 13.143 ( -1.784 -10.337 -2.501) 10.784 13.320 ( -19.218 -6.923 -7.591) 21.792 16.145 ( 5.373 8.977 5.927) 12.024 16.256 ( -5.646 4.297 1.798) 7.319 16.548 ( 11.523 -15.693 25.286) 31.913 16.702 ( -2.541 -18.820 25.409) 31.722 17.719 ( 11.567 7.635 24.843) 28.448 17.964 ( -12.672 -11.977 16.213) 23.809 19.609 ( 6.600 15.349 6.983) 18.108 19.734 ( -5.360 10.270 8.191) 14.187 21.212 ( 2.440 7.056 -8.170) 11.068 21.230 ( 0.518 3.472 -6.862) 7.707 21.797 ( 8.092 -3.253 -2.034) 8.955 21.908 ( -2.581 -0.713 0.960) 2.845 23.582 ( 2.645 -0.751 -2.916) 4.008 23.662 ( -5.399 -1.416 -3.496) 6.586 26.040 ( 11.209 12.888 10.048) 19.817 26.219 ( -6.699 10.200 16.474) 20.502 28.895 ( 38.275 1.597 -25.465) 46.000 29.599 ( -32.938 -0.476 -28.535) 43.582======================= Grid point 871 (159/210) =======================q-point: ( 0.18 0.18 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.001 ( 2.128 2.128 43.595) 43.698 9.097 ( -1.251 -1.251 53.053) 53.082 11.032 ( -5.401 -5.401 43.544) 44.209 12.423 ( -35.370 -35.370 -19.186) 53.573 13.741 ( -12.718 -12.718 -25.223) 30.978 14.796 ( -22.789 -22.789 -23.459) 39.862 15.647 ( -13.924 -13.924 38.528) 43.268 15.700 ( 19.904 19.904 55.245) 62.003 16.220 ( 4.171 4.171 1.633) 6.120 16.923 ( -4.651 -4.651 -12.358) 14.000 17.608 ( 12.807 12.807 33.227) 37.843 17.961 ( -18.295 -18.295 5.592) 26.470 19.580 ( 4.271 4.271 15.181) 16.338 19.713 ( 17.584 17.584 -4.015) 25.190 20.808 ( 1.217 1.217 4.016) 4.369 21.183 ( 5.812 5.812 -5.014) 9.628 21.434 ( 5.031 5.031 -6.709) 9.779 21.722 ( 8.364 8.364 1.199) 11.890 23.623 ( -2.377 -2.377 0.445) 3.390 23.983 ( -5.692 -5.692 -2.980) 8.584 25.593 ( 18.661 18.661 -9.189) 27.945 26.012 ( 16.681 16.681 17.329) 29.272 27.127 ( 14.988 14.988 -4.121) 21.594 30.818 ( -12.000 -12.000 -37.014) 40.719======================= Grid point 872 (160/210) =======================q-point: ( 0.27 0.18 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.796 ( -7.849 16.261 36.153) 40.411 9.434 ( 21.032 -16.710 43.603) 51.214 10.939 ( -3.921 -5.503 35.334) 35.975 11.605 ( -44.606 -20.046 -12.591) 50.498 13.449 ( -17.770 -12.185 -16.891) 27.378 14.260 ( -30.501 -17.536 -19.904) 40.423 15.468 ( -0.411 -29.799 23.709) 38.082 16.115 ( 16.415 14.397 47.007) 51.830 16.297 ( 2.809 3.306 4.436) 6.205 16.796 ( -7.332 2.947 -8.631) 11.702 17.667 ( -5.410 -14.404 14.528) 21.161 17.845 ( 7.251 6.796 31.050) 32.601 19.708 ( 6.929 9.976 15.089) 19.370 19.970 ( 7.582 16.766 4.933) 19.050 20.892 ( 7.928 -6.129 4.034) 10.803 21.276 ( 4.164 8.823 -6.831) 11.910 21.526 ( 4.138 3.470 -9.306) 10.759 21.872 ( 6.156 5.705 2.017) 8.632 23.575 ( -2.139 -1.156 -0.930) 2.603 23.858 ( -6.666 -4.766 -3.350) 8.853 25.924 ( 15.027 24.573 -5.948) 29.411 26.329 ( 13.028 9.673 20.947) 26.496 27.560 ( 29.106 13.104 -14.713) 35.148 30.523 ( -17.914 -8.985 -33.734) 39.238======================= Grid point 873 (161/210) =======================q-point: ( 0.36 0.18 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.780 ( 6.851 12.525 22.279) 26.460 9.816 ( 13.349 -15.907 31.077) 37.377 10.712 ( -29.521 -5.852 -1.012) 30.113 10.940 ( -8.407 -8.812 30.013) 32.390 13.091 ( -15.991 -11.489 -6.446) 20.719 13.647 ( -30.128 -13.220 -13.625) 35.610 15.587 ( 10.752 -36.643 13.185) 40.400 16.274 ( -5.913 -10.728 6.509) 13.871 16.330 ( 6.907 5.645 20.712) 22.552 16.667 ( -5.745 6.365 -2.375) 8.897 17.698 ( 7.604 -4.712 28.051) 29.443 17.961 ( 3.726 14.176 35.739) 38.628 19.820 ( 4.424 12.897 11.573) 17.884 20.023 ( -1.056 14.097 11.416) 18.170 21.092 ( 10.774 -7.012 2.295) 13.057 21.346 ( 2.519 9.383 -7.403) 12.215 21.613 ( 5.395 1.483 -8.104) 9.848 21.941 ( 0.487 2.087 2.618) 3.383 23.548 ( -0.389 -0.623 -2.389) 2.500 23.730 ( -6.112 -3.490 -3.710) 7.956 26.191 ( 12.028 24.551 -0.362) 27.341 26.493 ( 3.925 12.880 16.871) 21.585 28.224 ( 36.416 7.527 -20.131) 42.285 30.111 ( -23.937 -5.439 -30.105) 38.844======================= Grid point 874 (162/210) =======================q-point: ( 0.45 0.18 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.073 ( 22.525 6.329 8.517) 24.900 9.615 ( -29.040 -3.489 1.048) 29.268 10.554 ( 12.174 -8.951 29.174) 32.855 10.804 ( -9.803 -8.890 30.466) 33.216 12.921 ( 0.736 -11.119 -3.157) 11.582 13.136 ( -20.033 -11.169 -6.889) 23.948 15.835 ( 13.439 -36.611 7.245) 39.667 16.089 ( -11.789 -28.824 5.888) 31.694 16.445 ( 5.444 7.317 6.329) 11.101 16.555 ( -5.711 6.775 1.404) 8.971 17.875 ( 8.243 8.397 37.489) 39.292 17.980 ( -2.081 13.873 38.133) 40.632 19.895 ( 3.636 13.096 11.030) 17.504 19.969 ( -3.704 12.669 12.253) 18.010 21.269 ( 6.724 -0.812 -2.254) 7.138 21.354 ( -1.932 5.775 -6.090) 8.612 21.749 ( 7.947 -0.901 -2.772) 8.465 21.890 ( -5.430 -0.759 1.496) 5.683 23.564 ( 1.969 -0.946 -3.424) 4.061 23.626 ( -4.315 -2.049 -3.819) 6.116 26.391 ( 8.076 21.844 5.174) 23.857 26.501 ( -2.813 17.734 10.915) 21.013 28.937 ( 34.988 2.560 -23.362) 42.148 29.580 ( -29.944 -1.613 -26.585) 40.075======================= Grid point 883 (163/210) =======================q-point: ( 0.27 0.27 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.050 ( -1.058 -1.058 40.609) 40.636 9.265 ( 10.496 10.496 24.146) 28.343 10.854 ( -3.018 -3.018 28.032) 28.355 11.086 ( -30.385 -30.385 -5.782) 43.358 13.212 ( -13.749 -13.749 -18.032) 26.518 13.841 ( -24.345 -24.345 -17.131) 38.455 15.007 ( -14.604 -14.604 22.471) 30.521 16.130 ( -11.822 -11.822 23.041) 28.467 16.413 ( 5.359 5.359 -1.099) 7.658 16.807 ( -1.626 -1.626 -8.861) 9.154 17.522 ( 8.094 8.094 38.273) 39.948 18.101 ( 11.668 11.668 35.823) 39.441 19.907 ( 9.384 9.384 14.985) 20.016 20.245 ( 9.724 9.724 13.681) 19.398 20.802 ( -1.013 -1.013 5.778) 5.952 21.422 ( 5.882 5.882 -7.343) 11.095 21.589 ( 2.691 2.691 -10.926) 11.570 21.960 ( 2.623 2.623 3.792) 5.305 23.551 ( -1.092 -1.092 -2.183) 2.674 23.757 ( -5.289 -5.289 -3.716) 8.352 26.390 ( 20.530 20.530 -9.626) 30.588 26.546 ( 12.098 12.098 19.046) 25.603 27.902 ( 21.865 21.865 -15.515) 34.596 30.297 ( -14.002 -14.002 -30.708) 36.539======================= Grid point 884 (164/210) =======================q-point: ( 0.36 0.27 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.992 ( 1.284 6.412 26.300) 27.100 9.576 ( 11.437 -6.386 16.888) 21.372 10.526 ( -21.050 -12.384 3.103) 24.619 10.814 ( -2.383 -2.059 21.108) 21.342 12.901 ( -15.566 -8.915 -9.762) 20.423 13.336 ( -25.595 -17.946 -11.672) 33.367 14.914 ( 3.931 -29.141 15.017) 33.017 15.784 ( -19.933 -29.876 8.018) 36.800 16.507 ( 4.584 6.893 -1.448) 8.404 16.754 ( -3.395 2.386 -6.869) 8.025 17.831 ( 18.445 16.148 48.779) 54.593 18.270 ( 5.192 14.392 37.994) 40.959 20.052 ( 5.356 10.476 12.127) 16.896 20.308 ( -2.442 15.225 17.979) 23.685 20.919 ( 12.073 -9.739 6.801) 16.936 21.487 ( -0.106 4.616 -4.785) 6.649 21.646 ( 3.923 1.198 -10.203) 10.996 21.962 ( -2.418 -0.345 4.948) 5.518 23.538 ( -0.098 -0.316 -3.379) 3.395 23.660 ( -4.389 -3.432 -4.058) 6.892 26.692 ( 10.977 24.294 -2.185) 26.748 26.777 ( 9.687 15.630 7.351) 19.803 28.410 ( 28.797 11.571 -17.369) 35.564 29.968 ( -19.493 -9.213 -27.196) 34.706======================= Grid point 885 (165/210) =======================q-point: ( 0.45 0.27 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.143 ( 13.781 -0.424 13.932) 19.601 9.483 ( -17.552 -9.447 6.649) 21.013 10.465 ( 11.590 1.005 15.652) 19.502 10.708 ( -9.539 0.514 16.478) 19.047 12.717 ( -0.751 -9.867 -3.426) 10.472 12.894 ( -17.520 -13.277 -5.429) 22.643 15.097 ( 13.324 -35.637 8.230) 38.926 15.408 ( -17.776 -35.732 5.640) 40.306 16.596 ( 4.417 6.355 -2.841) 8.244 16.680 ( -4.073 4.883 -4.788) 7.960 18.146 ( 12.264 17.081 46.847) 51.350 18.295 ( -2.908 16.194 42.047) 45.152 20.137 ( 3.988 11.700 12.843) 17.825 20.224 ( -4.821 13.660 15.732) 21.386 21.188 ( 13.401 -6.683 5.196) 15.851 21.405 ( -8.020 -0.544 -0.500) 8.054 21.750 ( 6.252 -0.102 -4.766) 7.862 21.875 ( -5.912 -1.239 1.856) 6.319 23.549 ( 1.244 -0.421 -4.044) 4.253 23.589 ( -2.784 -1.572 -4.204) 5.282 26.852 ( 5.210 23.269 1.115) 23.871 26.889 ( 1.667 21.125 1.948) 21.280 28.991 ( 29.115 2.892 -20.224) 35.568 29.529 ( -25.019 -3.707 -23.603) 34.595======================= Grid point 895 (166/210) =======================q-point: ( 0.36 0.36 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.020 ( -0.424 -0.424 25.250) 25.257 9.496 ( -6.961 -6.961 5.608) 11.330 10.395 ( 3.097 3.097 6.717) 8.019 10.823 ( 1.472 1.472 11.010) 11.205 12.696 ( -11.748 -11.748 -7.783) 18.347 12.961 ( -19.415 -19.415 -8.026) 28.606 14.519 ( -9.859 -9.859 14.958) 20.448 15.215 ( -26.448 -26.448 5.677) 37.832 16.616 ( 4.551 4.551 -3.779) 7.463 16.771 ( -0.408 -0.408 -6.926) 6.950 18.190 ( 17.664 17.664 50.552) 56.388 18.493 ( 7.863 7.863 38.628) 40.196 20.223 ( 7.298 7.298 11.419) 15.393 20.613 ( 9.991 9.991 26.824) 30.318 20.755 ( -1.122 -1.122 4.242) 4.529 21.516 ( -2.862 -2.862 3.648) 5.448 21.657 ( 1.011 1.011 -11.943) 12.028 21.920 ( -3.781 -3.781 4.249) 6.830 23.538 ( 0.251 0.251 -4.141) 4.156 23.602 ( -2.333 -2.333 -4.300) 5.420 27.048 ( 13.320 13.320 5.301) 19.569 27.116 ( 15.322 15.322 -9.541) 23.676 28.688 ( 16.711 16.711 -15.712) 28.379 29.743 ( -13.682 -13.682 -23.685) 30.584======================= Grid point 896 (167/210) =======================q-point: ( 0.45 0.36 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.072 ( 6.565 -4.941 16.294) 18.248 9.273 ( -12.841 -11.060 8.679) 19.041 10.602 ( 13.699 11.769 3.626) 18.420 10.804 ( -5.176 7.550 4.098) 10.030 12.519 ( -3.312 -10.209 -1.972) 10.913 12.622 ( -13.035 -13.810 -2.696) 19.181 14.509 ( 7.503 -22.443 10.544) 25.907 14.770 ( -18.305 -27.581 6.930) 33.820 16.693 ( 3.291 3.667 -4.855) 6.917 16.746 ( -2.056 1.985 -5.951) 6.601 18.468 ( 9.868 14.201 46.068) 49.207 18.569 ( -0.402 10.777 41.224) 42.611 20.362 ( 7.213 11.232 13.230) 18.794 20.516 ( -8.401 15.435 15.493) 23.427 21.040 ( 17.862 -7.525 14.609) 24.272 21.352 ( -12.957 -4.675 10.791) 17.498 21.718 ( 4.748 -2.893 -7.875) 9.640 21.824 ( -5.567 -3.956 -1.316) 6.955 23.547 ( 0.733 0.184 -4.406) 4.471 23.567 ( -1.299 -0.646 -4.392) 4.625 27.253 ( 6.916 17.286 -1.738) 18.699 27.297 ( 3.009 18.062 -7.118) 19.645 29.054 ( 19.637 3.722 -16.886) 26.165 29.430 ( -17.895 -6.271 -20.017) 27.572======================= Grid point 907 (168/210) =======================q-point: ( 0.45 0.45 0.37)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.014 ( 0.001 0.001 13.150) 13.150 9.085 ( -7.122 -7.122 10.266) 14.382 10.845 ( 10.268 10.268 -4.175) 15.110 10.926 ( 2.509 2.509 -3.807) 5.205 12.351 ( -4.920 -4.920 1.842) 7.197 12.387 ( -8.437 -8.437 1.397) 12.014 14.251 ( -3.532 -3.532 10.943) 12.028 14.357 ( -13.736 -13.736 9.167) 21.480 16.746 ( 1.781 1.781 -5.523) 6.071 16.764 ( -0.048 -0.048 -5.899) 5.899 18.671 ( 6.040 6.040 42.639) 43.486 18.703 ( 2.716 2.716 40.702) 40.883 20.578 ( 10.402 10.402 10.707) 18.194 20.724 ( -0.415 -0.415 2.506) 2.574 20.984 ( 7.085 7.085 34.307) 35.740 21.204 ( -10.629 -10.629 26.060) 30.084 21.681 ( 0.258 0.258 -12.223) 12.229 21.734 ( -4.489 -4.489 -7.775) 10.038 23.553 ( 0.337 0.337 -4.441) 4.466 23.559 ( -0.269 -0.269 -4.405) 4.422 27.511 ( 8.025 8.025 -7.031) 13.351 27.539 ( 5.608 5.608 -9.300) 12.223 29.149 ( 6.120 6.120 -15.193) 17.486 29.289 ( -7.643 -7.643 -16.651) 19.852======================= Grid point 968 (169/210) =======================q-point: ( 0.00 0.00 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 10.358 ( 0.000 0.000 59.098) 59.098 10.358 ( 0.000 0.000 59.098) 59.098 12.430 ( -0.000 -0.000 55.916) 55.916 13.612 ( -0.000 -0.000 -43.070) 43.070 13.612 ( 0.000 0.000 -43.070) 43.070 15.191 ( -0.000 -0.000 -34.241) 34.241 15.544 ( -0.000 -0.000 56.704) 56.704 16.207 ( 0.000 0.000 8.302) 8.302 16.977 ( 0.000 0.000 -20.011) 20.011 17.408 ( 0.000 0.000 18.546) 18.546 17.408 ( 0.000 0.000 18.546) 18.546 18.035 ( -0.000 -0.000 -29.951) 29.951 18.507 ( 0.000 0.000 36.094) 36.094 20.385 ( -0.000 0.000 -4.500) 4.500 20.385 ( 0.000 -0.000 -4.500) 4.500 20.460 ( 0.000 0.000 -21.194) 21.194 21.460 ( 0.000 0.000 15.488) 15.488 21.460 ( -0.000 0.000 15.488) 15.488 23.868 ( 0.000 0.000 5.152) 5.152 24.212 ( -0.000 -0.000 -4.707) 4.707 24.605 ( 0.000 0.000 -11.132) 11.132 24.605 ( 0.000 -0.000 -11.132) 11.132 27.392 ( 0.000 0.000 44.813) 44.813 30.436 ( -0.000 -0.000 -49.651) 49.651======================= Grid point 969 (170/210) =======================q-point: ( 0.09 0.00 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 10.151 ( -19.546 0.000 56.660) 59.937 10.430 ( 7.198 0.000 57.849) 58.295 12.348 ( -7.908 0.000 53.234) 53.818 13.244 ( -34.474 0.000 -40.502) 53.188 13.620 ( 0.785 0.000 -40.442) 40.450 15.061 ( -13.468 0.000 -34.211) 36.766 15.767 ( 20.073 0.000 55.249) 58.783 16.212 ( 1.231 0.000 8.477) 8.566 16.892 ( -8.216 0.000 -16.984) 18.867 17.275 ( -11.203 0.000 24.237) 26.701 17.427 ( 2.035 0.000 15.668) 15.799 18.284 ( 22.704 0.000 -27.532) 35.686 18.601 ( 8.105 0.000 26.559) 27.768 20.001 ( -22.382 0.000 -12.849) 25.808 20.454 ( 6.441 0.000 -3.218) 7.200 20.734 ( 12.080 0.000 -11.327) 16.560 21.460 ( 0.023 0.000 14.449) 14.449 21.528 ( 6.645 0.000 14.861) 16.279 23.817 ( -4.530 0.000 4.379) 6.300 24.146 ( -5.076 0.000 -5.100) 7.196 24.717 ( 10.827 0.000 -8.427) 13.720 24.898 ( 27.037 0.000 -11.726) 29.470 27.383 ( -1.028 0.000 43.459) 43.471 30.378 ( -5.922 0.000 -48.866) 49.223======================= Grid point 970 (171/210) =======================q-point: ( 0.18 0.00 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.675 ( -26.392 0.000 49.544) 56.135 10.628 ( 12.226 0.000 53.407) 54.789 12.152 ( -10.991 0.000 47.740) 48.989 12.390 ( -48.963 0.000 -34.010) 59.616 13.622 ( -1.458 0.000 -34.657) 34.688 14.669 ( -25.501 0.000 -32.311) 41.162 16.076 ( 4.308 0.000 22.209) 22.623 16.421 ( 24.594 0.000 39.337) 46.393 16.690 ( -11.214 0.000 -11.739) 16.235 17.067 ( -7.809 0.000 27.214) 28.313 17.476 ( 2.455 0.000 13.561) 13.781 18.782 ( 9.896 0.000 13.421) 16.675 18.792 ( 24.657 0.000 -23.367) 33.971 19.581 ( -18.407 0.000 -12.278) 22.126 20.610 ( 8.698 0.000 -1.944) 8.913 20.914 ( 6.603 0.000 -8.923) 11.100 21.466 ( 0.858 0.000 12.394) 12.423 21.697 ( 9.673 0.000 12.542) 15.839 23.715 ( -5.392 0.000 3.433) 6.392 24.030 ( -6.662 0.000 -5.025) 8.344 25.005 ( 17.848 0.000 -2.018) 17.962 25.578 ( 39.800 0.000 -12.862) 41.827 27.351 ( -2.090 0.000 38.713) 38.769 30.203 ( -11.852 0.000 -46.694) 48.175======================= Grid point 971 (172/210) =======================q-point: ( 0.27 0.00 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.197 ( -20.229 0.000 38.163) 43.194 10.826 ( -0.334 0.000 29.535) 29.537 11.472 ( -34.895 0.000 -7.898) 35.777 11.951 ( -8.692 0.000 41.736) 42.631 13.537 ( -7.365 0.000 -25.671) 26.706 14.104 ( -30.259 0.000 -27.509) 40.894 16.092 ( -0.227 0.000 8.457) 8.460 16.479 ( -9.825 0.000 -7.093) 12.118 16.881 ( 11.763 0.000 46.597) 48.058 17.089 ( 16.993 0.000 22.498) 28.195 17.511 ( 0.885 0.000 12.812) 12.842 18.945 ( -12.875 0.000 -15.038) 19.797 18.995 ( 12.081 0.000 6.958) 13.942 19.505 ( 12.929 0.000 -10.126) 16.422 20.775 ( 7.701 0.000 -2.639) 8.141 21.007 ( 3.023 0.000 -8.496) 9.018 21.510 ( 4.093 0.000 9.260) 10.124 21.875 ( 7.575 0.000 8.366) 11.286 23.617 ( -4.364 0.000 2.270) 4.919 23.886 ( -7.765 0.000 -4.707) 9.081 25.402 ( 21.902 0.000 6.726) 22.912 26.371 ( 37.123 0.000 -5.912) 37.591 27.323 ( 1.222 0.000 23.950) 23.981 29.910 ( -17.895 0.000 -43.593) 47.123======================= Grid point 972 (173/210) =======================q-point: ( 0.36 0.00 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 8.937 ( -5.030 0.000 23.332) 23.868 10.245 ( -42.427 0.000 -17.669) 45.959 11.415 ( 13.299 0.000 42.815) 44.833 11.826 ( -3.897 0.000 36.211) 36.420 13.345 ( -11.221 0.000 -15.208) 18.899 13.541 ( -25.170 0.000 -20.763) 32.629 16.095 ( 0.742 0.000 4.521) 4.581 16.310 ( -7.205 0.000 -3.561) 8.037 17.034 ( 8.777 0.000 24.806) 26.312 17.500 ( -2.316 0.000 12.583) 12.794 17.522 ( 21.040 0.000 27.057) 34.275 18.594 ( -19.307 0.000 -7.330) 20.651 19.262 ( 14.725 0.000 7.048) 16.325 19.739 ( 6.913 0.000 -1.235) 7.022 20.906 ( 5.455 0.000 -4.353) 6.979 21.039 ( 0.428 0.000 -8.272) 8.283 21.636 ( 8.427 0.000 3.947) 9.306 21.973 ( 2.058 0.000 3.773) 4.298 23.551 ( -2.056 0.000 0.392) 2.092 23.734 ( -7.362 0.000 -4.217) 8.484 25.846 ( 22.663 0.000 16.202) 27.859 26.782 ( 1.187 0.000 29.357) 29.381 27.610 ( 30.459 0.000 -20.152) 36.522 29.496 ( -24.177 0.000 -40.064) 46.794======================= Grid point 973 (174/210) =======================q-point: ( 0.45 0.00 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.026 ( 14.254 0.000 6.977) 15.870 9.489 ( -32.126 0.000 -8.065) 33.123 11.664 ( 9.738 0.000 38.958) 40.156 11.775 ( -2.549 0.000 34.427) 34.521 13.153 ( -6.313 0.000 -9.862) 11.709 13.179 ( -10.208 0.000 -13.543) 16.959 16.126 ( 2.427 0.000 1.756) 2.996 16.194 ( -4.616 0.000 -0.773) 4.681 17.233 ( 10.433 0.000 15.812) 18.943 17.410 ( -6.970 0.000 12.887) 14.651 17.890 ( 17.016 0.000 15.891) 23.283 18.226 ( -17.736 0.000 2.899) 17.971 19.549 ( 13.393 0.000 8.843) 16.049 19.747 ( -5.658 0.000 6.712) 8.779 20.989 ( 3.085 0.000 -6.079) 6.817 21.031 ( -1.223 0.000 -7.439) 7.538 21.815 ( 8.806 0.000 0.220) 8.809 21.950 ( -4.358 0.000 0.555) 4.393 23.544 ( 1.437 0.000 -1.733) 2.251 23.609 ( -5.056 0.000 -3.326) 6.052 26.273 ( 20.071 0.000 24.860) 31.951 26.617 ( -14.314 0.000 31.693) 34.775 28.300 ( 35.636 0.000 -32.265) 48.072 28.957 ( -30.530 0.000 -36.409) 47.515======================= Grid point 980 (175/210) =======================q-point: ( 0.09 0.09 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 10.158 ( -8.643 -8.643 54.099) 55.462 10.295 ( -3.186 -3.186 56.912) 57.090 12.261 ( -8.327 -8.327 49.930) 51.300 13.066 ( -24.073 -24.073 -37.669) 50.774 13.483 ( -5.992 -5.992 -38.556) 39.476 14.941 ( -12.401 -12.401 -33.984) 38.243 15.969 ( 18.632 18.632 54.964) 60.954 16.212 ( 0.533 0.533 6.972) 7.013 16.850 ( -4.693 -4.693 -15.445) 16.811 16.984 ( -17.335 -17.335 24.441) 34.617 17.638 ( 10.347 10.347 18.527) 23.609 18.487 ( 13.168 13.168 -14.854) 23.821 18.589 ( 4.558 4.558 5.741) 8.632 19.838 ( -11.216 -11.216 -5.746) 16.870 20.566 ( 7.541 7.541 -4.979) 11.770 20.815 ( 7.009 7.009 -10.446) 14.400 21.453 ( -0.276 -0.276 13.614) 13.619 21.595 ( 6.234 6.234 14.539) 17.003 23.785 ( -3.227 -3.227 3.932) 6.024 24.104 ( -4.020 -4.020 -4.759) 7.414 24.808 ( 10.304 10.304 -10.837) 18.159 25.148 ( 23.143 23.143 -8.564) 33.831 27.377 ( -0.651 -0.651 42.021) 42.031 30.323 ( -5.544 -5.544 -48.082) 48.717======================= Grid point 981 (176/210) =======================q-point: ( 0.18 0.09 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.740 ( -25.573 6.232 47.896) 54.651 10.446 ( 11.988 -17.065 52.155) 56.170 12.041 ( -14.926 -9.535 38.232) 42.135 12.349 ( -41.663 -7.583 -26.221) 49.808 13.437 ( -1.720 -15.177 -32.929) 36.299 14.576 ( -23.957 -9.813 -31.769) 40.982 16.168 ( -0.243 6.885 12.332) 14.126 16.465 ( 21.956 0.913 36.883) 42.933 16.682 ( -7.666 -7.713 17.716) 20.787 16.739 ( -7.994 -9.161 5.181) 13.216 17.788 ( 5.254 19.291 17.692) 26.698 18.461 ( -4.382 -23.523 2.628) 24.071 19.031 ( 26.668 19.246 -21.081) 39.064 19.667 ( -5.273 6.522 0.575) 8.406 20.710 ( 7.250 7.655 -3.760) 11.194 20.949 ( 5.708 3.561 -8.543) 10.874 21.455 ( 0.676 -0.763 11.133) 11.180 21.752 ( 8.935 5.327 12.957) 16.616 23.701 ( -4.886 -1.597 3.043) 5.973 23.999 ( -6.411 -3.145 -4.626) 8.508 25.102 ( 18.470 10.085 -6.511) 22.028 25.747 ( 35.914 16.452 -8.291) 40.364 27.356 ( -1.299 0.506 36.940) 36.966 30.159 ( -11.156 -4.472 -45.901) 47.448======================= Grid point 982 (177/210) =======================q-point: ( 0.27 0.09 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.271 ( -20.086 7.377 36.970) 42.716 10.664 ( 4.619 -15.864 34.863) 38.580 11.403 ( -36.424 -6.280 -10.591) 38.449 11.898 ( -9.943 -6.400 35.990) 37.883 13.354 ( -7.177 -15.648 -24.585) 30.013 14.042 ( -28.745 -6.930 -26.900) 39.974 16.153 ( -0.640 4.437 6.370) 7.789 16.479 ( -6.107 -12.217 4.205) 14.291 16.608 ( -3.304 -14.758 6.519) 16.468 16.967 ( 17.618 1.281 42.868) 46.365 17.873 ( 4.678 20.117 15.850) 26.035 18.399 ( -1.707 -24.807 2.639) 25.005 19.443 ( 10.955 21.851 -8.730) 25.956 19.684 ( 9.344 14.323 -1.308) 17.152 20.854 ( 7.268 6.281 -3.932) 10.380 21.034 ( 3.055 2.938 -7.557) 8.664 21.493 ( 3.550 -1.452 8.295) 9.138 21.913 ( 6.574 3.857 8.980) 11.778 23.608 ( -4.267 -0.975 1.865) 4.758 23.860 ( -7.521 -2.658 -4.423) 9.121 25.506 ( 21.945 10.469 2.482) 24.441 26.471 ( 33.822 9.845 -1.253) 35.248 27.351 ( 2.899 2.850 21.089) 21.477 29.882 ( -16.970 -2.855 -42.742) 46.076======================= Grid point 983 (178/210) =======================q-point: ( 0.36 0.09 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.008 ( -5.499 7.041 22.640) 24.340 10.228 ( -38.884 -2.094 -14.169) 41.438 11.251 ( 12.017 -15.220 38.455) 43.068 11.758 ( -4.814 -7.590 34.097) 35.262 13.169 ( -10.448 -14.382 -15.075) 23.308 13.504 ( -24.489 -5.156 -19.907) 31.978 16.155 ( 0.897 4.182 3.352) 5.434 16.356 ( -6.027 1.142 -1.942) 6.435 16.643 ( 6.231 -28.989 9.252) 31.061 17.137 ( -0.245 -18.656 19.936) 27.305 18.015 ( 9.358 22.260 21.159) 32.106 18.375 ( -1.501 -7.677 11.235) 13.690 19.577 ( 6.995 21.577 2.495) 22.819 19.884 ( 6.269 13.279 1.531) 14.764 20.987 ( 5.792 7.152 -5.408) 10.674 21.075 ( 1.292 3.665 -7.376) 8.337 21.607 ( 8.027 -2.648 3.918) 9.316 21.989 ( 0.884 1.844 4.303) 4.765 23.543 ( -2.064 -0.817 0.140) 2.224 23.713 ( -7.032 -2.062 -4.012) 8.354 25.944 ( 22.035 9.767 12.554) 27.176 26.832 ( 0.659 4.891 29.484) 29.894 27.666 ( 30.328 5.685 -19.741) 36.631 29.488 ( -23.110 -0.872 -39.067) 45.398======================= Grid point 984 (179/210) =======================q-point: ( 0.45 0.09 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.081 ( 13.175 5.456 6.941) 15.859 9.518 ( -30.433 2.677 -7.177) 31.383 11.508 ( 11.621 -14.806 36.490) 41.058 11.673 ( -5.253 -10.743 32.987) 35.088 13.018 ( -2.482 -10.569 -10.365) 15.010 13.124 ( -13.087 -6.366 -12.606) 19.254 16.188 ( 2.462 4.613 1.001) 5.324 16.253 ( -4.273 4.084 -0.868) 5.974 16.818 ( 10.602 -32.818 5.013) 34.850 17.024 ( -9.371 -30.412 6.366) 32.453 18.194 ( 7.968 19.811 21.873) 30.568 18.318 ( -4.526 9.848 18.081) 21.081 19.746 ( 9.326 16.323 7.544) 20.257 19.895 ( -4.524 13.147 7.593) 15.842 21.068 ( 2.368 7.348 -6.038) 9.801 21.088 ( 0.006 5.547 -6.785) 8.764 21.788 ( 9.449 -2.366 0.396) 9.748 21.943 ( -5.497 -0.439 0.886) 5.585 23.534 ( 1.284 -0.925 -1.770) 2.375 23.595 ( -4.742 -1.392 -3.209) 5.893 26.354 ( 19.070 8.094 21.891) 30.140 26.678 ( -13.303 6.036 29.508) 32.926 28.338 ( 34.411 3.735 -30.727) 46.284 28.971 ( -29.367 1.343 -35.161) 45.832======================= Grid point 992 (180/210) =======================q-point: ( 0.18 0.18 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.829 ( -6.403 -6.403 40.670) 41.666 10.110 ( -6.146 -6.146 49.839) 50.591 11.823 ( -12.945 -12.945 34.603) 39.148 11.976 ( -28.901 -28.901 -26.104) 48.497 13.191 ( -8.285 -8.285 -27.438) 29.835 14.280 ( -19.855 -19.855 -29.097) 40.435 16.148 ( -19.268 -19.268 20.181) 33.909 16.271 ( 2.531 2.531 3.521) 5.021 16.703 ( -2.438 -2.438 -10.066) 10.640 16.800 ( 11.502 11.502 48.172) 50.844 18.033 ( -13.527 -13.527 3.660) 19.477 18.127 ( 13.482 13.482 19.345) 27.161 19.492 ( 24.861 24.861 -17.994) 39.495 19.795 ( 6.473 6.473 6.855) 11.436 20.835 ( 4.929 4.929 -1.638) 7.160 21.042 ( 5.183 5.183 -7.934) 10.802 21.446 ( 0.036 0.036 7.135) 7.135 21.889 ( 7.769 7.769 13.177) 17.156 23.650 ( -3.460 -3.460 2.165) 5.351 23.910 ( -5.654 -5.654 -4.140) 9.004 25.394 ( 18.702 18.702 -10.221) 28.355 26.188 ( 27.134 27.134 -1.352) 38.397 27.372 ( 1.245 1.245 30.509) 30.560 30.025 ( -9.168 -9.168 -43.653) 45.537======================= Grid point 993 (181/210) =======================q-point: ( 0.27 0.18 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.475 ( -19.393 12.813 33.113) 40.456 10.252 ( 9.664 -24.109 37.658) 45.747 11.245 ( -35.247 -10.053 -11.950) 38.552 11.654 ( -8.791 -18.098 25.071) 32.146 13.053 ( -7.356 -12.656 -20.675) 25.333 13.825 ( -25.121 -14.769 -24.203) 37.881 15.862 ( -8.624 -29.135 16.764) 34.703 16.311 ( 1.389 4.825 2.334) 5.537 16.617 ( -6.155 1.863 -6.459) 9.115 16.841 ( -7.243 -17.822 17.024) 25.688 18.032 ( 12.668 5.967 26.562) 30.028 18.365 ( 10.100 14.976 19.629) 26.676 19.840 ( 7.386 15.415 -2.532) 17.279 20.002 ( 15.645 19.832 -0.441) 25.264 20.936 ( 6.184 1.136 -0.337) 6.296 21.135 ( 4.221 6.989 -7.110) 10.827 21.465 ( 2.176 -1.076 3.615) 4.355 22.021 ( 4.750 6.503 10.944) 13.588 23.577 ( -3.574 -2.114 1.004) 4.272 23.786 ( -6.686 -4.623 -3.845) 8.992 25.799 ( 21.535 18.531 -5.752) 28.987 26.732 ( 24.046 15.485 10.887) 30.602 27.442 ( 8.514 6.882 11.193) 15.657 29.795 ( -14.316 -6.151 -40.278) 43.187======================= Grid point 994 (182/210) =======================q-point: ( 0.36 0.18 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.201 ( -7.136 11.931 20.761) 24.986 10.131 ( -25.907 -8.906 -1.909) 27.461 10.902 ( 5.346 -17.634 24.023) 30.276 11.510 ( -6.398 -17.032 25.801) 31.571 12.891 ( -8.050 -12.107 -12.564) 19.215 13.339 ( -23.014 -11.000 -17.606) 30.994 15.808 ( 2.586 -35.234 9.819) 36.668 16.308 ( -3.351 -0.118 1.377) 3.625 16.480 ( -5.735 -5.763 -2.704) 8.568 16.661 ( -8.407 -18.122 -0.236) 19.979 18.343 ( 15.176 15.252 33.588) 39.889 18.527 ( 6.317 16.796 21.157) 27.742 19.949 ( 5.422 15.397 3.762) 16.752 20.207 ( 3.881 18.560 5.660) 19.788 21.082 ( 7.453 0.890 -2.945) 8.063 21.214 ( 3.662 10.015 -6.326) 12.399 21.548 ( 6.917 -2.823 1.421) 7.605 22.054 ( -1.693 4.489 6.975) 8.466 23.521 ( -1.835 -1.332 -0.430) 2.308 23.658 ( -6.004 -3.321 -3.485) 7.696 26.215 ( 20.190 17.062 3.653) 26.685 26.962 ( -0.041 7.857 28.375) 29.443 27.830 ( 29.095 10.758 -18.013) 35.871 29.457 ( -20.023 -2.414 -36.160) 41.404======================= Grid point 995 (183/210) =======================q-point: ( 0.45 0.18 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.224 ( 9.761 8.310 7.160) 14.683 9.576 ( -25.104 2.374 -4.028) 25.536 11.137 ( 13.598 -20.881 28.747) 38.044 11.366 ( -9.117 -18.935 25.932) 33.378 12.805 ( 1.036 -10.110 -8.185) 13.050 12.961 ( -14.399 -9.447 -10.846) 20.353 15.933 ( 9.259 -35.625 3.520) 36.976 16.142 ( -11.132 -26.465 0.827) 28.723 16.459 ( 2.180 0.130 -2.333) 3.196 16.531 ( -5.011 -3.789 -2.917) 6.927 18.560 ( 6.449 17.654 28.986) 34.546 18.606 ( 1.334 17.642 24.164) 29.949 20.070 ( 6.698 15.321 8.400) 18.712 20.189 ( -4.479 15.572 10.017) 19.050 21.195 ( 4.175 4.445 -4.235) 7.424 21.247 ( -0.755 8.618 -4.481) 9.743 21.744 ( 11.716 -1.383 0.468) 11.807 21.952 ( -8.425 1.738 2.954) 9.095 23.511 ( 0.954 -1.235 -1.850) 2.420 23.559 ( -3.848 -1.993 -2.879) 5.202 26.578 ( 16.265 14.098 13.938) 25.643 26.844 ( -10.419 10.384 23.267) 27.527 28.441 ( 30.773 6.484 -26.431) 41.081 29.004 ( -25.967 1.822 -31.569) 40.917======================= Grid point 1004 (184/210) =======================q-point: ( 0.27 0.27 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.709 ( -0.325 -0.325 20.806) 20.811 9.820 ( -8.315 -8.315 37.206) 39.020 10.936 ( -21.842 -21.842 -9.222) 32.236 11.325 ( -11.350 -11.350 17.944) 24.076 12.858 ( -8.314 -8.314 -15.267) 19.271 13.480 ( -19.619 -19.619 -19.519) 33.924 15.378 ( -18.356 -18.356 15.666) 30.320 16.337 ( -26.704 -26.704 2.103) 37.824 16.403 ( 3.915 3.915 0.187) 5.540 16.651 ( -0.421 -0.421 -6.914) 6.939 18.326 ( 19.692 19.692 39.750) 48.534 18.643 ( 12.179 12.179 19.394) 25.938 20.054 ( 8.265 8.265 2.980) 12.063 20.411 ( 17.919 17.919 1.248) 25.372 20.932 ( 0.350 0.350 5.496) 5.519 21.282 ( 7.551 7.551 -6.631) 12.570 21.458 ( 0.443 0.443 -1.610) 1.727 22.130 ( 3.526 3.526 11.976) 12.973 23.531 ( -2.288 -2.288 -0.017) 3.236 23.687 ( -5.184 -5.184 -3.262) 8.024 26.196 ( 20.752 20.752 -9.431) 30.826 27.011 ( 10.731 10.731 24.445) 28.773 27.661 ( 16.483 16.483 -5.473) 23.945 29.635 ( -10.240 -10.240 -36.456) 39.227======================= Grid point 1005 (185/210) =======================q-point: ( 0.36 0.27 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.438 ( -10.806 10.417 18.798) 24.055 9.862 ( -7.591 -16.847 10.788) 21.398 10.618 ( -2.815 -11.119 7.731) 13.832 11.170 ( -6.509 -14.663 13.645) 21.061 12.702 ( -7.096 -7.797 -8.866) 13.775 13.087 ( -19.178 -14.157 -13.454) 27.372 15.164 ( -3.539 -28.007 10.664) 30.176 15.841 ( -22.591 -32.493 -0.783) 39.582 16.475 ( 3.307 4.453 -1.302) 5.697 16.629 ( -1.727 1.985 -5.555) 6.146 18.689 ( 15.447 18.242 36.352) 43.507 18.837 ( 7.490 13.646 19.867) 25.239 20.202 ( 7.275 11.188 6.360) 14.783 20.582 ( -0.559 18.933 8.987) 20.965 21.038 ( 9.936 -4.798 3.493) 11.573 21.401 ( 1.940 7.523 -3.745) 8.625 21.517 ( 8.139 0.325 -3.212) 8.756 22.133 ( -3.441 2.436 10.771) 11.567 23.496 ( -1.095 -1.069 -1.081) 1.873 23.592 ( -4.229 -3.147 -2.711) 5.928 26.583 ( 17.818 19.205 -5.200) 26.709 27.121 ( 0.933 7.715 23.376) 24.634 28.084 ( 24.878 14.791 -14.879) 32.543 29.385 ( -15.198 -5.097 -31.618) 35.450======================= Grid point 1006 (186/210) =======================q-point: ( 0.45 0.27 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.365 ( 3.682 4.538 8.902) 10.649 9.569 ( -15.814 -4.020 2.243) 16.470 10.777 ( 13.056 -13.442 15.540) 24.344 11.015 ( -10.016 -14.258 13.610) 22.109 12.629 ( 1.054 -8.017 -4.807) 9.407 12.765 ( -12.477 -10.232 -7.305) 17.713 15.216 ( 8.119 -33.807 4.423) 35.048 15.459 ( -16.071 -35.098 0.342) 38.604 16.535 ( 2.833 4.616 -2.774) 6.085 16.587 ( -2.440 3.802 -4.178) 6.153 18.900 ( 5.886 16.039 28.520) 33.246 18.933 ( 2.041 14.652 22.497) 26.925 20.350 ( 7.656 13.480 10.912) 18.957 20.495 ( -6.639 15.358 12.348) 20.795 21.227 ( 8.396 -0.717 -1.030) 8.490 21.361 ( -4.873 2.834 -2.733) 6.265 21.753 ( 13.553 1.646 2.594) 13.897 21.995 ( -10.226 1.530 7.652) 12.864 23.492 ( 0.743 -0.574 -1.849) 2.074 23.525 ( -2.550 -1.305 -2.276) 3.658 26.883 ( 12.431 16.055 3.782) 20.654 27.067 ( -6.173 11.637 14.068) 19.272 28.583 ( 24.759 7.714 -20.440) 33.020 29.033 ( -20.526 0.895 -26.137) 33.245======================= Grid point 1016 (187/210) =======================q-point: ( 0.36 0.36 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.489 ( -7.856 -7.856 21.728) 24.404 9.587 ( -8.201 -8.201 3.616) 12.149 10.505 ( 1.767 1.767 4.407) 5.066 10.977 ( -6.116 -6.116 4.234) 9.630 12.562 ( -6.357 -6.357 -4.874) 10.226 12.802 ( -14.114 -14.114 -8.087) 21.536 14.756 ( -12.735 -12.735 9.499) 20.361 15.259 ( -25.562 -25.562 -0.308) 36.152 16.555 ( 3.463 3.463 -2.321) 5.420 16.653 ( 0.331 0.331 -5.013) 5.035 19.001 ( 12.347 12.347 30.688) 35.308 19.053 ( 8.332 8.332 18.871) 22.248 20.411 ( 10.253 10.253 10.565) 17.940 20.906 ( -1.195 -1.195 9.581) 9.729 20.946 ( 10.565 10.565 6.607) 16.337 21.473 ( 0.277 0.277 -6.457) 6.469 21.584 ( 5.997 5.997 3.389) 9.133 22.118 ( -4.271 -4.271 12.991) 14.326 23.484 ( -0.106 -0.106 -1.544) 1.551 23.541 ( -1.974 -1.974 -1.805) 3.324 26.934 ( 15.628 15.628 -8.521) 23.688 27.245 ( 4.365 4.365 14.297) 15.573 28.401 ( 17.016 17.016 -12.898) 27.303 29.249 ( -8.931 -8.931 -25.925) 28.838======================= Grid point 1017 (188/210) =======================q-point: ( 0.45 0.36 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.360 ( -1.970 -4.762 12.192) 13.237 9.424 ( -7.584 -9.135 6.768) 13.667 10.660 ( 11.063 1.246 2.351) 11.378 10.855 ( -7.744 -2.733 1.051) 8.279 12.482 ( -0.550 -6.732 -1.415) 6.901 12.566 ( -8.853 -9.618 -2.937) 13.398 14.664 ( 3.038 -21.168 5.717) 22.136 14.852 ( -15.472 -25.497 1.961) 29.889 16.611 ( 2.278 3.007 -3.303) 5.014 16.644 ( -1.094 1.952 -4.211) 4.769 19.159 ( 3.847 9.744 23.726) 25.936 19.165 ( 2.908 8.738 19.751) 21.793 20.604 ( 9.101 11.832 13.578) 20.179 20.769 ( -7.766 10.920 12.387) 18.248 21.218 ( 12.034 1.602 1.171) 12.197 21.408 ( -6.888 3.295 -3.801) 8.529 21.754 ( 10.876 -2.392 9.578) 14.689 21.971 ( -10.076 -4.454 12.724) 16.830 23.491 ( 0.779 0.421 -1.481) 1.725 23.511 ( -1.207 -0.177 -1.341) 1.813 27.177 ( 8.758 12.940 -4.690) 16.314 27.277 ( -1.497 8.967 3.912) 9.898 28.735 ( 16.409 7.530 -14.813) 23.353 29.030 ( -13.197 -1.347 -19.860) 23.883======================= Grid point 1028 (189/210) =======================q-point: ( 0.45 0.45 0.42)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.257 ( -3.274 -3.274 11.152) 12.075 9.274 ( -4.941 -4.941 8.545) 11.038 10.753 ( 5.921 5.921 -4.747) 9.626 10.831 ( -1.613 -1.613 -5.342) 5.809 12.384 ( -2.409 -2.409 1.537) 3.738 12.412 ( -5.220 -5.220 0.987) 7.448 14.408 ( -4.571 -4.571 5.545) 8.517 14.481 ( -11.655 -11.655 3.963) 16.952 16.654 ( 1.369 1.369 -3.714) 4.189 16.665 ( 0.216 0.216 -4.024) 4.036 19.279 ( 2.958 2.958 18.446) 18.915 19.282 ( 2.855 2.855 19.718) 20.127 20.790 ( 6.683 6.683 12.785) 15.899 20.865 ( -0.622 -0.622 10.830) 10.865 21.342 ( 9.805 9.805 0.130) 13.867 21.479 ( 0.076 0.076 -8.109) 8.110 21.693 ( 0.297 0.297 21.604) 21.608 21.828 ( -9.275 -9.275 17.114) 21.562 23.503 ( 0.611 0.611 -0.817) 1.189 23.510 ( -0.097 -0.097 -0.660) 0.674 27.366 ( 5.748 5.748 -7.885) 11.325 27.396 ( 2.593 2.593 -4.440) 5.758 28.873 ( 6.283 6.283 -12.327) 15.195 28.977 ( -4.082 -4.082 -14.462) 15.572======================= Grid point 1089 (190/210) =======================q-point: ( 0.00 0.00 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 210Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 11.424 ( 0.000 0.000 45.842) 45.842 11.424 ( -0.000 -0.000 45.842) 45.842 12.750 ( 0.000 0.000 -40.735) 40.735 12.750 ( 0.000 0.000 -40.735) 40.735 13.483 ( 0.000 0.000 51.313) 51.313 14.421 ( 0.000 0.000 -44.141) 44.141 16.393 ( -0.000 -0.000 10.853) 10.853 16.551 ( -0.000 -0.000 46.499) 46.499 16.640 ( 0.000 0.000 -14.645) 14.645 17.373 ( 0.000 0.000 -37.751) 37.751 17.643 ( 0.000 0.000 5.803) 5.803 17.643 ( 0.000 0.000 5.803) 5.803 19.224 ( 0.000 0.000 36.711) 36.711 19.914 ( -0.000 -0.000 -32.905) 32.905 20.325 ( 0.000 0.000 -1.556) 1.556 20.325 ( 0.000 0.000 -1.556) 1.556 21.711 ( 0.000 0.000 7.883) 7.883 21.711 ( 0.000 0.000 7.883) 7.883 23.982 ( 0.000 0.000 6.249) 6.249 24.104 ( -0.000 -0.000 -6.073) 6.073 24.425 ( 0.000 0.000 -5.677) 5.677 24.425 ( -0.000 0.000 -5.677) 5.677 28.369 ( -0.000 -0.000 53.248) 53.248 29.423 ( 0.000 0.000 -53.503) 53.503======================= Grid point 1090 (191/210) =======================q-point: ( 0.09 0.00 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 11.191 ( -22.687 0.000 47.507) 52.646 11.445 ( 1.065 0.000 38.571) 38.585 12.460 ( -26.166 0.000 -32.198) 41.490 12.724 ( -1.808 0.000 -40.291) 40.331 13.407 ( -7.430 0.000 46.357) 46.949 14.302 ( -11.932 0.000 -42.945) 44.571 16.369 ( -2.622 0.000 10.638) 10.957 16.597 ( -4.419 0.000 -13.129) 13.853 16.775 ( 21.008 0.000 44.714) 49.404 17.490 ( 7.043 0.000 -19.639) 20.863 17.616 ( -2.531 0.000 10.840) 11.132 17.774 ( 16.188 0.000 -14.111) 21.475 19.136 ( -6.863 0.000 27.801) 28.635 19.649 ( -18.963 0.000 -23.155) 29.929 20.432 ( 9.105 0.000 1.370) 9.207 20.522 ( 12.662 0.000 -8.202) 15.086 21.718 ( 0.646 0.000 9.306) 9.328 21.754 ( 4.066 0.000 6.004) 7.251 23.915 ( -5.340 0.000 5.555) 7.705 24.032 ( -5.264 0.000 -6.222) 8.150 24.607 ( 16.963 0.000 -1.484) 17.028 24.682 ( 23.397 0.000 -8.690) 24.959 28.340 ( -3.038 0.000 52.449) 52.537 29.379 ( -4.483 0.000 -52.790) 52.980======================= Grid point 1091 (192/210) =======================q-point: ( 0.18 0.00 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 10.605 ( -34.381 0.000 44.941) 56.583 11.303 ( -23.405 0.000 -10.537) 25.667 11.991 ( -10.980 0.000 19.207) 22.124 12.693 ( -1.731 0.000 -26.441) 26.498 13.215 ( -11.038 0.000 27.876) 29.982 13.969 ( -21.100 0.000 -38.873) 44.230 16.300 ( -4.027 0.000 8.770) 9.651 16.480 ( -6.911 0.000 -9.831) 12.017 17.246 ( 21.412 0.000 32.792) 39.164 17.571 ( 2.114 0.000 -4.171) 4.676 17.578 ( 1.563 0.000 28.554) 28.597 18.230 ( 24.701 0.000 -33.358) 41.508 19.040 ( -1.237 0.000 13.388) 13.445 19.313 ( -12.598 0.000 -14.366) 19.107 20.618 ( 8.843 0.000 2.988) 9.334 20.730 ( 8.160 0.000 -8.253) 11.606 21.733 ( 0.836 0.000 11.951) 11.980 21.849 ( 4.936 0.000 1.233) 5.088 23.802 ( -5.954 0.000 5.413) 8.047 23.919 ( -6.300 0.000 -6.168) 8.817 25.048 ( 26.930 0.000 7.117) 27.855 25.278 ( 35.688 0.000 -15.348) 38.849 28.246 ( -6.573 0.000 50.120) 50.550 29.244 ( -9.268 0.000 -50.784) 51.623======================= Grid point 1092 (193/210) =======================q-point: ( 0.27 0.00 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.927 ( -32.382 0.000 36.243) 48.602 10.596 ( -40.861 0.000 -31.027) 51.306 12.029 ( 8.710 0.000 42.349) 43.236 12.622 ( -6.173 0.000 9.358) 11.210 13.025 ( -7.080 0.000 -8.660) 11.185 13.514 ( -23.738 0.000 -32.359) 40.132 16.224 ( -3.489 0.000 6.127) 7.050 16.346 ( -6.314 0.000 -6.474) 9.043 17.385 ( -1.403 0.000 15.335) 15.399 17.588 ( -0.352 0.000 -4.298) 4.313 17.829 ( 16.676 0.000 40.876) 44.147 18.516 ( 0.924 0.000 -28.789) 28.804 19.131 ( 10.859 0.000 7.320) 13.096 19.298 ( 12.982 0.000 -9.997) 16.385 20.766 ( 6.124 0.000 1.884) 6.407 20.850 ( 4.279 0.000 -6.559) 7.832 21.752 ( 1.146 0.000 12.876) 12.927 21.929 ( 2.828 0.000 -3.664) 4.628 23.684 ( -5.810 0.000 4.568) 7.391 23.785 ( -7.054 0.000 -5.427) 8.900 25.635 ( 31.815 0.000 17.086) 36.113 26.034 ( 39.782 0.000 -21.991) 45.455 28.076 ( -10.777 0.000 46.241) 47.480 29.010 ( -14.586 0.000 -47.796) 49.972======================= Grid point 1093 (194/210) =======================q-point: ( 0.36 0.00 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.395 ( -20.251 0.000 23.360) 30.916 9.843 ( -33.586 0.000 -22.201) 40.260 12.222 ( 9.466 0.000 37.768) 38.936 12.476 ( -7.085 0.000 28.164) 29.041 12.930 ( -3.616 0.000 -25.083) 25.343 13.087 ( -18.237 0.000 -25.384) 31.256 16.169 ( -1.909 0.000 3.518) 4.003 16.239 ( -4.427 0.000 -3.622) 5.720 17.362 ( -0.011 0.000 12.707) 12.707 17.554 ( -3.056 0.000 -5.499) 6.291 18.067 ( 7.897 0.000 23.895) 25.166 18.409 ( -7.610 0.000 -12.100) 14.294 19.430 ( 17.387 0.000 10.172) 20.144 19.633 ( 15.858 0.000 -9.174) 18.321 20.861 ( 3.526 0.000 -0.064) 3.526 20.907 ( 1.639 0.000 -4.743) 5.018 21.784 ( 2.284 0.000 9.851) 10.113 21.954 ( -0.394 0.000 -5.824) 5.837 23.582 ( -4.310 0.000 2.697) 5.084 23.651 ( -6.273 0.000 -4.129) 7.510 26.267 ( 31.494 0.000 25.957) 40.812 26.798 ( 36.251 0.000 -24.923) 43.992 27.824 ( -14.240 0.000 38.793) 41.324 28.666 ( -20.445 0.000 -44.082) 48.592======================= Grid point 1094 (195/210) =======================q-point: ( 0.45 0.00 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.170 ( -1.934 0.000 7.775) 8.012 9.328 ( -17.717 0.000 -8.270) 19.552 12.354 ( 3.124 0.000 31.004) 31.161 12.384 ( -2.065 0.000 27.589) 27.666 12.851 ( -4.760 0.000 -20.157) 20.712 12.859 ( -3.330 0.000 -20.402) 20.672 16.151 ( 0.065 0.000 1.116) 1.118 16.173 ( -2.226 0.000 -1.177) 2.518 17.394 ( 3.185 0.000 4.735) 5.706 17.475 ( -4.555 0.000 -2.834) 5.364 18.181 ( 4.633 0.000 10.777) 11.731 18.277 ( -5.571 0.000 0.370) 5.583 19.730 ( 11.300 0.000 8.485) 14.131 19.824 ( 2.529 0.000 -0.134) 2.533 20.908 ( 1.411 0.000 -1.927) 2.389 20.921 ( 0.014 0.000 -3.313) 3.313 21.844 ( 3.699 0.000 2.947) 4.730 21.916 ( -3.160 0.000 -3.571) 4.769 23.528 ( -0.872 0.000 0.212) 0.897 23.553 ( -3.346 0.000 -2.237) 4.025 26.848 ( 26.795 0.000 32.459) 42.090 27.243 ( -5.204 0.000 19.576) 20.256 27.709 ( 16.333 0.000 -15.877) 22.779 28.205 ( -26.016 0.000 -39.220) 47.064======================= Grid point 1101 (196/210) =======================q-point: ( 0.09 0.09 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 11.136 ( -13.013 -13.013 42.532) 46.343 11.320 ( -5.391 -5.391 43.860) 44.518 12.298 ( -19.829 -19.829 -37.249) 46.625 12.564 ( -9.299 -9.299 -32.909) 35.439 13.340 ( -6.564 -6.564 41.579) 42.603 14.199 ( -10.482 -10.482 -41.317) 43.896 16.368 ( -1.015 -1.015 8.803) 8.920 16.584 ( -1.925 -1.925 -11.583) 11.898 16.877 ( 7.189 7.189 32.934) 34.467 17.363 ( -1.845 -1.845 17.553) 17.746 17.874 ( 10.566 10.566 5.839) 16.043 17.920 ( 20.079 20.079 -32.457) 43.125 18.852 ( -20.387 -20.387 9.851) 30.467 19.703 ( 0.474 0.474 -6.107) 6.144 20.495 ( 7.386 7.386 -1.939) 10.624 20.635 ( 8.475 8.475 -5.683) 13.264 21.680 ( -1.518 -1.518 7.218) 7.531 21.840 ( 6.000 6.000 7.858) 11.565 23.867 ( -4.117 -4.117 3.886) 7.001 24.007 ( -3.480 -3.480 -4.451) 6.635 24.636 ( 10.638 10.638 -5.361) 15.971 24.999 ( 24.040 24.040 -4.855) 34.343 28.313 ( -2.821 -2.821 51.511) 51.666 29.339 ( -4.033 -4.033 -51.953) 52.265======================= Grid point 1102 (197/210) =======================q-point: ( 0.18 0.09 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 10.629 ( -32.703 1.680 41.897) 53.176 11.226 ( -15.649 -8.734 6.735) 19.146 11.815 ( -17.011 -15.788 0.989) 23.230 12.464 ( -2.735 -20.714 -24.140) 31.926 13.167 ( -10.251 -4.671 26.625) 28.910 13.899 ( -19.330 -7.317 -36.598) 42.031 16.321 ( -3.300 1.815 6.638) 7.632 16.512 ( -5.059 2.302 -8.159) 9.872 16.889 ( -4.517 -25.051 9.025) 27.007 17.554 ( 15.257 6.740 44.157) 47.202 18.003 ( 2.378 20.036 4.913) 20.766 18.290 ( 7.008 -3.547 -26.605) 27.741 18.686 ( 15.590 -3.580 -6.680) 17.334 19.664 ( -2.630 16.285 -0.413) 16.501 20.668 ( 8.664 5.024 -0.443) 10.025 20.794 ( 6.898 5.739 -5.478) 10.514 21.667 ( 0.187 -4.195 7.382) 8.493 21.956 ( 5.105 8.142 6.015) 11.337 23.771 ( -5.402 -2.904 3.648) 7.135 23.904 ( -6.354 -1.904 -4.429) 7.976 25.014 ( 26.169 3.034 -2.092) 26.427 25.569 ( 32.885 23.135 -6.598) 40.745 28.225 ( -6.202 -2.231 48.721) 49.165 29.218 ( -8.386 -2.704 -49.534) 50.312======================= Grid point 1103 (198/210) =======================q-point: ( 0.27 0.09 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.973 ( -31.715 4.405 34.417) 47.008 10.600 ( -39.171 0.075 -27.415) 47.812 11.798 ( 8.029 -21.931 37.164) 43.893 12.407 ( -3.657 -20.985 -2.293) 21.424 12.970 ( -8.964 -4.286 3.074) 10.401 13.477 ( -22.265 -4.286 -29.875) 37.505 16.256 ( -2.938 2.879 4.404) 6.026 16.403 ( -5.612 4.534 -4.886) 8.713 16.802 ( -3.214 -34.277 6.724) 35.078 17.579 ( -12.106 -21.227 14.472) 28.401 18.145 ( 12.774 24.267 15.270) 31.389 18.422 ( 9.120 0.519 -2.276) 9.414 19.194 ( 27.011 15.921 -12.032) 33.583 19.663 ( 3.939 20.797 -0.637) 21.176 20.816 ( 6.403 4.531 0.023) 7.844 20.899 ( 3.860 4.846 -4.939) 7.923 21.686 ( 1.641 -5.184 7.918) 9.606 22.022 ( 1.346 7.996 1.809) 8.308 23.662 ( -5.462 -2.172 3.323) 6.752 23.770 ( -7.047 -1.670 -4.291) 8.418 25.607 ( 32.614 0.461 6.074) 33.178 26.259 ( 36.227 19.353 -11.547) 42.665 28.063 ( -10.328 -1.407 43.943) 45.162 29.005 ( -13.309 -0.560 -45.756) 47.655======================= Grid point 1104 (199/210) =======================q-point: ( 0.36 0.09 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.449 ( -20.105 5.253 22.239) 30.436 9.871 ( -32.640 2.617 -20.541) 38.654 11.984 ( 9.377 -22.481 33.090) 41.088 12.320 ( -4.725 -17.401 16.612) 24.517 12.827 ( -5.699 -6.495 -12.912) 15.536 13.074 ( -17.278 -2.548 -22.839) 28.752 16.214 ( -1.325 3.517 2.549) 4.541 16.303 ( -4.373 5.133 -2.641) 7.242 16.782 ( 1.463 -37.070 4.557) 37.378 17.298 ( -14.325 -31.912 0.785) 34.988 18.356 ( 8.411 23.179 10.316) 26.729 18.571 ( 4.125 12.853 6.999) 15.205 19.634 ( 17.425 18.364 3.638) 25.576 19.834 ( 11.471 16.901 -5.144) 21.064 20.923 ( 4.411 5.729 -0.984) 7.297 20.956 ( 2.220 4.954 -4.088) 6.795 21.731 ( 3.037 -4.741 6.505) 8.603 22.007 ( -2.810 5.211 -1.924) 6.225 23.566 ( -3.993 -1.536 2.001) 4.723 23.637 ( -6.121 -1.377 -3.456) 7.163 26.255 ( 32.236 0.186 16.113) 36.039 26.953 ( 32.603 14.121 -15.127) 38.616 27.822 ( -13.341 -0.194 34.687) 37.165 28.689 ( -18.829 2.282 -40.830) 45.021======================= Grid point 1105 (200/210) =======================q-point: ( 0.45 0.09 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.222 ( -2.210 5.109 7.443) 9.295 9.371 ( -17.089 4.190 -7.668) 19.193 12.137 ( 6.005 -20.527 25.705) 33.439 12.234 ( -4.238 -17.107 21.793) 28.028 12.755 ( -0.568 -5.935 -14.087) 15.297 12.827 ( -7.852 -3.825 -16.697) 18.843 16.206 ( 0.529 4.288 0.827) 4.399 16.235 ( -2.477 4.902 -0.861) 5.560 16.863 ( 6.740 -37.459 0.956) 38.072 17.043 ( -11.287 -35.959 -1.393) 37.714 18.493 ( 5.744 22.290 7.622) 24.248 18.579 ( -2.605 19.820 7.294) 21.280 19.905 ( 9.749 15.568 7.640) 19.894 19.987 ( 2.056 14.662 0.541) 14.815 20.985 ( 1.729 7.575 -2.436) 8.143 20.991 ( 1.073 6.657 -2.607) 7.230 21.811 ( 5.071 -3.069 1.775) 6.188 21.921 ( -5.543 0.791 -2.372) 6.081 23.517 ( -0.726 -1.068 0.019) 1.291 23.542 ( -3.248 -1.049 -1.973) 3.943 26.848 ( 27.314 0.423 25.187) 37.157 27.276 ( -10.997 2.668 23.393) 25.986 27.780 ( 19.733 7.206 -17.974) 27.648 28.263 ( -24.237 5.601 -34.576) 42.595======================= Grid point 1113 (201/210) =======================q-point: ( 0.18 0.18 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 10.557 ( -14.716 -14.716 30.886) 37.243 10.988 ( -11.537 -11.537 35.558) 39.123 11.438 ( -21.397 -21.397 -26.048) 39.927 12.060 ( -15.164 -15.164 -14.491) 25.883 13.040 ( -7.876 -7.876 19.119) 22.127 13.678 ( -14.893 -14.893 -30.963) 37.447 16.352 ( 0.609 0.609 4.138) 4.227 16.428 ( -19.974 -19.974 7.712) 29.282 16.537 ( -0.403 -0.403 -6.300) 6.326 17.453 ( -21.236 -21.236 15.437) 33.768 18.211 ( 13.640 13.640 14.837) 24.335 18.371 ( 13.548 13.548 5.990) 20.074 19.072 ( 29.821 29.821 -20.649) 46.957 19.874 ( 6.581 6.581 1.728) 9.466 20.791 ( 6.553 6.553 -1.681) 9.418 20.922 ( 6.463 6.463 -3.520) 9.794 21.599 ( -2.484 -2.484 5.492) 6.519 22.117 ( 7.142 7.142 7.436) 12.543 23.697 ( -4.410 -4.410 2.132) 6.590 23.834 ( -5.101 -5.101 -3.037) 7.827 25.236 ( 19.113 19.113 -4.731) 27.441 26.100 ( 29.851 29.851 -3.952) 42.400 28.154 ( -5.152 -5.152 44.517) 45.109 29.135 ( -5.816 -5.816 -45.862) 46.594======================= Grid point 1114 (202/210) =======================q-point: ( 0.27 0.18 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 10.076 ( -28.153 4.718 27.195) 39.426 10.576 ( -32.491 -3.274 -11.654) 34.673 11.256 ( 4.600 -30.408 19.533) 36.432 11.894 ( -4.051 -27.456 -6.329) 28.466 12.873 ( -8.565 -5.593 8.244) 13.138 13.337 ( -18.711 -9.787 -24.006) 31.972 16.104 ( -11.831 -27.843 6.944) 31.039 16.366 ( 0.184 1.395 2.930) 3.250 16.498 ( -3.618 3.131 -4.629) 6.657 16.978 ( -22.948 -34.508 1.023) 41.454 18.566 ( 16.354 19.557 18.798) 31.675 18.618 ( 12.795 14.679 8.729) 21.340 19.656 ( 26.838 27.467 -11.438) 40.069 19.993 ( 7.206 13.508 -0.332) 15.314 20.910 ( 5.718 4.282 -1.133) 7.233 21.029 ( 4.450 7.838 -3.018) 9.505 21.578 ( 0.501 -5.275 4.749) 7.115 22.203 ( 1.047 9.233 5.694) 10.898 23.606 ( -4.570 -3.321 1.530) 5.853 23.718 ( -6.289 -3.573 -2.633) 7.697 25.723 ( 28.822 11.725 -1.845) 31.171 26.712 ( 31.360 25.401 -4.502) 40.607 28.016 ( -8.859 -3.462 37.338) 38.530 28.984 ( -9.699 -1.807 -40.096) 41.292======================= Grid point 1115 (203/210) =======================q-point: ( 0.36 0.18 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.587 ( -19.545 8.110 18.431) 28.062 9.932 ( -29.665 2.957 -14.720) 33.248 11.421 ( 9.888 -32.244 22.634) 40.617 11.833 ( -3.058 -28.865 3.570) 29.245 12.723 ( -6.183 -4.650 0.118) 7.737 12.984 ( -15.990 -6.303 -17.006) 24.179 15.961 ( -2.784 -34.264 4.848) 34.717 16.340 ( -6.078 -3.594 1.840) 7.297 16.408 ( -2.654 -0.720 -3.340) 4.327 16.621 ( -12.149 -26.229 -2.319) 28.999 18.774 ( 7.765 18.314 6.923) 21.062 18.868 ( 8.821 16.519 14.457) 23.658 20.042 ( 12.787 19.666 6.831) 24.432 20.199 ( 11.584 20.382 -6.060) 24.215 21.026 ( 6.063 3.670 -1.816) 7.316 21.114 ( 4.616 10.724 -3.057) 12.069 21.618 ( 3.675 -6.342 3.514) 8.129 22.152 ( -6.164 8.887 2.431) 11.085 23.527 ( -3.158 -2.208 0.759) 3.927 23.600 ( -5.382 -2.276 -2.169) 6.233 26.317 ( 30.332 6.629 4.883) 31.430 27.286 ( 23.942 18.037 -2.223) 30.058 27.822 ( -8.617 0.552 22.697) 24.284 28.747 ( -14.498 3.205 -32.907) 36.102======================= Grid point 1116 (204/210) =======================q-point: ( 0.45 0.18 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.357 ( -3.056 7.939 6.426) 10.661 9.478 ( -15.218 6.136 -5.623) 17.346 11.608 ( 8.648 -30.775 16.588) 36.014 11.751 ( -5.671 -29.144 10.725) 31.568 12.655 ( 0.024 -4.519 -4.369) 6.285 12.739 ( -8.494 -4.970 -10.124) 14.118 15.985 ( 4.998 -35.585 1.674) 35.973 16.143 ( -10.412 -29.259 -0.409) 31.059 16.416 ( 1.883 1.522 -1.369) 2.781 16.475 ( -4.356 -4.501 -1.987) 6.571 18.897 ( 4.709 18.105 7.131) 20.021 18.948 ( 0.038 17.365 9.437) 19.764 20.242 ( 7.682 16.933 7.860) 20.187 20.321 ( 0.396 18.018 2.207) 18.157 21.137 ( 4.731 6.327 -1.399) 8.023 21.184 ( 0.855 11.153 -1.940) 11.353 21.748 ( 9.958 -2.190 0.220) 10.199 21.973 ( -11.342 5.115 -0.329) 12.446 23.491 ( -0.350 -1.377 -0.328) 1.458 23.516 ( -2.885 -1.378 -1.385) 3.484 26.883 ( 26.347 3.328 13.468) 29.777 27.326 ( -17.070 2.208 20.921) 27.092 27.984 ( 21.890 12.906 -15.821) 29.933 28.409 ( -19.743 8.642 -25.094) 33.078======================= Grid point 1125 (205/210) =======================q-point: ( 0.27 0.27 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 10.041 ( -11.560 -11.560 11.097) 19.759 10.430 ( -16.026 -16.026 21.151) 31.000 10.758 ( -11.631 -11.631 -7.145) 17.934 11.466 ( -14.009 -14.009 -2.316) 19.947 12.751 ( -6.609 -6.609 5.279) 10.734 13.103 ( -13.489 -13.489 -17.261) 25.726 15.606 ( -20.479 -20.479 6.675) 29.721 16.321 ( -29.943 -29.943 -1.757) 42.383 16.419 ( 2.558 2.558 1.114) 3.785 16.545 ( 0.709 0.709 -3.437) 3.580 18.881 ( 11.824 11.824 5.655) 17.651 18.935 ( 16.348 16.348 18.790) 29.792 20.119 ( 15.729 15.729 5.511) 22.916 20.300 ( 20.277 20.277 -10.323) 30.478 20.978 ( 3.003 3.003 0.218) 4.253 21.185 ( 7.825 7.825 -2.687) 11.387 21.497 ( -2.492 -2.492 2.972) 4.610 22.336 ( 3.177 3.177 6.698) 8.065 23.539 ( -3.263 -3.263 0.446) 4.636 23.637 ( -4.346 -4.346 -1.532) 6.335 26.056 ( 21.190 21.190 -4.098) 30.246 27.220 ( 25.010 25.010 -0.539) 35.374 27.926 ( -5.426 -5.426 26.479) 27.569 28.925 ( -4.374 -4.374 -32.179) 32.768======================= Grid point 1126 (206/210) =======================q-point: ( 0.36 0.27 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.714 ( -16.753 2.489 8.732) 19.055 9.959 ( -24.726 -1.082 0.121) 24.750 10.817 ( 9.867 -25.742 9.344) 29.109 11.303 ( -5.002 -22.347 0.621) 22.908 12.628 ( -5.376 -5.053 1.956) 7.633 12.835 ( -12.809 -8.663 -11.006) 18.980 15.322 ( -8.191 -28.203 4.805) 29.758 15.801 ( -22.322 -32.751 -2.048) 39.688 16.463 ( 1.961 3.864 0.006) 4.333 16.547 ( -0.561 2.357 -2.502) 3.483 19.075 ( 8.019 12.486 5.512) 15.830 19.176 ( 7.630 13.456 12.372) 19.808 20.370 ( 11.469 15.142 10.022) 21.477 20.625 ( 8.956 20.633 -4.098) 22.863 21.058 ( 5.730 -0.174 -0.240) 5.737 21.343 ( 6.274 11.296 -2.103) 13.092 21.505 ( 5.795 -3.910 1.097) 7.076 22.307 ( -6.157 5.377 5.328) 9.757 23.486 ( -1.860 -1.723 -0.150) 2.539 23.556 ( -3.672 -1.920 -0.913) 4.243 26.516 ( 24.372 13.103 -1.603) 27.717 27.559 ( 1.399 5.917 14.488) 15.712 27.910 ( 11.124 11.280 0.496) 15.851 28.801 ( -8.527 1.869 -23.779) 25.330======================= Grid point 1127 (207/210) =======================q-point: ( 0.45 0.27 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.495 ( -4.027 4.656 4.300) 7.509 9.579 ( -12.446 2.978 -0.857) 12.826 11.026 ( 10.294 -25.547 8.193) 28.736 11.197 ( -6.745 -24.479 4.383) 25.767 12.565 ( -0.312 -4.738 -0.858) 4.825 12.632 ( -7.136 -5.862 -5.380) 10.688 15.278 ( 3.474 -32.906 1.804) 33.138 15.447 ( -13.449 -34.227 -0.829) 36.784 16.498 ( 1.633 4.349 -0.904) 4.733 16.528 ( -1.314 3.813 -1.695) 4.375 19.199 ( 4.529 12.443 5.957) 14.520 19.246 ( 0.083 12.402 7.833) 14.669 20.564 ( 7.790 16.163 8.655) 19.921 20.668 ( -2.550 16.771 4.045) 17.440 21.197 ( 7.755 0.053 -1.146) 7.839 21.333 ( -5.104 2.663 -0.231) 5.762 21.779 ( 17.686 5.628 0.122) 18.560 22.103 ( -14.096 6.460 2.755) 15.748 23.471 ( 0.318 -0.442 -0.489) 0.732 23.497 ( -2.252 -0.348 -0.660) 2.373 26.980 ( 21.998 6.307 4.281) 23.281 27.361 ( -16.207 1.300 12.193) 20.323 28.258 ( 18.638 14.192 -10.289) 25.586 28.581 ( -13.813 8.324 -16.271) 22.909======================= Grid point 1137 (208/210) =======================q-point: ( 0.36 0.36 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.635 ( -8.638 -8.638 1.254) 12.280 9.816 ( -13.879 -13.879 9.842) 21.958 10.564 ( 0.841 0.841 1.544) 1.949 10.999 ( -9.400 -9.400 -0.748) 13.315 12.530 ( -4.472 -4.472 1.313) 6.459 12.657 ( -8.809 -8.809 -5.933) 13.798 14.891 ( -14.965 -14.965 3.966) 21.532 15.234 ( -24.125 -24.125 -1.414) 34.147 16.528 ( 2.625 2.625 -0.520) 3.748 16.581 ( 0.967 0.967 -2.066) 2.478 19.273 ( 7.842 7.842 4.901) 12.125 19.370 ( 6.148 6.148 8.203) 11.953 20.661 ( 13.809 13.809 12.616) 23.250 20.939 ( 9.349 9.349 -5.079) 14.163 21.046 ( 0.702 0.702 3.439) 3.579 21.414 ( -1.625 -1.625 -0.240) 2.311 21.617 ( 12.864 12.864 0.073) 18.193 22.326 ( -3.738 -3.738 6.310) 8.231 23.466 ( -0.173 -0.173 -0.407) 0.475 23.527 ( -1.157 -1.157 -0.024) 1.637 26.810 ( 16.003 16.003 -3.537) 22.906 27.537 ( -5.663 -5.663 11.855) 14.306 28.218 ( 16.865 16.865 -5.019) 24.372 28.804 ( -1.838 -1.838 -15.800) 16.013======================= Grid point 1138 (209/210) =======================q-point: ( 0.45 0.36 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.494 ( -3.233 -4.422 2.550) 6.042 9.555 ( -9.421 -5.695 4.756) 11.992 10.695 ( 9.005 -7.176 1.096) 11.567 10.855 ( -6.957 -10.006 -0.457) 12.196 12.473 ( -0.797 -4.395 0.363) 4.482 12.514 ( -5.047 -5.771 -2.063) 7.939 14.741 ( -0.375 -20.831 2.077) 20.937 14.867 ( -12.820 -23.946 0.003) 27.162 16.568 ( 1.492 2.666 -1.082) 3.241 16.587 ( -0.384 2.086 -1.588) 2.650 19.389 ( 3.986 7.044 4.809) 9.414 19.429 ( 0.188 6.192 5.668) 8.396 20.868 ( 6.672 13.349 10.857) 18.455 20.955 ( -2.981 11.145 4.314) 12.317 21.180 ( 9.601 -0.176 -2.649) 9.962 21.346 ( -6.110 0.869 -1.447) 6.339 21.900 ( 15.014 5.101 3.793) 16.304 22.170 ( -11.512 -0.323 5.738) 12.867 23.478 ( 1.175 1.136 -0.163) 1.643 23.504 ( -1.271 0.860 0.159) 1.543 27.118 ( 14.709 7.345 -1.364) 16.497 27.372 ( -10.827 -0.320 4.091) 11.578 28.517 ( 12.949 11.550 -6.310) 18.463 28.717 ( -7.221 4.990 -9.885) 13.220======================= Grid point 1149 (210/210) =======================q-point: ( 0.45 0.45 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 630Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 9.398 ( -3.126 -3.126 3.514) 5.648 9.421 ( -5.409 -5.409 4.717) 8.988 10.680 ( 2.932 2.932 -2.218) 4.703 10.744 ( -3.338 -3.338 -2.766) 5.471 12.409 ( -1.598 -1.598 0.866) 2.421 12.423 ( -3.010 -3.010 0.112) 4.259 14.479 ( -5.481 -5.481 1.779) 7.952 14.526 ( -10.149 -10.149 0.961) 14.384 16.604 ( 1.080 1.080 -1.286) 1.997 16.611 ( 0.430 0.430 -1.455) 1.577 19.484 ( 2.731 2.731 4.260) 5.750 19.499 ( 1.245 1.245 4.474) 4.808 21.026 ( 3.233 3.233 8.712) 9.839 21.055 ( 0.005 0.005 6.119) 6.119 21.273 ( 8.295 8.295 -3.804) 12.333 21.372 ( -0.518 -0.518 -2.730) 2.826 21.985 ( 4.709 4.709 7.529) 10.052 22.100 ( -5.914 -5.914 7.707) 11.374 23.505 ( 1.276 1.276 0.470) 1.865 23.517 ( 0.171 0.171 0.696) 0.737 27.252 ( 5.897 5.897 -3.189) 8.929 27.341 ( -3.011 -3.011 -1.256) 4.440 28.697 ( 6.425 6.425 -4.915) 10.330 28.765 ( -0.387 -0.387 -6.115) 6.140=================== 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 3/55176 10.0 17634.187 17634.187 24483.771 0.000 0.000 0.000 3/55176 20.0 66925.028 66925.028 70826.721 0.000 0.000 0.000 3/55176 30.0 41716.500 41716.500 29048.152 0.000 -0.000 0.000 3/55176 40.0 20494.323 20494.323 15551.944 0.000 -0.000 0.000 3/55176 50.0 11310.377 11310.377 9737.580 0.000 -0.000 0.000 3/55176 60.0 6957.620 6957.620 6604.925 0.000 -0.000 0.000 3/55176 70.0 4592.803 4592.803 4747.262 0.000 -0.000 0.000 3/55176 80.0 3182.995 3182.995 3558.071 0.000 -0.000 0.000 3/55176 90.0 2294.140 2294.140 2751.387 0.000 -0.000 0.000 3/55176 100.0 1711.894 1711.894 2181.386 0.000 -0.000 0.000 3/55176 110.0 1317.960 1317.960 1766.633 0.000 -0.000 0.000 3/55176 120.0 1043.297 1043.297 1457.874 0.000 -0.000 0.000 3/55176 130.0 846.321 846.321 1223.537 0.000 -0.000 0.000 3/55176 140.0 701.341 701.341 1042.575 0.000 -0.000 0.000 3/55176 150.0 592.080 592.080 900.582 0.000 -0.000 0.000 3/55176 160.0 507.965 507.965 787.501 0.000 -0.000 0.000 3/55176 170.0 441.961 441.961 696.193 0.000 -0.000 0.000 3/55176 180.0 389.274 389.274 621.515 0.000 -0.000 0.000 3/55176 190.0 346.566 346.566 559.709 0.000 -0.000 0.000 3/55176 200.0 311.468 311.468 507.992 0.000 -0.000 0.000 3/55176 210.0 282.261 282.261 464.278 0.000 -0.000 0.000 3/55176 220.0 257.684 257.684 426.981 0.000 -0.000 0.000 3/55176 230.0 236.790 236.790 394.884 0.000 -0.000 0.000 3/55176 240.0 218.863 218.863 367.044 0.000 -0.000 0.000 3/55176 250.0 203.349 203.349 342.716 0.000 -0.000 0.000 3/55176 260.0 189.821 189.821 321.315 0.000 -0.000 0.000 3/55176 270.0 177.940 177.940 302.369 0.000 -0.000 0.000 3/55176 280.0 167.438 167.438 285.499 0.000 -0.000 0.000 3/55176 290.0 158.097 158.097 270.398 0.000 -0.000 0.000 3/55176 300.0 149.744 149.744 256.811 0.000 -0.000 0.000 3/55176 310.0 142.235 142.235 244.530 0.000 -0.000 0.000 3/55176 320.0 135.454 135.454 233.381 0.000 -0.000 0.000 3/55176 330.0 129.301 129.301 223.219 0.000 -0.000 0.000 3/55176 340.0 123.696 123.696 213.922 0.000 -0.000 0.000 3/55176 350.0 118.570 118.570 205.386 0.000 -0.000 0.000 3/55176 360.0 113.866 113.866 197.524 0.000 -0.000 0.000 3/55176 370.0 109.534 109.534 190.259 0.000 -0.000 0.000 3/55176 380.0 105.532 105.532 183.526 0.000 -0.000 0.000 3/55176 390.0 101.825 101.825 177.271 0.000 -0.000 0.000 3/55176 400.0 98.380 98.380 171.444 0.000 -0.000 0.000 3/55176 410.0 95.172 95.172 166.002 0.000 -0.000 0.000 3/55176 420.0 92.176 92.176 160.909 0.000 -0.000 0.000 3/55176 430.0 89.372 89.372 156.132 0.000 -0.000 0.000 3/55176 440.0 86.743 86.743 151.643 0.000 -0.000 0.000 3/55176 450.0 84.271 84.271 147.416 0.000 -0.000 0.000 3/55176 460.0 81.944 81.944 143.429 0.000 -0.000 0.000 3/55176 470.0 79.749 79.749 139.662 0.000 -0.000 0.000 3/55176 480.0 77.674 77.674 136.096 0.000 -0.000 0.000 3/55176 490.0 75.710 75.710 132.716 0.000 -0.000 0.000 3/55176 500.0 73.849 73.849 129.508 0.000 -0.000 0.000 3/55176 510.0 72.081 72.081 126.458 0.000 -0.000 0.000 3/55176 520.0 70.401 70.401 123.555 0.000 -0.000 0.000 3/55176 530.0 68.801 68.801 120.788 0.000 -0.000 0.000 3/55176 540.0 67.277 67.277 118.149 0.000 -0.000 0.000 3/55176 550.0 65.822 65.822 115.627 0.000 -0.000 0.000 3/55176 560.0 64.431 64.431 113.216 0.000 -0.000 0.000 3/55176 570.0 63.102 63.102 110.907 0.000 -0.000 0.000 3/55176 580.0 61.828 61.828 108.695 0.000 -0.000 0.000 3/55176 590.0 60.608 60.608 106.574 0.000 -0.000 0.000 3/55176 600.0 59.437 59.437 104.537 0.000 -0.000 0.000 3/55176 610.0 58.313 58.313 102.580 0.000 -0.000 0.000 3/55176 620.0 57.233 57.233 100.698 0.000 -0.000 0.000 3/55176 630.0 56.194 56.194 98.886 0.000 -0.000 0.000 3/55176 640.0 55.193 55.193 97.142 0.000 -0.000 0.000 3/55176 650.0 54.230 54.230 95.460 0.000 -0.000 0.000 3/55176 660.0 53.301 53.301 93.838 0.000 -0.000 0.000 3/55176 670.0 52.404 52.404 92.272 0.000 -0.000 0.000 3/55176 680.0 51.539 51.539 90.760 0.000 -0.000 0.000 3/55176 690.0 50.703 50.703 89.298 0.000 -0.000 0.000 3/55176 700.0 49.894 49.894 87.885 0.000 -0.000 0.000 3/55176 710.0 49.113 49.113 86.517 0.000 -0.000 0.000 3/55176 720.0 48.356 48.356 85.192 0.000 -0.000 0.000 3/55176 730.0 47.623 47.623 83.910 0.000 -0.000 0.000 3/55176 740.0 46.913 46.913 82.666 0.000 -0.000 0.000 3/55176 750.0 46.225 46.225 81.460 0.000 -0.000 0.000 3/55176 760.0 45.557 45.557 80.290 0.000 -0.000 0.000 3/55176 770.0 44.909 44.909 79.154 0.000 -0.000 0.000 3/55176 780.0 44.280 44.280 78.051 0.000 -0.000 0.000 3/55176 790.0 43.669 43.669 76.979 0.000 -0.000 0.000 3/55176 800.0 43.075 43.075 75.938 0.000 -0.000 0.000 3/55176 810.0 42.497 42.497 74.925 0.000 -0.000 0.000 3/55176 820.0 41.936 41.936 73.939 0.000 -0.000 0.000 3/55176 830.0 41.389 41.389 72.980 0.000 -0.000 0.000 3/55176 840.0 40.857 40.857 72.046 0.000 -0.000 0.000 3/55176 850.0 40.340 40.340 71.137 0.000 -0.000 0.000 3/55176 860.0 39.835 39.835 70.250 0.000 -0.000 0.000 3/55176 870.0 39.343 39.343 69.387 0.000 -0.000 0.000 3/55176 880.0 38.864 38.864 68.545 0.000 -0.000 0.000 3/55176 890.0 38.396 38.396 67.723 0.000 -0.000 0.000 3/55176 900.0 37.940 37.940 66.922 0.000 -0.000 0.000 3/55176 910.0 37.495 37.495 66.140 0.000 -0.000 0.000 3/55176 920.0 37.061 37.061 65.376 0.000 -0.000 0.000 3/55176 930.0 36.637 36.637 64.630 0.000 -0.000 0.000 3/55176 940.0 36.222 36.222 63.902 0.000 -0.000 0.000 3/55176 950.0 35.818 35.818 63.190 0.000 -0.000 0.000 3/55176 960.0 35.422 35.422 62.494 0.000 -0.000 0.000 3/55176 970.0 35.035 35.035 61.814 0.000 -0.000 0.000 3/55176 980.0 34.657 34.657 61.149 0.000 -0.000 0.000 3/55176 990.0 34.287 34.287 60.498 0.000 -0.000 0.000 3/55176 1000.0 33.926 33.926 59.861 0.000 -0.000 0.000 3/55176Thermal conductivity related properties were written into "kappa-m111119.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-07 22:29:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|