# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/c474a5d8-e396-423d-a011-701eae1aa525/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 Ca(SbO3)2 / P-31m (162) / materials id 9125](https://mdr.nims.go.jp/datasets/df3b08a2-2e9b-4976-887b-fee2c4c78872) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-07 23:13:04]-------------------------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 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P-31m (162)Number of symmetry operations in supercell: 144------------------------------ primitive cell ------------------------------Lattice vectors: a 5.268175932555225 0.000000000000000 0.000000000000000 b -2.634087966277613 4.562374189198600 0.000000000000000 c 0.000000000000000 0.000000000000000 5.014585530000000Atomic positions (fractional): *1 O 0.63289220351356 0.63289220351356 0.28012685748676 15.999 2 O 0.00000000000000 0.36710779648644 0.28012685748676 15.999 3 O 0.36710779648644 0.00000000000000 0.28012685748676 15.999 4 O 0.00000000000000 0.63289220351356 0.71987314251324 15.999 5 O 0.63289220351356 0.00000000000000 0.71987314251324 15.999 6 O 0.36710779648644 0.36710779648644 0.71987314251324 15.999 *7 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 *8 Sb 0.33333333333333 0.66666666666667 0.50000000000000 121.760 9 Sb 0.66666666666667 0.33333333333333 0.50000000000000 121.760-------------------------------- unit cell ---------------------------------Lattice vectors: a 5.268175932555225 0.000000000000000 0.000000000000000 b -2.634087966277613 4.562374189198600 0.000000000000000 c 0.000000000000000 0.000000000000000 5.014585530000000Atomic positions (fractional): *1 O 0.63289220351356 0.63289220351356 0.28012685748676 15.999 > 1 2 O 0.00000000000000 0.36710779648644 0.28012685748676 15.999 > 2 3 O 0.36710779648644 0.00000000000000 0.28012685748676 15.999 > 3 4 O 0.00000000000000 0.63289220351356 0.71987314251324 15.999 > 4 5 O 0.63289220351356 0.00000000000000 0.71987314251324 15.999 > 5 6 O 0.36710779648644 0.36710779648644 0.71987314251324 15.999 > 6 *7 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 > 7 *8 Sb 0.33333333333333 0.66666666666667 0.50000000000000 121.760 > 8 9 Sb 0.66666666666667 0.33333333333333 0.50000000000000 121.760 > 9-------------------------------- super cell --------------------------------Lattice vectors: a 10.536351865110451 0.000000000000000 0.000000000000000 b -5.268175932555226 9.124748378397200 0.000000000000000 c 0.000000000000000 0.000000000000000 15.043756589999999Atomic positions (fractional): *1 O 0.31644610175678 0.31644610175678 0.09337561916225 15.999 > 1 2 O 0.81644610175678 0.31644610175678 0.09337561916225 15.999 > 1 3 O 0.31644610175678 0.81644610175678 0.09337561916225 15.999 > 1 4 O 0.81644610175678 0.81644610175678 0.09337561916225 15.999 > 1 5 O 0.31644610175678 0.31644610175678 0.42670895249559 15.999 > 1 6 O 0.81644610175678 0.31644610175678 0.42670895249559 15.999 > 1 7 O 0.31644610175678 0.81644610175678 0.42670895249559 15.999 > 1 8 O 0.81644610175678 0.81644610175678 0.42670895249559 15.999 > 1 9 O 0.31644610175678 0.31644610175678 0.76004228582892 15.999 > 1 10 O 0.81644610175678 0.31644610175678 0.76004228582892 15.999 > 1 11 O 0.31644610175678 0.81644610175678 0.76004228582892 15.999 > 1 12 O 0.81644610175678 0.81644610175678 0.76004228582892 15.999 > 1 13 O 0.00000000000000 0.18355389824322 0.09337561916225 15.999 > 2 14 O 0.50000000000000 0.18355389824322 0.09337561916225 15.999 > 2 15 O 0.00000000000000 0.68355389824322 0.09337561916225 15.999 > 2 16 O 0.50000000000000 0.68355389824322 0.09337561916225 15.999 > 2 17 O 0.00000000000000 0.18355389824322 0.42670895249559 15.999 > 2 18 O 0.50000000000000 0.18355389824322 0.42670895249559 15.999 > 2 19 O 0.00000000000000 0.68355389824322 0.42670895249559 15.999 > 2 20 O 0.50000000000000 0.68355389824322 0.42670895249559 15.999 > 2 21 O 0.00000000000000 0.18355389824322 0.76004228582892 15.999 > 2 22 O 0.50000000000000 0.18355389824322 0.76004228582892 15.999 > 2 23 O 0.00000000000000 0.68355389824322 0.76004228582892 15.999 > 2 24 O 0.50000000000000 0.68355389824322 0.76004228582892 15.999 > 2 25 O 0.18355389824322 0.00000000000000 0.09337561916225 15.999 > 3 26 O 0.68355389824322 0.00000000000000 0.09337561916225 15.999 > 3 27 O 0.18355389824322 0.50000000000000 0.09337561916225 15.999 > 3 28 O 0.68355389824322 0.50000000000000 0.09337561916225 15.999 > 3 29 O 0.18355389824322 0.00000000000000 0.42670895249559 15.999 > 3 30 O 0.68355389824322 0.00000000000000 0.42670895249559 15.999 > 3 31 O 0.18355389824322 0.50000000000000 0.42670895249559 15.999 > 3 32 O 0.68355389824322 0.50000000000000 0.42670895249559 15.999 > 3 33 O 0.18355389824322 0.00000000000000 0.76004228582892 15.999 > 3 34 O 0.68355389824322 0.00000000000000 0.76004228582892 15.999 > 3 35 O 0.18355389824322 0.50000000000000 0.76004228582892 15.999 > 3 36 O 0.68355389824322 0.50000000000000 0.76004228582892 15.999 > 3 37 O 0.00000000000000 0.31644610175678 0.23995771417108 15.999 > 4 38 O 0.50000000000000 0.31644610175678 0.23995771417108 15.999 > 4 39 O 0.00000000000000 0.81644610175678 0.23995771417108 15.999 > 4 40 O 0.50000000000000 0.81644610175678 0.23995771417108 15.999 > 4 41 O 0.00000000000000 0.31644610175678 0.57329104750441 15.999 > 4 42 O 0.50000000000000 0.31644610175678 0.57329104750441 15.999 > 4 43 O 0.00000000000000 0.81644610175678 0.57329104750441 15.999 > 4 44 O 0.50000000000000 0.81644610175678 0.57329104750441 15.999 > 4 45 O 0.00000000000000 0.31644610175678 0.90662438083775 15.999 > 4 46 O 0.50000000000000 0.31644610175678 0.90662438083775 15.999 > 4 47 O 0.00000000000000 0.81644610175678 0.90662438083775 15.999 > 4 48 O 0.50000000000000 0.81644610175678 0.90662438083775 15.999 > 4 49 O 0.31644610175678 0.00000000000000 0.23995771417108 15.999 > 5 50 O 0.81644610175678 0.00000000000000 0.23995771417108 15.999 > 5 51 O 0.31644610175678 0.50000000000000 0.23995771417108 15.999 > 5 52 O 0.81644610175678 0.50000000000000 0.23995771417108 15.999 > 5 53 O 0.31644610175678 0.00000000000000 0.57329104750441 15.999 > 5 54 O 0.81644610175678 0.00000000000000 0.57329104750441 15.999 > 5 55 O 0.31644610175678 0.50000000000000 0.57329104750441 15.999 > 5 56 O 0.81644610175678 0.50000000000000 0.57329104750441 15.999 > 5 57 O 0.31644610175678 0.00000000000000 0.90662438083775 15.999 > 5 58 O 0.81644610175678 0.00000000000000 0.90662438083775 15.999 > 5 59 O 0.31644610175678 0.50000000000000 0.90662438083775 15.999 > 5 60 O 0.81644610175678 0.50000000000000 0.90662438083775 15.999 > 5 61 O 0.18355389824322 0.18355389824322 0.23995771417108 15.999 > 6 62 O 0.68355389824322 0.18355389824322 0.23995771417108 15.999 > 6 63 O 0.18355389824322 0.68355389824322 0.23995771417108 15.999 > 6 64 O 0.68355389824322 0.68355389824322 0.23995771417108 15.999 > 6 65 O 0.18355389824322 0.18355389824322 0.57329104750441 15.999 > 6 66 O 0.68355389824322 0.18355389824322 0.57329104750441 15.999 > 6 67 O 0.18355389824322 0.68355389824322 0.57329104750441 15.999 > 6 68 O 0.68355389824322 0.68355389824322 0.57329104750441 15.999 > 6 69 O 0.18355389824322 0.18355389824322 0.90662438083775 15.999 > 6 70 O 0.68355389824322 0.18355389824322 0.90662438083775 15.999 > 6 71 O 0.18355389824322 0.68355389824322 0.90662438083775 15.999 > 6 72 O 0.68355389824322 0.68355389824322 0.90662438083775 15.999 > 6 *73 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 > 7 74 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 > 7 75 Ca 0.00000000000000 0.50000000000000 0.00000000000000 40.078 > 7 76 Ca 0.50000000000000 0.50000000000000 0.00000000000000 40.078 > 7 77 Ca 0.00000000000000 0.00000000000000 0.33333333333333 40.078 > 7 78 Ca 0.50000000000000 0.00000000000000 0.33333333333333 40.078 > 7 79 Ca 0.00000000000000 0.50000000000000 0.33333333333333 40.078 > 7 80 Ca 0.50000000000000 0.50000000000000 0.33333333333333 40.078 > 7 81 Ca 0.00000000000000 0.00000000000000 0.66666666666667 40.078 > 7 82 Ca 0.50000000000000 0.00000000000000 0.66666666666667 40.078 > 7 83 Ca 0.00000000000000 0.50000000000000 0.66666666666667 40.078 > 7 84 Ca 0.50000000000000 0.50000000000000 0.66666666666667 40.078 > 7 *85 Sb 0.16666666666667 0.33333333333333 0.16666666666667 121.760 > 8 86 Sb 0.66666666666667 0.33333333333333 0.16666666666667 121.760 > 8 87 Sb 0.16666666666667 0.83333333333333 0.16666666666667 121.760 > 8 88 Sb 0.66666666666667 0.83333333333333 0.16666666666667 121.760 > 8 89 Sb 0.16666666666667 0.33333333333333 0.50000000000000 121.760 > 8 90 Sb 0.66666666666667 0.33333333333333 0.50000000000000 121.760 > 8 91 Sb 0.16666666666667 0.83333333333333 0.50000000000000 121.760 > 8 92 Sb 0.66666666666667 0.83333333333333 0.50000000000000 121.760 > 8 93 Sb 0.16666666666667 0.33333333333333 0.83333333333333 121.760 > 8 94 Sb 0.66666666666667 0.33333333333333 0.83333333333333 121.760 > 8 95 Sb 0.16666666666667 0.83333333333333 0.83333333333333 121.760 > 8 96 Sb 0.66666666666667 0.83333333333333 0.83333333333333 121.760 > 8 97 Sb 0.33333333333333 0.16666666666667 0.16666666666667 121.760 > 9 98 Sb 0.83333333333333 0.16666666666667 0.16666666666667 121.760 > 9 99 Sb 0.33333333333333 0.66666666666667 0.16666666666667 121.760 > 9 100 Sb 0.83333333333333 0.66666666666667 0.16666666666667 121.760 > 9 101 Sb 0.33333333333333 0.16666666666667 0.50000000000000 121.760 > 9 102 Sb 0.83333333333333 0.16666666666667 0.50000000000000 121.760 > 9 103 Sb 0.33333333333333 0.66666666666667 0.50000000000000 121.760 > 9 104 Sb 0.83333333333333 0.66666666666667 0.50000000000000 121.760 > 9 105 Sb 0.33333333333333 0.16666666666667 0.83333333333333 121.760 > 9 106 Sb 0.83333333333333 0.16666666666667 0.83333333333333 121.760 > 9 107 Sb 0.33333333333333 0.66666666666667 0.83333333333333 121.760 > 9 108 Sb 0.83333333333333 0.66666666666667 0.83333333333333 121.760 > 9----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 3.8580637 0.0000000 0.0000000 -0.0000000 3.8580637 0.0000000 0.0000000 0.0000000 3.1522675-------------------------- Born effective charges -------------------------- 1 O -2.2536253 0.3255622 0.1831012 0.3255622 -1.8776984 0.3171405 0.2342662 0.4057609 -1.4845671 2 O -2.2536253 -0.3255622 0.1831012 -0.3255622 -1.8776984 -0.3171405 0.2342662 -0.4057609 -1.4845671 3 O -1.6897349 -0.0000000 -0.3662024 0.0000000 -2.4415887 0.0000000 -0.4685323 -0.0000000 -1.4845671 4 O -2.2536253 -0.3255622 0.1831012 -0.3255622 -1.8776984 -0.3171405 0.2342662 -0.4057609 -1.4845671 5 O -1.6897349 -0.0000000 -0.3662024 0.0000000 -2.4415887 0.0000000 -0.4685323 -0.0000000 -1.4845671 6 O -2.2536253 0.3255622 0.1831012 0.3255622 -1.8776984 0.3171405 0.2342662 0.4057609 -1.4845671 7 Ca 2.4946414 0.0000000 0.0000000 0.0000000 2.4946414 0.0000000 -0.0000000 0.0000000 3.0284596 8 Sb 4.9496647 0.0000000 0.0000000 0.0000000 4.9496647 0.0000000 -0.0000000 0.0000000 2.9394714 9 Sb 4.9496647 0.0000000 0.0000000 0.0000000 4.9496647 0.0000000 -0.0000000 0.0000000 2.9394714----------------------------------------------------------------------------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: 324/324Permutation basis: 4806/4806Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 420Number of blocks in projector: 257Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 3--- Eigsh_solver_block: 1 / 3 ---Block_size: 194Use standard eigh solver.--- Eigsh_solver_block: 2 / 3 ---Block_size: 158Use standard eigh solver.--- Eigsh_solver_block: 3 / 3 ---Block_size: 68Use standard eigh solver.Tree of FC basis block matrices:- (420, 411), data: False|-- (68, 65), data: True|-- (158, 156), data: True|-- (194, 190), data: True-----Solver_atoms: 1 -- 108 / 108Time (Solver_compr_matrix_reshape): 0.011Solver_block: 100 / 160 - Time: 0.311Solver_block: 160 / 160 - Time: 0.215Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.540--------------------------------- Symfc end --------------------------------Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 324/324Permutation basis: 4806/4806Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 420Number of blocks in projector: 257Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 3--- Eigsh_solver_block: 1 / 3 ---Block_size: 194Use standard eigh solver.--- Eigsh_solver_block: 2 / 3 ---Block_size: 158Use standard eigh solver.--- Eigsh_solver_block: 3 / 3 ---Block_size: 68Use standard eigh solver.Tree of FC basis block matrices:- (420, 411), data: False|-- (68, 65), data: True|-- (158, 156), data: True|-- (194, 190), data: TrueMax drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5".---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d)----------------------------------------------------------------------------Summary of calculation was written in "phonopy.yaml".-------------------------[time 2026-01-07 23:13:11]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-07 23:13:12]-------------------------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 3]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P-31m (162)------------------------------ primitive cell ------------------------------Lattice vectors: a 5.268175932555225 0.000000000000000 0.000000000000000 b -2.634087966277613 4.562374189198600 0.000000000000000 c 0.000000000000000 0.000000000000000 5.014585530000000Atomic positions (fractional): 1 O 0.63289220351356 0.63289220351356 0.28012685748676 15.999 2 O 0.00000000000000 0.36710779648644 0.28012685748676 15.999 3 O 0.36710779648644 0.00000000000000 0.28012685748676 15.999 4 O 0.00000000000000 0.63289220351356 0.71987314251324 15.999 5 O 0.63289220351356 0.00000000000000 0.71987314251324 15.999 6 O 0.36710779648644 0.36710779648644 0.71987314251324 15.999 7 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 8 Sb 0.33333333333333 0.66666666666667 0.50000000000000 121.760 9 Sb 0.66666666666667 0.33333333333333 0.50000000000000 121.760-------------------------------- supercell ---------------------------------Lattice vectors: a 10.536351865110451 0.000000000000000 0.000000000000000 b -5.268175932555226 9.124748378397200 0.000000000000000 c 0.000000000000000 0.000000000000000 15.043756589999999Atomic positions (fractional): 1 O 0.31644610175678 0.31644610175678 0.09337561916225 15.999 > 1 2 O 0.81644610175678 0.31644610175678 0.09337561916225 15.999 > 1 3 O 0.31644610175678 0.81644610175678 0.09337561916225 15.999 > 1 4 O 0.81644610175678 0.81644610175678 0.09337561916225 15.999 > 1 5 O 0.31644610175678 0.31644610175678 0.42670895249559 15.999 > 1 6 O 0.81644610175678 0.31644610175678 0.42670895249559 15.999 > 1 7 O 0.31644610175678 0.81644610175678 0.42670895249559 15.999 > 1 8 O 0.81644610175678 0.81644610175678 0.42670895249559 15.999 > 1 9 O 0.31644610175678 0.31644610175678 0.76004228582892 15.999 > 1 10 O 0.81644610175678 0.31644610175678 0.76004228582892 15.999 > 1 11 O 0.31644610175678 0.81644610175678 0.76004228582892 15.999 > 1 12 O 0.81644610175678 0.81644610175678 0.76004228582892 15.999 > 1 13 O 0.00000000000000 0.18355389824322 0.09337561916225 15.999 > 13 14 O 0.50000000000000 0.18355389824322 0.09337561916225 15.999 > 13 15 O 0.00000000000000 0.68355389824322 0.09337561916225 15.999 > 13 16 O 0.50000000000000 0.68355389824322 0.09337561916225 15.999 > 13 17 O 0.00000000000000 0.18355389824322 0.42670895249559 15.999 > 13 18 O 0.50000000000000 0.18355389824322 0.42670895249559 15.999 > 13 19 O 0.00000000000000 0.68355389824322 0.42670895249559 15.999 > 13 20 O 0.50000000000000 0.68355389824322 0.42670895249559 15.999 > 13 21 O 0.00000000000000 0.18355389824322 0.76004228582892 15.999 > 13 22 O 0.50000000000000 0.18355389824322 0.76004228582892 15.999 > 13 23 O 0.00000000000000 0.68355389824322 0.76004228582892 15.999 > 13 24 O 0.50000000000000 0.68355389824322 0.76004228582892 15.999 > 13 25 O 0.18355389824322 0.00000000000000 0.09337561916225 15.999 > 25 26 O 0.68355389824322 0.00000000000000 0.09337561916225 15.999 > 25 27 O 0.18355389824322 0.50000000000000 0.09337561916225 15.999 > 25 28 O 0.68355389824322 0.50000000000000 0.09337561916225 15.999 > 25 29 O 0.18355389824322 0.00000000000000 0.42670895249559 15.999 > 25 30 O 0.68355389824322 0.00000000000000 0.42670895249559 15.999 > 25 31 O 0.18355389824322 0.50000000000000 0.42670895249559 15.999 > 25 32 O 0.68355389824322 0.50000000000000 0.42670895249559 15.999 > 25 33 O 0.18355389824322 0.00000000000000 0.76004228582892 15.999 > 25 34 O 0.68355389824322 0.00000000000000 0.76004228582892 15.999 > 25 35 O 0.18355389824322 0.50000000000000 0.76004228582892 15.999 > 25 36 O 0.68355389824322 0.50000000000000 0.76004228582892 15.999 > 25 37 O 0.00000000000000 0.31644610175678 0.23995771417108 15.999 > 37 38 O 0.50000000000000 0.31644610175678 0.23995771417108 15.999 > 37 39 O 0.00000000000000 0.81644610175678 0.23995771417108 15.999 > 37 40 O 0.50000000000000 0.81644610175678 0.23995771417108 15.999 > 37 41 O 0.00000000000000 0.31644610175678 0.57329104750441 15.999 > 37 42 O 0.50000000000000 0.31644610175678 0.57329104750441 15.999 > 37 43 O 0.00000000000000 0.81644610175678 0.57329104750441 15.999 > 37 44 O 0.50000000000000 0.81644610175678 0.57329104750441 15.999 > 37 45 O 0.00000000000000 0.31644610175678 0.90662438083775 15.999 > 37 46 O 0.50000000000000 0.31644610175678 0.90662438083775 15.999 > 37 47 O 0.00000000000000 0.81644610175678 0.90662438083775 15.999 > 37 48 O 0.50000000000000 0.81644610175678 0.90662438083775 15.999 > 37 49 O 0.31644610175678 0.00000000000000 0.23995771417108 15.999 > 49 50 O 0.81644610175678 0.00000000000000 0.23995771417108 15.999 > 49 51 O 0.31644610175678 0.50000000000000 0.23995771417108 15.999 > 49 52 O 0.81644610175678 0.50000000000000 0.23995771417108 15.999 > 49 53 O 0.31644610175678 0.00000000000000 0.57329104750441 15.999 > 49 54 O 0.81644610175678 0.00000000000000 0.57329104750441 15.999 > 49 55 O 0.31644610175678 0.50000000000000 0.57329104750441 15.999 > 49 56 O 0.81644610175678 0.50000000000000 0.57329104750441 15.999 > 49 57 O 0.31644610175678 0.00000000000000 0.90662438083775 15.999 > 49 58 O 0.81644610175678 0.00000000000000 0.90662438083775 15.999 > 49 59 O 0.31644610175678 0.50000000000000 0.90662438083775 15.999 > 49 60 O 0.81644610175678 0.50000000000000 0.90662438083775 15.999 > 49 61 O 0.18355389824322 0.18355389824322 0.23995771417108 15.999 > 61 62 O 0.68355389824322 0.18355389824322 0.23995771417108 15.999 > 61 63 O 0.18355389824322 0.68355389824322 0.23995771417108 15.999 > 61 64 O 0.68355389824322 0.68355389824322 0.23995771417108 15.999 > 61 65 O 0.18355389824322 0.18355389824322 0.57329104750441 15.999 > 61 66 O 0.68355389824322 0.18355389824322 0.57329104750441 15.999 > 61 67 O 0.18355389824322 0.68355389824322 0.57329104750441 15.999 > 61 68 O 0.68355389824322 0.68355389824322 0.57329104750441 15.999 > 61 69 O 0.18355389824322 0.18355389824322 0.90662438083775 15.999 > 61 70 O 0.68355389824322 0.18355389824322 0.90662438083775 15.999 > 61 71 O 0.18355389824322 0.68355389824322 0.90662438083775 15.999 > 61 72 O 0.68355389824322 0.68355389824322 0.90662438083775 15.999 > 61 73 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 > 73 74 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 > 73 75 Ca 0.00000000000000 0.50000000000000 0.00000000000000 40.078 > 73 76 Ca 0.50000000000000 0.50000000000000 0.00000000000000 40.078 > 73 77 Ca 0.00000000000000 0.00000000000000 0.33333333333333 40.078 > 73 78 Ca 0.50000000000000 0.00000000000000 0.33333333333333 40.078 > 73 79 Ca 0.00000000000000 0.50000000000000 0.33333333333333 40.078 > 73 80 Ca 0.50000000000000 0.50000000000000 0.33333333333333 40.078 > 73 81 Ca 0.00000000000000 0.00000000000000 0.66666666666667 40.078 > 73 82 Ca 0.50000000000000 0.00000000000000 0.66666666666667 40.078 > 73 83 Ca 0.00000000000000 0.50000000000000 0.66666666666667 40.078 > 73 84 Ca 0.50000000000000 0.50000000000000 0.66666666666667 40.078 > 73 85 Sb 0.16666666666667 0.33333333333333 0.16666666666667 121.760 > 85 86 Sb 0.66666666666667 0.33333333333333 0.16666666666667 121.760 > 85 87 Sb 0.16666666666667 0.83333333333333 0.16666666666667 121.760 > 85 88 Sb 0.66666666666667 0.83333333333333 0.16666666666667 121.760 > 85 89 Sb 0.16666666666667 0.33333333333333 0.50000000000000 121.760 > 85 90 Sb 0.66666666666667 0.33333333333333 0.50000000000000 121.760 > 85 91 Sb 0.16666666666667 0.83333333333333 0.50000000000000 121.760 > 85 92 Sb 0.66666666666667 0.83333333333333 0.50000000000000 121.760 > 85 93 Sb 0.16666666666667 0.33333333333333 0.83333333333333 121.760 > 85 94 Sb 0.66666666666667 0.33333333333333 0.83333333333333 121.760 > 85 95 Sb 0.16666666666667 0.83333333333333 0.83333333333333 121.760 > 85 96 Sb 0.66666666666667 0.83333333333333 0.83333333333333 121.760 > 85 97 Sb 0.33333333333333 0.16666666666667 0.16666666666667 121.760 > 97 98 Sb 0.83333333333333 0.16666666666667 0.16666666666667 121.760 > 97 99 Sb 0.33333333333333 0.66666666666667 0.16666666666667 121.760 > 97 100 Sb 0.83333333333333 0.66666666666667 0.16666666666667 121.760 > 97 101 Sb 0.33333333333333 0.16666666666667 0.50000000000000 121.760 > 97 102 Sb 0.83333333333333 0.16666666666667 0.50000000000000 121.760 > 97 103 Sb 0.33333333333333 0.66666666666667 0.50000000000000 121.760 > 97 104 Sb 0.83333333333333 0.66666666666667 0.50000000000000 121.760 > 97 105 Sb 0.33333333333333 0.16666666666667 0.83333333333333 121.760 > 97 106 Sb 0.83333333333333 0.16666666666667 0.83333333333333 121.760 > 97 107 Sb 0.33333333333333 0.66666666666667 0.83333333333333 121.760 > 97 108 Sb 0.83333333333333 0.66666666666667 0.83333333333333 121.760 > 97----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 3.8580637 0.0000000 0.0000000 -0.0000000 3.8580637 0.0000000 0.0000000 0.0000000 3.1522675-------------------------- Born effective charges -------------------------- 1 O -2.2536253 0.3255622 0.1831012 0.3255622 -1.8776984 0.3171405 0.2342662 0.4057609 -1.4845671 2 O -2.2536253 -0.3255622 0.1831012 -0.3255622 -1.8776984 -0.3171405 0.2342662 -0.4057609 -1.4845671 3 O -1.6897349 -0.0000000 -0.3662024 0.0000000 -2.4415887 0.0000000 -0.4685323 -0.0000000 -1.4845671 4 O -2.2536253 -0.3255622 0.1831012 -0.3255622 -1.8776984 -0.3171405 0.2342662 -0.4057609 -1.4845671 5 O -1.6897349 -0.0000000 -0.3662024 0.0000000 -2.4415887 0.0000000 -0.4685323 -0.0000000 -1.4845671 6 O -2.2536253 0.3255622 0.1831012 0.3255622 -1.8776984 0.3171405 0.2342662 0.4057609 -1.4845671 7 Ca 2.4946414 0.0000000 0.0000000 0.0000000 2.4946414 0.0000000 -0.0000000 0.0000000 3.0284596 8 Sb 4.9496647 0.0000000 0.0000000 0.0000000 4.9496647 0.0000000 -0.0000000 0.0000000 2.9394714 9 Sb 4.9496647 0.0000000 0.0000000 0.0000000 4.9496647 0.0000000 -0.0000000 0.0000000 2.9394714----------------------------------------------------------------------------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[ 73, 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[ 85, 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: 0.00000003 (yyy) 0.00000003 (yyy) 0.00000003 (yyy)fc3 was written into "fc3.hdf5".Max drift of fc2: 0.00000004 (zx) 0.00000004 (zx) fc2 was written into "fc2.hdf5".--------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): 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 23:13:18]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-07 23:13:19]-------------------------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 3]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P-31m (162)------------------------------ primitive cell ------------------------------Lattice vectors: a 5.268175932555225 0.000000000000000 0.000000000000000 b -2.634087966277613 4.562374189198600 0.000000000000000 c 0.000000000000000 0.000000000000000 5.014585530000000Atomic positions (fractional): 1 O 0.63289220351356 0.63289220351356 0.28012685748676 15.999 2 O 0.00000000000000 0.36710779648644 0.28012685748676 15.999 3 O 0.36710779648644 0.00000000000000 0.28012685748676 15.999 4 O 0.00000000000000 0.63289220351356 0.71987314251324 15.999 5 O 0.63289220351356 0.00000000000000 0.71987314251324 15.999 6 O 0.36710779648644 0.36710779648644 0.71987314251324 15.999 7 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 8 Sb 0.33333333333333 0.66666666666667 0.50000000000000 121.760 9 Sb 0.66666666666667 0.33333333333333 0.50000000000000 121.760-------------------------------- supercell ---------------------------------Lattice vectors: a 10.536351865110451 0.000000000000000 0.000000000000000 b -5.268175932555226 9.124748378397200 0.000000000000000 c 0.000000000000000 0.000000000000000 15.043756589999999Atomic positions (fractional): 1 O 0.31644610175678 0.31644610175678 0.09337561916225 15.999 > 1 2 O 0.81644610175678 0.31644610175678 0.09337561916225 15.999 > 1 3 O 0.31644610175678 0.81644610175678 0.09337561916225 15.999 > 1 4 O 0.81644610175678 0.81644610175678 0.09337561916225 15.999 > 1 5 O 0.31644610175678 0.31644610175678 0.42670895249559 15.999 > 1 6 O 0.81644610175678 0.31644610175678 0.42670895249559 15.999 > 1 7 O 0.31644610175678 0.81644610175678 0.42670895249559 15.999 > 1 8 O 0.81644610175678 0.81644610175678 0.42670895249559 15.999 > 1 9 O 0.31644610175678 0.31644610175678 0.76004228582892 15.999 > 1 10 O 0.81644610175678 0.31644610175678 0.76004228582892 15.999 > 1 11 O 0.31644610175678 0.81644610175678 0.76004228582892 15.999 > 1 12 O 0.81644610175678 0.81644610175678 0.76004228582892 15.999 > 1 13 O 0.00000000000000 0.18355389824322 0.09337561916225 15.999 > 13 14 O 0.50000000000000 0.18355389824322 0.09337561916225 15.999 > 13 15 O 0.00000000000000 0.68355389824322 0.09337561916225 15.999 > 13 16 O 0.50000000000000 0.68355389824322 0.09337561916225 15.999 > 13 17 O 0.00000000000000 0.18355389824322 0.42670895249559 15.999 > 13 18 O 0.50000000000000 0.18355389824322 0.42670895249559 15.999 > 13 19 O 0.00000000000000 0.68355389824322 0.42670895249559 15.999 > 13 20 O 0.50000000000000 0.68355389824322 0.42670895249559 15.999 > 13 21 O 0.00000000000000 0.18355389824322 0.76004228582892 15.999 > 13 22 O 0.50000000000000 0.18355389824322 0.76004228582892 15.999 > 13 23 O 0.00000000000000 0.68355389824322 0.76004228582892 15.999 > 13 24 O 0.50000000000000 0.68355389824322 0.76004228582892 15.999 > 13 25 O 0.18355389824322 0.00000000000000 0.09337561916225 15.999 > 25 26 O 0.68355389824322 0.00000000000000 0.09337561916225 15.999 > 25 27 O 0.18355389824322 0.50000000000000 0.09337561916225 15.999 > 25 28 O 0.68355389824322 0.50000000000000 0.09337561916225 15.999 > 25 29 O 0.18355389824322 0.00000000000000 0.42670895249559 15.999 > 25 30 O 0.68355389824322 0.00000000000000 0.42670895249559 15.999 > 25 31 O 0.18355389824322 0.50000000000000 0.42670895249559 15.999 > 25 32 O 0.68355389824322 0.50000000000000 0.42670895249559 15.999 > 25 33 O 0.18355389824322 0.00000000000000 0.76004228582892 15.999 > 25 34 O 0.68355389824322 0.00000000000000 0.76004228582892 15.999 > 25 35 O 0.18355389824322 0.50000000000000 0.76004228582892 15.999 > 25 36 O 0.68355389824322 0.50000000000000 0.76004228582892 15.999 > 25 37 O 0.00000000000000 0.31644610175678 0.23995771417108 15.999 > 37 38 O 0.50000000000000 0.31644610175678 0.23995771417108 15.999 > 37 39 O 0.00000000000000 0.81644610175678 0.23995771417108 15.999 > 37 40 O 0.50000000000000 0.81644610175678 0.23995771417108 15.999 > 37 41 O 0.00000000000000 0.31644610175678 0.57329104750441 15.999 > 37 42 O 0.50000000000000 0.31644610175678 0.57329104750441 15.999 > 37 43 O 0.00000000000000 0.81644610175678 0.57329104750441 15.999 > 37 44 O 0.50000000000000 0.81644610175678 0.57329104750441 15.999 > 37 45 O 0.00000000000000 0.31644610175678 0.90662438083775 15.999 > 37 46 O 0.50000000000000 0.31644610175678 0.90662438083775 15.999 > 37 47 O 0.00000000000000 0.81644610175678 0.90662438083775 15.999 > 37 48 O 0.50000000000000 0.81644610175678 0.90662438083775 15.999 > 37 49 O 0.31644610175678 0.00000000000000 0.23995771417108 15.999 > 49 50 O 0.81644610175678 0.00000000000000 0.23995771417108 15.999 > 49 51 O 0.31644610175678 0.50000000000000 0.23995771417108 15.999 > 49 52 O 0.81644610175678 0.50000000000000 0.23995771417108 15.999 > 49 53 O 0.31644610175678 0.00000000000000 0.57329104750441 15.999 > 49 54 O 0.81644610175678 0.00000000000000 0.57329104750441 15.999 > 49 55 O 0.31644610175678 0.50000000000000 0.57329104750441 15.999 > 49 56 O 0.81644610175678 0.50000000000000 0.57329104750441 15.999 > 49 57 O 0.31644610175678 0.00000000000000 0.90662438083775 15.999 > 49 58 O 0.81644610175678 0.00000000000000 0.90662438083775 15.999 > 49 59 O 0.31644610175678 0.50000000000000 0.90662438083775 15.999 > 49 60 O 0.81644610175678 0.50000000000000 0.90662438083775 15.999 > 49 61 O 0.18355389824322 0.18355389824322 0.23995771417108 15.999 > 61 62 O 0.68355389824322 0.18355389824322 0.23995771417108 15.999 > 61 63 O 0.18355389824322 0.68355389824322 0.23995771417108 15.999 > 61 64 O 0.68355389824322 0.68355389824322 0.23995771417108 15.999 > 61 65 O 0.18355389824322 0.18355389824322 0.57329104750441 15.999 > 61 66 O 0.68355389824322 0.18355389824322 0.57329104750441 15.999 > 61 67 O 0.18355389824322 0.68355389824322 0.57329104750441 15.999 > 61 68 O 0.68355389824322 0.68355389824322 0.57329104750441 15.999 > 61 69 O 0.18355389824322 0.18355389824322 0.90662438083775 15.999 > 61 70 O 0.68355389824322 0.18355389824322 0.90662438083775 15.999 > 61 71 O 0.18355389824322 0.68355389824322 0.90662438083775 15.999 > 61 72 O 0.68355389824322 0.68355389824322 0.90662438083775 15.999 > 61 73 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 > 73 74 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 > 73 75 Ca 0.00000000000000 0.50000000000000 0.00000000000000 40.078 > 73 76 Ca 0.50000000000000 0.50000000000000 0.00000000000000 40.078 > 73 77 Ca 0.00000000000000 0.00000000000000 0.33333333333333 40.078 > 73 78 Ca 0.50000000000000 0.00000000000000 0.33333333333333 40.078 > 73 79 Ca 0.00000000000000 0.50000000000000 0.33333333333333 40.078 > 73 80 Ca 0.50000000000000 0.50000000000000 0.33333333333333 40.078 > 73 81 Ca 0.00000000000000 0.00000000000000 0.66666666666667 40.078 > 73 82 Ca 0.50000000000000 0.00000000000000 0.66666666666667 40.078 > 73 83 Ca 0.00000000000000 0.50000000000000 0.66666666666667 40.078 > 73 84 Ca 0.50000000000000 0.50000000000000 0.66666666666667 40.078 > 73 85 Sb 0.16666666666667 0.33333333333333 0.16666666666667 121.760 > 85 86 Sb 0.66666666666667 0.33333333333333 0.16666666666667 121.760 > 85 87 Sb 0.16666666666667 0.83333333333333 0.16666666666667 121.760 > 85 88 Sb 0.66666666666667 0.83333333333333 0.16666666666667 121.760 > 85 89 Sb 0.16666666666667 0.33333333333333 0.50000000000000 121.760 > 85 90 Sb 0.66666666666667 0.33333333333333 0.50000000000000 121.760 > 85 91 Sb 0.16666666666667 0.83333333333333 0.50000000000000 121.760 > 85 92 Sb 0.66666666666667 0.83333333333333 0.50000000000000 121.760 > 85 93 Sb 0.16666666666667 0.33333333333333 0.83333333333333 121.760 > 85 94 Sb 0.66666666666667 0.33333333333333 0.83333333333333 121.760 > 85 95 Sb 0.16666666666667 0.83333333333333 0.83333333333333 121.760 > 85 96 Sb 0.66666666666667 0.83333333333333 0.83333333333333 121.760 > 85 97 Sb 0.33333333333333 0.16666666666667 0.16666666666667 121.760 > 97 98 Sb 0.83333333333333 0.16666666666667 0.16666666666667 121.760 > 97 99 Sb 0.33333333333333 0.66666666666667 0.16666666666667 121.760 > 97 100 Sb 0.83333333333333 0.66666666666667 0.16666666666667 121.760 > 97 101 Sb 0.33333333333333 0.16666666666667 0.50000000000000 121.760 > 97 102 Sb 0.83333333333333 0.16666666666667 0.50000000000000 121.760 > 97 103 Sb 0.33333333333333 0.66666666666667 0.50000000000000 121.760 > 97 104 Sb 0.83333333333333 0.66666666666667 0.50000000000000 121.760 > 97 105 Sb 0.33333333333333 0.16666666666667 0.83333333333333 121.760 > 97 106 Sb 0.83333333333333 0.16666666666667 0.83333333333333 121.760 > 97 107 Sb 0.33333333333333 0.66666666666667 0.83333333333333 121.760 > 97 108 Sb 0.83333333333333 0.66666666666667 0.83333333333333 121.760 > 97----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 3.8580637 0.0000000 0.0000000 -0.0000000 3.8580637 0.0000000 0.0000000 0.0000000 3.1522675-------------------------- Born effective charges -------------------------- 1 O -2.2536253 0.3255622 0.1831012 0.3255622 -1.8776984 0.3171405 0.2342662 0.4057609 -1.4845671 2 O -2.2536253 -0.3255622 0.1831012 -0.3255622 -1.8776984 -0.3171405 0.2342662 -0.4057609 -1.4845671 3 O -1.6897349 -0.0000000 -0.3662024 0.0000000 -2.4415887 0.0000000 -0.4685323 -0.0000000 -1.4845671 4 O -2.2536253 -0.3255622 0.1831012 -0.3255622 -1.8776984 -0.3171405 0.2342662 -0.4057609 -1.4845671 5 O -1.6897349 -0.0000000 -0.3662024 0.0000000 -2.4415887 0.0000000 -0.4685323 -0.0000000 -1.4845671 6 O -2.2536253 0.3255622 0.1831012 0.3255622 -1.8776984 0.3171405 0.2342662 0.4057609 -1.4845671 7 Ca 2.4946414 0.0000000 0.0000000 0.0000000 2.4946414 0.0000000 -0.0000000 0.0000000 3.0284596 8 Sb 4.9496647 0.0000000 0.0000000 0.0000000 4.9496647 0.0000000 -0.0000000 0.0000000 2.9394714 9 Sb 4.9496647 0.0000000 0.0000000 0.0000000 4.9496647 0.0000000 -0.0000000 0.0000000 2.9394714----------------------------------------------------------------------------fc3 was read from "fc3.hdf5".fc2 was read from "fc2.hdf5".----------------------------- Force constants ------------------------------Max drift of fc3: 0.00000003 (yyy) 0.00000003 (yyy) 0.00000003 (yyy)Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- 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 10 ]fc3-r2q-transformation over three atoms: True--------------------------- Phonon calculations ----------------------------Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.84, Number of G-points: 315, Lambda: 0.17Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/136) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 136Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 4.099 ( 0.000 0.000 0.000) 0.000 5.511 ( 0.000 0.000 0.000) 0.000 5.638 ( 0.000 0.000 0.000) 0.000 5.638 ( 0.000 0.000 0.000) 0.000 6.686 ( 0.000 0.000 0.000) 0.000 6.686 ( 0.000 0.000 0.000) 0.000 8.335 ( 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 9.415 ( 0.000 0.000 0.000) 0.000 9.415 ( 0.000 0.000 0.000) 0.000 9.548 ( 0.000 0.000 0.000) 0.000 15.352 ( 0.000 0.000 0.000) 0.000 15.352 ( 0.000 0.000 0.000) 0.000 15.578 ( 0.000 0.000 0.000) 0.000 15.578 ( 0.000 0.000 0.000) 0.000 16.384 ( 0.000 0.000 0.000) 0.000 16.384 ( 0.000 0.000 0.000) 0.000 17.086 ( 0.000 0.000 0.000) 0.000 17.430 ( 0.000 0.000 0.000) 0.000 19.277 ( 0.000 0.000 0.000) 0.000 19.320 ( 0.000 0.000 0.000) 0.000 19.422 ( 0.000 0.000 0.000) 0.000 19.422 ( 0.000 0.000 0.000) 0.000======================= Grid point 1 (2/136) =======================q-point: ( 0.09 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.568 ( 24.576 14.189 0.000) 28.378 0.700 ( 29.956 17.295 0.000) 34.591 1.376 ( 59.246 34.206 0.000) 68.412 4.063 ( -3.092 -1.785 0.000) 3.571 5.500 ( -0.777 -0.449 0.000) 0.897 5.595 ( -3.621 -2.091 0.000) 4.182 5.976 ( -8.774 -5.066 0.000) 10.131 6.672 ( -1.347 -0.777 0.000) 1.555 6.700 ( 1.265 0.730 0.000) 1.460 8.256 ( -6.139 -3.544 0.000) 7.089 8.792 ( -1.702 -0.983 0.000) 1.965 9.339 ( -6.566 -3.791 0.000) 7.582 9.468 ( -6.559 -3.787 0.000) 7.574 9.507 ( 7.105 4.102 0.000) 8.205 10.241 ( 4.728 2.730 0.000) 5.460 15.352 ( -0.060 -0.034 0.000) 0.069 15.352 ( -0.000 -0.000 0.000) 0.000 15.657 ( 6.593 3.806 0.000) 7.612 16.310 ( 6.248 3.607 0.000) 7.214 16.331 ( -4.199 -2.424 0.000) 4.848 17.057 ( -2.463 -1.422 0.000) 2.844 17.449 ( 1.385 0.800 0.000) 1.599 19.294 ( -0.314 -0.181 0.000) 0.363 19.310 ( 0.358 0.207 0.000) 0.413 19.402 ( -1.205 -0.696 0.000) 1.392 19.415 ( -0.553 -0.319 0.000) 0.638 20.684 ( -2.426 -1.400 0.000) 2.801======================= Grid point 2 (3/136) =======================q-point: ( 0.18 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.124 ( 23.527 13.583 0.000) 27.167 1.369 ( 28.052 16.196 0.000) 32.392 2.712 ( 56.520 32.632 0.000) 65.264 3.958 ( -5.946 -3.433 0.000) 6.866 5.470 ( -5.256 -3.034 0.000) 6.069 5.501 ( -0.570 -0.329 0.000) 0.658 5.693 ( -15.160 -8.753 0.000) 17.505 6.618 ( -3.337 -1.927 0.000) 3.853 6.746 ( 2.722 1.571 0.000) 3.143 8.085 ( -8.332 -4.810 0.000) 9.621 8.744 ( -2.326 -1.343 0.000) 2.686 9.112 ( -13.207 -7.625 0.000) 15.250 9.269 ( -10.202 -5.890 0.000) 11.780 9.696 ( 8.638 4.987 0.000) 9.974 10.376 ( 6.637 3.832 0.000) 7.664 15.348 ( -0.602 -0.348 0.000) 0.696 15.351 ( 0.005 0.003 0.000) 0.006 15.866 ( 11.175 6.452 0.000) 12.904 16.222 ( -4.414 -2.548 0.000) 5.097 16.512 ( 10.938 6.315 0.000) 12.630 16.977 ( -4.405 -2.544 0.000) 5.087 17.475 ( 0.432 0.249 0.000) 0.499 19.207 ( -5.986 -3.456 0.000) 6.912 19.359 ( 1.780 1.028 0.000) 2.056 19.398 ( -0.967 -0.559 0.000) 1.117 19.404 ( 2.371 1.369 0.000) 2.737 20.600 ( -4.879 -2.817 0.000) 5.634======================= Grid point 3 (4/136) =======================q-point: ( 0.27 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.634 ( 20.291 11.715 0.000) 23.430 1.984 ( 25.336 14.628 0.000) 29.256 3.794 ( -8.211 -4.741 0.000) 9.482 3.952 ( 50.102 28.926 0.000) 57.853 5.297 ( -8.889 -5.132 0.000) 10.264 5.323 ( -15.300 -8.834 0.000) 17.667 5.548 ( 3.933 2.271 0.000) 4.542 6.532 ( -3.697 -2.134 0.000) 4.269 6.822 ( 3.745 2.162 0.000) 4.324 7.882 ( -9.186 -5.304 0.000) 10.607 8.689 ( -2.430 -1.403 0.000) 2.806 8.732 ( -19.691 -11.368 0.000) 22.737 9.018 ( -11.225 -6.481 0.000) 12.961 9.882 ( 7.231 4.175 0.000) 8.350 10.530 ( 6.446 3.722 0.000) 7.443 15.313 ( -2.579 -1.489 0.000) 2.978 15.352 ( 0.146 0.084 0.000) 0.168 16.124 ( 5.750 3.320 0.000) 6.639 16.187 ( 6.817 3.936 0.000) 7.872 16.793 ( 12.990 7.500 0.000) 15.000 16.863 ( -5.281 -3.049 0.000) 6.098 17.455 ( -2.389 -1.379 0.000) 2.759 19.040 ( -8.174 -4.719 0.000) 9.439 19.373 ( -1.106 -0.638 0.000) 1.277 19.382 ( 0.796 0.459 0.000) 0.919 19.506 ( 5.765 3.329 0.000) 6.657 20.462 ( -7.101 -4.100 0.000) 8.200======================= Grid point 4 (5/136) =======================q-point: ( 0.36 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.035 ( 14.111 8.147 0.000) 16.294 2.529 ( 21.760 12.563 0.000) 25.126 3.586 ( -9.817 -5.668 0.000) 11.335 4.702 ( 1.123 0.648 0.000) 1.297 5.078 ( -9.560 -5.519 0.000) 11.039 5.334 ( 30.906 17.844 0.000) 35.688 5.670 ( 6.175 3.565 0.000) 7.130 6.463 ( -2.075 -1.198 0.000) 2.396 6.896 ( 1.651 0.953 0.000) 1.906 7.672 ( -8.617 -4.975 0.000) 9.950 8.224 ( -23.629 -13.642 0.000) 27.284 8.635 ( -2.085 -1.204 0.000) 2.408 8.774 ( -9.466 -5.465 0.000) 10.930 10.021 ( 4.725 2.728 0.000) 5.456 10.660 ( 4.633 2.675 0.000) 5.350 15.238 ( -3.428 -1.979 0.000) 3.959 15.357 ( 0.203 0.117 0.000) 0.235 16.186 ( 3.744 2.162 0.000) 4.323 16.437 ( 8.204 4.737 0.000) 9.473 16.768 ( -0.910 -0.525 0.000) 1.051 17.083 ( 11.480 6.628 0.000) 13.256 17.360 ( -5.903 -3.408 0.000) 6.817 18.849 ( -7.922 -4.574 0.000) 9.148 19.349 ( -0.879 -0.508 0.000) 1.015 19.400 ( 0.718 0.414 0.000) 0.829 19.659 ( 7.380 4.261 0.000) 8.521 20.279 ( -8.591 -4.960 0.000) 9.920======================= Grid point 5 (6/136) =======================q-point: ( 0.45 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.263 ( 5.230 3.020 0.000) 6.039 2.964 ( 15.113 8.725 0.000) 17.450 3.347 ( -10.432 -6.023 0.000) 12.046 4.565 ( -4.894 -2.826 0.000) 5.651 4.900 ( -4.690 -2.708 0.000) 5.415 5.791 ( 3.309 1.910 0.000) 3.821 6.199 ( 35.603 20.555 0.000) 41.110 6.436 ( -0.436 -0.252 0.000) 0.504 6.798 ( -13.772 -7.951 0.000) 15.903 7.517 ( -3.994 -2.306 0.000) 4.612 7.746 ( -13.667 -7.891 0.000) 15.781 8.600 ( -0.865 -0.499 0.000) 0.999 8.612 ( -3.932 -2.270 0.000) 4.541 10.095 ( 1.651 0.953 0.000) 1.906 10.734 ( 1.683 0.971 0.000) 1.943 15.177 ( -1.537 -0.888 0.000) 1.775 15.360 ( 0.095 0.055 0.000) 0.110 16.298 ( 5.321 3.072 0.000) 6.145 16.451 ( -4.306 -2.486 0.000) 4.972 16.898 ( 8.930 5.156 0.000) 10.311 17.193 ( -7.790 -4.498 0.000) 8.996 17.283 ( 4.988 2.880 0.000) 5.760 18.706 ( -3.679 -2.124 0.000) 4.248 19.335 ( -0.335 -0.193 0.000) 0.387 19.412 ( 0.295 0.170 0.000) 0.341 19.838 ( 7.631 4.406 0.000) 8.812 20.079 ( -8.135 -4.696 0.000) 9.393======================= Grid point 12 (7/136) =======================q-point: ( 0.09 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.988 ( 14.272 24.719 0.984) 28.560 1.202 ( 16.937 29.335 8.915) 35.027 2.352 ( 32.742 56.710 -5.413) 65.707 3.993 ( -3.008 -5.210 0.765) 6.065 5.492 ( 0.037 0.065 -0.609) 0.614 5.510 ( -3.571 -6.185 -7.653) 10.468 5.788 ( -7.730 -13.389 4.776) 16.181 6.657 ( -1.068 -1.850 -1.248) 2.475 6.710 ( 0.677 1.172 4.929) 5.112 8.136 ( -4.533 -7.851 -2.793) 9.485 8.720 ( -3.229 -5.593 -5.382) 8.407 9.306 ( -2.422 -4.196 6.549) 8.146 9.331 ( -5.433 -9.410 -0.066) 10.866 9.546 ( 2.006 3.474 -2.446) 4.698 10.351 ( 4.381 7.589 1.290) 8.857 15.212 ( -3.091 -5.354 4.096) 7.416 15.556 ( 5.525 9.570 0.931) 11.089 15.732 ( 3.237 5.606 -5.730) 8.645 16.249 ( -2.975 -5.154 -0.379) 5.963 16.452 ( 5.920 10.253 1.979) 12.003 17.003 ( -2.247 -3.892 2.240) 5.021 17.470 ( 0.497 0.861 -0.331) 1.048 19.262 ( -2.074 -3.592 4.823) 6.361 19.321 ( -0.108 -0.187 -0.452) 0.501 19.394 ( 0.506 0.876 0.091) 1.015 19.406 ( 0.142 0.246 -1.336) 1.366 20.629 ( -2.424 -4.198 -4.604) 6.685======================= Grid point 13 (8/136) =======================q-point: ( 0.18 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.492 ( 16.243 21.997 1.171) 27.369 1.794 ( 19.450 24.864 5.929) 32.120 3.500 ( 40.367 43.236 -4.439) 59.317 3.860 ( -5.603 -6.299 2.051) 8.677 5.355 ( -6.100 -8.156 -9.550) 13.962 5.466 ( -11.517 -12.212 0.520) 16.794 5.526 ( 1.220 2.045 4.337) 4.948 6.587 ( -4.411 -1.809 -1.975) 5.160 6.756 ( 3.800 -0.291 5.064) 6.338 7.962 ( -6.782 -6.960 -4.208) 10.590 8.588 ( -2.155 -11.433 -5.126) 12.713 9.096 ( -14.218 -3.657 1.491) 14.757 9.134 ( -12.434 -1.348 3.587) 13.011 9.669 ( 12.207 -6.377 0.822) 13.797 10.516 ( 4.489 9.136 1.211) 10.251 15.124 ( 1.128 -9.757 2.925) 10.248 15.652 ( -8.330 17.004 -1.768) 19.017 15.952 ( 15.512 2.740 -2.783) 15.996 16.159 ( -1.429 -3.320 -0.115) 3.616 16.695 ( 8.753 10.659 1.157) 13.841 16.914 ( -3.234 -2.649 4.892) 6.435 17.467 ( -0.931 -1.322 -0.620) 1.732 19.141 ( -7.462 -3.318 5.167) 9.664 19.299 ( 1.597 -5.443 1.377) 5.837 19.419 ( 0.039 1.934 -4.290) 4.706 19.462 ( 3.599 3.975 0.502) 5.385 20.517 ( -4.839 -5.494 -5.099) 8.922======================= Grid point 14 (9/136) =======================q-point: ( 0.27 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.957 ( 12.509 19.962 1.241) 23.590 2.350 ( 18.117 21.135 3.094) 28.009 3.680 ( -7.699 -6.383 3.610) 10.633 4.489 ( 28.986 18.611 0.051) 34.446 5.129 ( -7.927 -9.438 -11.057) 16.558 5.224 ( -1.102 1.243 -1.765) 2.424 5.633 ( 5.002 6.898 3.648) 9.269 6.491 ( -3.592 -2.540 -3.197) 5.438 6.819 ( 4.497 -2.824 3.847) 6.557 7.771 ( -8.074 -4.780 -3.770) 10.112 8.397 ( -7.438 -12.833 -0.925) 14.861 8.793 ( -16.988 0.661 -0.268) 17.003 8.900 ( -11.423 -3.106 1.576) 11.942 9.808 ( 13.125 -10.392 2.686) 16.955 10.672 ( 2.712 9.175 1.189) 9.641 15.048 ( 3.030 -12.566 1.479) 13.011 15.652 ( -10.739 16.964 -1.541) 20.136 16.134 ( 2.882 -0.248 -1.530) 3.272 16.276 ( 14.759 3.614 -1.523) 15.271 16.765 ( -1.873 -5.092 -0.442) 5.444 17.029 ( 7.878 14.188 8.646) 18.387 17.403 ( -3.597 -4.026 -0.608) 5.433 18.959 ( -9.195 -3.411 2.911) 10.230 19.274 ( 2.484 -6.637 3.530) 7.917 19.443 ( -0.541 3.432 -5.751) 6.719 19.585 ( 5.837 4.225 0.200) 7.209 20.356 ( -6.818 -6.477 -4.429) 10.395======================= Grid point 15 (10/136) =======================q-point: ( 0.36 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.294 ( 4.275 17.245 0.674) 17.780 2.825 ( 14.667 16.236 2.307) 22.001 3.472 ( -9.577 -5.184 4.820) 11.909 4.603 ( -4.290 -7.609 2.384) 9.055 4.910 ( -5.149 -10.791 -5.459) 13.144 5.660 ( 19.029 7.860 -13.349) 24.537 5.894 ( 18.476 20.356 5.471) 28.030 6.425 ( -0.671 -2.998 -4.189) 5.195 6.807 ( -0.685 -9.923 0.234) 9.949 7.624 ( -5.988 2.543 -0.113) 6.506 8.048 ( -21.765 -3.187 6.623) 22.972 8.598 ( -4.022 -2.788 -4.208) 6.455 8.697 ( -8.167 -2.661 -0.116) 8.591 9.905 ( 11.426 -12.915 3.365) 17.570 10.782 ( -0.135 8.001 1.285) 8.105 14.984 ( 4.666 -13.166 0.450) 13.976 15.634 ( -10.759 17.038 -0.666) 20.162 16.215 ( 5.778 0.868 -1.934) 6.154 16.460 ( 1.554 -1.812 -2.857) 3.723 16.767 ( 8.543 0.540 1.842) 8.756 17.249 ( -3.813 -2.562 0.436) 4.615 17.299 ( 2.029 9.019 8.541) 12.586 18.780 ( -7.341 -2.322 0.415) 7.710 19.255 ( 3.119 -6.798 4.376) 8.666 19.465 ( -1.442 4.218 -6.122) 7.573 19.745 ( 7.727 4.115 -0.502) 8.768 20.161 ( -7.753 -6.799 -3.464) 10.878======================= Grid point 16 (11/136) =======================q-point: ( 0.45 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.422 ( -6.982 12.093 0.099) 13.964 3.109 ( -1.785 3.092 2.711) 4.483 3.292 ( -1.663 2.881 5.320) 6.274 4.513 ( 1.348 -2.334 -0.982) 2.869 4.798 ( 4.080 -7.067 -2.733) 8.606 5.809 ( -0.021 0.036 -3.941) 3.941 6.397 ( 1.842 -3.190 -7.682) 8.520 6.465 ( 4.961 -8.593 -9.561) 13.779 6.557 ( 0.273 -0.472 3.087) 3.135 7.646 ( -7.739 13.405 9.730) 18.283 7.744 ( -4.388 7.600 4.296) 9.771 8.572 ( 0.959 -1.662 -1.830) 2.652 8.591 ( 0.142 -0.245 -3.652) 3.663 9.940 ( 8.618 -14.926 3.526) 17.592 10.821 ( -3.551 6.151 1.339) 7.228 14.957 ( 6.998 -12.121 0.101) 13.996 15.625 ( -10.034 17.380 -0.364) 20.072 16.306 ( 1.656 -2.868 -3.066) 4.513 16.404 ( 0.492 -0.853 -1.089) 1.468 16.933 ( 1.860 -3.221 1.092) 3.877 17.106 ( 1.404 -2.432 -0.735) 2.902 17.403 ( -4.695 8.132 10.844) 14.345 18.697 ( -0.743 1.287 -0.983) 1.782 19.248 ( 3.776 -6.540 4.575) 8.830 19.474 ( -2.390 4.140 -6.148) 7.788 19.893 ( 0.255 -0.442 -0.616) 0.800 19.998 ( 1.074 -1.860 -3.274) 3.916======================= Grid point 25 (12/136) =======================q-point: ( 0.18 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.954 ( 13.504 23.390 1.315) 27.040 2.308 ( 14.843 25.709 5.564) 30.203 3.716 ( -4.567 -7.911 4.838) 10.337 4.303 ( 18.640 32.286 -2.361) 37.355 5.159 ( -6.564 -11.369 -12.331) 18.011 5.246 ( -2.991 -5.181 -2.867) 6.634 5.625 ( 4.470 7.742 4.269) 9.907 6.521 ( -2.830 -4.902 -6.089) 8.313 6.748 ( -0.272 -0.472 7.343) 7.363 7.827 ( -3.572 -6.187 -4.014) 8.194 8.368 ( -5.678 -9.835 -4.676) 12.282 8.911 ( -6.057 -10.490 -1.517) 12.208 9.151 ( -2.389 -4.139 5.576) 7.344 9.527 ( -2.879 -4.986 3.099) 6.538 10.700 ( 5.045 8.738 1.808) 10.250 14.955 ( -4.194 -7.264 1.789) 8.576 15.963 ( 3.337 5.780 -4.472) 8.034 16.029 ( 7.383 12.788 -0.264) 14.768 16.113 ( -0.343 -0.595 -0.472) 0.833 16.752 ( -2.588 -4.483 -0.435) 5.195 17.040 ( 8.311 14.395 11.126) 20.002 17.412 ( -2.543 -4.404 -1.021) 5.187 19.055 ( -3.503 -6.067 8.614) 11.103 19.186 ( -2.794 -4.839 -1.491) 5.783 19.467 ( 1.627 2.819 -6.286) 7.078 19.552 ( 2.905 5.032 0.976) 5.892 20.383 ( -4.583 -7.939 -6.601) 11.296======================= Grid point 26 (13/136) =======================q-point: ( 0.27 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.388 ( 9.366 22.115 1.626) 24.072 2.787 ( 12.440 21.605 3.241) 25.140 3.553 ( -5.945 -5.967 7.598) 11.344 4.547 ( -0.128 -7.474 7.042) 10.270 4.906 ( -8.116 -12.974 -11.385) 19.074 5.463 ( 15.349 16.352 -17.447) 28.414 5.852 ( 9.327 14.999 5.220) 18.418 6.415 ( -2.814 -5.056 -8.562) 10.334 6.714 ( -0.297 -7.277 4.026) 8.322 7.742 ( -3.098 2.998 1.007) 4.427 8.212 ( -3.776 -5.515 -0.641) 6.714 8.700 ( -7.872 -6.833 -3.424) 10.972 8.925 ( -19.530 2.307 3.545) 19.983 9.516 ( 12.811 -17.895 5.262) 22.628 10.849 ( 2.308 7.889 2.328) 8.543 14.833 ( -0.526 -8.981 0.632) 9.019 15.980 ( -9.008 14.891 -1.547) 17.472 16.143 ( 3.245 1.410 -2.294) 4.217 16.336 ( 12.715 2.873 -3.328) 13.453 16.662 ( 0.283 -4.642 2.896) 5.479 17.285 ( -4.818 -6.015 -0.460) 7.721 17.342 ( 7.001 14.530 13.091) 20.773 18.900 ( -8.345 -2.651 4.136) 9.684 19.122 ( 2.472 -8.126 0.686) 8.521 19.524 ( 0.213 4.822 -7.185) 8.656 19.666 ( 5.396 3.762 0.394) 6.589 20.207 ( -6.195 -8.379 -6.062) 12.055======================= Grid point 27 (14/136) =======================q-point: ( 0.36 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.676 ( -1.527 19.575 0.885) 19.654 3.121 ( 5.503 11.138 3.928) 13.030 3.411 ( -6.370 0.582 8.625) 10.738 4.454 ( 1.084 -6.697 1.791) 7.016 4.665 ( -2.315 -13.287 -6.127) 14.814 5.779 ( 6.580 5.270 -8.751) 12.152 6.204 ( 14.040 7.728 -8.431) 18.109 6.343 ( 0.320 -4.532 -9.960) 10.947 6.576 ( -4.148 -10.916 -1.254) 11.744 7.829 ( 1.642 17.499 8.864) 19.685 8.069 ( -14.710 4.513 9.151) 17.903 8.542 ( -2.614 -3.057 -5.425) 6.754 8.648 ( -9.755 -1.839 -2.355) 10.202 9.556 ( 13.723 -21.307 5.811) 26.002 10.930 ( -1.161 6.211 2.645) 6.850 14.764 ( 2.904 -8.667 -0.029) 9.140 15.973 ( -9.667 16.332 -0.773) 18.994 16.230 ( 4.461 0.944 -3.153) 5.543 16.400 ( -1.555 -3.572 -2.952) 4.888 16.780 ( 11.867 0.613 2.414) 12.125 17.101 ( -5.893 -8.924 -0.600) 10.711 17.559 ( 0.058 12.781 17.304) 21.513 18.759 ( -5.311 0.290 -0.805) 5.379 19.099 ( 4.298 -8.562 2.130) 9.814 19.561 ( -2.053 5.547 -6.882) 9.074 19.815 ( 7.837 2.817 -1.296) 8.428 20.013 ( -6.299 -7.908 -4.853) 11.215======================= Grid point 37 (15/136) =======================q-point: ( 0.27 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.791 ( 9.950 17.233 3.165) 20.150 3.145 ( 6.449 11.171 1.655) 13.005 3.472 ( -0.185 -0.320 9.578) 9.585 4.387 ( -3.513 -6.085 5.780) 9.099 4.628 ( -8.161 -14.136 -8.584) 18.442 5.734 ( 6.192 10.726 -12.550) 17.632 6.132 ( 6.059 10.494 -6.442) 13.723 6.320 ( -1.913 -3.313 -12.038) 12.631 6.543 ( -5.479 -9.490 -1.026) 11.005 7.922 ( 8.551 14.811 11.196) 20.441 8.174 ( 0.635 1.100 1.851) 2.245 8.566 ( -3.442 -5.962 -6.235) 9.288 8.897 ( -5.324 -9.221 3.017) 11.067 9.174 ( -6.707 -11.616 6.719) 15.002 10.972 ( 2.491 4.314 3.143) 5.890 14.694 ( -2.771 -4.799 -0.078) 5.542 16.189 ( 2.816 4.878 0.739) 5.681 16.199 ( 2.661 4.608 -4.535) 6.992 16.377 ( -0.325 -0.563 -5.432) 5.471 16.643 ( 2.970 5.143 4.753) 7.607 17.109 ( -5.984 -10.365 -0.625) 11.985 17.626 ( 6.757 11.704 19.396) 23.640 18.844 ( -1.867 -3.233 2.356) 4.415 18.980 ( -2.987 -5.173 -2.016) 6.304 19.629 ( 2.932 5.078 -9.217) 10.924 19.737 ( 2.260 3.914 0.731) 4.578 20.029 ( -5.290 -9.163 -5.510) 11.929======================= Grid point 38 (16/136) =======================q-point: ( 0.36 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.003 ( -6.594 11.420 3.729) 13.704 3.190 ( 1.234 -2.137 6.461) 6.916 3.527 ( -4.042 7.001 4.534) 9.269 4.353 ( 1.913 -3.313 0.862) 3.922 4.429 ( 4.570 -7.916 -2.795) 9.558 5.854 ( -0.999 1.730 -8.029) 8.274 6.255 ( -0.824 1.428 -12.312) 12.422 6.293 ( 0.388 -0.672 -12.203) 12.228 6.400 ( 3.979 -6.891 -5.893) 9.902 8.162 ( -5.248 9.090 8.058) 13.233 8.213 ( -4.324 7.490 18.208) 20.157 8.512 ( -1.999 3.462 -8.841) 9.702 8.649 ( -1.752 3.035 -2.334) 4.211 9.099 ( 12.715 -22.023 6.351) 26.211 11.016 ( -1.288 2.232 3.431) 4.291 14.646 ( 1.756 -3.041 -0.350) 3.529 16.244 ( -5.209 9.022 -1.061) 10.471 16.258 ( -0.944 1.635 -3.232) 3.743 16.332 ( 1.607 -2.784 -2.923) 4.345 16.788 ( -0.101 0.174 1.987) 1.997 16.932 ( 3.648 -6.319 0.142) 7.297 17.753 ( -3.241 5.614 23.122) 24.014 18.798 ( -2.136 3.700 -2.036) 4.733 18.932 ( 4.288 -7.427 -1.019) 8.637 19.684 ( -3.706 6.419 -8.709) 11.436 19.851 ( 1.055 -1.828 -0.504) 2.170 19.858 ( 2.627 -4.550 -5.072) 7.303======================= Grid point 133 (17/136) =======================q-point: ( 0.00 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 130Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.580 ( 0.000 0.000 28.538) 28.538 0.580 ( 0.000 0.000 28.538) 28.538 0.893 ( -0.000 0.000 43.635) 43.635 4.131 ( 0.000 0.000 3.073) 3.073 5.595 ( 0.000 0.000 -4.247) 4.247 5.595 ( 0.000 0.000 -4.247) 4.247 6.601 ( 0.000 -0.000 -8.055) 8.055 6.601 ( 0.000 0.000 -8.055) 8.055 6.964 ( 0.000 0.000 7.138) 7.138 8.683 ( 0.000 0.000 -4.995) 4.995 8.859 ( 0.000 -0.000 4.281) 4.281 8.859 ( -0.000 0.000 4.281) 4.281 9.419 ( 0.000 -0.000 0.402) 0.402 9.419 ( -0.000 0.000 0.402) 0.402 9.518 ( 0.000 0.000 -3.063) 3.063 15.290 ( -0.000 -0.000 -4.688) 4.688 15.290 ( -0.000 0.000 -4.688) 4.688 15.655 ( 0.000 -0.000 6.157) 6.157 15.655 ( 0.000 0.000 6.157) 6.157 16.371 ( 0.000 0.000 -1.248) 1.248 16.371 ( -0.000 0.000 -1.248) 1.248 17.450 ( -0.000 0.000 1.974) 1.974 19.265 ( 0.000 0.000 -1.192) 1.192 19.325 ( 0.000 0.000 0.493) 0.493 19.418 ( 0.000 -0.000 -0.404) 0.404 19.418 ( 0.000 -0.000 -0.404) 0.404 20.414 ( 0.000 0.000 -0.450) 0.450======================= Grid point 134 (18/136) =======================q-point: ( 0.09 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.816 ( 17.095 20.452 14.738) 30.459 0.925 ( 11.440 18.203 24.951) 32.936 1.584 ( 54.191 18.676 18.872) 60.346 4.096 ( -3.262 -1.342 3.141) 4.723 5.494 ( -2.985 -5.545 -6.849) 9.304 5.627 ( -0.169 -2.575 2.937) 3.910 6.179 ( -20.683 -13.505 13.595) 28.196 6.613 ( -4.034 6.635 -6.213) 9.945 6.697 ( -2.219 -1.072 2.019) 3.186 8.265 ( -7.344 -6.369 0.749) 9.750 8.831 ( 2.834 -10.132 3.579) 11.113 9.299 ( -9.842 1.833 -4.159) 10.840 9.373 ( -5.410 -1.394 -8.095) 9.836 9.524 ( 7.231 2.510 1.089) 7.731 10.011 ( 23.111 15.455 -13.142) 30.752 15.274 ( -5.779 9.986 -4.961) 12.560 15.373 ( 3.862 -1.804 -0.422) 4.283 15.703 ( 10.330 -6.551 3.634) 12.761 16.189 ( 12.378 12.815 -10.917) 20.896 16.324 ( -3.063 -3.059 -0.809) 4.404 16.652 ( 18.390 12.932 -17.678) 28.600 17.466 ( 1.218 0.446 1.636) 2.088 19.283 ( -0.062 0.254 -1.187) 1.215 19.305 ( -3.312 0.259 -0.429) 3.350 19.396 ( -0.402 0.038 -0.330) 0.522 19.414 ( -0.031 0.879 -0.169) 0.896 20.494 ( 4.884 -2.423 -9.314) 10.792======================= Grid point 135 (19/136) =======================q-point: ( 0.18 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.290 ( 19.051 11.960 14.710) 26.877 1.428 ( 19.284 24.237 6.358) 31.619 2.770 ( 55.539 24.029 5.479) 60.762 3.994 ( -6.579 -1.821 3.440) 7.644 5.359 ( -4.985 -9.309 -9.683) 14.328 5.571 ( -2.136 -3.323 6.401) 7.522 5.822 ( -12.240 -5.981 9.756) 16.756 6.573 ( -4.253 0.205 -3.894) 5.770 6.712 ( 0.900 4.503 -3.186) 5.590 8.078 ( -6.151 -8.985 -0.459) 10.899 8.761 ( 1.708 -11.522 1.482) 11.742 9.080 ( -17.685 1.760 -3.108) 18.042 9.195 ( -9.533 -5.656 -6.741) 12.973 9.698 ( 7.932 4.890 0.066) 9.319 10.365 ( 9.941 7.499 -0.622) 12.468 15.279 ( -6.446 12.160 -4.103) 14.362 15.397 ( 5.067 -9.246 2.006) 10.732 15.879 ( 12.813 1.306 0.937) 12.914 16.224 ( -3.508 -2.634 0.109) 4.388 16.451 ( 8.678 9.587 -5.211) 13.942 16.910 ( 2.701 5.361 -5.254) 7.978 17.485 ( 0.444 -0.432 0.978) 1.158 19.162 ( -9.201 -0.232 -3.470) 9.836 19.324 ( -0.200 0.222 -2.314) 2.333 19.404 ( 2.169 1.686 0.096) 2.749 19.440 ( 1.780 -0.170 2.140) 2.788 20.485 ( 0.258 -7.188 -9.222) 11.695======================= Grid point 136 (20/136) =======================q-point: ( 0.27 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.726 ( 17.000 11.952 8.811) 22.572 1.993 ( 21.037 18.187 0.849) 27.822 3.809 ( -0.949 1.987 1.048) 2.438 3.945 ( 39.655 19.565 -0.096) 44.219 5.136 ( -7.597 -10.423 -8.875) 15.656 5.438 ( -8.018 -7.699 6.442) 12.848 5.682 ( 0.350 0.666 10.111) 10.139 6.493 ( -2.844 -2.837 -3.060) 5.050 6.795 ( 2.199 6.216 -2.858) 7.187 7.867 ( -7.165 -10.358 -1.215) 12.653 8.645 ( -1.549 -18.388 -3.621) 18.805 8.745 ( -21.161 5.459 0.512) 21.860 8.962 ( -10.275 -5.715 -5.239) 12.872 9.876 ( 5.963 6.210 -0.484) 8.622 10.572 ( 7.073 5.431 3.948) 9.752 15.287 ( -8.480 14.491 -2.647) 16.998 15.363 ( 5.749 -15.398 1.345) 16.491 16.138 ( 11.372 1.787 0.573) 11.526 16.186 ( 3.170 2.023 0.354) 3.777 16.693 ( 7.626 7.835 -5.828) 12.390 16.952 ( -1.520 5.923 5.069) 7.943 17.460 ( -2.093 -2.059 0.533) 2.984 18.987 ( -9.858 -1.461 -4.760) 11.044 19.298 ( -2.410 0.599 -3.611) 4.382 19.464 ( 2.421 -2.077 3.699) 4.885 19.501 ( 5.328 3.306 -0.357) 6.281 20.378 ( -3.084 -8.605 -7.475) 11.808======================= Grid point 137 (21/136) =======================q-point: ( 0.36 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.086 ( 12.040 8.562 4.864) 15.554 2.505 ( 19.304 14.536 -2.473) 24.291 3.608 ( -13.364 -2.253 2.155) 13.723 4.648 ( 3.394 6.128 -4.299) 8.219 5.124 ( 11.392 -7.970 -0.220) 13.905 5.253 ( 11.114 1.195 -1.019) 11.224 5.786 ( 7.244 6.392 7.648) 12.321 6.435 ( 0.167 -3.683 -2.033) 4.210 6.886 ( 1.043 3.706 -1.323) 4.071 7.633 ( -7.920 -8.901 -3.220) 12.342 8.232 ( -24.184 -7.150 0.285) 25.220 8.599 ( -1.320 -5.912 -3.358) 6.926 8.746 ( -8.495 -4.158 -2.519) 9.787 10.017 ( 3.076 5.929 -0.356) 6.689 10.719 ( 4.450 3.829 5.474) 8.027 15.248 ( -7.101 5.100 0.780) 8.777 15.330 ( 3.814 -7.102 -2.257) 8.372 16.220 ( 5.043 0.466 3.089) 5.932 16.414 ( 9.966 1.893 -2.185) 10.377 16.804 ( 1.581 2.902 2.752) 4.301 17.072 ( 3.140 13.318 -0.137) 13.684 17.367 ( -5.416 -3.480 0.663) 6.472 18.807 ( -7.952 -2.939 -4.086) 9.411 19.265 ( -2.766 2.023 -5.068) 6.118 19.482 ( 2.878 -3.507 4.549) 6.425 19.643 ( 6.901 3.729 -1.439) 7.975 20.218 ( -5.294 -8.626 -5.739) 11.635======================= Grid point 138 (22/136) =======================q-point: ( 0.45 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.290 ( 4.413 2.999 2.594) 5.933 2.946 ( 15.760 13.158 -3.320) 20.798 3.315 ( -16.893 -4.106 -1.542) 17.453 4.626 ( -0.705 -0.324 5.786) 5.837 4.953 ( -4.626 -7.156 5.003) 9.881 5.691 ( 11.273 -0.359 -8.758) 14.280 6.155 ( 24.162 8.791 -4.248) 26.060 6.434 ( 5.228 -3.448 -1.256) 6.387 6.794 ( -11.247 -9.440 -0.128) 14.684 7.510 ( -1.524 5.965 -0.137) 6.159 7.782 ( -19.616 -2.099 2.617) 19.901 8.550 ( 1.941 -4.557 -4.215) 6.504 8.602 ( -3.573 -3.048 -1.257) 4.862 10.094 ( -0.299 4.521 -0.104) 4.533 10.797 ( 1.192 1.988 5.907) 6.345 15.187 ( -2.357 0.415 0.987) 2.589 15.331 ( 1.020 -1.505 -2.611) 3.181 16.329 ( 6.404 -0.157 2.779) 6.983 16.469 ( -1.011 -3.447 1.375) 3.847 16.935 ( 7.238 6.006 3.838) 10.158 17.179 ( -5.233 -1.243 -1.203) 5.512 17.258 ( -4.078 9.400 -2.153) 10.470 18.679 ( -2.806 -2.556 -2.737) 4.679 19.246 ( -2.382 3.105 -5.941) 7.115 19.493 ( 2.775 -4.233 4.854) 7.013 19.805 ( 7.036 3.065 -3.204) 8.317 20.039 ( -5.104 -7.409 -3.715) 9.734======================= Grid point 145 (23/136) =======================q-point: ( 0.09 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.175 ( 11.666 20.206 15.531) 28.028 1.457 ( 14.666 25.403 15.546) 33.198 2.334 ( 29.662 51.377 3.967) 59.457 4.042 ( -2.300 -3.984 4.079) 6.148 5.338 ( -5.049 -8.744 -9.270) 13.707 5.573 ( -1.482 -2.567 6.211) 6.882 5.909 ( -7.705 -13.346 6.173) 16.601 6.634 ( -2.233 -3.868 -0.203) 4.471 6.727 ( 2.193 3.799 -3.329) 5.506 8.084 ( -5.892 -10.206 -1.930) 11.942 8.649 ( -4.685 -8.114 -1.520) 9.492 9.251 ( -4.949 -8.573 -7.517) 12.429 9.432 ( -1.401 -2.427 5.727) 6.376 9.470 ( 2.255 3.906 -4.670) 6.492 10.330 ( 7.895 13.675 -2.405) 15.972 15.273 ( -2.832 -4.905 1.300) 5.811 15.543 ( 5.722 9.910 -2.728) 11.764 15.656 ( 2.478 4.291 -1.056) 5.066 16.241 ( -2.569 -4.449 -0.395) 5.152 16.431 ( 6.744 11.681 -3.336) 13.894 16.908 ( 5.025 8.704 -8.502) 13.165 17.476 ( 0.131 0.228 0.939) 0.975 19.284 ( -1.088 -1.885 -2.358) 3.209 19.295 ( -0.611 -1.058 -2.045) 2.382 19.398 ( 0.953 1.651 0.197) 1.917 19.424 ( -0.312 -0.540 2.454) 2.532 20.424 ( -2.389 -4.138 -11.763) 12.696======================= Grid point 146 (24/136) =======================q-point: ( 0.18 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.610 ( 14.842 19.318 9.883) 26.289 1.943 ( 12.662 25.774 8.700) 30.005 3.415 ( 40.459 38.256 -3.478) 55.790 3.940 ( -5.058 -3.583 5.757) 8.459 5.148 ( -6.036 -10.995 -10.422) 16.308 5.483 ( -6.266 -8.323 2.897) 10.813 5.696 ( -2.791 -3.194 8.537) 9.532 6.528 ( -4.592 -4.589 -2.689) 7.027 6.804 ( 2.326 3.838 -0.905) 4.578 7.885 ( -6.007 -8.788 -2.858) 11.022 8.484 ( -1.643 -14.185 -4.657) 15.020 9.039 ( -8.823 -9.452 -6.175) 14.329 9.213 ( -20.463 8.077 2.928) 22.193 9.669 ( 15.387 -6.363 -0.395) 16.655 10.564 ( 5.351 11.225 3.367) 12.883 15.173 ( 0.067 -10.169 1.701) 10.311 15.604 ( -8.900 16.760 -2.517) 19.143 15.905 ( 16.683 1.545 -2.217) 16.900 16.169 ( -0.881 -2.579 0.958) 2.888 16.665 ( 6.509 10.337 -2.533) 12.476 17.015 ( 1.380 5.902 3.896) 7.206 17.462 ( -0.956 -2.009 0.208) 2.235 19.161 ( -10.252 0.063 -2.860) 10.643 19.298 ( 2.240 -2.980 -4.423) 5.784 19.400 ( 0.312 -3.537 4.722) 5.908 19.470 ( 3.228 4.346 0.317) 5.423 20.329 ( -1.959 -7.784 -12.112) 14.530======================= Grid point 147 (25/136) =======================q-point: ( 0.27 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.034 ( 11.411 18.418 6.179) 22.530 2.407 ( 13.220 22.402 2.476) 26.129 3.784 ( -8.926 -2.304 6.356) 11.197 4.418 ( 35.101 22.964 -6.226) 42.405 4.919 ( -5.309 -10.861 -9.284) 15.243 5.238 ( -6.388 -11.058 3.363) 13.206 5.750 ( 4.657 6.123 5.729) 9.592 6.405 ( -2.708 -6.532 -4.197) 8.222 6.871 ( 2.128 0.233 0.720) 2.258 7.703 ( -7.324 -3.658 -2.301) 8.504 8.317 ( -1.176 -14.171 -6.118) 15.480 8.761 ( -13.986 -6.194 -4.057) 15.825 8.931 ( -18.548 4.687 2.046) 19.240 9.848 ( 13.423 -8.012 1.293) 15.686 10.743 ( 2.729 10.420 5.459) 12.075 15.074 ( 2.050 -13.249 0.899) 13.437 15.609 ( -9.865 16.883 -2.406) 19.701 16.133 ( 5.240 -0.474 0.816) 5.324 16.237 ( 11.944 1.977 -1.936) 12.260 16.795 ( 1.684 1.562 2.942) 3.732 17.165 ( 3.956 15.482 5.122) 16.780 17.398 ( -2.829 -4.164 0.177) 5.038 18.959 ( -11.832 -1.342 -3.021) 12.285 19.308 ( 0.231 0.301 -7.322) 7.331 19.374 ( 2.859 -6.734 6.035) 9.483 19.583 ( 4.704 4.413 -0.336) 6.459 20.200 ( -3.312 -8.757 -10.388) 13.984======================= Grid point 148 (26/136) =======================q-point: ( 0.36 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.336 ( 2.902 16.139 3.374) 16.742 2.845 ( 13.675 18.667 -0.533) 23.146 3.565 ( -14.332 -1.867 4.112) 15.027 4.637 ( -3.772 -4.853 1.243) 6.271 4.888 ( -0.023 -13.990 3.079) 14.325 5.394 ( 24.518 9.366 -12.242) 28.961 5.943 ( 9.995 7.623 -1.135) 12.621 6.319 ( 1.396 -8.512 -5.630) 10.301 6.819 ( -4.139 -10.039 0.565) 10.873 7.624 ( -2.807 9.665 0.367) 10.071 8.125 ( -13.618 -2.844 0.079) 13.912 8.508 ( -5.779 -3.779 -4.411) 8.193 8.686 ( -11.178 -2.040 -0.315) 11.367 9.966 ( 10.464 -9.971 2.450) 14.660 10.861 ( -0.496 9.085 6.168) 10.992 14.990 ( 4.226 -13.731 0.144) 14.368 15.604 ( -10.186 17.068 -2.053) 19.982 16.215 ( 5.677 -0.583 1.626) 5.934 16.412 ( 4.999 -1.318 -1.847) 5.489 16.853 ( 5.929 1.681 6.616) 9.041 17.244 ( -5.531 -4.846 0.232) 7.358 17.429 ( 1.140 17.701 3.350) 18.051 18.752 ( -8.866 -2.387 -3.301) 9.757 19.307 ( -1.650 2.101 -6.935) 7.432 19.370 ( 4.837 -7.771 4.487) 10.194 19.718 ( 6.239 3.449 -2.085) 7.427 20.046 ( -4.549 -8.236 -7.727) 12.175======================= Grid point 149 (27/136) =======================q-point: ( 0.45 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.443 ( -6.731 11.658 1.928) 13.599 3.208 ( -2.824 4.892 6.825) 8.859 3.281 ( -4.767 8.256 -6.362) 11.461 4.585 ( 1.769 -3.065 8.151) 8.886 4.783 ( 5.474 -9.481 1.132) 11.006 5.677 ( 1.071 -1.855 -8.407) 8.675 6.198 ( 3.241 -5.614 -10.739) 12.544 6.252 ( 6.965 -12.064 -11.296) 17.934 6.641 ( 2.092 -3.624 4.088) 5.850 7.809 ( -5.383 9.324 1.334) 10.849 7.819 ( -9.491 16.440 6.759) 20.150 8.496 ( 0.709 -1.229 -4.866) 5.069 8.533 ( 1.590 -2.754 -1.773) 3.641 10.007 ( 6.971 -12.073 2.861) 14.232 10.902 ( -4.135 7.162 6.332) 10.415 14.957 ( 7.167 -12.414 -0.138) 14.335 15.600 ( -9.949 17.232 -1.889) 19.987 16.280 ( 2.266 -3.925 0.291) 4.541 16.419 ( 1.011 -1.751 2.042) 2.874 16.988 ( 1.250 -2.165 4.795) 5.407 17.104 ( 1.278 -2.213 0.796) 2.677 17.544 ( -9.093 15.750 2.871) 18.412 18.653 ( -0.220 0.382 -3.493) 3.521 19.301 ( -1.181 2.046 -5.854) 6.313 19.375 ( 4.248 -7.357 3.045) 9.024 19.840 ( 0.412 -0.714 -4.507) 4.582 19.913 ( 2.212 -3.831 -5.020) 6.691======================= Grid point 158 (28/136) =======================q-point: ( 0.18 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.027 ( 12.500 21.651 5.647) 25.630 2.429 ( 13.114 22.714 6.324) 26.980 3.853 ( -2.906 -5.033 8.535) 10.326 4.192 ( 21.404 37.073 -7.627) 43.483 4.924 ( -6.702 -11.608 -10.803) 17.215 5.236 ( -7.753 -13.428 1.848) 15.615 5.741 ( 3.606 6.246 5.260) 8.926 6.397 ( -4.688 -8.121 -5.247) 10.745 6.848 ( 0.112 0.194 2.267) 2.278 7.767 ( -1.610 -2.788 -1.277) 3.463 8.227 ( -6.191 -10.723 -8.311) 14.913 8.830 ( -6.499 -11.256 -6.346) 14.464 9.297 ( -2.482 -4.300 8.012) 9.426 9.540 ( -1.139 -1.973 -1.718) 2.854 10.778 ( 5.626 9.745 5.517) 12.532 14.987 ( -4.869 -8.433 1.198) 9.811 15.883 ( 3.680 6.374 -2.771) 7.864 15.990 ( 6.396 11.078 -3.450) 13.249 16.137 ( -0.069 -0.120 2.267) 2.271 16.786 ( 0.841 1.457 3.385) 3.780 17.213 ( 8.318 14.408 6.209) 17.757 17.397 ( -2.673 -4.630 -0.306) 5.354 19.142 ( -3.035 -5.256 -2.861) 6.710 19.195 ( -2.509 -4.346 0.947) 5.106 19.344 ( -0.740 -1.281 -1.857) 2.375 19.565 ( 2.908 5.037 0.387) 5.829 20.181 ( -4.146 -7.182 -12.644) 15.121======================= Grid point 159 (29/136) =======================q-point: ( 0.27 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.435 ( 8.801 21.033 2.915) 22.986 2.844 ( 10.243 20.462 2.533) 23.023 3.732 ( -6.908 -2.925 9.452) 12.067 4.658 ( -3.312 -4.066 -0.174) 5.247 4.724 ( 2.505 -8.419 -2.875) 9.242 5.162 ( 12.039 9.163 -11.713) 19.133 5.896 ( 5.175 7.259 -1.052) 8.976 6.235 ( -2.873 -9.797 -8.124) 13.048 6.781 ( -3.629 -9.217 2.329) 10.176 7.779 ( -1.378 11.269 2.638) 11.656 8.107 ( 2.889 -6.084 -8.369) 10.743 8.602 ( -7.908 -8.744 -6.383) 13.407 9.036 ( -23.370 4.511 6.435) 24.656 9.600 ( 14.421 -16.084 2.937) 21.801 10.941 ( 2.378 8.836 6.473) 11.209 14.842 ( -1.145 -9.792 0.271) 9.862 15.930 ( -7.348 14.491 -2.644) 16.461 16.145 ( 2.319 2.114 1.563) 3.506 16.264 ( 11.568 0.857 -3.088) 12.004 16.786 ( 1.449 -1.361 8.737) 8.961 17.274 ( -4.771 -6.926 -0.108) 8.411 17.539 ( 7.972 19.558 5.949) 21.942 18.933 ( -13.484 -1.183 -1.590) 13.629 19.171 ( 6.239 -11.882 3.343) 13.831 19.344 ( -0.076 1.896 -9.065) 9.261 19.667 ( 3.737 3.831 -0.352) 5.363 20.038 ( -3.938 -7.498 -10.234) 13.284======================= Grid point 160 (30/136) =======================q-point: ( 0.36 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.697 ( -2.804 19.081 1.098) 19.317 3.195 ( 9.611 14.372 2.879) 17.528 3.541 ( -13.027 -0.127 3.971) 13.619 4.523 ( -0.182 -5.731 3.886) 6.927 4.610 ( 0.502 -12.807 2.628) 13.083 5.573 ( 14.125 8.256 -10.871) 19.643 6.024 ( 5.094 0.120 -9.633) 10.898 6.119 ( 0.455 -9.399 -11.315) 14.717 6.570 ( -3.531 -13.827 0.137) 14.272 7.941 ( 1.060 17.524 0.427) 17.561 8.157 ( -2.921 8.245 0.058) 8.747 8.438 ( 0.496 -3.312 -4.105) 5.298 8.661 ( -20.257 -0.350 4.148) 20.680 9.665 ( 13.265 -19.428 4.713) 23.992 11.030 ( -1.487 7.124 6.847) 9.992 14.760 ( 2.749 -9.083 -0.313) 9.495 15.939 ( -9.041 15.916 -2.298) 18.449 16.211 ( 2.957 0.426 0.923) 3.127 16.374 ( 2.559 -2.392 0.029) 3.503 16.870 ( 8.315 0.119 6.753) 10.712 17.102 ( -5.373 -8.187 1.026) 9.846 17.818 ( -0.692 19.566 7.750) 21.056 18.717 ( -8.118 -0.974 -3.542) 8.911 19.162 ( 6.689 -12.192 4.101) 14.498 19.364 ( -0.844 2.963 -11.885) 12.278 19.774 ( 5.342 2.105 -2.664) 6.330 19.899 ( -4.040 -6.339 -6.436) 9.895======================= Grid point 166 (31/136) =======================q-point: (-0.09 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.136 ( -15.226 26.373 2.722) 30.574 1.166 ( -10.615 18.385 17.460) 27.487 2.524 ( -30.168 52.253 10.988) 61.329 4.012 ( 3.548 -6.144 2.553) 7.540 5.457 ( 2.573 -4.457 -7.750) 9.303 5.630 ( 1.213 -2.101 4.137) 4.795 5.879 ( 8.240 -14.272 15.168) 22.397 6.548 ( 0.169 -0.293 -10.711) 10.716 6.668 ( 0.799 -1.384 -0.301) 1.626 8.178 ( 3.287 -5.694 1.324) 6.707 8.838 ( 3.915 -6.781 5.476) 9.555 9.192 ( 2.384 -4.129 -4.033) 6.245 9.248 ( 4.761 -8.246 -8.160) 12.540 9.552 ( -0.714 1.237 -1.897) 2.374 10.294 ( -7.663 13.272 -2.915) 15.600 15.131 ( 2.543 -4.405 -3.693) 6.286 15.528 ( -5.400 9.353 -1.589) 10.916 15.857 ( -3.049 5.280 6.325) 8.785 16.257 ( 2.642 -4.576 0.538) 5.311 16.338 ( -5.753 9.964 -9.023) 14.621 16.840 ( -3.382 5.858 -10.219) 12.255 17.488 ( -0.511 0.885 1.381) 1.718 19.167 ( 4.436 -7.684 -3.733) 9.625 19.311 ( -0.321 0.555 -1.365) 1.508 19.395 ( -0.130 0.224 0.124) 0.287 19.433 ( -1.494 2.588 0.871) 3.113 20.568 ( -0.204 0.354 -7.913) 7.924======================= Grid point 170 (32/136) =======================q-point: ( 0.27 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.835 ( 10.299 17.838 1.113) 20.628 3.181 ( 7.099 12.296 1.773) 14.308 3.660 ( -2.581 -4.471 8.064) 9.575 4.494 ( -4.540 -7.864 -3.726) 9.815 4.539 ( -4.902 -8.490 9.194) 13.441 5.468 ( 9.660 16.732 -13.165) 23.379 5.997 ( 1.404 2.432 -7.339) 7.858 6.063 ( -3.327 -5.763 -12.543) 14.199 6.522 ( -8.998 -15.585 -1.148) 18.032 8.081 ( 2.209 3.826 -9.647) 10.611 8.126 ( 12.212 21.152 8.258) 25.783 8.428 ( -4.762 -8.248 -6.747) 11.672 9.041 ( -5.340 -9.249 9.601) 14.361 9.279 ( -6.127 -10.612 3.585) 12.768 11.080 ( 2.783 4.820 7.098) 9.020 14.690 ( -3.067 -5.312 -0.329) 6.143 16.135 ( 3.301 5.717 -1.807) 6.845 16.224 ( 2.222 3.848 2.619) 5.158 16.281 ( 1.016 1.760 -4.174) 4.643 16.783 ( 1.266 2.193 9.178) 9.521 17.108 ( -5.328 -9.228 0.843) 10.688 17.924 ( 10.253 17.759 9.239) 22.491 18.903 ( -4.960 -8.592 3.081) 10.388 18.921 ( -3.163 -5.479 -3.846) 7.404 19.389 ( 1.338 2.317 -13.202) 13.470 19.735 ( 1.785 3.092 -0.929) 3.689 19.902 ( -3.481 -6.030 -7.036) 9.899======================= Grid point 171 (33/136) =======================q-point: ( 0.36 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.049 ( -8.406 14.559 0.716) 16.826 3.304 ( 2.136 -3.700 4.297) 6.059 3.592 ( -2.250 3.898 1.531) 4.754 4.425 ( 2.534 -4.389 2.849) 5.814 4.431 ( 1.962 -3.399 7.218) 8.217 5.677 ( -0.710 1.229 -8.977) 9.088 6.023 ( 0.912 -1.579 -14.036) 14.154 6.024 ( -2.384 4.129 -10.615) 11.637 6.293 ( 7.256 -12.567 -4.759) 15.272 8.151 ( -3.617 6.265 -7.990) 10.778 8.302 ( 1.935 -3.352 -10.625) 11.308 8.553 ( -7.587 13.140 14.109) 20.720 8.706 ( -5.778 10.007 6.799) 13.407 9.223 ( 13.438 -23.275 5.701) 27.474 11.128 ( -1.481 2.565 7.308) 7.886 14.637 ( 1.848 -3.200 -0.564) 3.738 16.203 ( -5.277 9.139 -2.322) 10.806 16.231 ( -0.842 1.459 0.375) 1.726 16.319 ( 1.832 -3.174 0.692) 3.729 16.863 ( 0.405 -0.702 5.822) 5.878 16.957 ( 2.781 -4.816 2.665) 6.167 18.145 ( -6.240 10.809 14.215) 18.916 18.733 ( -2.075 3.595 -4.443) 6.081 18.907 ( 6.980 -12.090 -1.320) 14.022 19.417 ( -1.042 1.804 -15.167) 15.310 19.793 ( 0.696 -1.205 -2.758) 3.089 19.810 ( 0.564 -0.977 -3.380) 3.564======================= Grid point 177 (34/136) =======================q-point: (-0.18 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.575 ( -14.322 18.313 9.111) 24.970 1.720 ( -22.005 21.949 -1.215) 31.104 3.572 ( -34.634 41.338 2.536) 53.989 3.859 ( 5.081 -8.352 1.844) 9.949 5.297 ( 8.823 -6.095 -9.481) 14.314 5.540 ( 5.615 -3.998 8.249) 10.750 5.693 ( 2.636 -3.273 14.043) 14.658 6.540 ( 2.087 0.561 -7.622) 7.922 6.670 ( -4.281 -2.721 -2.209) 5.533 8.031 ( 7.941 -4.389 2.391) 9.383 8.648 ( 5.111 -14.696 -0.235) 15.561 9.031 ( 15.529 5.142 -3.874) 16.810 9.057 ( 9.073 -6.469 -3.984) 11.833 9.629 ( -12.084 -9.338 -2.987) 15.561 10.527 ( -6.102 9.939 2.385) 11.904 15.068 ( -2.174 -8.753 -2.503) 9.360 15.666 ( 5.944 16.261 -0.149) 17.314 16.013 ( -11.784 2.979 2.711) 12.454 16.182 ( 1.251 -1.735 2.476) 3.272 16.568 ( -9.173 9.082 -9.955) 16.301 16.880 ( -0.527 -2.770 0.645) 2.892 17.485 ( 1.188 -0.992 1.059) 1.875 19.013 ( 4.946 -6.808 -6.462) 10.610 19.283 ( 1.213 -3.510 -1.079) 3.867 19.448 ( -3.216 3.260 -0.551) 4.612 19.489 ( -1.648 3.110 2.134) 4.116 20.512 ( 5.405 -1.532 -4.841) 7.416======================= Grid point 189 (35/136) =======================q-point: (-0.27 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.989 ( -12.205 17.467 4.362) 21.751 2.288 ( -19.277 19.137 -3.099) 27.339 3.647 ( 7.525 -9.888 0.324) 12.429 4.420 ( -21.831 12.269 -6.027) 25.758 5.214 ( -4.558 15.180 -3.708) 16.278 5.344 ( 10.228 -7.075 10.341) 16.175 5.710 ( -3.717 3.038 10.993) 11.996 6.496 ( 3.112 1.160 -2.571) 4.200 6.748 ( -7.511 -3.701 -3.010) 8.898 7.823 ( 10.992 -3.912 0.844) 11.697 8.348 ( 12.663 -16.003 -4.915) 20.991 8.808 ( 15.252 6.261 0.325) 16.491 8.839 ( 8.353 -5.804 -4.064) 10.953 9.750 ( -14.259 -13.144 -2.772) 19.590 10.703 ( -3.710 8.343 4.163) 10.035 15.019 ( -3.964 -11.779 -1.349) 12.501 15.666 ( 11.573 16.574 -0.011) 20.215 16.192 ( -3.221 1.126 3.583) 4.947 16.300 ( -14.209 5.225 1.299) 15.195 16.767 ( -1.524 1.748 -5.464) 5.935 16.880 ( -7.179 0.381 -0.666) 7.220 17.418 ( 3.953 -3.658 0.865) 5.454 18.864 ( 5.566 -4.480 -5.930) 9.285 19.224 ( 0.451 -4.838 -2.124) 5.303 19.522 ( -0.870 3.201 1.797) 3.772 19.581 ( -5.179 4.409 0.092) 6.802 20.368 ( 8.375 -2.878 -2.919) 9.325======================= Grid point 190 (36/136) =======================q-point: (-0.18 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.977 ( -12.052 20.874 3.487) 24.354 2.219 ( -15.316 26.529 -3.084) 30.788 3.665 ( 6.041 -10.463 -0.335) 12.087 4.274 ( -13.051 22.604 -4.800) 26.539 5.257 ( -5.104 8.841 -3.260) 10.716 5.399 ( 5.857 -10.144 11.250) 16.241 5.697 ( -1.783 3.088 12.467) 12.967 6.576 ( -0.723 1.253 -9.384) 9.495 6.610 ( 1.079 -1.869 2.358) 3.197 7.900 ( 4.852 -8.405 2.859) 10.117 8.367 ( 7.545 -13.067 -5.051) 15.912 8.885 ( 4.796 -8.306 -4.029) 10.403 9.116 ( 1.256 -2.175 2.372) 3.455 9.424 ( 4.272 -7.399 -6.700) 10.857 10.717 ( -5.000 8.660 3.506) 10.596 14.922 ( 3.526 -6.108 -1.414) 7.193 16.013 ( -7.957 13.782 -1.331) 15.969 16.018 ( -1.526 2.643 0.943) 3.194 16.185 ( -1.278 2.214 6.425) 6.915 16.768 ( -2.412 4.177 -8.921) 10.141 16.821 ( -1.709 2.960 -0.321) 3.433 17.433 ( 2.497 -4.325 1.057) 5.104 18.894 ( 2.981 -5.163 -7.407) 9.508 19.199 ( 2.638 -4.568 -0.325) 5.285 19.529 ( -2.682 4.645 -1.205) 5.497 19.557 ( -2.188 3.790 2.595) 5.088 20.429 ( 3.742 -6.482 -1.731) 7.682======================= Grid point 201 (37/136) =======================q-point: (-0.36 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.312 ( -4.820 16.054 2.424) 16.936 2.750 ( -14.916 14.262 -5.550) 21.370 3.396 ( 10.042 -10.092 -2.141) 14.397 4.567 ( -4.236 -5.694 -0.716) 7.133 5.068 ( 10.686 -9.298 9.350) 16.972 5.700 ( -9.012 16.571 -9.410) 21.080 5.944 ( -21.181 17.814 10.381) 29.560 6.471 ( 0.971 1.336 1.001) 1.932 6.812 ( -3.591 -6.714 0.156) 7.615 7.595 ( 11.245 -1.550 -3.919) 12.008 7.919 ( 19.087 -10.232 -5.001) 22.227 8.658 ( 5.980 -0.088 1.560) 6.181 8.672 ( 6.793 -0.090 -2.806) 7.350 9.844 ( -12.865 -15.461 -2.487) 20.266 10.817 ( -0.763 6.536 4.645) 8.055 14.973 ( -5.169 -12.793 -0.578) 13.810 15.631 ( 11.406 17.051 -0.678) 20.525 16.291 ( -5.487 2.956 5.329) 8.200 16.514 ( -1.812 1.665 2.048) 3.201 16.784 ( -8.257 -1.531 3.463) 9.083 17.060 ( -7.100 3.357 -12.071) 14.401 17.275 ( 6.636 -6.306 0.892) 9.198 18.742 ( 4.782 -1.192 -3.200) 5.876 19.178 ( -1.149 -5.235 -3.590) 6.451 19.555 ( 0.758 3.552 2.858) 4.622 19.735 ( -6.969 4.650 -1.499) 8.511 20.180 ( 9.160 -3.489 -1.373) 9.898======================= Grid point 202 (38/136) =======================q-point: (-0.27 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.372 ( -9.686 19.327 -0.078) 21.618 2.718 ( -12.112 23.178 -3.497) 26.384 3.448 ( 7.200 -9.672 -2.763) 12.370 4.419 ( -2.851 -6.525 -5.495) 8.994 5.137 ( 10.273 -13.735 11.276) 20.526 5.704 ( -13.188 22.670 -8.593) 27.599 5.829 ( -10.672 13.770 18.127) 25.141 6.524 ( 4.218 1.100 1.100) 4.496 6.652 ( -5.947 -5.464 -1.035) 8.142 7.723 ( 6.787 -4.867 -1.374) 8.464 8.114 ( 10.479 -7.921 -9.559) 16.246 8.733 ( 5.142 -4.538 -0.509) 6.877 8.909 ( 18.337 3.736 1.161) 18.750 9.409 ( -14.668 -19.945 -4.628) 25.187 10.861 ( -2.492 6.969 3.597) 8.229 14.820 ( 0.028 -8.233 -0.627) 8.257 15.987 ( 9.609 14.331 -0.301) 17.257 16.236 ( -3.251 3.716 5.995) 7.767 16.380 ( -15.725 3.922 1.460) 16.272 16.686 ( 1.692 -6.336 4.833) 8.147 17.027 ( -5.887 10.090 -16.521) 20.234 17.309 ( 5.177 -7.403 0.980) 9.086 18.805 ( 3.383 -1.520 -5.043) 6.260 19.113 ( 0.831 -5.984 -0.862) 6.103 19.602 ( -0.053 4.949 0.500) 4.974 19.664 ( -5.858 3.797 0.482) 6.997 20.269 ( 6.668 -6.733 0.258) 9.480======================= Grid point 211 (39/136) =======================q-point: (-0.45 0.55 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.440 ( 6.796 11.770 1.880) 13.721 3.096 ( 0.016 0.028 -13.335) 13.335 3.106 ( -0.035 -0.061 2.439) 2.440 4.601 ( -1.721 -2.980 7.089) 7.880 4.886 ( -3.068 -5.314 5.713) 8.385 5.813 ( 2.293 3.972 -3.550) 5.800 6.395 ( 2.452 4.247 -4.665) 6.769 6.599 ( 0.204 0.354 2.747) 2.777 6.624 ( -1.619 -2.803 6.665) 7.410 7.472 ( 2.136 3.700 -6.524) 7.798 7.659 ( 1.635 2.832 -4.054) 5.208 8.599 ( 0.483 0.836 0.792) 1.249 8.617 ( 1.699 2.943 -1.153) 3.589 9.879 ( -10.077 -17.453 -2.372) 20.293 10.856 ( 2.619 4.537 4.723) 7.053 14.953 ( -6.978 -12.086 -0.328) 13.960 15.617 ( 10.259 17.769 -0.894) 20.538 16.401 ( -0.245 -0.424 6.168) 6.187 16.462 ( 0.219 0.380 4.093) 4.116 16.941 ( -2.519 -4.363 2.085) 5.452 17.123 ( -1.009 -1.747 0.562) 2.094 17.143 ( -0.696 -1.205 -13.895) 13.964 18.692 ( 1.229 2.129 -1.539) 2.901 19.162 ( -2.762 -4.783 -4.246) 6.966 19.567 ( 1.903 3.296 3.072) 4.891 19.862 ( 0.070 0.121 -3.613) 3.616 20.039 ( 0.841 1.457 0.803) 1.864======================= Grid point 213 (40/136) =======================q-point: (-0.36 0.55 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.663 ( -1.308 16.802 -0.653) 16.865 3.045 ( -4.039 13.459 -4.238) 14.677 3.239 ( 8.459 -3.487 -6.944) 11.486 4.459 ( -9.614 -4.656 2.133) 10.893 4.813 ( 7.667 -15.705 8.123) 19.272 5.875 ( -0.739 5.860 0.134) 5.907 6.358 ( -16.631 15.867 6.315) 23.838 6.484 ( 0.156 0.199 5.039) 5.045 6.645 ( 0.583 -8.607 5.073) 10.008 7.625 ( 4.116 6.711 -11.305) 13.776 7.842 ( 14.917 0.898 -12.139) 19.253 8.633 ( 3.093 -0.372 3.298) 4.536 8.695 ( 7.158 0.735 1.241) 7.302 9.456 ( -14.524 -22.392 -3.553) 26.925 10.938 ( 0.656 5.060 3.472) 6.171 14.762 ( -2.998 -8.271 -0.232) 8.801 15.973 ( 9.948 16.626 -0.393) 19.379 16.337 ( -4.893 1.663 7.213) 8.873 16.490 ( 2.909 -2.893 5.619) 6.957 16.766 ( -13.096 -0.234 0.996) 13.136 17.116 ( 5.767 -8.665 0.125) 10.410 17.177 ( -0.648 6.170 -19.151) 20.131 18.752 ( 2.862 1.943 -1.536) 3.785 19.061 ( -2.067 -6.355 -2.107) 7.007 19.636 ( 1.699 4.648 1.088) 5.067 19.814 ( -6.348 2.868 -1.720) 7.175 20.088 ( 5.962 -5.323 2.505) 8.376======================= Grid point 214 (41/136) =======================q-point: (-0.27 0.55 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.716 ( -8.461 14.656 -4.222) 17.442 3.121 ( -5.585 9.673 -0.650) 11.188 3.306 ( -0.507 0.878 -6.665) 6.742 4.314 ( 0.919 -1.592 -1.488) 2.365 4.808 ( 10.635 -18.421 9.021) 23.105 5.899 ( -3.426 5.935 2.281) 7.223 6.285 ( -11.234 19.458 9.910) 24.556 6.517 ( 1.198 -2.076 7.256) 7.641 6.568 ( 1.246 -2.158 1.575) 2.948 7.696 ( -2.075 3.594 -11.281) 12.020 8.000 ( 2.709 -4.691 -14.142) 15.144 8.662 ( 1.268 -2.196 3.001) 3.929 8.935 ( 3.946 -6.836 5.484) 9.611 9.028 ( 6.309 -10.928 -7.200) 14.528 10.970 ( -2.174 3.766 2.995) 5.280 14.694 ( 2.514 -4.355 -0.157) 5.031 16.186 ( -3.519 6.096 0.335) 7.047 16.318 ( -1.825 3.162 7.268) 8.133 16.489 ( -1.100 1.905 4.884) 5.356 16.599 ( -2.117 3.666 1.049) 4.362 17.125 ( 6.243 -10.813 0.863) 12.515 17.206 ( -4.043 7.003 -21.342) 22.823 18.798 ( -0.377 0.653 -2.598) 2.705 18.998 ( 2.970 -5.145 -0.292) 5.948 19.707 ( -2.295 3.975 -2.182) 5.082 19.737 ( -2.743 4.751 1.762) 5.762 20.115 ( 4.717 -8.169 2.893) 9.867======================= Grid point 225 (42/136) =======================q-point: (-0.36 0.64 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.910 ( 4.312 7.469 -5.295) 10.120 3.074 ( -2.099 -3.636 -4.606) 6.232 3.435 ( 7.385 12.792 -4.216) 15.361 4.380 ( -2.255 -3.906 3.231) 5.548 4.515 ( -5.805 -10.054 5.456) 12.827 5.965 ( 1.547 2.680 2.450) 3.947 6.487 ( 0.560 0.970 7.149) 7.236 6.502 ( -0.406 -0.704 12.044) 12.072 6.527 ( -1.025 -1.775 6.661) 6.970 7.822 ( 4.331 7.501 -20.491) 22.246 7.898 ( 2.419 4.189 -16.518) 17.212 8.672 ( 2.501 4.332 7.078) 8.667 8.716 ( 1.934 3.349 1.568) 4.173 9.002 ( -12.277 -21.265 -1.976) 24.634 11.008 ( 1.049 1.817 2.754) 3.462 14.650 ( -1.662 -2.879 0.008) 3.325 16.252 ( 5.432 9.408 0.241) 10.866 16.362 ( 0.689 1.194 7.143) 7.275 16.435 ( -1.402 -2.429 6.762) 7.321 16.770 ( 0.360 0.623 -0.072) 0.723 16.939 ( -4.058 -7.028 0.590) 8.137 17.280 ( 1.741 3.015 -23.216) 23.475 18.813 ( 2.264 3.921 -0.577) 4.564 18.937 ( -3.232 -5.598 -0.787) 6.511 19.738 ( 3.033 5.253 -1.066) 6.159 19.828 ( -1.135 -1.965 -2.724) 3.546 19.998 ( -1.548 -2.681 6.645) 7.331======================= Grid point 266 (43/136) =======================q-point: ( 0.00 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 136Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.126 ( 0.000 -0.000 25.943) 25.943 1.126 ( 0.000 0.000 25.943) 25.943 1.717 ( 0.000 0.000 38.409) 38.409 4.213 ( 0.000 0.000 4.845) 4.845 5.476 ( 0.000 -0.000 -7.473) 7.473 5.476 ( 0.000 0.000 -7.473) 7.473 6.392 ( 0.000 0.000 -12.160) 12.160 6.392 ( 0.000 -0.000 -12.160) 12.160 7.164 ( 0.000 0.000 12.472) 12.472 8.550 ( 0.000 0.000 -7.931) 7.931 8.969 ( -0.000 -0.000 6.332) 6.332 8.969 ( -0.000 0.000 6.332) 6.332 9.423 ( 0.000 0.000 -6.533) 6.533 9.427 ( 0.000 -0.000 0.257) 0.257 9.427 ( 0.000 0.000 0.257) 0.257 15.201 ( 0.000 -0.000 -3.954) 3.954 15.201 ( 0.000 0.000 -3.954) 3.954 15.785 ( 0.000 -0.000 6.423) 6.423 15.785 ( -0.000 0.000 6.423) 6.423 16.337 ( 0.000 -0.000 -2.101) 2.101 16.337 ( 0.000 -0.000 -2.101) 2.101 17.505 ( 0.000 0.000 3.313) 3.313 19.232 ( 0.000 0.000 -2.043) 2.043 19.339 ( 0.000 0.000 0.859) 0.859 19.407 ( -0.000 -0.000 -0.657) 0.657 19.407 ( 0.000 0.000 -0.657) 0.657 20.402 ( 0.000 0.000 -0.779) 0.779======================= Grid point 267 (44/136) =======================q-point: ( 0.09 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.170 ( 5.142 18.731 20.025) 27.897 1.458 ( 12.137 7.838 25.984) 29.730 2.037 ( 33.922 9.595 24.558) 42.963 4.180 ( -3.280 -0.806 5.022) 6.052 5.326 ( -4.827 -6.607 -9.058) 12.207 5.605 ( 3.877 2.559 -4.447) 6.431 6.239 ( -6.296 -12.279 -6.464) 15.238 6.452 ( -1.449 8.047 -9.719) 12.701 6.870 ( -17.170 -6.115 14.276) 23.152 8.275 ( -9.039 -7.350 -0.001) 11.650 8.913 ( 3.989 -15.653 3.877) 16.612 9.144 ( -4.631 0.934 -8.392) 9.630 9.273 ( -11.909 2.937 -2.654) 12.549 9.532 ( 4.576 7.631 -0.324) 8.903 9.860 ( 27.915 14.381 -3.470) 31.593 15.180 ( -4.117 7.995 -3.989) 9.838 15.327 ( 7.874 0.035 -3.761) 8.727 15.783 ( 8.436 -8.981 4.524) 13.126 16.057 ( 10.731 16.567 -1.296) 19.782 16.300 ( -1.557 -3.213 -1.457) 3.856 16.474 ( 11.114 9.146 -4.669) 15.131 17.512 ( 0.627 0.015 2.880) 2.947 19.247 ( 0.672 0.166 -2.256) 2.360 19.296 ( -6.208 -1.280 -0.395) 6.351 19.391 ( 0.158 -0.067 -0.266) 0.317 19.409 ( 0.762 1.117 -0.316) 1.389 20.381 ( -0.144 -3.969 -3.214) 5.110======================= Grid point 268 (45/136) =======================q-point: ( 0.18 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.549 ( 14.266 18.822 10.612) 25.892 1.711 ( 7.699 12.729 20.901) 25.655 2.905 ( 46.408 15.792 7.127) 49.537 4.086 ( -6.927 -0.141 5.494) 8.843 5.166 ( -5.092 -8.831 -8.832) 13.488 5.640 ( 0.107 -2.905 -0.198) 2.914 5.990 ( -6.259 -11.170 4.194) 13.473 6.503 ( -4.151 9.331 -3.663) 10.850 6.653 ( -3.629 -1.155 0.282) 3.819 8.076 ( -5.613 -10.313 0.468) 11.750 8.784 ( 0.796 -18.876 -0.006) 18.892 8.991 ( -14.536 5.194 -5.657) 16.440 9.050 ( -13.205 -2.990 -6.282) 14.926 9.697 ( 6.150 6.644 -0.066) 9.054 10.367 ( 16.288 10.555 0.849) 19.427 15.198 ( -4.224 9.746 -3.694) 11.246 15.422 ( 4.949 -4.597 0.253) 6.760 15.895 ( 11.927 -3.090 0.960) 12.359 16.220 ( -1.444 -0.953 -0.683) 1.860 16.362 ( 6.705 11.495 -2.768) 13.593 16.814 ( 11.729 11.376 -4.046) 16.833 17.514 ( -0.131 -1.033 2.005) 2.259 19.099 ( -11.807 -1.620 -2.609) 12.200 19.269 ( -0.505 -1.105 -3.238) 3.458 19.407 ( 1.995 1.786 0.224) 2.687 19.461 ( 2.432 1.750 -0.106) 2.998 20.317 ( 0.183 -8.814 -6.615) 11.022======================= Grid point 269 (46/136) =======================q-point: ( 0.27 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.949 ( 13.194 9.118 11.319) 19.630 2.024 ( 12.054 18.428 3.635) 22.318 3.810 ( 26.011 12.266 -1.307) 28.788 3.971 ( 3.743 6.133 2.594) 7.639 4.993 ( -2.638 -9.379 -4.778) 10.851 5.546 ( -3.921 -8.885 3.267) 10.247 5.860 ( 0.739 -4.860 6.405) 8.074 6.465 ( -3.485 -0.072 1.670) 3.865 6.702 ( 2.896 7.212 -6.543) 10.159 7.850 ( -8.215 -11.702 -0.094) 14.298 8.557 ( -5.737 -18.288 -4.986) 19.805 8.731 ( -19.051 4.153 -2.637) 19.676 8.839 ( -7.352 -3.868 -5.818) 10.142 9.867 ( 5.020 7.559 -0.311) 9.080 10.671 ( 9.682 6.962 5.477) 13.123 15.224 ( -4.526 10.347 -3.195) 11.737 15.398 ( 1.944 -11.010 1.852) 11.333 16.119 ( 13.672 1.745 -1.898) 13.913 16.216 ( 2.328 -0.061 2.010) 3.076 16.596 ( 6.236 12.593 -3.839) 14.567 17.045 ( 3.328 9.367 4.390) 10.867 17.478 ( -2.218 -2.476 1.324) 3.578 18.877 ( -11.281 -1.627 -5.654) 12.723 19.222 ( -2.441 -2.023 -4.174) 5.241 19.490 ( 3.710 3.650 -0.196) 5.208 19.515 ( 2.848 0.175 0.656) 2.928 20.214 ( -0.716 -10.933 -7.852) 13.480======================= Grid point 270 (47/136) =======================q-point: ( 0.36 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.213 ( 8.147 7.205 7.383) 13.145 2.424 ( 14.068 14.492 -5.778) 21.007 3.667 ( -16.425 -1.295 3.706) 16.888 4.562 ( 14.345 13.348 -4.094) 20.018 5.034 ( 21.280 -4.935 -4.295) 22.263 5.355 ( -5.807 -9.942 6.445) 13.195 5.894 ( 6.277 -1.643 3.050) 7.170 6.417 ( 0.836 -5.123 0.492) 5.214 6.827 ( 2.015 5.693 -4.871) 7.758 7.578 ( -10.097 -6.915 -1.539) 12.334 8.215 ( -18.988 -6.371 -2.068) 20.135 8.513 ( -4.075 -6.365 -5.127) 9.132 8.688 ( -6.476 -2.838 -2.995) 7.678 10.009 ( 2.352 7.607 -0.345) 7.970 10.855 ( 5.257 4.560 7.607) 10.310 15.242 ( -7.860 14.057 -1.960) 16.224 15.306 ( 4.531 -16.400 0.699) 17.029 16.289 ( 6.296 -0.916 3.214) 7.128 16.360 ( 10.558 1.810 -2.841) 11.083 16.822 ( 5.508 12.348 -1.635) 13.619 17.137 ( -3.038 10.011 7.398) 12.814 17.386 ( -5.074 -3.283 1.449) 6.215 18.696 ( -6.984 -2.529 -6.820) 10.084 19.159 ( -2.745 -1.025 -5.690) 6.400 19.550 ( 2.133 -0.466 1.993) 2.956 19.607 ( 5.216 2.711 -2.070) 6.233 20.081 ( -1.814 -10.803 -6.966) 12.981======================= Grid point 271 (48/136) =======================q-point: ( 0.45 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.358 ( 2.858 2.345 3.981) 5.433 2.777 ( 8.872 13.269 -13.201) 20.714 3.355 ( -14.912 -1.858 5.526) 16.011 4.776 ( 6.317 5.515 8.780) 12.141 5.075 ( -5.747 -10.833 6.131) 13.710 5.499 ( 15.208 0.994 -9.229) 17.817 6.056 ( 14.832 -1.551 -4.709) 15.638 6.354 ( 0.647 -13.623 -6.600) 15.152 6.794 ( -5.281 -3.291 -0.393) 6.235 7.519 ( 2.555 11.996 0.883) 12.297 7.819 ( -21.192 -1.137 0.802) 21.237 8.452 ( 2.458 -4.832 -5.209) 7.518 8.569 ( -2.641 -3.736 -1.814) 4.922 10.091 ( -1.227 6.391 -0.263) 6.513 10.946 ( 1.249 2.367 8.318) 8.738 15.212 ( -5.006 5.087 1.367) 7.267 15.274 ( 3.823 -6.599 -2.741) 8.104 16.382 ( 5.869 -3.472 1.739) 7.037 16.487 ( 3.638 -1.066 0.305) 3.803 17.035 ( 6.223 9.835 3.344) 12.109 17.163 ( -6.389 12.196 2.009) 13.914 17.238 ( -8.627 -2.421 1.618) 9.106 18.596 ( -1.284 -2.891 -5.655) 6.480 19.117 ( -1.711 0.597 -7.111) 7.339 19.573 ( 1.578 -1.547 2.873) 3.625 19.718 ( 4.423 1.348 -5.171) 6.937 19.952 ( -0.658 -8.930 -4.315) 9.940======================= Grid point 278 (49/136) =======================q-point: ( 0.09 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.531 ( 8.758 15.170 19.063) 25.889 1.780 ( 11.123 19.265 15.910) 27.350 2.500 ( 21.589 37.392 11.682) 44.730 4.147 ( -1.480 -2.564 6.074) 6.757 5.155 ( -5.444 -9.429 -8.647) 13.904 5.624 ( -0.953 -1.650 -1.801) 2.622 5.988 ( -6.734 -11.663 0.397) 13.474 6.590 ( 3.590 6.219 -9.752) 12.110 6.705 ( -5.109 -8.850 8.241) 13.128 8.070 ( -6.412 -11.106 0.597) 12.838 8.655 ( -6.619 -11.464 1.771) 13.356 9.064 ( -4.341 -7.519 -10.338) 13.499 9.375 ( 1.311 2.271 -4.675) 5.360 9.526 ( -0.413 -0.715 3.575) 3.669 10.290 ( 12.246 21.212 -1.349) 24.530 15.254 ( -1.360 -2.356 -2.655) 3.801 15.454 ( 6.374 11.040 -5.340) 13.822 15.699 ( 0.669 1.159 4.775) 4.959 16.232 ( -1.735 -3.005 -0.527) 3.510 16.362 ( 7.596 13.156 -2.832) 15.453 16.763 ( 9.918 17.178 -5.631) 20.619 17.508 ( -0.358 -0.619 2.246) 2.357 19.227 ( -3.092 -5.355 -2.816) 6.794 19.244 ( -0.960 -1.663 -2.994) 3.557 19.402 ( 1.232 2.135 0.177) 2.471 19.451 ( 1.320 2.286 0.040) 2.640 20.255 ( -4.340 -7.516 -5.047) 10.040======================= Grid point 279 (50/136) =======================q-point: ( 0.18 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.848 ( 11.208 14.296 13.016) 22.348 2.126 ( 5.375 23.240 9.314) 25.608 3.374 ( 36.033 30.245 -0.684) 47.049 4.075 ( -4.784 -1.143 7.290) 8.794 4.962 ( -5.082 -10.793 -7.526) 14.105 5.521 ( -4.585 -9.560 -0.142) 10.603 5.823 ( -1.801 -4.861 3.427) 6.214 6.531 ( -6.260 -5.928 3.825) 9.432 6.718 ( 3.426 6.872 -7.303) 10.597 7.868 ( -5.660 -8.381 1.431) 10.214 8.414 ( -4.162 -18.031 -2.361) 18.655 8.876 ( -7.340 -9.320 -9.631) 15.281 9.227 ( -21.050 11.936 -1.588) 24.250 9.669 ( 16.138 -7.431 0.563) 17.776 10.638 ( 7.997 14.492 3.807) 16.984 15.180 ( -0.364 -8.699 -1.061) 8.771 15.567 ( -7.597 15.769 -1.268) 17.550 15.870 ( 15.663 0.094 -0.689) 15.679 16.193 ( 0.105 -1.010 1.396) 1.727 16.613 ( 6.778 12.828 -2.907) 14.797 17.062 ( 6.902 12.454 1.174) 14.287 17.479 ( -1.295 -2.617 1.524) 3.294 19.065 ( -10.717 -1.578 -5.918) 12.344 19.206 ( 0.395 -5.145 -4.457) 6.818 19.473 ( 2.559 3.980 0.426) 4.751 19.484 ( 1.304 0.372 2.033) 2.444 20.111 ( -1.633 -10.638 -8.283) 13.581======================= Grid point 280 (51/136) =======================q-point: ( 0.27 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.179 ( 9.680 13.881 7.515) 18.516 2.445 ( 5.538 22.715 1.452) 23.425 3.909 ( -10.817 0.530 5.464) 12.130 4.284 ( 33.371 20.978 -6.605) 39.967 4.791 ( -0.595 -10.217 -2.762) 10.600 5.315 ( -4.447 -13.709 3.211) 14.766 5.813 ( 2.505 -0.307 0.682) 2.614 6.370 ( -3.562 -8.935 1.360) 9.714 6.834 ( 2.502 4.058 -4.459) 6.528 7.697 ( -8.399 -1.425 1.722) 8.692 8.191 ( -0.000 -16.798 -5.775) 17.763 8.635 ( -9.707 -8.699 -7.948) 15.267 8.961 ( -21.408 9.623 0.395) 23.475 9.862 ( 13.865 -6.893 0.222) 15.486 10.868 ( 3.873 11.533 6.640) 13.861 15.079 ( 1.594 -13.111 -0.422) 13.214 15.573 ( -9.657 16.326 -0.981) 18.993 16.133 ( 12.103 0.544 -0.951) 12.153 16.233 ( 5.317 1.231 1.830) 5.756 16.840 ( 5.509 10.357 0.282) 11.735 17.260 ( 1.973 12.305 5.284) 13.536 17.412 ( -2.236 -3.791 1.348) 4.603 18.848 ( -12.213 -1.203 -7.750) 14.515 19.162 ( 0.042 -4.012 -7.045) 8.107 19.488 ( 2.017 -3.434 4.602) 6.086 19.574 ( 3.260 4.330 -0.536) 5.446 19.987 ( -0.591 -10.551 -9.648) 14.309======================= Grid point 281 (52/136) =======================q-point: ( 0.36 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.415 ( 1.524 12.901 4.073) 13.614 2.787 ( 8.676 21.081 -5.519) 23.455 3.635 ( -18.265 -2.026 3.176) 18.649 4.694 ( 5.086 -1.238 5.100) 7.309 4.955 ( 9.993 -6.114 0.748) 11.739 5.216 ( 15.133 0.937 -3.845) 15.642 5.874 ( 5.110 -1.127 -4.425) 6.853 6.224 ( -1.288 -13.708 -3.718) 14.262 6.817 ( -3.550 -6.945 -0.973) 7.860 7.626 ( -2.071 10.293 -0.838) 10.532 8.067 ( -5.288 -4.877 -4.470) 8.469 8.421 ( -4.529 -3.840 -4.406) 7.394 8.697 ( -16.053 2.932 1.018) 16.350 9.997 ( 10.108 -7.985 0.646) 12.897 11.005 ( -0.101 9.350 7.729) 12.132 14.988 ( 4.094 -14.110 -0.333) 14.695 15.568 ( -10.070 16.969 -1.264) 19.773 16.261 ( 5.311 -1.139 2.513) 5.985 16.388 ( 7.691 0.720 -0.529) 7.742 17.003 ( 5.107 4.947 6.865) 9.883 17.272 ( -4.454 -3.977 2.759) 6.578 17.447 ( -2.469 16.968 -0.009) 17.147 18.646 ( -8.215 -2.299 -7.383) 11.282 19.131 ( -0.191 -1.907 -9.425) 9.618 19.489 ( 3.639 -6.088 5.982) 9.279 19.668 ( 3.371 2.829 -2.766) 5.198 19.879 ( -0.941 -8.316 -8.113) 11.656======================= Grid point 282 (53/136) =======================q-point: ( 0.45 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.491 ( -5.871 10.169 2.561) 12.018 3.067 ( -7.723 13.377 -14.135) 20.937 3.364 ( -2.572 4.455 8.373) 9.827 4.809 ( 1.631 -2.824 13.382) 13.774 4.833 ( 6.372 -11.037 3.472) 13.209 5.511 ( 0.795 -1.378 -7.329) 7.500 5.999 ( 4.259 -7.377 -8.480) 12.020 6.031 ( 7.104 -12.305 -10.573) 17.711 6.707 ( 3.300 -5.717 2.472) 7.049 7.766 ( -2.796 4.843 -5.669) 7.963 7.893 ( -7.444 12.893 0.500) 14.896 8.431 ( -1.731 2.998 -1.446) 3.752 8.515 ( 0.110 -0.190 0.184) 0.286 10.045 ( 5.849 -10.131 0.881) 11.731 11.051 ( -4.115 7.127 7.981) 11.464 14.952 ( 7.381 -12.785 -0.357) 14.767 15.565 ( -9.943 17.223 -1.335) 19.932 16.306 ( 2.009 -3.480 1.995) 4.486 16.458 ( 1.314 -2.275 1.381) 2.968 17.134 ( 0.559 -0.968 9.808) 9.871 17.144 ( 1.043 -1.806 2.919) 3.587 17.523 ( -10.914 18.904 -4.161) 22.221 18.556 ( 0.311 -0.539 -6.321) 6.352 19.119 ( 0.330 -0.571 -10.372) 10.393 19.491 ( 4.151 -7.190 6.474) 10.528 19.729 ( 0.308 -0.533 -6.192) 6.223 19.811 ( 2.448 -4.241 -4.880) 6.913======================= Grid point 291 (54/136) =======================q-point: ( 0.18 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.162 ( 9.726 16.846 7.371) 20.802 2.547 ( 10.858 18.806 5.182) 22.325 4.029 ( -2.233 -3.868 8.055) 9.210 4.042 ( 20.175 34.943 -6.779) 40.915 4.754 ( -5.627 -9.747 -5.332) 12.454 5.278 ( -7.809 -13.526 1.354) 15.677 5.791 ( 0.464 0.804 -0.190) 0.948 6.358 ( -6.108 -10.580 1.952) 12.372 6.831 ( 1.987 3.441 -3.931) 5.590 7.793 ( 0.463 0.802 3.863) 3.972 8.070 ( -8.853 -15.333 -6.959) 19.023 8.670 ( -6.323 -10.951 -9.254) 15.670 9.443 ( -1.919 -3.323 6.307) 7.383 9.466 ( 0.181 0.313 -5.337) 5.349 10.900 ( 6.564 11.370 6.268) 14.548 14.998 ( -5.113 -8.857 -0.151) 10.228 15.864 ( 3.465 6.001 0.846) 6.981 15.909 ( 6.095 10.556 -4.170) 12.883 16.193 ( 0.741 1.283 3.295) 3.613 16.843 ( 5.395 9.344 0.874) 10.825 17.307 ( 7.368 12.761 4.117) 15.300 17.406 ( -2.726 -4.721 1.320) 5.609 19.029 ( -2.407 -4.168 -12.302) 13.210 19.075 ( -3.332 -5.771 -3.788) 7.666 19.447 ( -1.880 -3.257 6.623) 7.616 19.568 ( 2.697 4.671 -0.097) 5.395 19.932 ( -3.989 -6.909 -10.839) 13.458======================= Grid point 292 (55/136) =======================q-point: ( 0.27 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.491 ( 7.630 17.016 2.337) 18.794 2.885 ( 6.459 20.228 1.411) 21.281 3.881 ( -11.297 -3.715 4.126) 12.588 4.605 ( -0.427 -6.585 1.101) 6.690 4.705 ( 20.885 17.909 -4.470) 27.873 5.048 ( -0.752 -10.234 0.251) 10.265 5.819 ( 1.397 0.171 -5.434) 5.613 6.140 ( -4.837 -12.915 -0.919) 13.822 6.800 ( -4.104 -8.661 -0.468) 9.596 7.783 ( -6.338 5.400 -5.513) 9.986 7.977 ( 8.885 0.389 -1.223) 8.978 8.458 ( -6.034 -8.470 -7.504) 12.824 9.139 ( -24.796 7.724 3.128) 26.159 9.636 ( 16.935 -15.113 0.907) 22.716 11.085 ( 2.730 9.520 7.408) 12.368 14.842 ( -1.522 -10.235 -0.278) 10.351 15.892 ( -7.938 14.934 -1.044) 16.945 16.157 ( 9.223 1.921 -0.690) 9.446 16.258 ( 6.078 1.319 2.759) 6.804 16.971 ( 2.900 3.039 8.368) 9.363 17.291 ( -3.999 -6.293 1.983) 7.716 17.588 ( 6.631 18.195 0.013) 19.365 18.832 ( -13.820 -0.377 -9.081) 16.541 19.050 ( 4.897 -7.903 -10.887) 14.316 19.376 ( 0.109 -6.826 8.245) 10.705 19.652 ( 2.264 3.381 -1.049) 4.202 19.829 ( -1.396 -5.239 -9.934) 11.317======================= Grid point 293 (56/136) =======================q-point: ( 0.36 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.710 ( -2.600 16.167 -0.128) 16.375 3.209 ( 8.960 19.113 -1.969) 21.201 3.576 ( -18.118 -4.081 0.257) 18.573 4.606 ( 6.527 -5.235 5.903) 10.240 4.770 ( -2.292 -9.383 11.050) 14.676 5.373 ( 19.149 10.819 -8.822) 23.697 5.832 ( 2.041 -2.862 -8.710) 9.392 5.934 ( -4.316 -13.216 -6.748) 15.455 6.575 ( -1.939 -16.538 0.392) 16.656 7.819 ( 1.401 6.549 -10.853) 12.753 8.095 ( -3.716 3.839 -6.588) 8.482 8.428 ( 7.490 9.222 3.067) 12.270 8.766 ( -24.161 3.337 4.941) 24.886 9.733 ( 13.122 -17.714 1.975) 22.132 11.181 ( -1.506 7.482 7.777) 10.897 14.752 ( 2.641 -9.334 -0.470) 9.712 15.899 ( -8.940 15.777 -1.321) 18.182 16.253 ( 2.321 0.289 2.977) 3.786 16.385 ( 5.451 -1.056 0.854) 5.617 17.043 ( 4.834 -0.036 9.773) 10.904 17.154 ( -3.813 -6.659 4.603) 8.948 17.849 ( -1.697 21.271 -4.329) 21.773 18.610 ( -8.668 -1.171 -7.380) 11.444 19.059 ( 4.355 -6.832 -13.443) 15.696 19.329 ( 3.066 -7.786 8.051) 11.612 19.711 ( 1.648 1.474 -3.752) 4.355 19.769 ( -0.709 -3.140 -5.979) 6.791======================= Grid point 299 (57/136) =======================q-point: (-0.09 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.295 ( -10.012 17.342 12.222) 23.459 1.604 ( -5.231 9.060 24.742) 26.863 2.750 ( -24.169 41.862 10.577) 49.482 4.087 ( 3.888 -6.735 4.676) 9.074 5.266 ( 3.151 -5.457 -9.656) 11.530 5.664 ( -1.454 2.518 -1.073) 3.099 6.196 ( 6.266 -10.852 11.828) 17.232 6.313 ( 0.104 -0.180 -12.055) 12.057 6.668 ( 3.253 -5.635 2.414) 6.940 8.193 ( 2.610 -4.521 0.352) 5.232 8.888 ( 8.346 -14.455 -0.803) 16.710 9.040 ( 3.833 -6.639 -11.481) 13.805 9.190 ( -0.584 1.011 4.001) 4.168 9.484 ( 0.535 -0.927 -4.516) 4.641 10.269 ( -11.428 19.794 0.311) 22.858 15.072 ( 1.919 -3.323 -2.164) 4.406 15.492 ( -5.597 9.694 -2.202) 11.409 15.968 ( -2.116 3.666 4.481) 6.164 16.162 ( -5.714 9.897 -6.699) 13.246 16.270 ( 1.303 -2.257 0.655) 2.688 16.684 ( -7.657 13.263 -5.539) 16.286 17.524 ( -0.175 0.304 2.244) 2.271 19.118 ( 6.259 -10.841 -1.336) 12.590 19.269 ( -0.242 0.419 -2.735) 2.777 19.398 ( -0.234 0.405 0.197) 0.507 19.437 ( -1.741 3.016 -0.471) 3.514 20.413 ( -0.197 0.342 -6.572) 6.584======================= Grid point 303 (58/136) =======================q-point: ( 0.27 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.831 ( 9.234 15.994 -1.572) 18.535 3.212 ( 6.924 11.993 1.327) 13.912 3.741 ( -5.790 -10.028 -0.530) 11.591 4.524 ( -0.404 -0.700 7.042) 7.089 4.736 ( -4.727 -8.187 10.021) 13.776 5.229 ( 12.138 21.023 -10.504) 26.450 5.803 ( -1.156 -2.003 -9.865) 10.132 5.915 ( -4.625 -8.010 -2.887) 9.689 6.498 ( -11.249 -19.484 -1.212) 22.531 7.843 ( 2.552 4.421 -13.410) 14.349 8.139 ( 0.908 1.572 -7.675) 7.887 8.407 ( 6.569 11.378 5.243) 14.145 9.225 ( -4.732 -8.196 8.060) 12.431 9.310 ( -4.830 -8.365 -0.516) 9.673 11.233 ( 2.966 5.137 7.771) 9.776 14.682 ( -3.251 -5.631 -0.468) 6.519 16.122 ( 3.703 6.414 0.379) 7.415 16.216 ( 2.443 4.231 -2.141) 5.334 16.291 ( 1.373 2.377 4.000) 4.852 16.996 ( 0.323 0.559 11.601) 11.619 17.152 ( -4.062 -7.035 3.704) 8.928 17.969 ( 10.883 18.849 -4.432) 22.212 18.829 ( -3.551 -6.151 -5.289) 8.856 18.830 ( -4.326 -7.493 -13.464) 16.005 19.272 ( -1.749 -3.030 4.862) 5.990 19.705 ( 1.078 1.867 -1.931) 2.894 19.759 ( -1.274 -2.206 -6.988) 7.438======================= Grid point 304 (59/136) =======================q-point: ( 0.36 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.030 ( -8.443 14.623 -2.558) 17.078 3.345 ( 4.521 -7.831 -0.136) 9.043 3.586 ( -3.609 6.251 -1.847) 7.451 4.546 ( 0.171 -0.296 8.919) 8.926 4.626 ( 2.781 -4.817 11.439) 12.719 5.521 ( -0.752 1.302 -6.227) 6.406 5.769 ( 1.328 -2.301 -10.450) 10.782 5.844 ( -3.910 6.771 -7.006) 10.499 6.215 ( 9.881 -17.114 -2.828) 19.963 7.930 ( -2.848 4.933 -12.922) 14.121 8.071 ( 2.244 -3.887 -12.165) 12.967 8.791 ( -7.155 12.392 9.491) 17.171 8.834 ( -7.722 13.375 4.921) 16.209 9.316 ( 13.512 -23.404 3.493) 27.250 11.285 ( -1.569 2.717 7.870) 8.472 14.625 ( 1.898 -3.287 -0.557) 3.836 16.170 ( -6.107 10.577 -0.764) 12.237 16.264 ( -0.261 0.453 2.744) 2.793 16.337 ( 2.341 -4.055 0.918) 4.771 17.024 ( 1.169 -2.025 10.100) 10.368 17.047 ( 1.363 -2.362 6.285) 6.851 18.228 ( -7.976 13.815 -7.309) 17.547 18.621 ( -2.188 3.790 -6.824) 8.106 18.830 ( 8.214 -14.227 -8.599) 18.542 19.245 ( 0.752 -1.303 2.076) 2.564 19.728 ( -0.123 0.213 -4.544) 4.551 19.733 ( 0.390 -0.676 -3.251) 3.343======================= Grid point 310 (60/136) =======================q-point: (-0.18 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.748 ( -19.064 17.626 4.139) 26.291 1.830 ( -9.550 10.248 15.401) 20.818 3.592 ( -26.849 33.794 -0.856) 43.170 3.923 ( 4.772 -10.011 4.206) 11.861 5.133 ( 5.895 -2.299 -6.212) 8.867 5.663 ( 3.568 -0.431 3.222) 4.826 5.993 ( 7.649 0.180 13.461) 15.483 6.372 ( -6.247 -2.730 -6.679) 9.544 6.618 ( -0.849 -1.175 -3.324) 3.626 8.059 ( 9.547 -2.816 0.684) 9.977 8.580 ( 6.617 -20.543 -5.429) 22.254 8.868 ( 8.318 -4.346 -10.204) 13.864 9.065 ( 17.872 8.530 2.016) 19.906 9.571 ( -15.592 -12.514 -2.233) 20.117 10.601 ( -8.429 12.594 4.604) 15.838 15.028 ( -2.507 -7.446 -1.392) 7.979 15.656 ( 3.482 15.227 -0.743) 15.638 16.043 ( -6.785 1.562 0.386) 6.973 16.245 ( 0.476 4.033 2.438) 4.737 16.387 ( -10.516 3.566 -6.334) 12.783 16.901 ( -6.794 3.328 1.274) 7.672 17.510 ( 1.604 -1.213 1.533) 2.529 18.904 ( 6.220 -9.105 -4.288) 11.831 19.243 ( 1.857 -2.669 -2.916) 4.368 19.441 ( -2.857 2.668 0.016) 3.909 19.504 ( -2.324 2.950 -0.627) 3.808 20.378 ( 4.917 0.738 -7.404) 8.919======================= Grid point 322 (61/136) =======================q-point: (-0.27 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.116 ( -10.360 11.564 7.738) 17.347 2.230 ( -15.439 16.939 -2.417) 23.047 3.687 ( 7.830 -12.117 3.430) 14.829 4.279 ( -20.934 11.119 -7.557) 24.879 5.134 ( -3.489 14.407 -3.121) 15.148 5.521 ( 9.668 -4.692 6.500) 12.560 5.956 ( 1.033 6.947 11.215) 13.233 6.444 ( -2.661 1.166 -0.774) 3.007 6.675 ( -7.167 -1.662 -5.036) 8.916 7.800 ( 15.880 -4.246 -2.808) 16.676 8.241 ( 9.285 -20.624 -5.210) 23.210 8.696 ( 8.609 0.089 -7.913) 11.693 8.835 ( 14.631 4.132 0.174) 15.204 9.712 ( -15.646 -14.279 -0.791) 21.197 10.821 ( -4.944 8.705 7.018) 12.226 14.997 ( -4.296 -10.880 -0.848) 11.728 15.662 ( 11.781 15.953 -0.154) 19.832 16.235 ( -9.749 2.862 0.267) 10.164 16.342 ( -5.349 8.033 2.295) 9.920 16.596 ( -10.510 1.634 -7.538) 13.037 16.982 ( -3.841 -4.570 7.849) 9.862 17.438 ( 4.076 -3.592 1.205) 5.565 18.740 ( 4.651 -4.501 -6.312) 9.041 19.170 ( 2.350 -3.912 -3.495) 5.748 19.527 ( -3.300 2.380 -0.385) 4.087 19.578 ( -2.887 3.711 -1.060) 4.819 20.268 ( 8.040 0.322 -6.228) 10.176======================= Grid point 323 (62/136) =======================q-point: (-0.18 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.081 ( -8.225 14.247 6.464) 17.675 2.193 ( -14.398 24.938 0.698) 28.805 3.695 ( 6.986 -12.100 3.151) 14.322 4.141 ( -10.282 17.809 -7.883) 22.024 5.179 ( -5.892 10.206 -3.265) 12.228 5.582 ( 4.746 -8.219 6.242) 11.360 6.019 ( -1.953 3.382 17.281) 17.716 6.403 ( -2.729 4.727 -7.158) 9.001 6.604 ( 0.066 -0.114 -2.863) 2.866 7.934 ( 5.833 -10.103 0.706) 11.687 8.202 ( 9.867 -17.090 -10.183) 22.206 8.760 ( 2.952 -5.112 -8.007) 9.948 9.216 ( 0.674 -1.167 6.573) 6.710 9.283 ( 4.850 -8.401 -6.864) 11.884 10.825 ( -5.535 9.588 6.761) 12.972 14.902 ( 3.124 -5.410 -0.586) 6.275 15.987 ( -8.151 14.119 -1.299) 16.354 16.025 ( -0.848 1.469 0.078) 1.698 16.326 ( -2.314 4.007 6.862) 8.277 16.522 ( -5.046 8.740 -11.311) 15.159 16.924 ( 0.648 -1.123 6.914) 7.034 17.455 ( 2.583 -4.474 1.193) 5.302 18.759 ( 2.999 -5.195 -6.197) 8.624 19.169 ( 2.607 -4.515 -2.708) 5.875 19.510 ( -2.295 3.975 -0.576) 4.626 19.571 ( -2.135 3.698 -1.093) 4.408 20.342 ( 2.358 -4.084 -6.095) 7.706======================= Grid point 334 (63/136) =======================q-point: (-0.36 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.381 ( -4.771 12.851 4.056) 14.296 2.598 ( -10.483 12.169 -9.374) 18.596 3.404 ( 10.003 -12.268 2.888) 16.091 4.580 ( -14.234 -1.848 1.959) 14.486 5.247 ( 12.366 -8.577 7.527) 16.827 5.500 ( -9.886 19.236 -9.460) 23.606 6.096 ( -5.208 14.802 4.662) 16.369 6.494 ( -0.366 4.219 1.156) 4.390 6.784 ( -5.004 -3.195 -3.437) 6.860 7.483 ( 12.069 -4.333 -5.705) 14.035 7.858 ( 12.300 -16.974 -1.853) 21.044 8.585 ( 6.216 3.662 -5.421) 9.024 8.668 ( 7.670 1.353 -0.455) 7.802 9.814 ( -13.520 -16.130 -0.438) 21.052 10.949 ( -1.524 5.915 7.955) 10.030 14.962 ( -5.414 -12.495 -0.523) 13.628 15.618 ( 11.891 17.240 -0.398) 20.947 16.398 ( -5.441 5.168 4.378) 8.688 16.520 ( -2.628 7.009 -1.839) 7.708 16.787 ( -11.897 -1.724 -6.244) 13.546 16.977 ( -4.255 -7.653 8.216) 12.008 17.298 ( 6.359 -6.229 1.554) 9.036 18.655 ( 3.017 0.366 -5.569) 6.344 19.098 ( 0.963 -4.142 -4.758) 6.381 19.583 ( -0.940 1.764 0.245) 2.013 19.685 ( -4.410 3.963 -3.498) 6.884 20.123 ( 8.421 0.406 -3.780) 9.239======================= Grid point 335 (64/136) =======================q-point: (-0.27 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.374 ( -9.199 13.328 -0.089) 16.194 2.660 ( -8.772 24.786 -1.853) 26.357 3.441 ( 8.266 -12.258 1.807) 14.895 4.335 ( -8.529 -1.914 -2.747) 9.163 5.333 ( 10.707 -14.133 7.685) 19.324 5.523 ( -10.769 20.326 -8.829) 24.639 6.162 ( -5.111 14.311 14.073) 20.711 6.505 ( -2.047 4.501 -0.540) 4.974 6.635 ( -5.918 -2.283 -2.563) 6.841 7.671 ( 12.469 -8.657 -4.285) 15.773 7.889 ( 9.081 -14.110 -11.372) 20.270 8.679 ( 3.057 -0.796 -4.545) 5.534 8.926 ( 19.000 3.624 -0.117) 19.343 9.367 ( -16.286 -18.812 0.743) 24.893 10.979 ( -2.810 6.743 7.619) 10.556 14.809 ( -0.122 -7.834 -0.383) 7.844 15.982 ( 9.898 14.798 -0.098) 17.803 16.319 ( -10.778 6.434 1.235) 12.613 16.442 ( -9.156 2.455 5.445) 10.932 16.684 ( -4.082 6.433 -12.269) 14.442 16.869 ( 0.427 -6.390 8.556) 10.687 17.329 ( 5.160 -7.422 1.173) 9.116 18.698 ( 1.407 -0.007 -5.972) 6.136 19.075 ( 2.207 -5.457 -3.180) 6.690 19.587 ( -1.736 3.513 -1.170) 4.090 19.653 ( -3.330 3.628 -2.080) 5.346 20.230 ( 5.479 -3.747 -3.661) 7.580======================= Grid point 344 (65/136) =======================q-point: (-0.45 0.55 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.491 ( 6.242 10.812 3.026) 12.846 2.795 ( 0.602 1.044 -16.154) 16.199 3.199 ( -1.916 -3.319 6.556) 7.594 4.769 ( -3.084 -5.342 9.304) 11.163 5.009 ( -2.679 -4.641 6.177) 8.178 5.686 ( 4.001 6.929 -8.397) 11.599 6.310 ( 5.000 8.661 -3.298) 10.530 6.547 ( 6.108 10.580 -7.669) 14.424 6.718 ( -1.786 -3.093 1.899) 4.045 7.419 ( -4.207 -7.287 1.037) 8.478 7.586 ( -1.278 -2.214 -3.175) 4.076 8.552 ( 2.939 5.091 -4.873) 7.636 8.605 ( 1.960 3.394 -0.070) 3.920 9.851 ( -10.477 -18.147 -0.378) 20.958 10.992 ( 2.075 3.594 8.174) 9.167 14.945 ( -6.999 -12.122 -0.426) 14.003 15.602 ( 10.617 18.389 -0.490) 21.239 16.514 ( 2.770 4.798 3.135) 6.366 16.533 ( 0.882 1.528 2.255) 2.863 16.896 ( -5.610 -9.717 -8.386) 14.007 17.031 ( -3.342 -5.789 7.293) 9.893 17.146 ( -1.214 -2.102 1.859) 3.057 18.633 ( 1.661 2.877 -4.469) 5.568 19.067 ( -1.795 -3.110 -5.553) 6.613 19.600 ( 0.664 1.151 0.496) 1.418 19.761 ( 0.393 0.680 -6.065) 6.116 20.033 ( 2.407 4.169 -1.199) 4.961======================= Grid point 346 (66/136) =======================q-point: (-0.36 0.55 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.631 ( -4.764 10.559 -3.243) 12.029 2.940 ( 3.499 21.822 -4.908) 22.639 3.189 ( 6.630 -9.251 1.553) 11.487 4.530 ( -16.614 -2.679 4.787) 17.496 4.970 ( 10.317 -17.838 7.338) 21.874 5.796 ( -1.491 10.732 -7.199) 13.009 6.433 ( -2.730 14.981 1.852) 15.339 6.580 ( -5.566 4.545 3.135) 7.840 6.716 ( -2.070 -2.524 0.981) 3.409 7.403 ( 8.635 -3.250 -9.656) 13.355 7.620 ( 7.749 -6.465 -9.867) 14.114 8.639 ( 2.284 2.279 -3.059) 4.446 8.714 ( 8.310 2.767 1.659) 8.914 9.431 ( -13.969 -20.919 0.956) 25.173 11.056 ( 0.303 4.426 7.840) 9.008 14.756 ( -2.985 -8.061 -0.370) 8.604 15.968 ( 10.249 17.197 0.028) 20.019 16.490 ( -5.677 3.759 6.722) 9.568 16.589 ( 0.277 -0.424 3.927) 3.959 16.794 ( -3.870 2.800 -12.592) 13.467 16.857 ( -7.383 -4.068 4.411) 9.514 17.140 ( 5.738 -9.294 1.473) 11.021 18.694 ( 1.463 3.201 -4.333) 5.582 19.001 ( -0.530 -5.406 -4.158) 6.841 19.629 ( 0.456 2.887 -1.182) 3.153 19.747 ( -3.140 1.913 -4.647) 5.926 20.108 ( 4.271 -1.505 -0.523) 4.559======================= Grid point 347 (67/136) =======================q-point: (-0.27 0.55 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.631 ( -7.060 12.228 -4.070) 14.695 3.119 ( -7.798 13.506 0.261) 15.598 3.218 ( 2.826 -4.894 -1.911) 5.965 4.325 ( -1.882 3.260 2.516) 4.528 4.974 ( 11.941 -20.682 7.416) 25.007 5.839 ( -6.126 10.610 -6.867) 14.045 6.499 ( -9.501 16.456 9.760) 21.362 6.587 ( 0.309 -0.534 -0.734) 0.959 6.613 ( -2.604 4.510 3.071) 6.046 7.486 ( 4.566 -7.909 -9.124) 12.909 7.669 ( 5.190 -8.990 -18.014) 20.791 8.671 ( 0.003 -0.005 -2.157) 2.157 8.924 ( 4.210 -7.291 -2.417) 8.759 9.066 ( 3.534 -6.122 6.904) 9.881 11.082 ( -2.023 3.503 7.701) 8.699 14.689 ( 2.419 -4.189 -0.321) 4.848 16.197 ( -3.715 6.435 0.585) 7.453 16.476 ( -1.776 3.076 8.023) 8.774 16.518 ( -6.059 10.495 -0.913) 12.153 16.727 ( 2.181 -3.777 9.804) 10.730 16.823 ( -2.291 3.967 -15.398) 16.065 17.144 ( 6.307 -10.924 1.239) 12.675 18.728 ( -1.540 2.668 -4.726) 5.642 18.963 ( 3.088 -5.349 -3.271) 6.989 19.658 ( -1.854 3.211 -2.463) 4.451 19.717 ( -1.598 2.767 -3.118) 4.465 20.139 ( 2.717 -4.705 -0.537) 5.460======================= Grid point 358 (68/136) =======================q-point: (-0.36 0.64 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.807 ( 4.083 7.072 -4.711) 9.427 3.018 ( -4.009 -6.943 -0.961) 8.075 3.369 ( 9.226 15.980 -2.271) 18.592 4.470 ( -2.389 -4.137 5.581) 7.347 4.635 ( -6.307 -10.923 6.372) 14.132 5.945 ( 2.339 4.051 -4.215) 6.297 6.571 ( 0.525 0.908 0.307) 1.093 6.654 ( 1.983 3.434 6.355) 7.490 6.716 ( -0.358 -0.620 8.579) 8.609 7.420 ( 2.715 4.703 -18.880) 19.645 7.546 ( -1.625 -2.815 -18.214) 18.502 8.676 ( 0.630 1.092 -3.950) 4.146 8.795 ( 3.656 6.333 5.280) 9.019 9.042 ( -9.372 -16.233 4.691) 19.323 11.117 ( 0.900 1.559 7.670) 7.879 14.646 ( -1.616 -2.799 -0.326) 3.249 16.258 ( 5.653 9.791 0.346) 11.311 16.529 ( 0.271 0.469 8.863) 8.879 16.574 ( -0.201 -0.348 5.811) 5.825 16.795 ( -0.597 -1.034 3.678) 3.867 16.866 ( 1.275 2.209 -16.814) 17.006 16.958 ( -4.245 -7.352 1.038) 8.552 18.771 ( 2.381 4.123 -3.739) 6.054 18.893 ( -2.842 -4.922 -3.696) 6.780 19.693 ( 1.806 3.128 -2.897) 4.631 19.752 ( -0.769 -1.332 -4.593) 4.843 20.082 ( -0.452 -0.782 1.677) 1.905======================= Grid point 399 (69/136) =======================q-point: ( 0.00 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 130Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.598 ( 0.000 -0.000 20.866) 20.866 1.598 ( -0.000 0.000 20.866) 20.866 2.399 ( -0.000 0.000 29.365) 29.365 4.311 ( 0.000 0.000 4.699) 4.699 5.311 ( 0.000 0.000 -8.622) 8.622 5.311 ( 0.000 0.000 -8.622) 8.622 6.150 ( 0.000 -0.000 -11.317) 11.317 6.150 ( 0.000 0.000 -11.317) 11.317 7.435 ( -0.000 0.000 13.784) 13.784 8.394 ( 0.000 0.000 -6.828) 6.828 9.097 ( 0.000 -0.000 6.260) 6.260 9.097 ( 0.000 0.000 6.260) 6.260 9.259 ( 0.000 0.000 -9.712) 9.712 9.425 ( 0.000 -0.000 -0.540) 0.540 9.425 ( 0.000 0.000 -0.540) 0.540 15.137 ( 0.000 -0.000 -2.385) 2.385 15.137 ( 0.000 0.000 -2.385) 2.385 15.901 ( 0.000 -0.000 4.975) 4.975 15.901 ( 0.000 0.000 4.975) 4.975 16.292 ( 0.000 -0.000 -2.210) 2.210 16.292 ( 0.000 0.000 -2.210) 2.210 17.575 ( 0.000 0.000 3.487) 3.487 19.188 ( 0.000 -0.000 -2.210) 2.210 19.358 ( 0.000 0.000 0.943) 0.943 19.393 ( 0.000 -0.000 -0.662) 0.662 19.393 ( 0.000 0.000 -0.662) 0.662 20.385 ( 0.000 0.000 -0.849) 0.849======================= Grid point 400 (70/136) =======================q-point: ( 0.09 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.574 ( -1.260 14.222 19.630) 24.273 1.920 ( 19.037 2.452 19.692) 27.499 2.498 ( 12.531 4.597 20.420) 24.395 4.283 ( -3.093 -0.232 5.008) 5.891 5.160 ( -4.756 -5.506 -7.011) 10.104 5.470 ( 6.290 3.285 -8.717) 11.240 6.067 ( -1.879 -5.432 -8.633) 10.371 6.239 ( 2.804 5.299 -11.015) 12.541 7.169 ( -19.378 -8.405 14.254) 25.482 8.263 ( -6.176 -5.462 -0.827) 8.286 8.927 ( -6.529 -5.433 -4.127) 9.444 9.055 ( 0.814 -13.909 0.476) 13.941 9.235 ( -14.287 1.598 -1.352) 14.439 9.520 ( 3.426 13.519 -0.528) 13.956 9.821 ( 29.262 11.557 -1.098) 31.480 15.121 ( -2.780 5.664 -1.934) 6.599 15.251 ( 9.194 0.271 -3.372) 9.797 15.882 ( 4.749 -6.242 5.113) 9.363 16.073 ( 6.168 11.975 1.517) 13.556 16.269 ( -0.082 -2.648 -1.569) 3.079 16.401 ( 8.905 7.850 -2.984) 12.241 17.575 ( 0.006 -0.268 3.189) 3.201 19.198 ( 0.527 -0.089 -2.517) 2.573 19.291 ( -7.336 -2.452 -0.080) 7.735 19.385 ( 0.350 -0.144 -0.261) 0.459 19.401 ( 0.920 0.987 -0.465) 1.427 20.337 ( -2.876 -3.983 -1.499) 5.136======================= Grid point 401 (71/136) =======================q-point: ( 0.18 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.774 ( 5.013 16.545 11.718) 20.885 2.137 ( 4.457 3.942 20.704) 21.542 3.012 ( 33.805 11.762 2.707) 35.895 4.197 ( -7.420 0.768 5.196) 9.091 5.037 ( -2.111 -6.990 -3.410) 8.059 5.565 ( 3.479 -2.134 -6.936) 8.048 5.981 ( -0.029 -7.769 -2.742) 8.239 6.359 ( 3.495 8.199 -9.602) 13.101 6.795 ( -14.390 -4.270 10.818) 18.502 8.104 ( -5.251 -8.390 2.548) 10.221 8.719 ( -8.207 -10.858 -6.635) 15.142 8.906 ( -1.449 -14.968 -2.004) 15.171 8.958 ( -21.281 6.869 -3.299) 22.604 9.698 ( 5.383 8.099 0.184) 9.726 10.390 ( 20.924 11.859 1.228) 24.083 15.140 ( -2.485 7.030 -2.031) 7.728 15.406 ( 7.313 -1.364 -1.556) 7.600 15.932 ( 7.587 -3.860 2.735) 8.941 16.201 ( 0.048 2.609 -0.947) 2.776 16.331 ( 5.657 7.442 -1.148) 9.419 16.750 ( 16.247 13.447 -2.289) 21.214 17.562 ( -0.864 -1.258 2.595) 3.011 19.061 ( -13.208 -4.036 -1.179) 13.861 19.199 ( -1.378 -1.868 -3.579) 4.265 19.412 ( 2.233 1.839 0.154) 2.897 19.443 ( 1.955 1.740 -1.382) 2.960 20.225 ( -2.659 -8.176 -2.983) 9.100======================= Grid point 402 (72/136) =======================q-point: ( 0.27 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.034 ( 7.783 12.112 1.707) 14.498 2.246 ( 2.880 6.781 13.184) 15.103 3.756 ( 33.396 15.670 -3.989) 37.105 4.032 ( -11.975 0.850 3.298) 12.450 4.963 ( 2.268 -6.877 1.733) 7.446 5.543 ( 0.081 -7.718 -3.539) 8.492 5.933 ( 3.477 -7.275 2.088) 8.329 6.518 ( 3.705 9.082 -5.955) 11.475 6.589 ( -5.817 -2.558 3.818) 7.414 7.879 ( -11.029 -9.594 3.172) 14.958 8.454 ( -7.213 -14.033 -5.328) 16.653 8.626 ( -15.981 -3.006 -6.591) 17.546 8.764 ( -8.043 -0.772 -2.480) 8.452 9.866 ( 4.805 7.538 0.148) 8.940 10.774 ( 12.619 7.942 4.557) 15.591 15.171 ( -2.156 6.901 -1.994) 7.500 15.428 ( 0.688 -7.402 0.998) 7.501 16.088 ( 11.219 1.752 -0.820) 11.385 16.248 ( 3.491 1.488 1.043) 3.935 16.529 ( 6.160 11.220 -3.133) 13.177 17.130 ( 10.902 12.758 4.126) 17.281 17.514 ( -2.553 -2.408 2.260) 4.175 18.775 ( -13.714 -4.566 -4.391) 15.106 19.131 ( -3.109 -3.471 -4.801) 6.691 19.489 ( 3.224 3.125 0.085) 4.491 19.496 ( 2.328 1.580 -2.211) 3.578 20.094 ( -1.545 -10.302 -3.962) 11.146======================= Grid point 403 (73/136) =======================q-point: ( 0.36 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.276 ( 7.221 10.527 -7.934) 15.030 2.364 ( 3.111 5.266 6.681) 9.058 3.751 ( -16.009 -1.692 4.534) 16.725 4.483 ( 26.154 18.882 -3.809) 32.482 5.002 ( 10.252 -6.112 0.914) 11.971 5.438 ( -2.019 -8.873 1.437) 9.213 5.946 ( 5.898 -7.169 3.096) 9.786 6.439 ( -4.435 -8.773 1.324) 9.919 6.694 ( 3.361 7.355 -8.164) 11.492 7.583 ( -11.913 -3.255 1.807) 12.481 8.164 ( -14.667 -8.129 -2.553) 16.962 8.403 ( -4.159 -4.579 -5.536) 8.301 8.631 ( -6.023 -1.486 -2.793) 6.804 10.004 ( 2.416 7.204 -0.164) 7.600 11.000 ( 6.577 4.804 6.464) 10.398 15.200 ( -2.683 7.088 -1.799) 7.790 15.332 ( -0.494 -9.651 1.414) 9.766 16.299 ( 9.302 0.364 -1.678) 9.459 16.345 ( 6.058 2.640 0.838) 6.661 16.762 ( 6.265 13.596 -3.593) 15.395 17.336 ( -0.285 8.014 11.285) 13.844 17.435 ( -3.711 -1.299 3.711) 5.407 18.541 ( -7.174 -4.321 -8.576) 11.987 19.035 ( -3.557 -3.491 -6.627) 8.292 19.550 ( 2.616 0.903 -2.612) 3.806 19.572 ( 2.297 2.859 -0.600) 3.716 19.973 ( -0.353 -10.261 -3.464) 10.835======================= Grid point 404 (74/136) =======================q-point: ( 0.45 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.438 ( 1.372 1.419 3.762) 4.249 2.470 ( 1.793 9.678 -16.286) 19.029 3.497 ( -10.027 0.550 7.803) 12.717 4.957 ( 11.206 10.023 8.824) 17.433 5.135 ( 3.242 -6.807 -1.547) 7.696 5.384 ( 6.843 -0.508 -0.971) 6.930 5.996 ( 9.648 -7.632 -0.926) 12.336 6.202 ( -6.620 -17.910 -7.712) 20.594 6.751 ( -1.295 2.371 -4.231) 5.020 7.540 ( 3.576 9.618 1.137) 10.325 7.817 ( -17.969 -2.605 -0.738) 18.171 8.355 ( 1.083 -2.440 -4.380) 5.130 8.536 ( -1.799 -2.850 -1.424) 3.658 10.084 ( -1.060 6.013 -0.418) 6.120 11.105 ( 1.725 2.166 7.172) 7.688 15.216 ( -5.986 11.002 -1.340) 12.596 15.253 ( 4.910 -12.748 1.028) 13.699 16.384 ( 3.478 -2.319 -1.230) 4.357 16.486 ( 5.051 0.624 -0.469) 5.111 16.987 ( 2.243 13.178 -5.014) 14.277 17.315 ( -3.632 2.178 8.451) 9.453 17.361 ( -6.785 2.929 11.958) 14.057 18.452 ( 0.342 -3.331 -8.834) 9.447 18.957 ( -1.643 -1.949 -8.812) 9.173 19.599 ( 1.619 0.867 -1.509) 2.377 19.616 ( 0.701 0.574 -3.315) 3.436 19.890 ( 2.023 -8.449 -1.739) 8.860======================= Grid point 411 (75/136) =======================q-point: ( 0.09 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.916 ( 6.879 11.914 19.303) 23.704 2.055 ( 7.519 13.023 10.869) 18.554 2.744 ( 12.965 22.456 11.278) 28.277 4.268 ( -0.924 -1.601 5.551) 5.851 5.015 ( -4.447 -7.703 -4.620) 10.023 5.520 ( 0.204 0.353 -7.826) 7.837 5.943 ( -3.549 -6.147 -3.299) 7.827 6.369 ( 4.314 7.472 -11.606) 14.462 6.920 ( -8.050 -13.942 11.416) 19.736 8.106 ( -5.036 -8.723 3.037) 10.520 8.703 ( -8.392 -14.535 2.711) 17.001 8.856 ( -4.795 -8.306 -10.354) 14.113 9.293 ( -0.082 -0.142 -3.281) 3.285 9.572 ( 0.380 0.658 0.983) 1.243 10.276 ( 14.593 25.276 -0.120) 29.186 15.191 ( -0.617 -1.068 -3.268) 3.493 15.363 ( 6.537 11.323 -3.293) 13.482 15.816 ( -0.251 -0.434 6.265) 6.285 16.222 ( -0.706 -1.222 -0.312) 1.445 16.314 ( 6.353 11.003 -2.452) 12.940 16.675 ( 10.920 18.914 -3.413) 22.105 17.561 ( -0.694 -1.202 2.897) 3.213 19.180 ( -4.947 -8.568 -1.880) 10.071 19.182 ( -1.223 -2.118 -2.978) 3.853 19.405 ( 1.401 2.426 0.124) 2.804 19.435 ( 1.284 2.224 -1.360) 2.906 20.201 ( -5.087 -8.811 -1.066) 10.230======================= Grid point 412 (76/136) =======================q-point: ( 0.18 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.094 ( 3.057 12.294 10.714) 16.591 2.303 ( 3.804 13.995 8.185) 16.653 3.372 ( 29.290 23.942 -0.067) 37.830 4.199 ( -6.208 -1.167 4.301) 7.642 4.880 ( -1.611 -7.781 0.163) 7.948 5.467 ( -1.596 -7.867 -4.951) 9.431 5.848 ( -0.582 -5.134 0.378) 5.180 6.533 ( 4.887 9.073 -10.222) 14.515 6.667 ( -8.163 -8.640 7.999) 14.327 7.943 ( -5.498 -5.994 5.827) 10.006 8.382 ( -7.885 -20.382 -1.183) 21.886 8.674 ( -5.955 -9.832 -10.280) 15.421 9.167 ( -18.603 11.456 -3.820) 22.179 9.683 ( 13.945 -6.776 0.498) 15.512 10.708 ( 10.623 17.197 3.068) 20.445 15.142 ( -0.262 -6.489 -2.351) 6.906 15.544 ( -2.926 14.247 -1.012) 14.580 15.891 ( 10.604 -0.628 2.630) 10.944 16.224 ( 1.230 1.194 1.791) 2.480 16.536 ( 6.556 11.853 -5.029) 14.449 17.075 ( 12.192 17.507 0.192) 21.335 17.522 ( -1.651 -2.785 2.613) 4.160 18.951 ( -11.629 -7.122 -5.154) 14.578 19.122 ( -1.415 -5.544 -3.867) 6.906 19.476 ( 2.576 4.111 0.052) 4.852 19.482 ( 1.606 2.114 -1.931) 3.283 20.020 ( -3.490 -11.322 -1.198) 11.908======================= Grid point 413 (77/136) =======================q-point: ( 0.27 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.287 ( 5.396 11.218 1.998) 12.608 2.482 ( -1.160 18.309 2.928) 18.578 3.982 ( -9.508 -0.543 1.842) 9.700 4.163 ( 27.952 18.420 -5.476) 33.921 4.824 ( 3.458 -6.284 5.794) 9.221 5.341 ( -0.565 -12.120 -0.614) 12.149 5.818 ( 2.252 -4.517 0.949) 5.135 6.446 ( -7.019 -10.667 5.353) 13.846 6.704 ( 4.099 7.652 -8.109) 11.879 7.755 ( -11.854 -3.456 3.232) 12.763 8.107 ( -0.195 -16.313 -2.318) 16.478 8.466 ( -6.565 -8.591 -8.497) 13.751 8.939 ( -20.179 11.245 -2.461) 23.231 9.859 ( 13.457 -6.841 -0.533) 15.106 10.991 ( 5.386 12.394 5.383) 14.547 15.060 ( 1.709 -11.940 -1.264) 12.128 15.570 ( -9.317 15.299 0.539) 17.921 16.119 ( 12.891 1.520 -0.122) 12.980 16.286 ( 3.611 2.274 2.995) 5.214 16.781 ( 7.161 13.442 -5.844) 16.314 17.388 ( 4.684 10.810 7.040) 13.724 17.456 ( -1.008 -2.014 3.059) 3.799 18.669 ( -12.347 -5.754 -9.570) 16.647 19.032 ( -1.804 -6.365 -5.864) 8.840 19.524 ( 1.588 1.248 -1.290) 2.397 19.565 ( 2.461 3.816 -0.442) 4.562 19.868 ( -0.830 -11.491 -1.614) 11.634======================= Grid point 414 (78/136) =======================q-point: ( 0.36 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.464 ( 2.190 8.594 -1.158) 8.945 2.649 ( -2.544 22.204 -6.050) 23.154 3.698 ( -14.555 -4.003 3.006) 15.392 4.825 ( 13.766 7.507 6.303) 16.899 4.896 ( 18.797 3.210 -3.411) 19.372 5.235 ( 3.634 -10.540 3.181) 11.594 5.822 ( 3.728 -5.509 0.105) 6.653 6.177 ( -9.490 -16.157 -0.737) 18.753 6.773 ( -0.638 -1.047 -3.451) 3.662 7.576 ( -2.348 -0.396 -3.769) 4.458 7.982 ( -5.808 -5.147 -4.104) 8.779 8.348 ( 0.244 0.115 -2.338) 2.354 8.705 ( -16.894 6.520 -0.436) 18.113 9.992 ( 9.929 -7.605 -1.081) 12.553 11.150 ( 0.647 9.193 6.385) 11.211 14.979 ( 4.246 -13.917 -0.581) 14.562 15.558 ( -10.218 16.752 0.300) 19.624 16.301 ( 5.831 0.471 1.444) 6.025 16.393 ( 6.291 1.773 0.983) 6.609 17.034 ( 6.193 12.189 -4.682) 14.451 17.355 ( -1.923 -2.544 5.340) 6.220 17.528 ( -4.458 7.543 9.422) 12.867 18.459 ( -5.659 -3.405 -11.362) 13.142 18.944 ( -1.011 -5.610 -8.945) 10.607 19.564 ( 2.355 0.224 -0.488) 2.416 19.622 ( 0.512 1.612 -0.732) 1.843 19.767 ( 1.431 -9.247 -1.732) 9.516======================= Grid point 415 (79/136) =======================q-point: ( 0.45 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.522 ( -3.809 6.598 -0.863) 7.668 2.769 ( -11.013 19.075 -13.557) 25.863 3.520 ( -0.972 1.683 6.782) 7.055 4.901 ( 5.339 -9.248 3.026) 11.099 5.086 ( 1.356 -2.348 13.575) 13.843 5.410 ( 0.340 -0.590 -2.683) 2.768 5.840 ( 5.851 -10.135 -8.232) 14.308 5.884 ( 4.775 -8.271 -2.565) 9.889 6.738 ( 2.515 -4.356 0.460) 5.051 7.615 ( 1.520 -2.632 -8.278) 8.819 7.850 ( -3.408 5.903 -4.189) 8.001 8.421 ( -4.641 8.038 -0.242) 9.285 8.535 ( -2.448 4.240 1.473) 5.113 10.041 ( 5.566 -9.641 -1.244) 11.202 11.200 ( -3.787 6.559 6.627) 10.064 14.944 ( 7.465 -12.930 -0.377) 14.935 15.554 ( -10.019 17.354 0.171) 20.039 16.349 ( 0.711 -1.231 2.105) 2.540 16.471 ( 1.202 -2.083 0.080) 2.406 17.157 ( -1.603 2.776 -4.129) 5.227 17.366 ( 0.148 -0.257 12.919) 12.922 17.465 ( -6.515 11.284 1.416) 13.106 18.401 ( 0.720 -1.247 -9.079) 9.193 18.904 ( 2.032 -3.520 -10.937) 11.668 19.606 ( 1.259 -2.180 4.224) 4.917 19.611 ( 0.007 -0.012 -5.247) 5.247 19.737 ( 3.239 -5.611 -1.650) 6.686======================= Grid point 424 (80/136) =======================q-point: ( 0.18 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.299 ( 5.865 10.159 5.905) 13.133 2.621 ( 9.014 15.612 1.871) 18.124 3.931 ( 17.953 31.096 -4.424) 36.178 4.118 ( -4.443 -7.696 0.174) 8.888 4.761 ( -2.066 -3.578 6.589) 7.777 5.274 ( -6.027 -10.439 -1.538) 12.152 5.776 ( -1.351 -2.339 0.043) 2.701 6.455 ( -7.101 -12.299 6.720) 15.711 6.706 ( 4.323 7.488 -7.962) 11.754 7.907 ( 1.018 1.763 6.933) 7.226 7.955 ( -12.012 -20.806 -4.592) 24.459 8.477 ( -5.546 -9.606 -9.664) 14.712 9.341 ( 0.557 0.965 -6.840) 6.930 9.539 ( -1.370 -2.373 3.178) 4.196 11.014 ( 7.496 12.984 4.935) 15.784 14.984 ( -4.815 -8.340 -1.117) 9.695 15.842 ( 6.498 11.255 -2.214) 13.184 15.905 ( 2.771 4.799 2.769) 6.195 16.266 ( 1.722 2.982 3.972) 5.257 16.786 ( 7.480 12.956 -6.549) 16.331 17.401 ( 8.318 14.407 5.045) 17.383 17.450 ( -2.539 -4.398 2.895) 5.845 18.775 ( -5.998 -10.389 -12.450) 17.289 18.998 ( -3.670 -6.357 -3.665) 8.205 19.517 ( 0.810 1.403 -0.556) 1.713 19.563 ( 2.367 4.100 -0.425) 4.753 19.810 ( -5.229 -9.057 -0.337) 10.464======================= Grid point 425 (81/136) =======================q-point: ( 0.27 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.511 ( 5.131 12.214 -0.667) 13.265 2.897 ( 2.232 20.740 -0.266) 20.861 3.882 ( -12.454 -8.634 -3.056) 15.459 4.584 ( 25.483 22.791 -6.156) 34.737 4.738 ( 1.957 -2.039 10.742) 11.108 5.091 ( -1.417 -11.891 2.740) 12.284 5.742 ( 0.414 -3.391 -1.162) 3.609 6.187 ( -8.664 -14.063 5.123) 17.294 6.764 ( -1.971 -4.422 -2.876) 5.632 7.605 ( -6.322 -9.234 -9.738) 14.835 7.992 ( 1.445 2.164 -0.790) 2.719 8.341 ( -0.395 -1.308 -2.948) 3.249 9.149 ( -22.174 9.207 -2.045) 24.097 9.643 ( 16.182 -14.074 -0.195) 21.447 11.220 ( 3.194 9.913 5.843) 11.942 14.833 ( -1.508 -10.126 -0.581) 10.254 15.887 ( -8.592 15.560 0.474) 17.781 16.151 ( 13.074 1.610 0.398) 13.179 16.336 ( 2.884 2.652 4.535) 5.993 17.036 ( 6.714 11.234 -3.712) 13.604 17.353 ( -2.634 -5.069 4.037) 6.995 17.626 ( 3.183 9.910 5.963) 11.995 18.563 ( -8.773 -4.480 -16.662) 19.356 18.883 ( -0.892 -8.404 -6.134) 10.442 19.529 ( 0.518 -1.663 4.734) 5.044 19.629 ( 0.910 2.237 -1.042) 2.630 19.680 ( -0.488 -5.821 -3.121) 6.623======================= Grid point 426 (82/136) =======================q-point: ( 0.36 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.676 ( -1.798 12.691 -3.675) 13.334 3.129 ( -1.543 23.717 -5.019) 24.291 3.571 ( -10.461 -9.052 -0.687) 13.851 4.758 ( 2.677 -3.142 8.677) 9.608 4.995 ( 2.473 -8.018 10.240) 13.239 5.227 ( 23.925 14.382 -5.564) 28.464 5.720 ( 1.749 -4.656 -1.765) 5.278 5.858 ( -13.209 -14.117 -0.667) 19.345 6.592 ( 0.362 -16.861 1.508) 16.933 7.573 ( 2.326 2.261 -12.921) 13.322 7.927 ( -4.104 -3.642 -9.401) 10.885 8.504 ( 7.381 15.893 3.535) 17.877 8.832 ( -22.247 5.557 1.615) 22.987 9.743 ( 12.647 -16.534 -0.899) 20.835 11.323 ( -1.310 7.385 6.096) 9.665 14.743 ( 2.638 -9.346 -0.387) 9.719 15.891 ( -9.160 16.043 0.502) 18.480 16.319 ( 4.041 1.148 3.368) 5.384 16.408 ( 3.623 -0.558 1.610) 4.004 17.178 ( 0.311 2.017 2.029) 2.878 17.312 ( 3.368 -2.218 9.751) 10.552 17.705 ( -5.158 10.685 -6.982) 13.767 18.422 ( -4.234 0.020 -11.103) 11.883 18.810 ( 2.243 -7.871 -10.690) 13.463 19.511 ( 2.429 -5.908 9.244) 11.236 19.622 ( -0.797 0.249 -4.377) 4.456 19.681 ( 1.263 -0.475 -3.061) 3.345======================= Grid point 432 (83/136) =======================q-point: (-0.09 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.583 ( -5.327 9.227 15.754) 19.018 2.102 ( -1.948 3.374 24.237) 24.548 2.899 ( -16.868 29.217 3.243) 33.892 4.187 ( 3.971 -6.877 5.092) 9.434 5.116 ( 1.571 -2.721 -4.611) 5.580 5.579 ( -3.249 5.627 -7.506) 9.927 6.101 ( -0.891 1.543 -8.382) 8.569 6.240 ( -0.655 1.134 -5.493) 5.647 6.838 ( 9.346 -16.188 12.545) 22.512 8.201 ( 2.110 -3.655 0.744) 4.286 8.822 ( 4.269 -7.395 -10.115) 13.237 8.849 ( 10.791 -18.691 -2.163) 21.691 9.304 ( -1.632 2.828 6.380) 7.167 9.386 ( 1.279 -2.215 -4.937) 5.560 10.286 ( -13.522 23.420 0.935) 27.059 15.046 ( 1.382 -2.394 -0.439) 2.798 15.439 ( -6.248 10.821 -2.906) 12.829 16.030 ( -0.588 1.019 1.688) 2.058 16.095 ( -3.957 6.854 -0.492) 7.929 16.280 ( -0.603 1.044 0.235) 1.228 16.604 ( -9.019 15.621 -2.631) 18.228 17.574 ( 0.269 -0.466 2.607) 2.662 19.106 ( 7.076 -12.255 -0.044) 14.151 19.208 ( 0.177 -0.307 -3.224) 3.243 19.402 ( -0.600 1.039 0.179) 1.213 19.420 ( -1.238 2.145 -1.107) 2.713 20.311 ( 1.305 -2.260 -3.862) 4.661======================= Grid point 436 (84/136) =======================q-point: ( 0.27 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.773 ( 7.727 13.384 -4.112) 15.992 3.232 ( 6.483 11.229 0.566) 12.978 3.664 ( -6.744 -11.681 -6.081) 14.795 4.736 ( 0.622 1.077 12.633) 12.694 4.898 ( -3.401 -5.891 3.651) 7.720 5.071 ( 14.172 24.546 -3.202) 28.524 5.676 ( -1.796 -3.110 -2.183) 4.203 5.929 ( -6.421 -11.122 4.309) 13.546 6.481 ( -12.008 -20.799 -0.188) 24.017 7.567 ( 2.610 4.520 -13.808) 14.762 7.941 ( -3.994 -6.919 -10.829) 13.457 8.519 ( 9.820 17.009 4.900) 20.242 9.262 ( -3.269 -5.662 -4.104) 7.720 9.347 ( -4.428 -7.669 4.121) 9.767 11.373 ( 3.021 5.233 5.919) 8.458 14.673 ( -3.263 -5.652 -0.379) 6.537 16.143 ( 3.658 6.336 1.460) 7.461 16.200 ( 3.656 6.332 0.521) 7.330 16.378 ( 0.577 0.999 4.650) 4.791 17.197 ( 2.523 4.369 5.913) 7.773 17.253 ( -2.410 -4.175 5.985) 7.685 17.805 ( 4.581 7.935 -8.906) 12.778 18.497 ( -1.356 -2.349 -17.304) 17.515 18.717 ( -4.190 -7.256 -5.543) 10.047 19.456 ( -2.232 -3.866 10.840) 11.723 19.636 ( 0.162 0.281 -5.109) 5.119 19.664 ( 0.424 0.735 -2.048) 2.217======================= Grid point 437 (85/136) =======================q-point: ( 0.36 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.953 ( -8.026 13.902 -4.890) 16.781 3.312 ( 6.884 -11.924 -2.826) 14.055 3.532 ( -5.986 10.368 -3.214) 12.396 4.748 ( -1.031 1.786 10.336) 10.540 4.842 ( 3.481 -6.030 8.838) 11.251 5.437 ( -1.174 2.033 -2.176) 3.201 5.639 ( 1.371 -2.375 -2.017) 3.404 5.766 ( -5.046 8.739 -0.115) 10.092 6.191 ( 11.603 -20.097 0.798) 23.220 7.662 ( -3.081 5.337 -13.494) 14.834 7.826 ( 3.093 -5.357 -12.118) 13.606 8.884 ( -6.953 12.044 0.012) 13.907 8.932 ( -7.140 12.366 4.734) 15.044 9.360 ( 12.297 -21.299 0.863) 24.610 11.425 ( -1.553 2.689 5.896) 6.663 14.616 ( 1.900 -3.290 -0.326) 3.813 16.174 ( -6.739 11.672 1.035) 13.517 16.335 ( 0.442 -0.766 4.291) 4.381 16.358 ( 2.251 -3.898 1.356) 4.701 17.193 ( -0.639 1.107 7.476) 7.584 17.247 ( 2.122 -3.676 11.492) 12.251 17.899 ( -3.749 6.494 -22.592) 23.804 18.467 ( -2.629 4.554 -8.183) 9.727 18.638 ( 4.954 -8.580 -8.739) 13.211 19.415 ( 1.555 -2.693 11.448) 11.862 19.642 ( -0.715 1.238 -3.817) 4.076 19.670 ( 0.510 -0.883 -2.901) 3.074======================= Grid point 443 (86/136) =======================q-point: (-0.18 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.872 ( -12.276 13.488 8.055) 19.938 2.156 ( -3.558 1.268 16.247) 16.680 3.529 ( -22.053 25.915 -5.422) 34.458 4.016 ( 5.553 -10.840 4.948) 13.146 5.069 ( 2.497 1.764 -0.202) 3.063 5.643 ( 1.397 2.350 -5.452) 6.100 6.103 ( 5.657 8.459 -0.893) 10.215 6.325 ( -9.752 -2.203 -2.790) 10.380 6.608 ( 3.873 -6.788 5.488) 9.550 8.074 ( 10.597 -3.418 1.260) 11.205 8.473 ( 7.082 -23.371 -4.702) 24.869 8.661 ( 6.387 -5.034 -10.135) 12.994 9.086 ( 21.369 9.095 -0.240) 23.225 9.557 ( -17.933 -12.276 0.990) 21.755 10.691 ( -10.459 15.576 4.080) 19.200 15.014 ( -2.213 -6.242 -0.051) 6.623 15.634 ( 1.176 14.856 -1.539) 14.981 16.039 ( -3.793 0.786 -0.475) 3.902 16.227 ( -3.548 4.959 -2.234) 6.494 16.363 ( -6.769 2.410 1.475) 7.335 16.933 ( -12.192 9.636 2.067) 15.677 17.546 ( 1.911 -1.726 2.029) 3.278 18.840 ( 8.716 -11.567 -2.189) 14.648 19.171 ( 2.429 -2.653 -4.067) 5.429 19.447 ( -2.505 2.521 0.482) 3.586 19.472 ( -2.152 2.171 -2.184) 3.757 20.245 ( 4.891 -0.167 -5.663) 7.485======================= Grid point 455 (87/136) =======================q-point: (-0.27 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.176 ( -6.467 11.564 -1.468) 13.330 2.297 ( -7.775 8.174 8.492) 14.120 3.773 ( 8.184 -12.971 4.882) 16.095 4.138 ( -24.397 13.796 -6.166) 28.698 5.104 ( -1.092 9.581 -0.018) 9.643 5.572 ( 6.470 -2.093 -1.509) 6.966 6.109 ( 4.378 10.696 4.540) 12.417 6.494 ( -7.300 0.142 2.914) 7.861 6.546 ( -2.642 -0.990 -5.738) 6.394 7.743 ( 18.197 -8.952 -2.029) 20.381 8.151 ( 5.129 -22.302 -3.706) 23.182 8.536 ( 5.783 1.428 -7.719) 9.751 8.823 ( 16.541 5.473 -1.133) 17.459 9.719 ( -15.387 -13.078 1.392) 20.242 10.959 ( -6.000 10.123 6.387) 13.389 14.987 ( -4.037 -10.113 -0.086) 10.890 15.659 ( 11.306 15.482 -0.320) 19.174 16.218 ( -11.444 4.439 -1.493) 12.365 16.338 ( -2.651 6.606 -2.366) 7.501 16.531 ( -10.596 0.580 0.297) 10.617 17.164 ( -8.353 -0.346 10.110) 13.119 17.470 ( 3.732 -3.646 2.080) 5.617 18.614 ( 6.492 -5.793 -6.327) 10.758 19.083 ( 3.725 -3.789 -5.107) 7.370 19.523 ( -3.009 2.041 -0.084) 3.637 19.534 ( -2.394 2.542 -2.887) 4.531 20.146 ( 6.830 1.112 -5.618) 8.914======================= Grid point 456 (88/136) =======================q-point: (-0.18 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.217 ( -3.121 5.407 6.689) 9.150 2.248 ( -12.523 21.691 4.664) 25.477 3.779 ( 7.424 -12.858 4.886) 15.631 3.983 ( -10.986 19.028 -7.315) 23.157 5.144 ( -4.055 7.024 -0.229) 8.114 5.618 ( 3.071 -5.319 -2.913) 6.797 6.292 ( -1.984 3.437 6.052) 7.237 6.317 ( -5.081 8.801 -1.308) 10.247 6.534 ( 0.789 -1.367 -0.820) 1.779 7.939 ( 6.801 -11.780 0.130) 13.603 8.006 ( 12.385 -21.451 -8.671) 26.243 8.592 ( 1.065 -1.845 -8.333) 8.601 9.165 ( 4.411 -7.640 -4.709) 10.000 9.349 ( 0.644 -1.116 6.452) 6.580 10.962 ( -6.504 11.265 6.438) 14.514 14.899 ( 3.057 -5.294 0.262) 6.119 15.957 ( -8.208 14.217 -1.863) 16.522 16.024 ( -0.909 1.575 -0.225) 1.832 16.353 ( -3.775 6.538 -5.280) 9.213 16.437 ( -2.908 5.036 3.873) 6.987 17.084 ( -2.682 4.646 9.059) 10.528 17.484 ( 2.641 -4.574 1.799) 5.579 18.642 ( 4.334 -7.506 -5.616) 10.328 19.094 ( 2.821 -4.886 -4.548) 7.246 19.508 ( -1.927 3.337 0.333) 3.868 19.525 ( -1.740 3.014 -3.077) 4.646 20.213 ( 1.688 -2.924 -6.426) 7.259======================= Grid point 467 (89/136) =======================q-point: (-0.36 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.368 ( -5.871 6.865 -9.026) 12.769 2.494 ( -0.046 14.095 3.259) 14.467 3.497 ( 7.541 -12.182 6.004) 15.534 4.636 ( -23.534 2.844 3.344) 23.939 5.268 ( 1.041 9.622 -6.132) 11.457 5.419 ( 2.943 -1.501 1.944) 3.833 6.163 ( 2.898 12.988 2.794) 13.597 6.476 ( 7.120 3.025 -3.701) 8.575 6.675 ( -5.088 -0.903 -6.919) 8.636 7.417 ( 4.484 -7.614 -0.594) 8.857 7.825 ( 8.293 -19.487 -1.592) 21.238 8.474 ( 5.542 5.042 -5.201) 9.121 8.650 ( 8.518 3.865 -1.069) 9.415 9.824 ( -12.775 -14.852 1.324) 19.634 11.108 ( -1.871 6.434 7.446) 10.017 14.954 ( -5.358 -12.312 -0.211) 13.429 15.615 ( 11.995 17.367 -0.038) 21.107 16.431 ( -2.507 5.330 -2.414) 6.366 16.446 ( -5.747 6.126 -2.854) 8.871 16.729 ( -12.228 -1.829 0.288) 12.368 17.217 ( -3.552 -7.303 14.261) 16.411 17.350 ( 4.399 -6.008 3.971) 8.439 18.517 ( 2.599 1.337 -8.384) 8.879 18.982 ( 2.907 -3.812 -6.757) 8.285 19.578 ( -1.648 1.056 -0.720) 2.085 19.603 ( -2.201 2.418 -4.049) 5.205 20.045 ( 6.333 2.272 -3.919) 7.786======================= Grid point 468 (90/136) =======================q-point: (-0.27 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.359 ( -4.998 8.822 -1.202) 10.210 2.660 ( -6.270 24.245 1.910) 25.116 3.507 ( 8.301 -13.656 4.448) 16.589 4.310 ( -15.043 4.669 0.101) 15.752 5.356 ( -4.424 13.321 -6.642) 15.529 5.435 ( 5.758 -10.143 1.207) 11.726 6.342 ( 2.632 11.901 2.754) 12.496 6.529 ( -0.407 0.645 -1.448) 1.637 6.553 ( -10.563 4.436 -0.371) 11.463 7.537 ( 17.093 -11.091 -8.528) 22.089 7.724 ( 3.527 -20.239 -4.469) 21.025 8.576 ( 1.621 2.301 -5.125) 5.848 8.914 ( 15.878 2.964 -0.517) 16.161 9.422 ( -13.407 -14.958 4.050) 20.491 11.138 ( -3.176 7.423 7.728) 11.176 14.805 ( 0.044 -7.895 -0.070) 7.895 15.980 ( 9.864 15.426 -0.175) 18.311 16.309 ( -14.227 5.696 -1.683) 15.417 16.475 ( -2.542 6.557 -6.176) 9.360 16.557 ( -6.837 2.057 3.901) 8.136 17.107 ( -0.790 -5.091 14.227) 15.131 17.363 ( 4.566 -7.150 2.432) 8.825 18.559 ( 1.211 0.132 -8.123) 8.214 18.986 ( 3.225 -5.648 -5.476) 8.502 19.569 ( -1.490 2.548 -0.548) 3.002 19.589 ( -2.265 2.774 -3.725) 5.167 20.139 ( 3.847 -1.627 -5.252) 6.710======================= Grid point 477 (91/136) =======================q-point: (-0.45 0.55 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.470 ( 1.298 2.249 -13.616) 13.861 2.563 ( 7.301 12.645 2.068) 14.747 3.351 ( -3.311 -5.735 8.189) 10.532 4.961 ( -4.657 -8.066 9.688) 13.439 5.112 ( -2.062 -3.571 3.578) 5.459 5.511 ( 3.809 6.597 -8.267) 11.242 6.268 ( 6.157 10.664 -1.297) 12.382 6.336 ( 7.261 12.576 -12.366) 19.073 6.691 ( -1.811 -3.136 -4.025) 5.414 7.478 ( -5.596 -9.692 3.976) 11.877 7.535 ( -4.001 -6.930 -2.002) 8.249 8.448 ( 3.612 6.256 -4.918) 8.739 8.600 ( 3.127 5.417 -0.394) 6.267 9.861 ( -9.723 -16.841 1.246) 19.486 11.156 ( 2.153 3.730 7.720) 8.840 14.938 ( -7.027 -12.172 -0.272) 14.057 15.598 ( 10.849 18.790 0.029) 21.697 16.472 ( 2.553 4.421 -5.195) 7.284 16.544 ( 0.951 1.647 -0.830) 2.075 16.847 ( -4.827 -8.361 0.800) 9.688 17.227 ( -3.780 -6.548 11.901) 14.100 17.231 ( -2.164 -3.748 7.417) 8.587 18.511 ( 2.012 3.485 -7.769) 8.749 18.932 ( -1.094 -1.895 -7.951) 8.246 19.598 ( -0.054 -0.094 -0.358) 0.375 19.639 ( 0.589 1.020 -5.763) 5.882 19.996 ( 2.634 4.563 -2.457) 5.814======================= Grid point 479 (92/136) =======================q-point: (-0.36 0.55 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.528 ( -1.961 9.388 -6.056) 11.342 2.898 ( 7.112 24.249 0.450) 25.275 3.262 ( 3.037 -11.652 5.136) 13.091 4.644 ( -20.972 -1.168 6.453) 21.973 5.095 ( 10.292 -17.510 4.952) 20.906 5.624 ( -2.551 13.017 -9.208) 16.147 6.425 ( 1.361 9.982 -4.291) 10.950 6.553 ( 1.326 6.284 -6.339) 9.024 6.682 ( 2.324 2.479 -2.273) 4.088 7.285 ( -1.693 -5.939 -2.918) 6.830 7.461 ( 4.548 -16.564 -5.224) 17.954 8.566 ( 3.097 3.925 -3.154) 5.911 8.747 ( 7.867 5.679 1.485) 9.815 9.479 ( -12.282 -18.332 3.458) 22.335 11.223 ( 0.268 4.658 8.204) 9.438 14.748 ( -2.924 -8.138 -0.363) 8.655 15.971 ( 10.320 17.531 0.121) 20.343 16.533 ( -4.148 4.752 -3.173) 7.061 16.554 ( -0.480 4.461 -5.519) 7.113 16.696 ( -6.629 -1.353 4.424) 8.084 17.069 ( -4.414 -6.882 13.518) 15.798 17.198 ( 4.219 -8.993 4.811) 11.037 18.575 ( 0.667 3.996 -7.695) 8.696 18.891 ( 0.702 -5.172 -6.811) 8.581 19.605 ( -0.121 1.606 -1.079) 1.939 19.646 ( -1.216 1.580 -4.955) 5.341 20.069 ( 2.809 0.358 -3.322) 4.364======================= Grid point 480 (93/136) =======================q-point: (-0.27 0.55 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.563 ( -6.546 11.338 -2.453) 13.320 3.126 ( -10.996 19.045 0.698) 22.002 3.231 ( 7.536 -13.053 2.750) 15.322 4.407 ( -4.213 7.296 5.503) 10.063 5.097 ( 11.379 -19.710 4.817) 23.263 5.669 ( -7.739 13.404 -9.399) 18.108 6.480 ( -0.482 0.835 -9.662) 9.710 6.613 ( -4.873 8.441 0.466) 9.758 6.692 ( -4.924 8.528 4.677) 10.902 7.309 ( 7.030 -12.177 -17.450) 22.410 7.367 ( 8.073 -13.983 -1.963) 16.265 8.613 ( -0.648 1.122 -2.410) 2.736 8.921 ( 1.256 -2.176 1.397) 2.875 9.196 ( 3.716 -6.436 5.960) 9.526 11.249 ( -2.137 3.702 8.406) 9.430 14.681 ( 2.504 -4.337 -0.389) 5.023 16.206 ( -3.662 6.342 0.268) 7.328 16.476 ( -5.972 10.344 -3.438) 12.429 16.590 ( -2.694 4.666 -5.828) 7.937 16.609 ( -1.866 3.232 4.472) 5.825 16.991 ( 3.091 -5.353 14.881) 16.114 17.189 ( 5.738 -9.939 3.772) 12.080 18.603 ( -2.118 3.669 -7.951) 9.009 18.868 ( 3.398 -5.885 -6.122) 9.146 19.617 ( -1.124 1.947 -1.539) 2.725 19.638 ( -1.134 1.964 -4.268) 4.833 20.095 ( 1.299 -2.250 -3.724) 4.541======================= Grid point 491 (94/136) =======================q-point: (-0.36 0.64 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.733 ( 5.883 10.190 -2.436) 12.016 3.032 ( -6.177 -10.699 2.115) 12.534 3.345 ( 9.319 16.142 -0.183) 18.640 4.597 ( -2.321 -4.019 7.053) 8.443 4.765 ( -6.032 -10.448 6.535) 13.721 5.819 ( 3.182 5.512 -7.758) 10.034 6.482 ( -0.101 -0.175 -9.147) 9.150 6.753 ( 4.228 7.323 -8.357) 11.889 6.775 ( 3.642 6.308 4.983) 8.825 7.167 ( -3.102 -5.373 -2.808) 6.810 7.195 ( -4.957 -8.586 -15.984) 18.809 8.621 ( 0.835 1.445 -0.810) 1.855 8.885 ( 4.778 8.275 3.818) 10.290 9.144 ( -8.105 -14.039 5.071) 16.986 11.286 ( 0.928 1.608 8.591) 8.789 14.637 ( -1.641 -2.842 -0.536) 3.325 16.262 ( 5.503 9.532 -0.004) 11.006 16.612 ( 1.579 2.734 -1.508) 3.499 16.620 ( 1.481 2.565 -5.725) 6.446 16.673 ( -0.878 -1.520 2.796) 3.302 16.960 ( -2.190 -3.792 11.949) 12.726 17.028 ( -3.469 -6.009 6.865) 9.761 18.662 ( 2.488 4.310 -7.179) 8.735 18.787 ( -2.728 -4.726 -6.823) 8.737 19.637 ( 0.853 1.478 -2.401) 2.946 19.660 ( -0.118 -0.205 -4.271) 4.277 20.069 ( -0.054 -0.093 -2.756) 2.758======================= Grid point 532 (95/136) =======================q-point: ( 0.00 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 136Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.935 ( 0.000 -0.000 12.199) 12.199 1.935 ( 0.000 0.000 12.199) 12.199 2.861 ( 0.000 0.000 16.242) 16.242 4.388 ( 0.000 0.000 2.835) 2.835 5.156 ( 0.000 -0.000 -6.231) 6.231 5.156 ( 0.000 0.000 -6.231) 6.231 5.966 ( 0.000 -0.000 -6.596) 6.596 5.966 ( 0.000 0.000 -6.596) 6.596 7.665 ( -0.000 0.000 7.949) 7.949 8.317 ( 0.000 0.000 -0.242) 0.242 9.054 ( 0.000 0.000 -9.897) 9.897 9.209 ( 0.000 -0.000 4.663) 4.663 9.209 ( 0.000 0.000 4.663) 4.663 9.404 ( 0.000 -0.000 -1.457) 1.457 9.404 ( 0.000 -0.000 -1.457) 1.457 15.104 ( 0.000 -0.000 -1.017) 1.017 15.104 ( 0.000 0.000 -1.017) 1.017 15.978 ( 0.000 -0.000 2.683) 2.683 15.978 ( 0.000 0.000 2.683) 2.683 16.255 ( 0.000 0.000 -1.423) 1.423 16.255 ( 0.000 -0.000 -1.423) 1.423 17.634 ( -0.000 0.000 2.261) 2.261 19.150 ( 0.000 0.000 -1.468) 1.468 19.374 ( 0.000 0.000 0.629) 0.629 19.382 ( 0.000 -0.000 -0.411) 0.411 19.382 ( 0.000 0.000 -0.411) 0.411 20.370 ( 0.000 -0.000 -0.564) 0.564======================= Grid point 533 (96/136) =======================q-point: ( 0.09 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.917 ( -3.502 10.694 13.721) 17.745 2.218 ( 24.037 1.001 9.696) 25.938 2.815 ( -3.521 0.189 10.843) 11.402 4.367 ( -2.674 -0.114 3.120) 4.111 5.072 ( -1.183 -3.516 -1.254) 3.916 5.280 ( 5.548 3.377 -9.514) 11.520 5.939 ( 0.599 -1.684 -3.699) 4.108 6.041 ( 3.667 3.708 -8.176) 9.697 7.397 ( -19.337 -9.805 7.851) 23.058 8.273 ( -2.630 -2.513 2.321) 4.315 8.800 ( -11.058 -4.637 -7.166) 13.969 9.091 ( -1.264 -14.822 1.909) 14.998 9.215 ( -14.140 -0.485 -0.748) 14.168 9.519 ( 4.460 12.212 0.380) 13.006 9.803 ( 29.725 12.451 -0.722) 32.235 15.099 ( -1.583 3.506 -0.439) 3.871 15.199 ( 8.498 1.186 -1.856) 8.779 15.974 ( 2.933 -3.666 3.802) 6.042 16.093 ( 3.988 7.932 0.282) 8.883 16.242 ( 0.524 -1.535 -1.074) 1.945 16.354 ( 9.075 6.966 -1.605) 11.552 17.630 ( -0.369 -0.347 2.145) 2.203 19.154 ( 0.099 -0.233 -1.694) 1.713 19.292 ( -7.548 -3.346 0.131) 8.257 19.381 ( 0.347 0.011 -0.175) 0.389 19.392 ( 0.774 0.588 -0.401) 1.051 20.316 ( -3.984 -3.387 -0.694) 5.275======================= Grid point 534 (97/136) =======================q-point: ( 0.18 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.988 ( -0.682 9.508 8.771) 12.953 2.506 ( 2.575 -2.933 15.727) 16.205 2.994 ( 23.760 13.199 -4.428) 27.538 4.280 ( -7.513 -0.480 2.901) 8.068 5.041 ( 1.755 -4.063 3.580) 5.693 5.390 ( 4.535 0.094 -9.716) 10.723 5.948 ( 3.291 -3.436 0.161) 4.761 6.167 ( 4.963 6.545 -8.878) 12.095 6.984 ( -16.176 -7.173 6.985) 19.024 8.184 ( -4.126 -4.742 5.439) 8.313 8.559 ( -11.001 -6.599 -8.591) 15.439 8.883 ( -7.493 -20.074 -0.811) 21.442 8.916 ( -16.907 5.497 -1.061) 17.810 9.704 ( 6.125 7.179 0.326) 9.442 10.409 ( 23.422 12.901 0.651) 26.748 15.115 ( -0.927 4.021 -0.634) 4.175 15.375 ( 8.361 1.259 -1.255) 8.548 15.989 ( 3.204 -2.660 2.512) 4.863 16.189 ( 1.060 4.277 -0.242) 4.413 16.302 ( 5.534 3.448 -1.647) 6.725 16.721 ( 19.166 13.598 -0.810) 23.514 17.610 ( -1.311 -1.128 1.948) 2.605 19.049 ( -13.639 -6.016 -0.085) 14.907 19.134 ( -2.502 -2.245 -2.660) 4.287 19.406 ( 1.632 1.311 -0.885) 2.273 19.423 ( 2.012 1.418 -0.230) 2.473 20.187 ( -4.808 -6.115 -1.045) 7.849======================= Grid point 535 (98/136) =======================q-point: ( 0.27 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.063 ( 0.447 5.461 1.116) 5.592 2.470 ( -2.048 1.339 8.490) 8.836 3.668 ( 32.442 17.720 -4.063) 37.188 4.093 ( -12.343 -2.209 2.472) 12.781 5.041 ( 2.455 -3.764 5.220) 6.887 5.433 ( 2.791 -3.680 -6.437) 7.923 5.981 ( 5.474 -5.387 3.014) 8.251 6.339 ( 5.917 8.724 -8.831) 13.751 6.709 ( -9.798 -5.144 4.992) 12.140 7.969 ( -14.771 -7.920 5.408) 17.611 8.343 ( -3.983 -7.538 -5.738) 10.277 8.516 ( -16.238 -7.387 -3.900) 18.261 8.722 ( -8.570 -2.561 -1.661) 9.097 9.871 ( 5.384 6.058 0.275) 8.109 10.845 ( 14.709 8.620 2.419) 17.220 15.144 ( -0.379 3.891 -0.741) 3.978 15.439 ( 0.269 -4.042 0.244) 4.058 16.087 ( 8.708 2.378 0.400) 9.036 16.259 ( 2.534 3.368 0.149) 4.218 16.472 ( 7.850 6.959 -2.401) 10.762 17.202 ( 18.434 14.571 2.783) 23.662 17.560 ( -2.564 -1.896 2.051) 3.791 18.707 ( -16.685 -8.075 -2.350) 18.685 19.043 ( -4.433 -3.933 -3.548) 6.907 19.447 ( 1.748 1.190 -2.153) 3.018 19.493 ( 3.148 2.570 0.166) 4.067 20.046 ( -3.472 -7.046 -1.195) 7.945======================= Grid point 536 (99/136) =======================q-point: ( 0.36 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.122 ( 0.697 5.115 -6.423) 8.240 2.478 ( 0.271 2.034 4.169) 4.646 3.836 ( -13.105 -2.954 3.560) 13.897 4.416 ( 31.776 19.859 -2.638) 37.564 5.046 ( 2.436 -3.650 2.729) 5.167 5.428 ( 1.810 -4.694 -1.601) 5.280 6.022 ( 6.116 -6.907 4.145) 10.114 6.464 ( -12.209 -10.483 1.064) 16.127 6.524 ( 4.651 8.177 -7.906) 12.288 7.631 ( -12.606 -3.616 2.345) 13.322 8.125 ( -14.148 -8.776 -1.287) 16.698 8.308 ( -1.490 -2.450 -3.656) 4.646 8.579 ( -5.417 -1.205 -2.151) 5.952 10.002 ( 3.124 5.207 -0.033) 6.073 11.101 ( 7.697 4.851 3.532) 9.760 15.175 ( -0.475 3.535 -0.710) 3.636 15.355 ( -2.539 -5.881 0.798) 6.455 16.282 ( 8.408 2.027 0.123) 8.650 16.339 ( 3.688 3.799 -1.271) 5.445 16.699 ( 8.451 9.050 -2.474) 12.627 17.489 ( -2.385 -1.147 3.815) 4.643 17.589 ( 8.186 11.368 10.489) 17.501 18.364 ( -11.251 -8.324 -8.583) 16.418 18.911 ( -5.499 -4.759 -5.151) 8.912 19.490 ( 1.863 0.941 -2.623) 3.352 19.565 ( 2.100 2.205 -0.219) 3.052 19.936 ( -1.382 -6.465 -0.765) 6.656======================= Grid point 537 (100/136) =======================q-point: ( 0.45 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.180 ( -0.723 5.165 -11.517) 12.643 2.499 ( 0.367 0.631 2.240) 2.355 3.635 ( -6.925 0.144 5.440) 8.807 5.047 ( 4.815 -4.552 -3.127) 7.327 5.123 ( 21.588 18.780 5.142) 29.072 5.410 ( 0.558 -2.973 1.774) 3.507 5.998 ( -8.236 -14.702 -0.879) 16.874 6.092 ( -2.386 -11.560 -1.540) 11.904 6.640 ( 0.270 5.412 -5.965) 8.059 7.563 ( 3.528 4.604 1.082) 5.901 7.800 ( -14.136 -4.819 -0.729) 14.953 8.281 ( -0.568 -0.318 -2.806) 2.881 8.514 ( -0.846 -1.364 -0.754) 1.773 10.076 ( -0.032 3.866 -0.329) 3.881 11.218 ( 2.229 1.810 3.968) 4.897 15.194 ( -1.338 3.366 -0.649) 3.680 15.275 ( 0.168 -4.860 0.871) 4.940 16.356 ( 1.235 0.336 -1.196) 1.752 16.470 ( 4.604 1.404 -0.891) 4.895 16.894 ( 3.065 6.839 -3.642) 8.333 17.480 ( 1.411 3.432 7.440) 8.314 17.640 ( -8.538 2.203 14.618) 17.072 18.247 ( 2.811 -3.064 -11.475) 12.205 18.783 ( -3.125 -3.641 -7.736) 9.103 19.524 ( 1.127 0.149 -3.063) 3.267 19.603 ( 0.248 1.326 -0.391) 1.404 19.875 ( 1.104 -5.051 -0.135) 5.172======================= Grid point 544 (101/136) =======================q-point: ( 0.09 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.185 ( 4.368 7.566 1.667) 8.894 2.293 ( 5.528 9.575 18.296) 21.378 2.894 ( 6.688 11.584 2.671) 13.640 4.345 ( -1.615 -2.798 1.792) 3.694 5.000 ( -1.539 -2.665 3.550) 4.698 5.346 ( 1.197 2.074 -8.898) 9.214 5.904 ( -0.937 -1.623 -0.005) 1.874 6.156 ( 4.327 7.494 -9.220) 12.645 7.104 ( -9.568 -16.573 6.241) 20.129 8.194 ( -2.742 -4.749 5.708) 7.915 8.656 ( -5.511 -9.546 -9.428) 14.504 8.753 ( -9.898 -17.145 2.161) 19.914 9.250 ( -1.368 -2.370 -1.035) 2.926 9.566 ( 0.975 1.689 -1.502) 2.462 10.281 ( 15.607 27.033 0.472) 31.218 15.131 ( -0.521 -0.903 -2.733) 2.925 15.328 ( 6.435 11.145 -0.354) 12.874 15.931 ( -0.600 -1.040 4.977) 5.120 16.225 ( 0.451 0.782 0.642) 1.108 16.253 ( 4.278 7.410 -3.604) 9.284 16.621 ( 11.210 19.416 -2.088) 22.517 17.614 ( -0.778 -1.348 2.154) 2.657 19.133 ( -1.332 -2.307 -1.729) 3.176 19.150 ( -6.251 -10.828 -1.179) 12.558 19.406 ( 1.435 2.486 0.055) 2.871 19.406 ( 0.656 1.135 -1.240) 1.805 20.197 ( -4.507 -7.806 0.499) 9.028======================= Grid point 545 (102/136) =======================q-point: ( 0.18 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.236 ( -6.963 13.740 2.742) 15.646 2.454 ( 6.591 -0.778 6.932) 9.597 3.355 ( 23.972 22.278 -1.698) 32.770 4.232 ( -7.272 -5.050 -0.732) 8.884 4.978 ( 1.113 -1.672 8.866) 9.090 5.350 ( 0.881 -4.356 -6.124) 7.567 5.880 ( 1.092 -3.184 3.422) 4.800 6.332 ( 5.817 9.825 -9.213) 14.671 6.805 ( -9.256 -10.196 5.061) 14.671 8.088 ( -5.871 -4.085 8.362) 11.004 8.351 ( -11.362 -17.752 -2.627) 21.240 8.484 ( -3.837 -14.070 -7.790) 16.533 9.095 ( -17.658 9.104 -2.926) 20.081 9.681 ( 12.944 -6.321 -0.833) 14.429 10.757 ( 12.268 18.806 1.713) 22.519 15.095 ( 0.271 -5.470 -2.254) 5.923 15.536 ( 0.436 13.736 0.380) 13.749 15.952 ( 6.059 -1.073 2.964) 6.830 16.266 ( 1.535 3.908 2.207) 4.743 16.420 ( 6.425 8.003 -6.028) 11.903 17.069 ( 15.988 20.103 -0.866) 25.700 17.573 ( -1.720 -2.531 2.242) 3.794 18.867 ( -12.590 -12.380 -3.206) 17.945 19.060 ( -2.929 -5.010 -2.076) 6.163 19.435 ( 1.205 1.459 -2.098) 2.825 19.476 ( 2.533 3.711 -0.160) 4.496 20.034 ( -4.321 -8.482 1.941) 9.715======================= Grid point 546 (103/136) =======================q-point: ( 0.27 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.263 ( -4.251 12.131 -3.220) 13.251 2.546 ( -0.389 8.960 2.289) 9.256 3.989 ( -4.727 -3.465 -0.957) 5.938 4.071 ( 24.452 16.773 -3.573) 29.867 4.984 ( 1.067 -1.725 8.933) 9.161 5.314 ( 2.847 -7.849 -1.113) 8.424 5.878 ( 3.177 -4.755 5.333) 7.820 6.534 ( 4.526 9.220 -7.669) 12.818 6.554 ( -9.040 -9.214 4.299) 13.605 7.794 ( -15.448 -12.676 0.344) 19.986 8.101 ( -2.345 -13.269 1.017) 13.513 8.321 ( -2.128 -4.846 -5.179) 7.405 8.877 ( -18.498 10.666 -3.406) 21.622 9.840 ( 12.881 -7.589 -1.382) 15.014 11.075 ( 6.532 12.865 2.835) 14.704 15.034 ( 2.199 -10.821 -1.297) 11.118 15.590 ( -8.881 14.793 1.373) 17.308 16.129 ( 11.738 2.094 1.017) 11.966 16.339 ( 1.741 4.523 1.986) 5.238 16.641 ( 8.701 9.779 -7.079) 14.881 17.500 ( 1.814 2.177 3.541) 4.536 17.527 ( 9.782 10.814 3.233) 14.936 18.496 ( -14.658 -12.929 -6.910) 20.730 18.939 ( -4.274 -6.427 -3.144) 8.334 19.474 ( 1.479 1.568 -2.517) 3.314 19.554 ( 2.218 3.216 -0.592) 3.951 19.894 ( -2.297 -7.649 3.085) 8.561======================= Grid point 547 (104/136) =======================q-point: ( 0.36 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.328 ( -3.208 12.419 -9.326) 15.858 2.616 ( -5.090 14.449 0.556) 15.329 3.740 ( -8.885 -7.079 0.743) 11.385 4.799 ( 30.332 17.938 -3.123) 35.377 4.980 ( 2.569 -2.807 5.578) 6.753 5.302 ( 4.271 -7.270 3.758) 9.232 5.887 ( 3.926 -6.396 6.218) 9.747 6.196 ( -17.991 -15.120 2.408) 23.624 6.684 ( 1.677 5.935 -5.234) 8.089 7.505 ( -1.440 -10.854 -2.815) 11.306 7.895 ( -7.191 -9.547 -4.456) 12.756 8.332 ( 1.250 5.833 0.410) 5.979 8.680 ( -14.800 7.988 -1.864) 16.922 9.958 ( 9.898 -8.654 -2.172) 13.326 11.248 ( 1.320 8.864 3.346) 9.567 14.968 ( 4.554 -13.419 -0.500) 14.180 15.575 ( -10.511 16.770 1.157) 19.826 16.325 ( 6.379 2.568 1.134) 6.969 16.413 ( 2.738 3.211 0.609) 4.263 16.887 ( 7.053 9.548 -7.942) 14.282 17.462 ( 1.207 -1.289 4.475) 4.811 17.776 ( -1.990 4.982 14.011) 15.003 18.197 ( -3.229 -6.325 -14.676) 16.304 18.795 ( -4.162 -6.766 -5.351) 9.578 19.512 ( 1.057 1.369 -2.588) 3.113 19.608 ( 0.994 1.860 -1.069) 2.364 19.806 ( 0.112 -6.187 3.956) 7.344======================= Grid point 548 (105/136) =======================q-point: ( 0.45 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.368 ( -6.219 10.772 -11.649) 17.041 2.648 ( -9.022 15.626 -0.580) 18.052 3.616 ( 1.418 -2.456 2.389) 3.708 4.960 ( 2.017 -3.493 3.257) 5.184 5.304 ( 3.345 -5.794 6.395) 9.255 5.386 ( 0.639 -1.107 -0.410) 1.342 5.734 ( 1.695 -2.936 -0.764) 3.475 5.909 ( 4.443 -7.695 5.011) 10.201 6.720 ( -0.659 1.142 -2.389) 2.729 7.482 ( 5.971 -10.341 -4.267) 12.681 7.751 ( -0.066 0.115 -5.336) 5.337 8.406 ( -5.999 10.391 -1.320) 12.071 8.563 ( -3.841 6.653 1.164) 7.770 10.002 ( 6.074 -10.520 -2.521) 12.407 11.303 ( -3.401 5.891 3.468) 7.636 14.938 ( 7.423 -12.858 -0.217) 14.848 15.567 ( -10.243 17.742 1.021) 20.512 16.383 ( -1.162 2.013 1.114) 2.577 16.471 ( 0.714 -1.237 0.174) 1.438 17.004 ( -2.414 4.182 -8.597) 9.860 17.560 ( -0.797 1.380 5.142) 5.383 17.617 ( 0.644 -1.115 10.866) 10.942 18.211 ( 0.402 -0.695 -8.816) 8.852 18.708 ( 2.078 -3.600 -7.642) 8.700 19.530 ( -0.320 0.554 -2.684) 2.759 19.625 ( -0.446 0.773 -1.135) 1.443 19.776 ( 2.674 -4.632 4.282) 6.851======================= Grid point 557 (106/136) =======================q-point: ( 0.18 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.384 ( 1.534 2.658 2.436) 3.918 2.612 ( 8.273 14.329 -2.903) 16.798 3.861 ( 16.331 28.287 -2.633) 32.769 4.067 ( -6.510 -11.275 -4.132) 13.659 4.975 ( 0.479 0.830 13.333) 13.367 5.233 ( -3.642 -6.308 -2.183) 7.604 5.827 ( -1.222 -2.117 5.363) 5.894 6.541 ( 6.036 10.455 -7.938) 14.449 6.588 ( -6.785 -11.751 5.851) 14.777 7.882 ( -14.311 -24.787 -2.808) 28.759 8.035 ( -2.186 -3.786 4.500) 6.274 8.312 ( -2.420 -4.191 -5.574) 7.381 9.210 ( -0.109 -0.189 -5.899) 5.903 9.570 ( -1.029 -1.782 -0.035) 2.057 11.089 ( 8.075 13.986 2.500) 16.343 14.958 ( -4.285 -7.421 -1.348) 8.675 15.826 ( 7.049 12.209 0.530) 14.108 15.958 ( 2.027 3.511 2.365) 4.694 16.351 ( 2.545 4.407 4.407) 6.732 16.611 ( 6.410 11.103 -10.011) 16.266 17.476 ( 11.427 19.792 1.543) 22.906 17.509 ( -2.204 -3.817 2.637) 5.136 18.565 ( -10.028 -17.369 -7.736) 21.496 18.941 ( -3.926 -6.800 -1.737) 8.041 19.469 ( 1.142 1.978 -2.599) 3.461 19.552 ( 2.045 3.542 -0.671) 4.144 19.874 ( -4.119 -7.135 5.019) 9.647======================= Grid point 558 (107/136) =======================q-point: ( 0.27 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.464 ( 0.882 9.327 -3.745) 10.090 2.872 ( 0.715 20.722 -2.241) 20.855 3.800 ( -9.556 -12.531 -4.594) 16.415 4.474 ( 25.583 20.769 -4.807) 33.301 4.972 ( -2.354 0.467 11.229) 11.483 5.153 ( 3.337 -7.091 4.084) 8.837 5.794 ( 0.670 -3.810 6.347) 7.433 6.319 ( -11.357 -12.463 7.469) 18.441 6.696 ( 1.694 2.894 -3.640) 4.950 7.436 ( -8.064 -18.011 -6.736) 20.851 7.908 ( -5.170 -8.454 -6.496) 11.849 8.352 ( 4.032 7.848 2.903) 9.288 9.075 ( -17.562 8.435 -4.803) 20.066 9.626 ( 13.093 -12.803 -1.549) 18.378 11.308 ( 3.545 9.932 2.802) 10.911 14.822 ( -1.217 -9.652 -0.545) 9.744 15.909 ( -8.575 16.044 1.559) 18.259 16.171 ( 13.502 2.103 1.553) 13.753 16.428 ( 1.189 3.947 4.408) 6.035 16.856 ( 8.197 11.745 -11.995) 18.682 17.433 ( -1.326 -4.025 3.352) 5.403 17.808 ( 6.134 10.621 9.747) 15.667 18.222 ( -9.070 -12.513 -15.940) 22.202 18.794 ( -4.386 -7.971 -2.613) 9.466 19.511 ( 1.210 2.122 -2.593) 3.563 19.607 ( 1.162 1.929 -1.190) 2.547 19.758 ( -1.755 -5.755 7.152) 9.346======================= Grid point 559 (108/136) =======================q-point: ( 0.36 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.567 ( -3.193 12.741 -6.563) 14.683 3.041 ( -7.837 24.675 -3.569) 26.134 3.543 ( -3.145 -12.729 -2.348) 13.320 4.927 ( -0.627 -1.311 7.507) 7.647 5.059 ( 18.017 -0.848 -3.733) 18.419 5.236 ( 12.797 8.606 6.175) 16.612 5.774 ( 2.103 -4.957 6.957) 8.798 5.913 ( -20.368 -11.400 6.210) 24.153 6.642 ( 2.354 -12.793 3.531) 13.478 7.330 ( 3.143 -1.838 -10.769) 11.367 7.741 ( -3.118 -7.231 -8.910) 11.891 8.551 ( 4.213 15.085 1.068) 15.699 8.835 ( -17.870 7.025 -1.041) 19.229 9.703 ( 11.764 -15.977 -2.879) 20.049 11.413 ( -1.028 6.966 2.815) 7.583 14.738 ( 2.714 -9.172 -0.136) 9.566 15.914 ( -9.423 16.562 1.619) 19.123 16.377 ( 6.968 2.368 2.449) 7.756 16.456 ( -1.082 0.629 3.010) 3.259 17.070 ( 2.002 8.726 -11.768) 14.787 17.448 ( 8.196 -0.010 3.535) 8.926 17.704 ( -11.711 -10.434 4.537) 16.328 18.201 ( 3.744 5.448 -9.075) 11.227 18.650 ( -1.937 -7.575 -4.958) 9.258 19.545 ( 0.116 1.866 -2.307) 2.969 19.631 ( 0.358 0.310 -1.695) 1.760 19.700 ( 0.777 -4.289 8.280) 9.358======================= Grid point 565 (109/136) =======================q-point: (-0.09 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.889 ( -2.800 4.849 14.201) 15.265 2.539 ( -0.514 0.890 18.897) 18.925 2.858 ( -10.718 18.565 -7.239) 22.626 4.280 ( 3.708 -6.423 4.031) 8.441 5.094 ( -0.679 1.175 2.223) 2.605 5.379 ( -3.259 5.644 -11.766) 13.451 5.997 ( -2.509 4.346 -1.984) 5.397 6.088 ( -1.941 3.362 -8.105) 8.987 7.062 ( 10.385 -17.987 8.532) 22.454 8.238 ( 1.469 -2.545 3.212) 4.354 8.636 ( 5.269 -9.125 -8.451) 13.507 8.814 ( 11.443 -19.819 -1.392) 22.927 9.300 ( 1.745 -3.023 -3.499) 4.942 9.424 ( -1.640 2.841 5.380) 6.301 10.297 ( -14.891 25.792 0.091) 29.782 15.052 ( 0.970 -1.679 1.012) 2.188 15.384 ( -6.541 11.329 -2.527) 13.324 16.039 ( 0.527 -0.913 -0.613) 1.220 16.118 ( -2.625 4.547 2.364) 5.757 16.274 ( -1.710 2.961 -0.903) 3.536 16.576 ( -10.082 17.463 -0.245) 20.166 17.620 ( 0.572 -0.990 1.823) 2.152 19.113 ( 7.268 -12.588 0.672) 14.551 19.150 ( 0.721 -1.248 -2.428) 2.824 19.399 ( -0.618 1.071 -0.837) 1.493 19.405 ( -0.999 1.730 0.115) 2.001 20.252 ( 2.552 -4.420 -2.283) 5.591======================= Grid point 569 (110/136) =======================q-point: ( 0.27 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.678 ( 6.860 11.881 -5.126) 14.645 3.232 ( 6.843 11.852 -0.679) 13.702 3.531 ( -7.043 -12.198 -6.778) 15.632 4.827 ( 6.107 10.578 -6.942) 14.050 4.977 ( -1.056 -1.829 10.560) 10.769 5.150 ( 7.124 12.338 7.288) 16.003 5.727 ( -1.592 -2.757 7.106) 7.786 6.076 ( -6.943 -12.026 9.950) 17.083 6.507 ( -10.947 -18.960 3.336) 22.146 7.304 ( 2.407 4.168 -12.317) 13.224 7.729 ( -5.315 -9.205 -10.095) 14.659 8.589 ( 8.441 14.620 2.026) 17.003 9.159 ( -1.783 -3.088 -5.777) 6.789 9.391 ( -4.313 -7.470 0.377) 8.634 11.459 ( 2.941 5.094 2.534) 6.404 14.668 ( -3.144 -5.446 -0.115) 6.289 16.173 ( 3.495 6.054 1.391) 7.127 16.235 ( 4.626 8.012 2.959) 9.713 16.475 ( 0.140 0.242 5.067) 5.075 17.102 ( 7.165 12.410 -14.222) 20.190 17.362 ( -1.249 -2.163 4.074) 4.779 17.758 ( -7.969 -13.802 2.061) 16.070 18.195 ( 4.779 8.278 -10.860) 14.467 18.628 ( -4.847 -8.396 -2.756) 10.079 19.555 ( 1.234 2.138 -2.343) 3.403 19.627 ( 0.053 0.092 -1.555) 1.559 19.670 ( -1.726 -2.989 9.811) 10.400======================= Grid point 570 (111/136) =======================q-point: ( 0.36 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.849 ( -8.319 14.410 -5.240) 17.444 3.245 ( 8.372 -14.500 -3.701) 17.148 3.465 ( -7.553 13.082 -3.342) 15.471 4.918 ( 0.165 -0.285 5.848) 5.857 4.935 ( 3.061 -5.303 0.303) 6.130 5.433 ( -2.361 4.089 1.799) 5.053 5.698 ( 1.040 -1.801 7.753) 8.027 5.863 ( -5.064 8.771 9.808) 14.099 6.264 ( 11.867 -20.554 6.834) 24.698 7.404 ( -3.527 6.110 -12.123) 14.027 7.596 ( 3.891 -6.740 -10.789) 13.303 8.841 ( -5.078 8.795 -3.931) 10.890 8.988 ( -6.923 11.991 1.133) 13.892 9.353 ( 10.483 -18.158 -1.381) 21.012 11.510 ( -1.450 2.511 2.391) 3.758 14.613 ( 1.865 -3.231 0.030) 3.731 16.205 ( -6.665 11.543 1.799) 13.450 16.397 ( 1.338 -2.318 2.715) 3.812 16.432 ( 0.782 -1.354 5.280) 5.506 17.244 ( -5.327 9.226 -8.992) 13.941 17.437 ( 3.114 -5.394 6.016) 8.660 17.488 ( 3.302 -5.720 -11.345) 13.128 18.327 ( -3.430 5.940 -4.577) 8.246 18.505 ( 3.656 -6.332 -3.971) 8.321 19.583 ( -1.007 1.745 -1.987) 2.830 19.622 ( 0.569 -0.985 -1.817) 2.144 19.641 ( 0.901 -1.561 10.670) 10.821======================= Grid point 576 (112/136) =======================q-point: (-0.18 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.049 ( -3.979 10.994 9.019) 14.766 2.437 ( 1.575 -6.567 10.811) 12.747 3.402 ( -22.231 23.373 -6.154) 32.838 4.112 ( 6.121 -10.220 4.501) 12.735 5.111 ( 1.098 2.923 3.817) 4.931 5.467 ( -1.355 2.960 -11.169) 11.634 6.086 ( 0.753 8.775 -0.740) 8.838 6.195 ( -7.971 2.143 -7.127) 10.905 6.767 ( 6.974 -9.764 7.270) 14.029 8.125 ( 10.588 -5.663 4.190) 12.717 8.398 ( 7.811 -19.949 -3.353) 21.685 8.474 ( 4.831 -9.210 -8.019) 13.133 9.067 ( 20.385 7.300 -1.127) 21.682 9.598 ( -16.046 -9.323 2.677) 18.750 10.754 ( -11.961 17.941 2.093) 21.664 15.025 ( -1.658 -5.516 1.089) 5.862 15.597 ( -0.536 14.672 -2.030) 14.822 16.027 ( -3.231 -0.509 -0.875) 3.386 16.214 ( -3.370 3.902 1.248) 5.305 16.375 ( -5.443 4.328 -0.540) 6.975 16.983 ( -16.017 15.332 2.831) 22.353 17.585 ( 1.881 -2.075 1.614) 3.233 18.815 ( 11.107 -13.856 -0.445) 17.764 19.093 ( 3.207 -3.294 -3.423) 5.732 19.429 ( -1.439 1.468 -1.732) 2.689 19.460 ( -2.451 2.681 0.575) 3.678 20.151 ( 4.798 -2.473 -3.905) 6.662======================= Grid point 588 (113/136) =======================q-point: (-0.27 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.162 ( 3.138 10.416 0.378) 10.885 2.454 ( -4.391 3.699 6.668) 8.799 3.871 ( 7.978 -12.236 4.649) 15.329 4.045 ( -28.188 17.303 -2.892) 33.202 5.120 ( 1.577 4.094 1.103) 4.524 5.481 ( 1.102 -0.192 -6.829) 6.920 6.146 ( 1.405 7.453 -2.013) 7.847 6.383 ( -8.515 4.693 -4.525) 10.724 6.602 ( 6.063 -4.178 3.112) 7.994 7.737 ( 17.039 -14.502 1.316) 22.413 8.098 ( 4.194 -22.029 -1.355) 22.465 8.398 ( 2.696 3.370 -6.051) 7.432 8.805 ( 17.226 6.752 -0.341) 18.505 9.759 ( -14.062 -10.953 2.322) 17.975 11.061 ( -6.736 11.697 3.636) 13.979 14.993 ( -3.496 -9.858 0.622) 10.478 15.646 ( 10.270 15.205 -0.993) 18.375 16.188 ( -11.351 3.917 -1.496) 12.100 16.307 ( -2.152 4.643 0.187) 5.121 16.541 ( -9.239 3.452 0.114) 9.863 17.369 ( -13.990 6.727 9.813) 18.365 17.516 ( 2.723 -3.366 2.128) 4.824 18.494 ( 10.801 -9.738 -5.338) 15.491 18.981 ( 5.084 -4.416 -4.624) 8.169 19.474 ( -1.783 1.774 -2.472) 3.527 19.530 ( -2.546 2.173 0.514) 3.387 20.047 ( 5.244 -0.532 -4.404) 6.869======================= Grid point 589 (114/136) =======================q-point: (-0.18 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.333 ( 1.012 -1.753 4.658) 5.079 2.369 ( -10.425 18.056 7.147) 22.040 3.868 ( -13.433 23.266 -3.916) 27.149 3.880 ( 7.489 -12.971 5.090) 15.819 5.160 ( -1.460 2.530 1.465) 3.268 5.484 ( 0.912 -1.579 -9.846) 10.014 6.198 ( -1.135 1.966 -10.310) 10.557 6.333 ( -6.624 11.473 2.416) 13.467 6.626 ( 2.635 -4.565 5.193) 7.400 7.878 ( 14.587 -25.265 -3.879) 29.430 7.958 ( 7.592 -13.149 2.250) 15.349 8.439 ( -0.792 1.372 -6.981) 7.159 9.104 ( 3.164 -5.481 -1.234) 6.448 9.464 ( 0.734 -1.271 4.900) 5.116 11.067 ( -7.488 12.970 3.799) 15.451 14.911 ( 3.294 -5.705 0.884) 6.647 15.911 ( -8.003 13.862 -2.654) 16.225 16.015 ( -1.170 2.026 -0.675) 2.434 16.320 ( -3.523 6.102 1.987) 7.321 16.472 ( -3.159 5.472 -0.311) 6.326 17.275 ( -7.179 12.434 9.540) 17.238 17.523 ( 2.422 -4.195 1.744) 5.149 18.539 ( 7.256 -12.568 -4.435) 15.175 19.002 ( 3.328 -5.765 -4.308) 7.929 19.467 ( -1.331 2.306 -2.394) 3.581 19.520 ( -1.766 3.060 0.788) 3.620 20.092 ( 1.918 -3.323 -5.761) 6.921======================= Grid point 600 (115/136) =======================q-point: (-0.36 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.209 ( 2.419 9.381 -5.286) 11.036 2.569 ( 1.325 11.255 3.303) 11.804 3.622 ( 5.509 -11.520 5.946) 14.086 4.701 ( -30.548 9.372 2.921) 32.086 5.146 ( 1.829 6.742 -5.125) 8.664 5.437 ( 1.490 -3.359 -0.922) 3.788 6.184 ( 2.460 6.072 -2.545) 7.029 6.365 ( 16.440 -3.723 -6.057) 17.911 6.558 ( -4.197 4.324 -2.996) 6.729 7.438 ( -0.272 -10.290 1.777) 10.446 7.800 ( 6.116 -19.191 -0.500) 20.148 8.392 ( 4.515 6.503 -2.934) 8.443 8.635 ( 9.434 6.217 -0.278) 11.302 9.861 ( -11.420 -12.730 2.274) 17.252 11.229 ( -1.911 7.438 4.400) 8.851 14.954 ( -5.159 -12.458 0.141) 13.485 15.612 ( 11.647 17.312 -0.386) 20.869 16.372 ( -0.560 3.862 -1.477) 4.173 16.414 ( -7.645 5.147 -1.477) 9.334 16.743 ( -10.024 1.484 0.623) 10.152 17.435 ( 0.892 -4.121 5.228) 6.716 17.538 ( -4.012 -6.567 16.280) 18.007 18.319 ( 3.356 1.340 -11.436) 11.994 18.843 ( 5.097 -4.381 -6.546) 9.382 19.521 ( -1.323 1.906 -3.007) 3.798 19.580 ( -1.356 0.801 0.142) 1.581 19.968 ( 4.018 1.120 -3.844) 5.672======================= Grid point 601 (116/136) =======================q-point: (-0.27 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.346 ( 0.539 8.149 0.434) 8.179 2.724 ( -4.966 21.629 4.141) 22.575 3.605 ( 7.784 -14.384 5.150) 17.147 4.334 ( -20.487 11.470 2.172) 23.579 5.237 ( -0.832 8.436 -5.200) 9.944 5.405 ( 1.970 -7.546 -4.273) 8.893 6.226 ( -0.534 1.134 -11.620) 11.687 6.528 ( 3.782 3.218 1.296) 5.132 6.575 ( -3.197 6.718 0.237) 7.443 7.391 ( 11.658 -19.827 -5.090) 23.557 7.699 ( 5.240 -17.260 1.666) 18.115 8.488 ( -0.307 5.290 -3.740) 6.486 8.922 ( 13.960 4.488 1.580) 14.748 9.507 ( -11.201 -12.820 4.140) 17.520 11.268 ( -3.494 8.524 4.910) 10.439 14.806 ( 0.390 -8.356 0.194) 8.367 15.970 ( 9.502 15.969 -0.922) 18.605 16.262 ( -14.040 4.183 -2.743) 14.905 16.434 ( -1.078 7.599 2.015) 7.935 16.602 ( -7.490 2.457 0.594) 7.905 17.417 ( 0.372 -3.613 10.708) 11.307 17.427 ( -0.184 -4.370 9.399) 10.367 18.371 ( 2.627 -1.762 -10.620) 11.081 18.871 ( 4.446 -6.416 -5.552) 9.579 19.517 ( -1.572 2.449 -2.822) 4.054 19.572 ( -1.237 1.845 0.427) 2.262 20.026 ( 2.669 -1.469 -6.011) 6.739======================= Grid point 610 (117/136) =======================q-point: (-0.45 0.55 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.242 ( 4.884 8.460 -7.577) 12.362 2.614 ( 6.658 11.533 2.130) 13.486 3.507 ( -3.903 -6.759 6.912) 10.426 5.127 ( 0.436 0.755 -2.447) 2.598 5.147 ( -5.927 -10.266 8.800) 14.763 5.393 ( 0.897 1.554 -2.911) 3.420 6.082 ( 5.997 10.387 -12.691) 17.462 6.216 ( 2.736 4.739 -5.261) 7.591 6.618 ( 0.774 1.340 -1.377) 2.071 7.494 ( -6.879 -11.914 -2.314) 13.951 7.560 ( -4.376 -7.579 4.229) 9.719 8.379 ( 4.811 8.334 -1.732) 9.778 8.591 ( 3.862 6.689 -0.456) 7.738 9.897 ( -8.432 -14.605 2.260) 17.015 11.282 ( 2.559 4.433 4.609) 6.887 14.934 ( -7.140 -12.366 -0.048) 14.279 15.598 ( 10.824 18.747 -0.203) 21.649 16.395 ( 1.830 3.169 -1.812) 4.084 16.515 ( 0.556 0.963 -1.781) 2.099 16.852 ( -2.057 -3.563 -0.054) 4.115 17.424 ( -2.907 -5.035 10.466) 11.972 17.482 ( -3.826 -6.627 12.922) 15.017 18.329 ( 2.244 3.886 -10.094) 11.046 18.763 ( -0.639 -1.106 -8.342) 8.440 19.545 ( 0.635 1.099 -3.426) 3.653 19.594 ( -0.154 -0.266 0.076) 0.317 19.938 ( 1.567 2.714 -3.352) 4.589======================= Grid point 612 (118/136) =======================q-point: (-0.36 0.55 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 606Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.438 ( 3.102 13.026 -2.215) 13.572 2.930 ( 7.331 23.144 2.322) 24.388 3.374 ( 0.805 -13.483 5.642) 14.638 4.780 ( -22.989 0.074 7.081) 24.055 5.155 ( 7.540 -11.957 0.463) 14.144 5.454 ( -2.866 10.408 -7.327) 13.047 6.241 ( -0.611 0.239 -12.680) 12.697 6.345 ( 13.886 2.190 -12.815) 19.022 6.698 ( 1.434 8.215 2.502) 8.707 7.202 ( -8.284 -13.491 -4.852) 16.558 7.459 ( 2.948 -13.845 4.247) 14.779 8.535 ( 2.567 7.325 0.024) 7.762 8.775 ( 9.137 7.618 1.390) 11.977 9.556 ( -11.171 -16.684 4.044) 20.482 11.362 ( 0.458 5.434 5.391) 7.668 14.742 ( -2.867 -8.461 -0.266) 8.938 15.968 ( 10.102 17.454 -0.563) 20.174 16.464 ( -1.864 5.207 -1.452) 5.718 16.509 ( -1.666 4.221 -1.264) 4.710 16.751 ( -6.867 -0.851 1.802) 7.151 17.328 ( -0.472 -6.252 7.799) 10.007 17.366 ( -0.311 -9.291 15.237) 17.849 18.391 ( -0.385 5.007 -10.436) 11.582 18.743 ( 2.251 -5.504 -7.408) 9.500 19.561 ( -0.631 1.961 -3.070) 3.697 19.595 ( -0.035 0.617 -0.116) 0.629 19.980 ( 1.616 0.178 -5.437) 5.675======================= Grid point 613 (119/136) =======================q-point: (-0.27 0.55 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.542 ( -6.631 11.485 0.536) 13.272 3.156 ( -10.364 17.950 2.206) 20.844 3.306 ( 8.475 -14.679 4.433) 17.520 4.535 ( -5.966 10.333 7.065) 13.866 5.160 ( 8.710 -15.086 1.157) 17.458 5.481 ( -7.694 13.327 -9.206) 17.932 6.230 ( 0.080 -0.139 -14.534) 14.535 6.516 ( 1.233 -2.135 -9.061) 9.391 6.763 ( -2.965 5.136 -0.547) 5.956 7.029 ( 6.368 -11.029 -7.119) 14.590 7.408 ( 7.125 -12.341 5.197) 15.168 8.593 ( -2.792 4.837 0.245) 5.590 8.967 ( 0.106 -0.183 3.127) 3.134 9.300 ( 3.995 -6.920 4.410) 9.127 11.394 ( -2.425 4.200 5.743) 7.517 14.674 ( 2.709 -4.692 -0.340) 5.428 16.206 ( -3.529 6.113 -0.261) 7.063 16.396 ( -5.643 9.774 -4.207) 12.044 16.586 ( -3.471 6.012 5.240) 8.698 16.638 ( -1.058 1.833 -1.393) 2.534 17.293 ( 3.720 -6.443 5.929) 9.514 17.312 ( 4.148 -7.184 16.849) 18.781 18.413 ( -2.784 4.821 -10.828) 12.175 18.734 ( 4.036 -6.991 -6.714) 10.500 19.565 ( -1.239 2.146 -2.774) 3.720 19.599 ( -0.447 0.774 -0.296) 0.941 19.995 ( 0.804 -1.393 -6.202) 6.407======================= Grid point 624 (120/136) =======================q-point: (-0.36 0.64 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 336Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.715 ( 7.885 13.656 0.644) 15.782 3.092 ( -7.912 -13.705 3.624) 16.234 3.359 ( 8.797 15.237 1.566) 17.664 4.743 ( -2.205 -3.820 7.328) 8.553 4.887 ( -4.990 -8.644 5.446) 11.370 5.657 ( 3.794 6.572 -8.119) 11.113 6.231 ( -0.321 -0.556 -15.028) 15.042 6.461 ( 5.254 9.101 -17.202) 20.158 6.730 ( -5.213 -9.029 -11.791) 15.739 7.041 ( 1.280 2.218 3.259) 4.145 7.241 ( -4.893 -8.475 6.920) 11.985 8.651 ( 1.945 3.369 3.535) 5.257 8.948 ( 5.726 9.917 2.572) 11.737 9.237 ( -8.204 -14.209 4.175) 16.931 11.436 ( 1.088 1.884 6.017) 6.399 14.626 ( -1.717 -2.973 -0.550) 3.477 16.256 ( 5.470 9.474 -0.614) 10.957 16.551 ( 1.329 2.302 -4.017) 4.817 16.589 ( 2.612 4.524 0.706) 5.271 16.698 ( -2.551 -4.419 2.650) 5.750 17.216 ( -2.226 -3.855 10.459) 11.367 17.219 ( -2.501 -4.332 13.002) 13.931 18.495 ( 2.776 4.808 -9.117) 10.674 18.634 ( -2.835 -4.911 -7.956) 9.771 19.591 ( 0.532 0.921 -2.442) 2.664 19.603 ( 0.095 0.164 -0.990) 1.008 19.980 ( -0.052 -0.090 -6.038) 6.038======================= Grid point 665 (121/136) =======================q-point: ( 0.00 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 68Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.060 ( -0.000 -0.000 0.000) 0.000 2.060 ( 0.000 0.000 0.000) 0.000 3.026 ( 0.000 0.000 0.000) 0.000 4.418 ( -0.000 0.000 0.000) 0.000 5.089 ( 0.000 -0.000 0.000) 0.000 5.089 ( 0.000 0.000 0.000) 0.000 5.899 ( 0.000 -0.000 0.000) 0.000 5.899 ( -0.000 -0.000 0.000) 0.000 7.738 ( -0.000 0.000 0.000) 0.000 8.340 ( 0.000 0.000 0.000) 0.000 8.934 ( -0.000 0.000 0.000) 0.000 9.263 ( 0.000 -0.000 0.000) 0.000 9.263 ( -0.000 -0.000 0.000) 0.000 9.382 ( 0.000 0.000 0.000) 0.000 9.382 ( 0.000 0.000 0.000) 0.000 15.094 ( 0.000 -0.000 0.000) 0.000 15.094 ( 0.000 0.000 0.000) 0.000 16.005 ( 0.000 -0.000 0.000) 0.000 16.005 ( 0.000 0.000 0.000) 0.000 16.240 ( 0.000 -0.000 0.000) 0.000 16.240 ( -0.000 0.000 0.000) 0.000 17.658 ( 0.000 -0.000 0.000) 0.000 19.135 ( 0.000 -0.000 0.000) 0.000 19.378 ( 0.000 -0.000 0.000) 0.000 19.378 ( 0.000 0.000 0.000) 0.000 19.381 ( -0.000 0.000 0.000) 0.000 20.364 ( 0.000 0.000 0.000) 0.000======================= Grid point 667 (122/136) =======================q-point: ( 0.09 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 308Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.068 ( 0.645 0.372 0.000) 0.744 2.309 ( 20.093 11.601 0.000) 23.201 2.923 ( -8.113 -4.684 0.000) 9.368 4.399 ( -1.955 -1.129 0.000) 2.258 5.104 ( 1.114 0.643 0.000) 1.287 5.136 ( 3.812 2.201 0.000) 4.402 5.923 ( 1.911 1.103 0.000) 2.206 5.936 ( 3.239 1.870 -0.000) 3.740 7.473 ( -18.670 -10.779 0.000) 21.558 8.318 ( -1.696 -0.979 0.000) 1.958 8.707 ( -10.995 -6.348 0.000) 12.696 9.113 ( -8.600 -4.965 0.000) 9.930 9.206 ( -10.535 -6.082 0.000) 12.165 9.525 ( 7.941 4.585 0.000) 9.169 9.795 ( 28.335 16.359 0.000) 32.718 15.096 ( 0.250 0.144 0.000) 0.289 15.179 ( 6.867 3.964 0.000) 7.929 16.017 ( 0.587 0.339 0.000) 0.678 16.091 ( 5.348 3.088 0.000) 6.176 16.230 ( -0.130 -0.075 0.000) 0.150 16.338 ( 10.009 5.779 0.000) 11.557 17.653 ( -0.507 -0.293 0.000) 0.585 19.136 ( -0.202 -0.117 0.000) 0.233 19.294 ( -7.229 -4.174 0.000) 8.348 19.379 ( 0.211 0.122 0.000) 0.243 19.387 ( 0.733 0.423 0.000) 0.846 20.309 ( -4.547 -2.625 0.000) 5.251======================= Grid point 669 (123/136) =======================q-point: ( 0.18 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 308Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.083 ( 0.404 0.233 0.000) 0.467 2.710 ( -9.018 -5.207 0.000) 10.413 2.898 ( 29.604 17.092 -0.000) 34.184 4.309 ( -6.117 -3.531 0.000) 7.063 5.126 ( 0.405 0.234 0.000) 0.467 5.244 ( 5.047 2.914 0.000) 5.827 5.976 ( 2.441 1.409 0.000) 2.818 6.049 ( 6.533 3.772 -0.000) 7.544 7.055 ( -15.818 -9.133 0.000) 18.265 8.278 ( -1.384 -0.799 0.000) 1.598 8.433 ( -13.913 -8.032 0.000) 16.065 8.874 ( -17.081 -9.862 0.000) 19.724 8.907 ( -9.131 -5.272 0.000) 10.543 9.708 ( 7.735 4.466 0.000) 8.931 10.416 ( 23.940 13.822 0.000) 27.644 15.110 ( 0.947 0.547 0.000) 1.094 15.362 ( 7.384 4.263 0.000) 8.526 16.016 ( 0.115 0.067 0.000) 0.133 16.189 ( 3.407 1.967 0.000) 3.934 16.280 ( 4.932 2.847 0.000) 5.695 16.713 ( 21.001 12.125 0.000) 24.250 17.630 ( -1.505 -0.869 0.000) 1.738 19.051 ( -13.643 -7.877 0.000) 15.754 19.104 ( -2.873 -1.659 0.000) 3.317 19.394 ( 1.058 0.611 0.000) 1.222 19.422 ( 2.505 1.446 0.000) 2.893 20.177 ( -6.374 -3.680 0.000) 7.360======================= Grid point 671 (124/136) =======================q-point: ( 0.27 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 308Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.074 ( -1.103 -0.637 0.000) 1.274 2.559 ( -3.741 -2.160 0.000) 4.319 3.623 ( 32.785 18.928 0.000) 37.857 4.119 ( -10.051 -5.803 0.000) 11.606 5.115 ( -1.259 -0.727 0.000) 1.454 5.346 ( 3.582 2.068 0.000) 4.136 6.030 ( 2.227 1.286 0.000) 2.572 6.229 ( 8.768 5.062 0.000) 10.124 6.761 ( -10.666 -6.158 0.000) 12.316 8.045 ( -19.088 -11.021 0.000) 22.041 8.264 ( 0.152 0.088 0.000) 0.176 8.477 ( -16.657 -9.617 0.000) 19.234 8.704 ( -8.110 -4.683 0.000) 9.365 9.874 ( 6.563 3.789 0.000) 7.578 10.869 ( 15.436 8.912 0.000) 17.824 15.138 ( 1.383 0.798 0.000) 1.597 15.441 ( -1.037 -0.598 0.000) 1.197 16.093 ( 7.091 4.094 0.000) 8.188 16.259 ( 2.754 1.590 0.000) 3.180 16.445 ( 8.999 5.196 0.000) 10.391 17.231 ( 22.777 13.150 0.000) 26.301 17.583 ( -2.508 -1.448 0.000) 2.896 18.684 ( -17.822 -10.289 0.000) 20.579 19.005 ( -5.570 -3.216 0.000) 6.431 19.424 ( 1.525 0.880 0.000) 1.761 19.494 ( 3.367 1.944 0.000) 3.887 20.036 ( -5.578 -3.220 0.000) 6.441======================= Grid point 673 (125/136) =======================q-point: ( 0.36 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 308Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.053 ( -0.335 -0.193 0.000) 0.387 2.521 ( -0.286 -0.165 0.000) 0.331 3.875 ( -10.300 -5.947 0.000) 11.894 4.388 ( 33.321 19.238 0.000) 38.476 5.079 ( -1.444 -0.833 0.000) 1.667 5.406 ( 1.674 0.967 0.000) 1.933 6.076 ( 1.717 0.991 0.000) 1.983 6.430 ( 8.048 4.647 0.000) 9.293 6.477 ( -16.394 -9.465 0.000) 18.930 7.657 ( -11.700 -6.755 0.000) 13.510 8.113 ( -15.101 -8.719 0.000) 17.438 8.270 ( -0.189 -0.109 0.000) 0.218 8.556 ( -4.306 -2.486 0.000) 4.972 10.002 ( 4.426 2.555 0.000) 5.110 11.137 ( 8.199 4.733 0.000) 9.467 15.168 ( 1.199 0.692 0.000) 1.385 15.363 ( -4.351 -2.512 0.000) 5.024 16.295 ( 9.075 5.239 0.000) 10.479 16.313 ( 1.885 1.088 -0.000) 2.176 16.673 ( 10.048 5.801 0.000) 11.602 17.530 ( -1.452 -0.838 0.000) 1.676 17.718 ( 18.826 10.869 0.000) 21.739 18.257 ( -18.678 -10.783 0.000) 21.567 18.856 ( -7.248 -4.184 0.000) 8.369 19.462 ( 1.649 0.952 0.000) 1.904 19.563 ( 2.348 1.355 0.000) 2.711 19.930 ( -3.553 -2.051 0.000) 4.103======================= Grid point 675 (126/136) =======================q-point: ( 0.45 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 308Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.057 ( 0.357 0.206 0.000) 0.412 2.522 ( 0.150 0.087 0.000) 0.173 3.693 ( -4.546 -2.625 0.000) 5.250 5.007 ( 4.963 2.865 0.000) 5.730 5.183 ( 24.336 14.050 0.000) 28.100 5.429 ( 0.441 0.255 0.000) 0.510 5.970 ( -25.407 -14.669 0.000) 29.337 6.105 ( 0.678 0.392 0.000) 0.783 6.567 ( 3.283 1.896 0.000) 3.791 7.576 ( 3.814 2.202 0.000) 4.404 7.793 ( -12.021 -6.941 0.000) 13.881 8.252 ( -0.852 -0.492 0.000) 0.983 8.507 ( -0.554 -0.320 0.000) 0.639 10.072 ( 1.563 0.902 0.000) 1.805 11.258 ( 2.541 1.467 0.000) 2.934 15.189 ( 0.471 0.272 0.000) 0.544 15.284 ( -1.968 -1.136 0.000) 2.272 16.343 ( 0.671 0.387 0.000) 0.774 16.459 ( 4.252 2.455 0.000) 4.910 16.856 ( 4.610 2.661 0.000) 5.323 17.564 ( 5.243 3.027 0.000) 6.054 17.861 ( -14.395 -8.311 0.000) 16.622 18.059 ( 9.345 5.395 0.000) 10.790 18.696 ( -5.343 -3.085 0.000) 6.169 19.492 ( 0.793 0.458 0.000) 0.916 19.598 ( 0.741 0.428 0.000) 0.856 19.875 ( -1.197 -0.691 0.000) 1.382======================= Grid point 689 (127/136) =======================q-point: ( 0.09 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.118 ( 2.547 4.412 -8.008) 9.491 2.629 ( 5.154 8.928 14.759) 18.003 2.828 ( 3.782 6.551 -9.209) 11.917 4.341 ( -2.955 -5.118 -1.910) 6.211 5.148 ( 1.668 2.890 10.432) 10.953 5.187 ( 1.662 2.878 -6.663) 7.446 5.953 ( 1.006 1.742 4.901) 5.298 6.019 ( 3.723 6.449 -4.154) 8.527 7.157 ( -10.162 -17.602 -1.009) 20.350 8.288 ( -0.895 -1.551 1.065) 2.083 8.530 ( -6.354 -11.005 -0.559) 12.720 8.788 ( -11.016 -19.080 1.409) 22.077 9.252 ( -1.924 -3.333 1.260) 4.049 9.514 ( 1.394 2.415 -3.637) 4.583 10.292 ( 15.637 27.084 0.531) 31.278 15.083 ( -0.679 -1.176 -2.018) 2.432 15.342 ( 6.491 11.242 1.562) 13.075 16.007 ( -0.819 -1.418 2.643) 3.109 16.179 ( 2.788 4.828 -3.594) 6.634 16.248 ( 1.501 2.601 1.495) 3.355 16.588 ( 10.903 18.885 -1.253) 21.842 17.638 ( -0.714 -1.237 0.152) 1.437 19.120 ( -1.166 -2.020 0.445) 2.374 19.129 ( -7.012 -12.145 -0.936) 14.055 19.391 ( 0.370 0.642 -0.194) 0.766 19.407 ( 1.299 2.250 -0.029) 2.599 20.216 ( -3.571 -6.185 1.351) 7.268======================= Grid point 691 (128/136) =======================q-point: ( 0.18 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.202 ( -3.873 11.541 -5.518) 13.366 2.544 ( -0.187 -8.862 0.505) 8.879 3.331 ( 23.424 23.901 0.463) 33.469 4.190 ( -6.612 -8.467 -3.164) 11.199 5.164 ( -3.182 2.959 4.209) 6.050 5.267 ( 5.690 -0.742 2.707) 6.344 5.988 ( 1.965 0.036 7.010) 7.280 6.186 ( 6.007 9.606 -4.921) 12.352 6.850 ( -8.764 -10.254 -0.837) 13.515 8.234 ( -15.895 -11.807 -3.474) 20.103 8.273 ( -0.527 0.395 5.360) 5.400 8.408 ( -5.815 -24.404 -0.426) 25.091 9.059 ( -18.539 7.225 -0.618) 19.907 9.650 ( 13.794 -7.126 -2.208) 15.682 10.774 ( 12.666 19.088 -0.005) 22.908 15.054 ( 0.986 -5.273 -1.817) 5.664 15.558 ( 1.225 14.146 1.725) 14.304 16.000 ( 3.957 -1.220 1.837) 4.530 16.269 ( 1.211 5.980 -3.177) 6.879 16.352 ( 6.756 4.029 0.690) 7.896 17.037 ( 17.370 19.246 -2.303) 26.027 17.600 ( -1.725 -2.247 0.267) 2.845 18.823 ( -12.537 -14.679 -1.286) 19.347 19.047 ( -3.589 -4.156 0.928) 5.569 19.412 ( 1.037 1.096 -0.140) 1.515 19.470 ( 2.488 3.188 -0.415) 4.065 20.084 ( -4.597 -5.283 2.937) 7.594======================= Grid point 693 (129/136) =======================q-point: ( 0.27 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.196 ( -7.895 10.756 -2.897) 13.653 2.547 ( 1.569 3.960 -2.402) 4.890 3.949 ( -5.190 -8.030 -3.026) 10.029 4.025 ( 26.783 17.348 -0.811) 31.921 5.116 ( -3.639 0.368 2.848) 4.636 5.344 ( 4.581 -2.011 5.152) 7.182 6.021 ( 2.784 -1.661 8.284) 8.896 6.399 ( 5.935 11.135 -4.832) 13.511 6.619 ( -9.841 -7.731 1.411) 12.594 7.775 ( -16.153 -17.122 -1.904) 23.616 8.100 ( -5.564 -19.543 -1.072) 20.348 8.301 ( 0.610 3.587 3.031) 4.735 8.820 ( -17.631 8.768 -1.949) 19.788 9.804 ( 13.030 -9.012 -2.134) 15.986 11.101 ( 6.976 12.687 -0.303) 14.481 15.010 ( 2.851 -10.134 -1.056) 10.580 15.620 ( -9.225 14.921 1.539) 17.609 16.156 ( 11.277 2.646 1.612) 11.695 16.341 ( 0.034 6.295 -1.973) 6.597 16.548 ( 10.279 4.919 -1.642) 11.513 17.520 ( 17.464 14.542 -4.146) 23.101 17.539 ( -1.670 -2.764 -0.066) 3.230 18.428 ( -15.404 -14.742 0.439) 21.326 18.918 ( -5.592 -5.502 1.217) 7.938 19.447 ( 1.504 1.507 0.002) 2.129 19.542 ( 2.208 2.560 -0.613) 3.436 19.966 ( -3.708 -3.606 3.851) 6.449======================= Grid point 695 (130/136) =======================q-point: ( 0.36 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.189 ( -6.096 11.898 -3.444) 13.806 2.614 ( -3.417 11.298 -1.148) 11.859 3.716 ( -5.660 -9.991 -3.159) 11.910 4.750 ( 32.489 15.964 -2.133) 36.262 5.065 ( -1.877 -0.438 3.476) 3.974 5.384 ( 2.966 -2.988 3.946) 5.770 6.048 ( 2.989 -3.121 9.041) 10.020 6.264 ( -21.607 -10.908 4.289) 24.582 6.582 ( 2.528 9.340 -4.295) 10.587 7.468 ( 0.298 -13.367 -1.270) 13.430 7.820 ( -6.339 -15.107 -2.623) 16.592 8.351 ( -1.734 7.583 1.373) 7.899 8.645 ( -11.755 7.775 -1.309) 14.154 9.910 ( 10.345 -10.532 -2.536) 14.979 11.278 ( 1.738 8.311 -0.468) 8.503 14.959 ( 4.886 -12.891 -0.351) 13.790 15.598 ( -11.043 17.060 1.026) 20.348 16.350 ( 4.557 3.425 1.290) 5.845 16.408 ( 2.692 5.179 -0.807) 5.892 16.772 ( 8.938 4.075 -3.163) 10.320 17.502 ( 1.994 -2.036 -0.887) 2.985 17.870 ( 6.205 -1.925 -15.950) 17.222 18.069 ( -7.501 -1.810 12.989) 15.108 18.755 ( -6.249 -5.831 1.552) 8.687 19.487 ( 1.077 1.624 0.216) 1.960 19.589 ( 1.061 1.143 -0.728) 1.721 19.889 ( -1.893 -1.931 4.114) 4.923======================= Grid point 697 (131/136) =======================q-point: ( 0.45 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.201 ( -7.090 12.280 -3.657) 14.643 2.642 ( -7.127 12.344 -0.681) 14.270 3.609 ( 3.330 -5.767 -2.984) 7.297 5.042 ( -0.892 1.545 4.888) 5.203 5.297 ( 6.366 -11.026 -5.522) 13.878 5.378 ( 0.874 -1.514 -0.377) 1.788 5.846 ( -3.773 6.534 10.325) 12.788 6.060 ( 2.365 -4.097 9.052) 10.214 6.652 ( -3.084 5.341 -3.674) 7.179 7.454 ( 8.300 -14.376 1.037) 16.633 7.649 ( 2.410 -4.174 -4.744) 6.763 8.377 ( -5.965 10.331 -1.148) 11.985 8.581 ( -4.152 7.191 0.654) 8.329 9.948 ( 7.118 -12.329 -2.747) 14.500 11.333 ( -3.002 5.200 -0.522) 6.027 14.935 ( 7.302 -12.648 -0.085) 14.604 15.587 ( -10.574 18.315 0.837) 21.165 16.388 ( -2.263 3.919 -0.337) 4.538 16.484 ( 0.059 -0.103 1.151) 1.157 16.878 ( 0.254 -0.440 -3.496) 3.533 17.582 ( 1.993 -3.452 -3.912) 5.585 17.692 ( 3.178 -5.505 -5.562) 8.446 18.152 ( -1.870 3.238 5.103) 6.327 18.646 ( 0.969 -1.679 2.005) 2.789 19.507 ( -0.544 0.942 0.380) 1.153 19.603 ( -0.045 0.079 -0.833) 0.838 19.863 ( 0.282 -0.489 4.135) 4.173======================= Grid point 715 (132/136) =======================q-point: ( 0.18 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.394 ( -1.564 -2.709 -1.374) 3.416 2.512 ( 8.828 15.290 -6.613) 18.853 3.831 ( 15.294 26.490 -0.089) 30.589 3.978 ( -7.249 -12.555 -4.699) 15.240 5.194 ( -1.141 -1.976 -1.831) 2.926 5.248 ( 0.563 0.974 13.302) 13.349 5.985 ( -0.134 -0.233 10.022) 10.026 6.408 ( 6.889 11.933 -5.216) 14.733 6.664 ( -5.007 -8.673 1.331) 10.102 7.847 ( -15.290 -26.483 -0.431) 30.583 8.028 ( -7.705 -13.345 -3.921) 15.900 8.315 ( 2.158 3.739 4.867) 6.505 9.120 ( -1.542 -2.670 -2.811) 4.173 9.541 ( -0.848 -1.470 -2.746) 3.228 11.110 ( 8.081 13.997 -0.524) 16.171 14.932 ( -3.741 -6.479 -1.225) 7.581 15.858 ( 7.555 13.086 2.423) 15.303 15.995 ( 1.521 2.634 1.357) 3.331 16.423 ( 4.631 8.021 -7.963) 12.215 16.432 ( 3.016 5.225 3.408) 6.929 17.435 ( 11.355 19.667 -5.677) 23.408 17.540 ( -2.127 -3.684 0.269) 4.263 18.488 ( -10.523 -18.226 -0.076) 21.045 18.939 ( -3.824 -6.624 1.655) 7.826 19.441 ( 1.112 1.927 -0.028) 2.225 19.536 ( 1.824 3.158 -0.831) 3.740 19.980 ( -2.781 -4.818 5.472) 7.803======================= Grid point 717 (133/136) =======================q-point: ( 0.27 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.386 ( -2.119 8.460 -3.403) 9.361 2.809 ( 2.576 20.432 -3.975) 20.974 3.706 ( -7.780 -14.297 -4.875) 16.991 4.391 ( 23.965 17.018 -3.530) 29.604 5.137 ( -4.309 2.697 5.509) 7.496 5.278 ( 4.285 -4.513 7.701) 9.901 5.980 ( 1.027 -2.210 11.734) 11.984 6.461 ( -11.118 -7.933 6.224) 15.009 6.626 ( 4.279 10.011 -3.414) 11.410 7.352 ( -9.265 -23.170 -1.316) 24.988 7.778 ( -6.030 -13.156 -5.817) 15.598 8.418 ( 2.710 8.004 3.427) 9.119 8.980 ( -14.559 6.606 -4.156) 16.519 9.580 ( 11.117 -12.259 -3.058) 16.829 11.327 ( 3.647 9.462 -0.999) 10.190 14.812 ( -0.808 -9.012 -0.386) 9.057 15.943 ( -8.927 16.264 1.707) 18.631 16.210 ( 13.683 2.961 2.337) 14.194 16.488 ( -1.880 7.436 0.107) 7.671 16.643 ( 10.387 5.193 -6.872) 13.494 17.464 ( -1.389 -4.305 -0.470) 4.548 17.760 ( 7.274 5.895 -15.471) 18.083 18.153 ( -7.972 -9.202 9.677) 15.553 18.789 ( -5.276 -7.410 2.193) 9.357 19.486 ( 1.395 2.284 0.173) 2.682 19.586 ( 0.990 1.663 -0.931) 2.147 19.899 ( -2.028 -2.961 6.750) 7.645======================= Grid point 719 (134/136) =======================q-point: ( 0.36 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 605Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.454 ( -4.876 14.368 -3.800) 15.642 2.981 ( -8.185 23.343 -2.690) 24.882 3.476 ( -0.396 -14.117 -4.349) 14.777 4.918 ( 21.944 0.323 -6.339) 22.843 5.098 ( -2.558 -1.000 5.608) 6.244 5.343 ( 5.265 4.064 4.474) 8.016 5.977 ( 1.950 -3.588 12.688) 13.329 6.095 ( -19.537 -4.613 11.444) 23.108 6.711 ( 1.152 -0.971 2.148) 2.623 7.176 ( 5.917 -10.362 -3.583) 12.459 7.579 ( -2.263 -9.883 -7.240) 12.459 8.550 ( 0.136 11.494 -0.901) 11.530 8.805 ( -12.694 7.973 -1.644) 15.080 9.635 ( 11.069 -15.998 -3.815) 19.824 11.429 ( -0.734 6.289 -1.273) 6.458 14.738 ( 2.803 -8.858 0.104) 9.292 15.947 ( -9.760 17.101 1.464) 19.745 16.425 ( 6.633 3.457 2.414) 7.859 16.503 ( -3.316 3.911 0.989) 5.222 16.840 ( 5.474 3.095 -8.673) 10.713 17.450 ( 5.586 -2.957 -3.498) 7.223 17.650 ( -6.563 -13.674 -11.190) 18.849 18.190 ( 3.688 8.132 7.877) 11.907 18.630 ( -3.571 -6.516 2.955) 7.996 19.526 ( 0.307 2.102 0.413) 2.164 19.603 ( 0.122 0.224 -0.925) 0.959 19.855 ( -0.469 -1.457 7.086) 7.249======================= Grid point 739 (135/136) =======================q-point: ( 0.27 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.586 ( 6.699 11.603 -3.678) 13.894 3.203 ( 8.593 14.884 -2.148) 17.320 3.406 ( -8.019 -13.889 -5.634) 16.999 4.681 ( 7.024 12.167 -7.434) 15.894 5.130 ( -4.674 -8.096 4.495) 10.373 5.306 ( 7.016 12.152 8.321) 16.314 5.940 ( -0.927 -1.606 13.523) 13.649 6.299 ( -5.291 -9.164 11.751) 15.813 6.627 ( -7.336 -12.706 8.490) 16.951 7.088 ( 1.260 2.183 -8.879) 9.230 7.545 ( -6.078 -10.527 -8.230) 14.679 8.604 ( 5.744 9.948 -0.280) 11.491 9.048 ( -0.547 -0.947 -5.020) 5.138 9.369 ( -4.201 -7.276 -2.410) 8.740 11.469 ( 2.729 4.726 -1.621) 5.693 14.669 ( -2.945 -5.101 0.163) 5.892 16.195 ( 3.444 5.965 0.841) 6.939 16.310 ( 5.321 9.216 4.282) 11.471 16.574 ( 0.283 0.490 4.491) 4.527 16.790 ( 5.176 8.965 -14.446) 17.772 17.384 ( -1.688 -2.924 -2.177) 4.017 17.635 ( -7.618 -13.194 -14.185) 20.817 18.197 ( 5.163 8.942 9.177) 13.815 18.629 ( -4.796 -8.306 3.050) 10.064 19.534 ( 1.365 2.364 0.259) 2.742 19.604 ( 0.061 0.106 -0.748) 0.758 19.851 ( -1.001 -1.734 8.191) 8.432======================= Grid point 741 (136/136) =======================q-point: ( 0.36 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 6.61e-05 6.61e-05 Number of triplets: 330Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.758 ( -8.671 15.019 -3.555) 17.702 3.168 ( 8.722 -15.106 -3.922) 17.879 3.403 ( -8.280 14.342 -2.767) 16.790 4.876 ( 2.338 -4.049 -5.466) 7.193 4.962 ( 3.007 -5.209 -1.347) 6.163 5.512 ( -3.727 6.456 5.967) 9.549 5.927 ( 0.646 -1.119 14.341) 14.399 6.127 ( -4.836 8.376 15.684) 18.426 6.463 ( 10.210 -17.683 12.659) 24.025 7.186 ( -3.713 6.430 -9.580) 12.120 7.400 ( 4.538 -7.861 -8.895) 12.708 8.744 ( -3.317 5.745 -5.315) 8.501 8.986 ( -6.449 11.169 -1.134) 12.947 9.309 ( 9.019 -15.621 -2.992) 18.284 11.516 ( -1.284 2.223 -1.863) 3.172 14.617 ( 1.802 -3.121 0.362) 3.622 16.237 ( -5.939 10.287 1.335) 11.954 16.467 ( -0.187 0.325 4.120) 4.137 16.536 ( 0.282 -0.488 4.849) 4.881 16.907 ( -1.788 3.098 -16.793) 17.170 17.389 ( 2.195 -3.802 -5.819) 7.289 17.431 ( 3.135 -5.431 -6.744) 9.209 18.335 ( -3.440 5.959 5.451) 8.778 18.505 ( 3.183 -5.513 3.967) 7.500 19.565 ( -0.940 1.628 0.203) 1.890 19.598 ( 0.385 -0.667 -0.493) 0.914 19.833 ( 0.350 -0.606 8.563) 8.591=================== 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 3/32670 10.0 2769.433 2769.433 1883.439 0.000 -0.000 0.000 3/32670 20.0 1283.736 1283.736 727.418 -0.000 -0.000 0.000 3/32670 30.0 673.868 673.868 308.900 0.000 -0.000 0.000 3/32670 40.0 353.452 353.452 140.833 0.000 -0.000 0.000 3/32670 50.0 214.274 214.274 76.439 0.000 -0.000 0.000 3/32670 60.0 146.301 146.301 48.363 0.000 -0.000 0.000 3/32670 70.0 108.619 108.619 34.215 0.000 -0.000 0.000 3/32670 80.0 85.603 85.603 26.181 0.000 -0.000 0.000 3/32670 90.0 70.416 70.416 21.159 0.000 -0.000 0.000 3/32670 100.0 59.748 59.748 17.769 0.000 -0.000 0.000 3/32670 110.0 51.867 51.867 15.337 0.000 -0.000 0.000 3/32670 120.0 45.807 45.807 13.508 0.000 -0.000 0.000 3/32670 130.0 40.998 40.998 12.081 0.000 -0.000 0.000 3/32670 140.0 37.086 37.086 10.935 0.000 -0.000 0.000 3/32670 150.0 33.842 33.842 9.994 0.000 -0.000 0.000 3/32670 160.0 31.108 31.108 9.207 0.000 -0.000 0.000 3/32670 170.0 28.774 28.774 8.539 0.000 -0.000 0.000 3/32670 180.0 26.760 26.760 7.964 0.000 -0.000 0.000 3/32670 190.0 25.005 25.005 7.465 0.000 -0.000 0.000 3/32670 200.0 23.464 23.464 7.027 0.000 -0.000 0.000 3/32670 210.0 22.100 22.100 6.640 0.000 -0.000 0.000 3/32670 220.0 20.886 20.886 6.294 0.000 -0.000 0.000 3/32670 230.0 19.798 19.798 5.985 0.000 -0.000 0.000 3/32670 240.0 18.818 18.818 5.706 0.000 -0.000 0.000 3/32670 250.0 17.932 17.932 5.453 0.000 -0.000 0.000 3/32670 260.0 17.126 17.126 5.222 0.000 -0.000 0.000 3/32670 270.0 16.390 16.390 5.011 0.000 -0.000 0.000 3/32670 280.0 15.716 15.716 4.817 0.000 -0.000 0.000 3/32670 290.0 15.097 15.097 4.638 0.000 -0.000 0.000 3/32670 300.0 14.525 14.525 4.473 0.000 -0.000 0.000 3/32670 310.0 13.995 13.995 4.319 0.000 -0.000 0.000 3/32670 320.0 13.504 13.504 4.176 0.000 -0.000 0.000 3/32670 330.0 13.047 13.047 4.042 0.000 -0.000 0.000 3/32670 340.0 12.620 12.620 3.917 0.000 -0.000 0.000 3/32670 350.0 12.221 12.221 3.800 0.000 -0.000 0.000 3/32670 360.0 11.848 11.848 3.690 0.000 -0.000 0.000 3/32670 370.0 11.496 11.496 3.586 0.000 -0.000 0.000 3/32670 380.0 11.166 11.166 3.488 0.000 -0.000 0.000 3/32670 390.0 10.855 10.855 3.396 0.000 -0.000 0.000 3/32670 400.0 10.560 10.560 3.308 0.000 -0.000 0.000 3/32670 410.0 10.282 10.282 3.225 0.000 -0.000 0.000 3/32670 420.0 10.018 10.018 3.146 0.000 -0.000 0.000 3/32670 430.0 9.768 9.768 3.071 0.000 -0.000 0.000 3/32670 440.0 9.531 9.531 2.999 0.000 -0.000 0.000 3/32670 450.0 9.304 9.304 2.931 0.000 -0.000 0.000 3/32670 460.0 9.089 9.089 2.866 0.000 -0.000 0.000 3/32670 470.0 8.884 8.884 2.804 0.000 -0.000 0.000 3/32670 480.0 8.687 8.687 2.744 0.000 -0.000 0.000 3/32670 490.0 8.500 8.500 2.687 0.000 -0.000 0.000 3/32670 500.0 8.321 8.321 2.633 0.000 -0.000 0.000 3/32670 510.0 8.149 8.149 2.580 0.000 -0.000 0.000 3/32670 520.0 7.984 7.984 2.530 0.000 -0.000 0.000 3/32670 530.0 7.826 7.826 2.482 0.000 -0.000 0.000 3/32670 540.0 7.674 7.674 2.435 0.000 -0.000 0.000 3/32670 550.0 7.528 7.528 2.390 0.000 -0.000 0.000 3/32670 560.0 7.388 7.388 2.347 0.000 -0.000 0.000 3/32670 570.0 7.253 7.253 2.305 0.000 -0.000 0.000 3/32670 580.0 7.122 7.122 2.265 0.000 -0.000 0.000 3/32670 590.0 6.997 6.997 2.227 0.000 -0.000 0.000 3/32670 600.0 6.876 6.876 2.189 0.000 -0.000 0.000 3/32670 610.0 6.759 6.759 2.153 0.000 -0.000 0.000 3/32670 620.0 6.646 6.646 2.118 0.000 -0.000 0.000 3/32670 630.0 6.537 6.537 2.084 0.000 -0.000 0.000 3/32670 640.0 6.431 6.431 2.051 0.000 -0.000 0.000 3/32670 650.0 6.329 6.329 2.019 0.000 -0.000 0.000 3/32670 660.0 6.230 6.230 1.989 0.000 -0.000 0.000 3/32670 670.0 6.134 6.134 1.959 0.000 -0.000 0.000 3/32670 680.0 6.041 6.041 1.930 0.000 -0.000 0.000 3/32670 690.0 5.951 5.951 1.902 0.000 -0.000 0.000 3/32670 700.0 5.864 5.864 1.874 0.000 -0.000 0.000 3/32670 710.0 5.779 5.779 1.848 0.000 -0.000 0.000 3/32670 720.0 5.697 5.697 1.822 0.000 -0.000 0.000 3/32670 730.0 5.617 5.617 1.797 0.000 -0.000 0.000 3/32670 740.0 5.539 5.539 1.773 0.000 -0.000 0.000 3/32670 750.0 5.463 5.463 1.749 0.000 -0.000 0.000 3/32670 760.0 5.390 5.390 1.726 0.000 -0.000 0.000 3/32670 770.0 5.318 5.318 1.703 0.000 -0.000 0.000 3/32670 780.0 5.248 5.248 1.682 0.000 -0.000 0.000 3/32670 790.0 5.180 5.180 1.660 0.000 -0.000 0.000 3/32670 800.0 5.114 5.114 1.639 0.000 -0.000 0.000 3/32670 810.0 5.050 5.050 1.619 0.000 -0.000 0.000 3/32670 820.0 4.987 4.987 1.599 0.000 -0.000 0.000 3/32670 830.0 4.926 4.926 1.580 0.000 -0.000 0.000 3/32670 840.0 4.866 4.866 1.561 0.000 -0.000 0.000 3/32670 850.0 4.808 4.808 1.543 0.000 -0.000 0.000 3/32670 860.0 4.751 4.751 1.525 0.000 -0.000 0.000 3/32670 870.0 4.695 4.695 1.507 0.000 -0.000 0.000 3/32670 880.0 4.641 4.641 1.490 0.000 -0.000 0.000 3/32670 890.0 4.588 4.588 1.473 0.000 -0.000 0.000 3/32670 900.0 4.536 4.536 1.457 0.000 -0.000 0.000 3/32670 910.0 4.486 4.486 1.441 0.000 -0.000 0.000 3/32670 920.0 4.436 4.436 1.425 0.000 -0.000 0.000 3/32670 930.0 4.388 4.388 1.410 0.000 -0.000 0.000 3/32670 940.0 4.340 4.340 1.395 0.000 -0.000 0.000 3/32670 950.0 4.294 4.294 1.380 0.000 -0.000 0.000 3/32670 960.0 4.249 4.249 1.366 0.000 -0.000 0.000 3/32670 970.0 4.204 4.204 1.352 0.000 -0.000 0.000 3/32670 980.0 4.161 4.161 1.338 0.000 -0.000 0.000 3/32670 990.0 4.118 4.118 1.324 0.000 -0.000 0.000 3/32670 1000.0 4.076 4.076 1.311 0.000 -0.000 0.000 3/32670Thermal conductivity related properties were written into "kappa-m111110.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-07 23:14:00]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|