# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/671e6451-894b-4d17-8282-b56169079e41/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 YZnPO / R-3m (166) / materials id 12509](https://mdr.nims.go.jp/datasets/962d1497-2024-4ebc-a4fe-cdf599e87a81) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-08 00:07:49]-------------------------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 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333]Spacegroup: R-3m (166)Number of symmetry operations in supercell: 144------------------------------ primitive cell ------------------------------Lattice vectors: a 1.924633535934412 1.111187690063112 9.992416946666655 b -1.924633535934409 1.111187690063112 9.992416946666655 c 0.000000000000002 -2.222375380126228 9.992416946666655Atomic positions (fractional): *1 O 0.69475369345917 0.69475369345917 0.69475369345917 15.999 2 O 0.30524630654083 0.30524630654083 0.30524630654083 15.999 *3 P 0.11173195828588 0.11173195828588 0.11173195828588 30.974 4 P 0.88826804171412 0.88826804171412 0.88826804171412 30.974 *5 Zn 0.80413729100117 0.80413729100117 0.80413729100117 65.380 6 Zn 0.19586270899883 0.19586270899883 0.19586270899883 65.380 *7 Y 0.62015064450210 0.62015064450211 0.62015064450210 88.906 8 Y 0.37984935549789 0.37984935549790 0.37984935549789 88.906-------------------------------- unit cell ---------------------------------Lattice vectors: a 3.849267071868821 0.000000000000000 0.000000000000000 b -1.924633535934411 3.333563070189340 0.000000000000000 c 0.000000000000000 0.000000000000000 29.977250839999996Atomic positions (fractional): *1 O 0.66666666666667 0.33333333333333 0.02808702679251 15.999 > 1 2 O 0.00000000000000 0.00000000000000 0.30524630654083 15.999 > 2 3 O 0.33333333333333 0.66666666666667 0.36142036012584 15.999 > 1 4 O 0.66666666666667 0.33333333333333 0.63857963987416 15.999 > 2 5 O 0.00000000000000 0.00000000000000 0.69475369345917 15.999 > 1 6 O 0.33333333333333 0.66666666666667 0.97191297320749 15.999 > 2 *7 P 0.00000000000000 0.00000000000000 0.11173195828588 30.974 > 3 8 P 0.66666666666667 0.33333333333333 0.22160137504745 30.974 > 4 9 P 0.66666666666667 0.33333333333333 0.44506529161921 30.974 > 3 10 P 0.33333333333333 0.66666666666667 0.55493470838078 30.974 > 4 11 P 0.33333333333333 0.66666666666667 0.77839862495255 30.974 > 3 12 P 0.00000000000000 0.00000000000000 0.88826804171412 30.974 > 4 *13 Zn 0.66666666666667 0.33333333333333 0.13747062433450 65.380 > 5 14 Zn 0.00000000000000 0.00000000000000 0.19586270899883 65.380 > 6 15 Zn 0.33333333333333 0.66666666666667 0.47080395766784 65.380 > 5 16 Zn 0.66666666666667 0.33333333333333 0.52919604233216 65.380 > 6 17 Zn 0.00000000000000 0.00000000000000 0.80413729100117 65.380 > 5 18 Zn 0.33333333333333 0.66666666666667 0.86252937566550 65.380 > 6 *19 Y 0.33333333333333 0.66666666666667 0.28681731116877 88.906 > 7 20 Y 0.33333333333333 0.66666666666667 0.04651602216456 88.906 > 8 21 Y 0.00000000000000 0.00000000000000 0.62015064450211 88.906 > 7 22 Y 0.00000000000000 0.00000000000000 0.37984935549789 88.906 > 8 23 Y 0.66666666666667 0.33333333333333 0.95348397783544 88.906 > 7 24 Y 0.66666666666667 0.33333333333333 0.71318268883123 88.906 > 8-------------------------------- super cell --------------------------------Lattice vectors: a 7.698534143737642 0.000000000000000 0.000000000000000 b -3.849267071868822 6.667126140378680 0.000000000000000 c 0.000000000000000 0.000000000000000 29.977250839999996Atomic positions (fractional): *1 O 0.33333333333333 0.16666666666667 0.02808702679251 15.999 > 1 2 O 0.83333333333333 0.16666666666667 0.02808702679251 15.999 > 1 3 O 0.33333333333333 0.66666666666667 0.02808702679251 15.999 > 1 4 O 0.83333333333333 0.66666666666667 0.02808702679251 15.999 > 1 5 O 0.00000000000000 0.00000000000000 0.30524630654083 15.999 > 2 6 O 0.50000000000000 0.00000000000000 0.30524630654083 15.999 > 2 7 O 0.00000000000000 0.50000000000000 0.30524630654083 15.999 > 2 8 O 0.50000000000000 0.50000000000000 0.30524630654083 15.999 > 2 9 O 0.16666666666667 0.33333333333333 0.36142036012584 15.999 > 1 10 O 0.66666666666667 0.33333333333333 0.36142036012584 15.999 > 1 11 O 0.16666666666667 0.83333333333333 0.36142036012584 15.999 > 1 12 O 0.66666666666667 0.83333333333333 0.36142036012584 15.999 > 1 13 O 0.33333333333333 0.16666666666667 0.63857963987416 15.999 > 2 14 O 0.83333333333333 0.16666666666667 0.63857963987416 15.999 > 2 15 O 0.33333333333333 0.66666666666667 0.63857963987416 15.999 > 2 16 O 0.83333333333333 0.66666666666667 0.63857963987416 15.999 > 2 17 O 0.00000000000000 0.00000000000000 0.69475369345917 15.999 > 1 18 O 0.50000000000000 0.00000000000000 0.69475369345917 15.999 > 1 19 O 0.00000000000000 0.50000000000000 0.69475369345917 15.999 > 1 20 O 0.50000000000000 0.50000000000000 0.69475369345917 15.999 > 1 21 O 0.16666666666667 0.33333333333333 0.97191297320749 15.999 > 2 22 O 0.66666666666667 0.33333333333333 0.97191297320749 15.999 > 2 23 O 0.16666666666667 0.83333333333333 0.97191297320749 15.999 > 2 24 O 0.66666666666667 0.83333333333333 0.97191297320749 15.999 > 2 *25 P 0.00000000000000 0.00000000000000 0.11173195828588 30.974 > 3 26 P 0.50000000000000 0.00000000000000 0.11173195828588 30.974 > 3 27 P 0.00000000000000 0.50000000000000 0.11173195828588 30.974 > 3 28 P 0.50000000000000 0.50000000000000 0.11173195828588 30.974 > 3 29 P 0.33333333333333 0.16666666666667 0.22160137504745 30.974 > 4 30 P 0.83333333333333 0.16666666666667 0.22160137504745 30.974 > 4 31 P 0.33333333333333 0.66666666666667 0.22160137504745 30.974 > 4 32 P 0.83333333333333 0.66666666666667 0.22160137504745 30.974 > 4 33 P 0.33333333333333 0.16666666666667 0.44506529161921 30.974 > 3 34 P 0.83333333333333 0.16666666666667 0.44506529161921 30.974 > 3 35 P 0.33333333333333 0.66666666666667 0.44506529161921 30.974 > 3 36 P 0.83333333333333 0.66666666666667 0.44506529161921 30.974 > 3 37 P 0.16666666666667 0.33333333333333 0.55493470838078 30.974 > 4 38 P 0.66666666666667 0.33333333333333 0.55493470838078 30.974 > 4 39 P 0.16666666666667 0.83333333333333 0.55493470838078 30.974 > 4 40 P 0.66666666666667 0.83333333333333 0.55493470838078 30.974 > 4 41 P 0.16666666666667 0.33333333333333 0.77839862495255 30.974 > 3 42 P 0.66666666666667 0.33333333333333 0.77839862495255 30.974 > 3 43 P 0.16666666666667 0.83333333333333 0.77839862495255 30.974 > 3 44 P 0.66666666666667 0.83333333333333 0.77839862495255 30.974 > 3 45 P 0.00000000000000 0.00000000000000 0.88826804171412 30.974 > 4 46 P 0.50000000000000 0.00000000000000 0.88826804171412 30.974 > 4 47 P 0.00000000000000 0.50000000000000 0.88826804171412 30.974 > 4 48 P 0.50000000000000 0.50000000000000 0.88826804171412 30.974 > 4 *49 Zn 0.33333333333333 0.16666666666667 0.13747062433450 65.380 > 5 50 Zn 0.83333333333333 0.16666666666667 0.13747062433450 65.380 > 5 51 Zn 0.33333333333333 0.66666666666667 0.13747062433450 65.380 > 5 52 Zn 0.83333333333333 0.66666666666667 0.13747062433450 65.380 > 5 53 Zn 0.00000000000000 0.00000000000000 0.19586270899883 65.380 > 6 54 Zn 0.50000000000000 0.00000000000000 0.19586270899883 65.380 > 6 55 Zn 0.00000000000000 0.50000000000000 0.19586270899883 65.380 > 6 56 Zn 0.50000000000000 0.50000000000000 0.19586270899883 65.380 > 6 57 Zn 0.16666666666667 0.33333333333333 0.47080395766784 65.380 > 5 58 Zn 0.66666666666667 0.33333333333333 0.47080395766784 65.380 > 5 59 Zn 0.16666666666667 0.83333333333333 0.47080395766784 65.380 > 5 60 Zn 0.66666666666667 0.83333333333333 0.47080395766784 65.380 > 5 61 Zn 0.33333333333333 0.16666666666667 0.52919604233216 65.380 > 6 62 Zn 0.83333333333333 0.16666666666667 0.52919604233216 65.380 > 6 63 Zn 0.33333333333333 0.66666666666667 0.52919604233216 65.380 > 6 64 Zn 0.83333333333333 0.66666666666667 0.52919604233216 65.380 > 6 65 Zn 0.00000000000000 0.00000000000000 0.80413729100117 65.380 > 5 66 Zn 0.50000000000000 0.00000000000000 0.80413729100117 65.380 > 5 67 Zn 0.00000000000000 0.50000000000000 0.80413729100117 65.380 > 5 68 Zn 0.50000000000000 0.50000000000000 0.80413729100117 65.380 > 5 69 Zn 0.16666666666667 0.33333333333333 0.86252937566550 65.380 > 6 70 Zn 0.66666666666667 0.33333333333333 0.86252937566550 65.380 > 6 71 Zn 0.16666666666667 0.83333333333333 0.86252937566550 65.380 > 6 72 Zn 0.66666666666667 0.83333333333333 0.86252937566550 65.380 > 6 *73 Y 0.16666666666667 0.33333333333333 0.28681731116877 88.906 > 7 74 Y 0.66666666666667 0.33333333333333 0.28681731116877 88.906 > 7 75 Y 0.16666666666667 0.83333333333333 0.28681731116877 88.906 > 7 76 Y 0.66666666666667 0.83333333333333 0.28681731116877 88.906 > 7 77 Y 0.16666666666667 0.33333333333333 0.04651602216456 88.906 > 8 78 Y 0.66666666666667 0.33333333333333 0.04651602216456 88.906 > 8 79 Y 0.16666666666667 0.83333333333333 0.04651602216456 88.906 > 8 80 Y 0.66666666666667 0.83333333333333 0.04651602216456 88.906 > 8 81 Y 0.00000000000000 0.00000000000000 0.62015064450211 88.906 > 7 82 Y 0.50000000000000 0.00000000000000 0.62015064450211 88.906 > 7 83 Y 0.00000000000000 0.50000000000000 0.62015064450211 88.906 > 7 84 Y 0.50000000000000 0.50000000000000 0.62015064450211 88.906 > 7 85 Y 0.00000000000000 0.00000000000000 0.37984935549789 88.906 > 8 86 Y 0.50000000000000 0.00000000000000 0.37984935549789 88.906 > 8 87 Y 0.00000000000000 0.50000000000000 0.37984935549789 88.906 > 8 88 Y 0.50000000000000 0.50000000000000 0.37984935549789 88.906 > 8 89 Y 0.33333333333333 0.16666666666667 0.95348397783544 88.906 > 7 90 Y 0.83333333333333 0.16666666666667 0.95348397783544 88.906 > 7 91 Y 0.33333333333333 0.66666666666667 0.95348397783544 88.906 > 7 92 Y 0.83333333333333 0.66666666666667 0.95348397783544 88.906 > 7 93 Y 0.33333333333333 0.16666666666667 0.71318268883123 88.906 > 8 94 Y 0.83333333333333 0.16666666666667 0.71318268883123 88.906 > 8 95 Y 0.33333333333333 0.66666666666667 0.71318268883123 88.906 > 8 96 Y 0.83333333333333 0.66666666666667 0.71318268883123 88.906 > 8----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 10.0446374 0.0000000 0.0000000 0.0000000 10.0446374 0.0000000 0.0000000 0.0000000 7.9250443-------------------------- Born effective charges -------------------------- 1 O -2.6519785 0.0000000 0.0000000 0.0000000 -2.6519785 0.0000000 0.0000000 0.0000000 -4.0156110 2 O -2.6519785 0.0000000 0.0000000 0.0000000 -2.6519785 0.0000000 0.0000000 0.0000000 -4.0156110 3 P -3.0679756 0.0000000 0.0000000 0.0000000 -3.0679756 0.0000000 0.0000000 0.0000000 -2.4392833 4 P -3.0679756 0.0000000 0.0000000 0.0000000 -3.0679756 0.0000000 0.0000000 0.0000000 -2.4392833 5 Zn 1.8777234 0.0000000 0.0000000 0.0000000 1.8777234 0.0000000 0.0000000 0.0000000 1.1878470 6 Zn 1.8777234 0.0000000 0.0000000 0.0000000 1.8777234 0.0000000 0.0000000 0.0000000 1.1878470 7 Y 3.8422307 0.0000000 0.0000000 0.0000000 3.8422307 0.0000000 0.0000000 0.0000000 5.2670473 8 Y 3.8422307 0.0000000 0.0000000 0.0000000 3.8422307 0.0000000 0.0000000 0.0000000 5.2670473----------------------------------------------------------------------------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: 288/288Permutation basis: 4128/4128Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 376Number of blocks in projector: 512Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 3--- Eigsh_solver_block: 1 / 3 ---Block_size: 168Use standard eigh solver.--- Eigsh_solver_block: 2 / 3 ---Block_size: 112Use standard eigh solver.--- Eigsh_solver_block: 3 / 3 ---Block_size: 96Use standard eigh solver.Tree of FC basis block matrices:- (376, 368), data: False|-- (96, 96), data: True|-- (112, 108), data: True|-- (168, 164), data: True-----Solver_atoms: 1 -- 96 / 96Time (Solver_compr_matrix_reshape): 0.009Solver_block: 80 / 80 - Time: 0.233Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.243--------------------------------- Symfc end --------------------------------Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 288/288Permutation basis: 4128/4128Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 376Number of blocks in projector: 512Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 3--- Eigsh_solver_block: 1 / 3 ---Block_size: 168Use standard eigh solver.--- Eigsh_solver_block: 2 / 3 ---Block_size: 112Use standard eigh solver.--- Eigsh_solver_block: 3 / 3 ---Block_size: 96Use standard eigh solver.Tree of FC basis block matrices:- (376, 368), data: False|-- (96, 96), data: True|-- (112, 108), data: True|-- (168, 164), data: TrueMax drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) Force constants are written into "force_constants.hdf5".---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d)----------------------------------------------------------------------------Summary of calculation was written in "phonopy.yaml".-------------------------[time 2026-01-08 00:07:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 00:07:54]-------------------------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 1]Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333]Spacegroup: R-3m (166)------------------------------ primitive cell ------------------------------Lattice vectors: a 1.924633535934412 1.111187690063112 9.992416946666655 b -1.924633535934409 1.111187690063112 9.992416946666655 c 0.000000000000002 -2.222375380126228 9.992416946666655Atomic positions (fractional): 1 O 0.69475369345917 0.69475369345917 0.69475369345917 15.999 2 O 0.30524630654083 0.30524630654083 0.30524630654083 15.999 3 P 0.11173195828588 0.11173195828588 0.11173195828588 30.974 4 P 0.88826804171412 0.88826804171412 0.88826804171412 30.974 5 Zn 0.80413729100117 0.80413729100117 0.80413729100117 65.380 6 Zn 0.19586270899883 0.19586270899883 0.19586270899883 65.380 7 Y 0.62015064450210 0.62015064450211 0.62015064450210 88.906 8 Y 0.37984935549789 0.37984935549790 0.37984935549789 88.906-------------------------------- supercell ---------------------------------Lattice vectors: a 7.698534143737642 0.000000000000000 0.000000000000000 b -3.849267071868822 6.667126140378680 0.000000000000000 c 0.000000000000000 0.000000000000000 29.977250839999996Atomic positions (fractional): 1 O 0.33333333333333 0.16666666666667 0.02808702679251 15.999 > 1 2 O 0.83333333333333 0.16666666666667 0.02808702679251 15.999 > 1 3 O 0.33333333333333 0.66666666666667 0.02808702679251 15.999 > 1 4 O 0.83333333333333 0.66666666666667 0.02808702679251 15.999 > 1 5 O 0.00000000000000 0.00000000000000 0.30524630654083 15.999 > 5 6 O 0.50000000000000 0.00000000000000 0.30524630654083 15.999 > 5 7 O 0.00000000000000 0.50000000000000 0.30524630654083 15.999 > 5 8 O 0.50000000000000 0.50000000000000 0.30524630654083 15.999 > 5 9 O 0.16666666666667 0.33333333333333 0.36142036012584 15.999 > 1 10 O 0.66666666666667 0.33333333333333 0.36142036012584 15.999 > 1 11 O 0.16666666666667 0.83333333333333 0.36142036012584 15.999 > 1 12 O 0.66666666666667 0.83333333333333 0.36142036012584 15.999 > 1 13 O 0.33333333333333 0.16666666666667 0.63857963987416 15.999 > 5 14 O 0.83333333333333 0.16666666666667 0.63857963987416 15.999 > 5 15 O 0.33333333333333 0.66666666666667 0.63857963987416 15.999 > 5 16 O 0.83333333333333 0.66666666666667 0.63857963987416 15.999 > 5 17 O 0.00000000000000 0.00000000000000 0.69475369345917 15.999 > 1 18 O 0.50000000000000 0.00000000000000 0.69475369345917 15.999 > 1 19 O 0.00000000000000 0.50000000000000 0.69475369345917 15.999 > 1 20 O 0.50000000000000 0.50000000000000 0.69475369345917 15.999 > 1 21 O 0.16666666666667 0.33333333333333 0.97191297320749 15.999 > 5 22 O 0.66666666666667 0.33333333333333 0.97191297320749 15.999 > 5 23 O 0.16666666666667 0.83333333333333 0.97191297320749 15.999 > 5 24 O 0.66666666666667 0.83333333333333 0.97191297320749 15.999 > 5 25 P 0.00000000000000 0.00000000000000 0.11173195828588 30.974 > 25 26 P 0.50000000000000 0.00000000000000 0.11173195828588 30.974 > 25 27 P 0.00000000000000 0.50000000000000 0.11173195828588 30.974 > 25 28 P 0.50000000000000 0.50000000000000 0.11173195828588 30.974 > 25 29 P 0.33333333333333 0.16666666666667 0.22160137504745 30.974 > 29 30 P 0.83333333333333 0.16666666666667 0.22160137504745 30.974 > 29 31 P 0.33333333333333 0.66666666666667 0.22160137504745 30.974 > 29 32 P 0.83333333333333 0.66666666666667 0.22160137504745 30.974 > 29 33 P 0.33333333333333 0.16666666666667 0.44506529161921 30.974 > 25 34 P 0.83333333333333 0.16666666666667 0.44506529161921 30.974 > 25 35 P 0.33333333333333 0.66666666666667 0.44506529161921 30.974 > 25 36 P 0.83333333333333 0.66666666666667 0.44506529161921 30.974 > 25 37 P 0.16666666666667 0.33333333333333 0.55493470838078 30.974 > 29 38 P 0.66666666666667 0.33333333333333 0.55493470838078 30.974 > 29 39 P 0.16666666666667 0.83333333333333 0.55493470838078 30.974 > 29 40 P 0.66666666666667 0.83333333333333 0.55493470838078 30.974 > 29 41 P 0.16666666666667 0.33333333333333 0.77839862495255 30.974 > 25 42 P 0.66666666666667 0.33333333333333 0.77839862495255 30.974 > 25 43 P 0.16666666666667 0.83333333333333 0.77839862495255 30.974 > 25 44 P 0.66666666666667 0.83333333333333 0.77839862495255 30.974 > 25 45 P 0.00000000000000 0.00000000000000 0.88826804171412 30.974 > 29 46 P 0.50000000000000 0.00000000000000 0.88826804171412 30.974 > 29 47 P 0.00000000000000 0.50000000000000 0.88826804171412 30.974 > 29 48 P 0.50000000000000 0.50000000000000 0.88826804171412 30.974 > 29 49 Zn 0.33333333333333 0.16666666666667 0.13747062433450 65.380 > 49 50 Zn 0.83333333333333 0.16666666666667 0.13747062433450 65.380 > 49 51 Zn 0.33333333333333 0.66666666666667 0.13747062433450 65.380 > 49 52 Zn 0.83333333333333 0.66666666666667 0.13747062433450 65.380 > 49 53 Zn 0.00000000000000 0.00000000000000 0.19586270899883 65.380 > 53 54 Zn 0.50000000000000 0.00000000000000 0.19586270899883 65.380 > 53 55 Zn 0.00000000000000 0.50000000000000 0.19586270899883 65.380 > 53 56 Zn 0.50000000000000 0.50000000000000 0.19586270899883 65.380 > 53 57 Zn 0.16666666666667 0.33333333333333 0.47080395766784 65.380 > 49 58 Zn 0.66666666666667 0.33333333333333 0.47080395766784 65.380 > 49 59 Zn 0.16666666666667 0.83333333333333 0.47080395766784 65.380 > 49 60 Zn 0.66666666666667 0.83333333333333 0.47080395766784 65.380 > 49 61 Zn 0.33333333333333 0.16666666666667 0.52919604233216 65.380 > 53 62 Zn 0.83333333333333 0.16666666666667 0.52919604233216 65.380 > 53 63 Zn 0.33333333333333 0.66666666666667 0.52919604233216 65.380 > 53 64 Zn 0.83333333333333 0.66666666666667 0.52919604233216 65.380 > 53 65 Zn 0.00000000000000 0.00000000000000 0.80413729100117 65.380 > 49 66 Zn 0.50000000000000 0.00000000000000 0.80413729100117 65.380 > 49 67 Zn 0.00000000000000 0.50000000000000 0.80413729100117 65.380 > 49 68 Zn 0.50000000000000 0.50000000000000 0.80413729100117 65.380 > 49 69 Zn 0.16666666666667 0.33333333333333 0.86252937566550 65.380 > 53 70 Zn 0.66666666666667 0.33333333333333 0.86252937566550 65.380 > 53 71 Zn 0.16666666666667 0.83333333333333 0.86252937566550 65.380 > 53 72 Zn 0.66666666666667 0.83333333333333 0.86252937566550 65.380 > 53 73 Y 0.16666666666667 0.33333333333333 0.28681731116877 88.906 > 73 74 Y 0.66666666666667 0.33333333333333 0.28681731116877 88.906 > 73 75 Y 0.16666666666667 0.83333333333333 0.28681731116877 88.906 > 73 76 Y 0.66666666666667 0.83333333333333 0.28681731116877 88.906 > 73 77 Y 0.16666666666667 0.33333333333333 0.04651602216456 88.906 > 77 78 Y 0.66666666666667 0.33333333333333 0.04651602216456 88.906 > 77 79 Y 0.16666666666667 0.83333333333333 0.04651602216456 88.906 > 77 80 Y 0.66666666666667 0.83333333333333 0.04651602216456 88.906 > 77 81 Y 0.00000000000000 0.00000000000000 0.62015064450211 88.906 > 73 82 Y 0.50000000000000 0.00000000000000 0.62015064450211 88.906 > 73 83 Y 0.00000000000000 0.50000000000000 0.62015064450211 88.906 > 73 84 Y 0.50000000000000 0.50000000000000 0.62015064450211 88.906 > 73 85 Y 0.00000000000000 0.00000000000000 0.37984935549789 88.906 > 77 86 Y 0.50000000000000 0.00000000000000 0.37984935549789 88.906 > 77 87 Y 0.00000000000000 0.50000000000000 0.37984935549789 88.906 > 77 88 Y 0.50000000000000 0.50000000000000 0.37984935549789 88.906 > 77 89 Y 0.33333333333333 0.16666666666667 0.95348397783544 88.906 > 73 90 Y 0.83333333333333 0.16666666666667 0.95348397783544 88.906 > 73 91 Y 0.33333333333333 0.66666666666667 0.95348397783544 88.906 > 73 92 Y 0.83333333333333 0.66666666666667 0.95348397783544 88.906 > 73 93 Y 0.33333333333333 0.16666666666667 0.71318268883123 88.906 > 77 94 Y 0.83333333333333 0.16666666666667 0.71318268883123 88.906 > 77 95 Y 0.33333333333333 0.66666666666667 0.71318268883123 88.906 > 77 96 Y 0.83333333333333 0.66666666666667 0.71318268883123 88.906 > 77----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 10.0446374 0.0000000 0.0000000 0.0000000 10.0446374 0.0000000 0.0000000 0.0000000 7.9250443-------------------------- Born effective charges -------------------------- 1 O -2.6519785 0.0000000 0.0000000 0.0000000 -2.6519785 0.0000000 0.0000000 0.0000000 -4.0156110 2 O -2.6519785 0.0000000 0.0000000 0.0000000 -2.6519785 0.0000000 0.0000000 0.0000000 -4.0156110 3 P -3.0679756 0.0000000 0.0000000 0.0000000 -3.0679756 0.0000000 0.0000000 0.0000000 -2.4392833 4 P -3.0679756 0.0000000 0.0000000 0.0000000 -3.0679756 0.0000000 0.0000000 0.0000000 -2.4392833 5 Zn 1.8777234 0.0000000 0.0000000 0.0000000 1.8777234 0.0000000 0.0000000 0.0000000 1.1878470 6 Zn 1.8777234 0.0000000 0.0000000 0.0000000 1.8777234 0.0000000 0.0000000 0.0000000 1.1878470 7 Y 3.8422307 0.0000000 0.0000000 0.0000000 3.8422307 0.0000000 0.0000000 0.0000000 5.2670473 8 Y 3.8422307 0.0000000 0.0000000 0.0000000 3.8422307 0.0000000 0.0000000 0.0000000 5.2670473----------------------------------------------------------------------------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[ 25, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 49, 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]Expanding fc3.Symmetrizing fc3 by traditional approach (N=3).Symmetrizing fc2 by traditional approach (N=3).Max drift of fc3: -0.00000019 (yzy) -0.00000019 (yzy) -0.00000019 (yyz)fc3 was written into "fc3.hdf5".Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) fc2 was written into "fc2.hdf5".--------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperatures: 0.0 300.0 Cutoff frequency: 0.01Frequency conversion factor to THz: 15.63330----------- None of ph-ph interaction calculation was performed. -----------Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 00:08:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 00:08:01]-------------------------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 1]Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333]Spacegroup: R-3m (166)------------------------------ primitive cell ------------------------------Lattice vectors: a 1.924633535934412 1.111187690063112 9.992416946666655 b -1.924633535934409 1.111187690063112 9.992416946666655 c 0.000000000000002 -2.222375380126228 9.992416946666655Atomic positions (fractional): 1 O 0.69475369345917 0.69475369345917 0.69475369345917 15.999 2 O 0.30524630654083 0.30524630654083 0.30524630654083 15.999 3 P 0.11173195828588 0.11173195828588 0.11173195828588 30.974 4 P 0.88826804171412 0.88826804171412 0.88826804171412 30.974 5 Zn 0.80413729100117 0.80413729100117 0.80413729100117 65.380 6 Zn 0.19586270899883 0.19586270899883 0.19586270899883 65.380 7 Y 0.62015064450210 0.62015064450211 0.62015064450210 88.906 8 Y 0.37984935549789 0.37984935549790 0.37984935549789 88.906-------------------------------- supercell ---------------------------------Lattice vectors: a 7.698534143737642 0.000000000000000 0.000000000000000 b -3.849267071868822 6.667126140378680 0.000000000000000 c 0.000000000000000 0.000000000000000 29.977250839999996Atomic positions (fractional): 1 O 0.33333333333333 0.16666666666667 0.02808702679251 15.999 > 1 2 O 0.83333333333333 0.16666666666667 0.02808702679251 15.999 > 1 3 O 0.33333333333333 0.66666666666667 0.02808702679251 15.999 > 1 4 O 0.83333333333333 0.66666666666667 0.02808702679251 15.999 > 1 5 O 0.00000000000000 0.00000000000000 0.30524630654083 15.999 > 5 6 O 0.50000000000000 0.00000000000000 0.30524630654083 15.999 > 5 7 O 0.00000000000000 0.50000000000000 0.30524630654083 15.999 > 5 8 O 0.50000000000000 0.50000000000000 0.30524630654083 15.999 > 5 9 O 0.16666666666667 0.33333333333333 0.36142036012584 15.999 > 1 10 O 0.66666666666667 0.33333333333333 0.36142036012584 15.999 > 1 11 O 0.16666666666667 0.83333333333333 0.36142036012584 15.999 > 1 12 O 0.66666666666667 0.83333333333333 0.36142036012584 15.999 > 1 13 O 0.33333333333333 0.16666666666667 0.63857963987416 15.999 > 5 14 O 0.83333333333333 0.16666666666667 0.63857963987416 15.999 > 5 15 O 0.33333333333333 0.66666666666667 0.63857963987416 15.999 > 5 16 O 0.83333333333333 0.66666666666667 0.63857963987416 15.999 > 5 17 O 0.00000000000000 0.00000000000000 0.69475369345917 15.999 > 1 18 O 0.50000000000000 0.00000000000000 0.69475369345917 15.999 > 1 19 O 0.00000000000000 0.50000000000000 0.69475369345917 15.999 > 1 20 O 0.50000000000000 0.50000000000000 0.69475369345917 15.999 > 1 21 O 0.16666666666667 0.33333333333333 0.97191297320749 15.999 > 5 22 O 0.66666666666667 0.33333333333333 0.97191297320749 15.999 > 5 23 O 0.16666666666667 0.83333333333333 0.97191297320749 15.999 > 5 24 O 0.66666666666667 0.83333333333333 0.97191297320749 15.999 > 5 25 P 0.00000000000000 0.00000000000000 0.11173195828588 30.974 > 25 26 P 0.50000000000000 0.00000000000000 0.11173195828588 30.974 > 25 27 P 0.00000000000000 0.50000000000000 0.11173195828588 30.974 > 25 28 P 0.50000000000000 0.50000000000000 0.11173195828588 30.974 > 25 29 P 0.33333333333333 0.16666666666667 0.22160137504745 30.974 > 29 30 P 0.83333333333333 0.16666666666667 0.22160137504745 30.974 > 29 31 P 0.33333333333333 0.66666666666667 0.22160137504745 30.974 > 29 32 P 0.83333333333333 0.66666666666667 0.22160137504745 30.974 > 29 33 P 0.33333333333333 0.16666666666667 0.44506529161921 30.974 > 25 34 P 0.83333333333333 0.16666666666667 0.44506529161921 30.974 > 25 35 P 0.33333333333333 0.66666666666667 0.44506529161921 30.974 > 25 36 P 0.83333333333333 0.66666666666667 0.44506529161921 30.974 > 25 37 P 0.16666666666667 0.33333333333333 0.55493470838078 30.974 > 29 38 P 0.66666666666667 0.33333333333333 0.55493470838078 30.974 > 29 39 P 0.16666666666667 0.83333333333333 0.55493470838078 30.974 > 29 40 P 0.66666666666667 0.83333333333333 0.55493470838078 30.974 > 29 41 P 0.16666666666667 0.33333333333333 0.77839862495255 30.974 > 25 42 P 0.66666666666667 0.33333333333333 0.77839862495255 30.974 > 25 43 P 0.16666666666667 0.83333333333333 0.77839862495255 30.974 > 25 44 P 0.66666666666667 0.83333333333333 0.77839862495255 30.974 > 25 45 P 0.00000000000000 0.00000000000000 0.88826804171412 30.974 > 29 46 P 0.50000000000000 0.00000000000000 0.88826804171412 30.974 > 29 47 P 0.00000000000000 0.50000000000000 0.88826804171412 30.974 > 29 48 P 0.50000000000000 0.50000000000000 0.88826804171412 30.974 > 29 49 Zn 0.33333333333333 0.16666666666667 0.13747062433450 65.380 > 49 50 Zn 0.83333333333333 0.16666666666667 0.13747062433450 65.380 > 49 51 Zn 0.33333333333333 0.66666666666667 0.13747062433450 65.380 > 49 52 Zn 0.83333333333333 0.66666666666667 0.13747062433450 65.380 > 49 53 Zn 0.00000000000000 0.00000000000000 0.19586270899883 65.380 > 53 54 Zn 0.50000000000000 0.00000000000000 0.19586270899883 65.380 > 53 55 Zn 0.00000000000000 0.50000000000000 0.19586270899883 65.380 > 53 56 Zn 0.50000000000000 0.50000000000000 0.19586270899883 65.380 > 53 57 Zn 0.16666666666667 0.33333333333333 0.47080395766784 65.380 > 49 58 Zn 0.66666666666667 0.33333333333333 0.47080395766784 65.380 > 49 59 Zn 0.16666666666667 0.83333333333333 0.47080395766784 65.380 > 49 60 Zn 0.66666666666667 0.83333333333333 0.47080395766784 65.380 > 49 61 Zn 0.33333333333333 0.16666666666667 0.52919604233216 65.380 > 53 62 Zn 0.83333333333333 0.16666666666667 0.52919604233216 65.380 > 53 63 Zn 0.33333333333333 0.66666666666667 0.52919604233216 65.380 > 53 64 Zn 0.83333333333333 0.66666666666667 0.52919604233216 65.380 > 53 65 Zn 0.00000000000000 0.00000000000000 0.80413729100117 65.380 > 49 66 Zn 0.50000000000000 0.00000000000000 0.80413729100117 65.380 > 49 67 Zn 0.00000000000000 0.50000000000000 0.80413729100117 65.380 > 49 68 Zn 0.50000000000000 0.50000000000000 0.80413729100117 65.380 > 49 69 Zn 0.16666666666667 0.33333333333333 0.86252937566550 65.380 > 53 70 Zn 0.66666666666667 0.33333333333333 0.86252937566550 65.380 > 53 71 Zn 0.16666666666667 0.83333333333333 0.86252937566550 65.380 > 53 72 Zn 0.66666666666667 0.83333333333333 0.86252937566550 65.380 > 53 73 Y 0.16666666666667 0.33333333333333 0.28681731116877 88.906 > 73 74 Y 0.66666666666667 0.33333333333333 0.28681731116877 88.906 > 73 75 Y 0.16666666666667 0.83333333333333 0.28681731116877 88.906 > 73 76 Y 0.66666666666667 0.83333333333333 0.28681731116877 88.906 > 73 77 Y 0.16666666666667 0.33333333333333 0.04651602216456 88.906 > 77 78 Y 0.66666666666667 0.33333333333333 0.04651602216456 88.906 > 77 79 Y 0.16666666666667 0.83333333333333 0.04651602216456 88.906 > 77 80 Y 0.66666666666667 0.83333333333333 0.04651602216456 88.906 > 77 81 Y 0.00000000000000 0.00000000000000 0.62015064450211 88.906 > 73 82 Y 0.50000000000000 0.00000000000000 0.62015064450211 88.906 > 73 83 Y 0.00000000000000 0.50000000000000 0.62015064450211 88.906 > 73 84 Y 0.50000000000000 0.50000000000000 0.62015064450211 88.906 > 73 85 Y 0.00000000000000 0.00000000000000 0.37984935549789 88.906 > 77 86 Y 0.50000000000000 0.00000000000000 0.37984935549789 88.906 > 77 87 Y 0.00000000000000 0.50000000000000 0.37984935549789 88.906 > 77 88 Y 0.50000000000000 0.50000000000000 0.37984935549789 88.906 > 77 89 Y 0.33333333333333 0.16666666666667 0.95348397783544 88.906 > 73 90 Y 0.83333333333333 0.16666666666667 0.95348397783544 88.906 > 73 91 Y 0.33333333333333 0.66666666666667 0.95348397783544 88.906 > 73 92 Y 0.83333333333333 0.66666666666667 0.95348397783544 88.906 > 73 93 Y 0.33333333333333 0.16666666666667 0.71318268883123 88.906 > 77 94 Y 0.83333333333333 0.16666666666667 0.71318268883123 88.906 > 77 95 Y 0.33333333333333 0.66666666666667 0.71318268883123 88.906 > 77 96 Y 0.83333333333333 0.66666666666667 0.71318268883123 88.906 > 77----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 10.0446374 0.0000000 0.0000000 0.0000000 10.0446374 0.0000000 0.0000000 0.0000000 7.9250443-------------------------- Born effective charges -------------------------- 1 O -2.6519785 0.0000000 0.0000000 0.0000000 -2.6519785 0.0000000 0.0000000 0.0000000 -4.0156110 2 O -2.6519785 0.0000000 0.0000000 0.0000000 -2.6519785 0.0000000 0.0000000 0.0000000 -4.0156110 3 P -3.0679756 0.0000000 0.0000000 0.0000000 -3.0679756 0.0000000 0.0000000 0.0000000 -2.4392833 4 P -3.0679756 0.0000000 0.0000000 0.0000000 -3.0679756 0.0000000 0.0000000 0.0000000 -2.4392833 5 Zn 1.8777234 0.0000000 0.0000000 0.0000000 1.8777234 0.0000000 0.0000000 0.0000000 1.1878470 6 Zn 1.8777234 0.0000000 0.0000000 0.0000000 1.8777234 0.0000000 0.0000000 0.0000000 1.1878470 7 Y 3.8422307 0.0000000 0.0000000 0.0000000 3.8422307 0.0000000 0.0000000 0.0000000 5.2670473 8 Y 3.8422307 0.0000000 0.0000000 0.0000000 3.8422307 0.0000000 0.0000000 0.0000000 5.2670473----------------------------------------------------------------------------fc3 was read from "fc3.hdf5".fc2 was read from "fc2.hdf5".----------------------------- Force constants ------------------------------Max drift of fc3: -0.00000019 (yzy) -0.00000019 (yzy) -0.00000019 (yyz)Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- 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 ... [ 15 15 15 ]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: 0.82, Number of G-points: 299, Lambda: 0.26Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/344) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 344Calculating 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 2.555 ( 0.000 0.000 0.000) 0.000 2.555 ( 0.000 0.000 0.000) 0.000 2.965 ( 0.000 0.000 0.000) 0.000 2.965 ( 0.000 0.000 0.000) 0.000 4.114 ( 0.000 0.000 0.000) 0.000 4.114 ( 0.000 0.000 0.000) 0.000 4.290 ( 0.000 0.000 0.000) 0.000 4.466 ( 0.000 0.000 0.000) 0.000 6.950 ( 0.000 0.000 0.000) 0.000 7.265 ( 0.000 0.000 0.000) 0.000 8.881 ( 0.000 0.000 0.000) 0.000 8.881 ( 0.000 0.000 0.000) 0.000 9.223 ( 0.000 0.000 0.000) 0.000 9.223 ( 0.000 0.000 0.000) 0.000 9.874 ( 0.000 0.000 0.000) 0.000 10.015 ( 0.000 0.000 0.000) 0.000 10.015 ( 0.000 0.000 0.000) 0.000 11.897 ( 0.000 0.000 0.000) 0.000 11.897 ( 0.000 0.000 0.000) 0.000 13.676 ( 0.000 0.000 0.000) 0.000 13.781 ( 0.000 0.000 0.000) 0.000======================= Grid point 1 (2/344) =======================q-point: ( 0.07 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.649 ( 26.993 15.584 4.660) 31.515 0.695 ( 29.398 16.973 4.053) 34.187 1.211 ( 51.155 29.534 4.775) 59.261 2.618 ( 5.273 3.044 -0.484) 6.108 2.659 ( 8.698 5.022 -5.769) 11.583 2.952 ( -1.006 -0.581 -0.163) 1.174 3.174 ( 6.959 4.018 4.117) 9.028 4.120 ( 1.221 0.705 -0.558) 1.517 4.127 ( 1.136 0.656 -0.083) 1.315 4.246 ( -3.390 -1.957 -0.805) 3.996 4.636 ( 13.692 7.905 -0.129) 15.811 6.923 ( -2.429 -1.402 0.271) 2.817 7.318 ( 2.211 1.276 11.795) 12.068 8.907 ( 2.082 1.202 0.745) 2.517 9.233 ( -0.400 -0.231 2.759) 2.798 9.237 ( 1.228 0.709 -0.511) 1.507 9.280 ( -11.542 -6.664 -3.190) 13.705 9.954 ( 4.881 2.818 -0.537) 5.662 9.963 ( -4.340 -2.505 -0.437) 5.030 11.648 ( -15.993 -9.233 -17.978) 25.773 11.920 ( 1.858 1.073 0.274) 2.163 12.348 ( -4.690 -2.708 -12.765) 13.866 13.814 ( 11.593 6.693 -5.544) 14.489 13.888 ( -1.879 -1.085 46.752) 46.803======================= Grid point 2 (3/344) =======================q-point: ( 0.13 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.251 ( 24.006 13.860 4.096) 28.021 1.365 ( 27.666 15.973 3.262) 32.112 2.359 ( 46.584 26.895 3.101) 53.880 2.773 ( 7.216 4.166 2.237) 8.627 2.873 ( 10.216 5.898 -9.099) 14.898 2.926 ( -0.431 -0.249 -3.215) 3.253 3.403 ( 11.151 6.438 8.003) 15.161 4.140 ( -4.055 -2.341 -3.347) 5.755 4.170 ( 2.711 1.565 0.011) 3.130 4.202 ( 5.250 3.031 2.523) 6.566 5.055 ( 21.817 12.596 -2.089) 25.279 6.830 ( -5.846 -3.375 -0.075) 6.751 7.426 ( 5.227 3.018 6.104) 8.584 8.951 ( -13.716 -7.919 1.643) 15.923 8.977 ( 3.708 2.141 1.454) 4.521 9.272 ( 1.706 0.985 -1.061) 2.238 9.275 ( 2.512 1.450 -3.515) 4.557 9.826 ( -7.016 -4.051 -0.424) 8.113 10.053 ( 3.564 2.058 0.644) 4.165 11.210 ( -17.558 -10.137 -9.955) 22.586 11.978 ( 3.035 1.752 0.183) 3.509 12.132 ( -11.873 -6.855 3.861) 14.243 13.945 ( 0.953 0.550 13.518) 13.562 14.121 ( 14.130 8.158 -2.512) 16.508======================= Grid point 3 (4/344) =======================q-point: ( 0.20 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.756 ( 18.615 10.748 2.603) 21.652 1.972 ( 23.951 13.828 2.069) 27.733 2.868 ( -0.659 -0.380 10.547) 10.574 3.003 ( 8.875 5.124 -10.875) 14.943 3.035 ( 7.658 4.422 -8.705) 12.409 3.324 ( 30.756 17.757 0.144) 35.514 3.714 ( 13.538 7.816 8.304) 17.701 4.081 ( 3.495 2.018 -0.329) 4.050 4.254 ( 4.459 2.574 0.202) 5.153 4.391 ( 9.984 5.764 0.610) 11.544 5.580 ( 22.612 13.055 -2.364) 26.217 6.658 ( -8.329 -4.809 -0.702) 9.643 7.573 ( 6.251 3.609 4.547) 8.531 8.692 ( -8.420 -4.861 0.312) 9.728 9.078 ( 4.478 2.585 2.331) 5.672 9.290 ( -0.675 -0.389 -1.808) 1.968 9.346 ( 4.591 2.651 -3.988) 6.633 9.668 ( -5.537 -3.197 -0.001) 6.393 10.125 ( 2.516 1.452 2.595) 3.895 10.843 ( -12.266 -7.082 -4.489) 14.857 11.860 ( -11.800 -6.813 1.623) 13.722 12.054 ( 3.413 1.970 -0.272) 3.950 13.990 ( 1.352 0.781 3.927) 4.226 14.415 ( 11.159 6.443 0.602) 12.900======================= Grid point 4 (5/344) =======================q-point: ( 0.27 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.104 ( 11.007 6.355 0.262) 12.712 2.452 ( 16.477 9.513 -0.083) 19.026 2.884 ( 0.787 0.454 8.012) 8.063 3.179 ( 7.756 4.478 -4.974) 10.244 3.200 ( 9.475 5.471 -6.572) 12.763 3.679 ( 1.817 1.049 -1.668) 2.681 3.931 ( 8.868 5.120 6.232) 11.987 4.370 ( 5.405 3.121 0.261) 6.246 4.519 ( 22.255 12.849 -5.480) 26.275 4.656 ( 16.179 9.341 6.281) 19.710 5.986 ( 9.649 5.571 -2.285) 11.374 6.526 ( 0.395 0.228 -0.106) 0.468 7.730 ( 6.618 3.821 3.913) 8.586 8.564 ( -2.882 -1.664 -1.717) 3.745 9.167 ( -1.851 -1.069 6.664) 6.999 9.221 ( -0.289 -0.167 -5.476) 5.487 9.480 ( 7.842 4.527 -4.101) 9.940 9.612 ( 0.502 0.290 -0.028) 0.580 10.185 ( 1.980 1.143 5.029) 5.524 10.630 ( -5.686 -3.283 -2.792) 7.134 11.603 ( -10.487 -6.055 -0.476) 12.119 12.130 ( 3.198 1.846 -0.807) 3.780 14.030 ( 1.772 1.023 0.640) 2.144 14.632 ( 7.392 4.268 1.756) 8.714======================= Grid point 5 (6/344) =======================q-point: ( 0.33 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.275 ( 4.429 2.557 -1.006) 5.212 2.702 ( 5.884 3.397 -2.124) 7.118 2.938 ( 2.265 1.308 5.656) 6.231 3.403 ( 8.765 5.061 -3.318) 10.651 3.415 ( 12.867 7.429 -0.616) 14.871 3.627 ( -3.416 -1.972 -0.711) 4.008 4.177 ( 10.147 5.858 4.124) 12.422 4.493 ( 4.948 2.857 0.167) 5.715 4.748 ( 5.242 3.026 -3.260) 6.875 5.145 ( 14.326 8.271 1.438) 16.605 6.053 ( 3.367 1.944 -1.740) 4.259 6.690 ( 9.258 5.345 1.781) 10.838 7.905 ( 7.893 4.557 2.815) 9.539 8.531 ( 0.063 0.036 -3.115) 3.116 9.011 ( -7.939 -4.583 1.857) 9.353 9.302 ( 3.981 2.298 -0.117) 4.598 9.654 ( 2.548 1.471 -0.245) 2.952 9.678 ( 9.574 5.527 -4.245) 11.842 10.238 ( 1.265 0.730 7.453) 7.595 10.555 ( -0.464 -0.268 -3.006) 3.053 11.372 ( -9.457 -5.460 -1.281) 10.994 12.195 ( 2.582 1.491 -1.093) 3.176 14.076 ( 2.127 1.228 -0.406) 2.490 14.769 ( 4.236 2.446 1.820) 5.219======================= Grid point 6 (7/344) =======================q-point: ( 0.40 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.334 ( 1.405 0.811 -0.795) 1.807 2.766 ( 1.027 0.593 -1.600) 1.991 2.998 ( 1.880 1.086 2.912) 3.633 3.545 ( -2.542 -1.468 0.217) 2.943 3.575 ( 6.231 3.598 -1.206) 7.296 3.725 ( 11.826 6.828 -0.021) 13.656 4.403 ( 8.712 5.030 2.933) 10.479 4.591 ( 3.359 1.939 0.062) 3.879 4.816 ( 1.734 1.001 -2.288) 3.040 5.208 ( -5.838 -3.370 -0.571) 6.765 6.278 ( 13.825 7.982 -1.940) 16.082 6.851 ( 3.740 2.159 3.396) 5.493 8.092 ( 7.318 4.225 1.348) 8.557 8.537 ( 0.775 0.447 -2.770) 2.911 8.852 ( -5.752 -3.321 1.300) 6.768 9.379 ( 2.637 1.523 0.185) 3.051 9.710 ( 2.117 1.222 -0.216) 2.453 9.874 ( 7.588 4.381 -4.177) 9.706 10.269 ( -0.001 -0.001 7.275) 7.275 10.591 ( 4.012 2.316 -2.225) 5.139 11.159 ( -8.752 -5.053 -1.290) 10.188 12.243 ( 1.679 0.969 -0.936) 2.152 14.122 ( 1.871 1.080 -0.526) 2.224 14.842 ( 1.986 1.146 1.315) 2.643======================= Grid point 7 (8/344) =======================q-point: ( 0.47 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.351 ( 0.317 0.183 -0.263) 0.451 2.772 ( 0.004 0.002 -0.508) 0.508 3.033 ( 0.683 0.394 0.860) 1.167 3.504 ( -0.948 -0.547 0.095) 1.098 3.673 ( 2.235 1.290 -0.267) 2.594 3.926 ( 4.760 2.748 0.105) 5.497 4.581 ( 5.294 3.057 1.244) 6.238 4.644 ( 1.177 0.680 0.012) 1.359 4.852 ( 2.644 1.527 -0.763) 3.147 5.019 ( -8.294 -4.789 -0.597) 9.596 6.543 ( 7.464 4.309 -1.840) 8.813 6.886 ( -0.548 -0.316 2.513) 2.591 8.219 ( 2.989 1.726 0.339) 3.468 8.547 ( 0.360 0.208 -1.070) 1.148 8.762 ( -2.076 -1.198 0.496) 2.448 9.421 ( 0.916 0.529 0.081) 1.060 9.744 ( 0.792 0.457 -0.079) 0.918 9.990 ( 2.817 1.626 -2.041) 3.840 10.275 ( -0.335 -0.194 3.030) 3.054 10.710 ( 5.407 3.122 -0.347) 6.253 10.971 ( -6.588 -3.804 -0.748) 7.644 12.268 ( 0.583 0.337 -0.367) 0.767 14.153 ( 0.762 0.440 -0.221) 0.907 14.872 ( 0.547 0.316 0.479) 0.793======================= Grid point 16 (9/344) =======================q-point: ( 0.07 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.654 ( -0.000 30.691 6.198) 31.311 0.708 ( -0.000 33.335 7.896) 34.258 1.237 ( -0.000 58.250 12.289) 59.532 2.588 ( -0.000 4.711 -8.874) 10.047 2.669 ( -0.000 10.922 -3.239) 11.392 2.977 ( 0.000 0.111 6.743) 6.744 3.154 ( -0.000 7.523 -1.290) 7.633 4.105 ( -0.000 0.034 -4.576) 4.576 4.125 ( -0.000 1.276 -0.459) 1.356 4.250 ( 0.000 -2.560 0.297) 2.578 4.636 ( -0.000 15.354 -0.622) 15.366 6.925 ( 0.000 -2.853 0.764) 2.954 7.346 ( 0.000 -1.478 19.415) 19.471 8.902 ( -0.000 2.139 -0.718) 2.256 9.192 ( -0.000 -6.578 -7.617) 10.065 9.241 ( -0.000 1.629 0.578) 1.729 9.317 ( 0.000 -6.735 6.202) 9.156 9.943 ( -0.000 4.957 -3.733) 6.205 9.968 ( 0.000 -4.817 1.188) 4.962 11.725 ( 0.000 -16.835 5.595) 17.741 11.916 ( -0.000 2.012 -0.875) 2.194 12.152 ( -0.000 4.680 -60.502) 60.682 13.786 ( -0.000 9.095 -0.135) 9.096 14.088 ( 0.000 -12.015 79.936) 80.833======================= Grid point 17 (10/344) =======================q-point: ( 0.13 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.134 ( 15.782 26.427 6.072) 31.374 1.205 ( 15.999 28.119 6.250) 32.950 2.074 ( 26.158 47.082 9.089) 54.622 2.692 ( 8.132 5.515 -12.154) 15.629 2.802 ( 2.703 10.842 -4.687) 12.117 2.982 ( -2.001 2.997 5.808) 6.835 3.321 ( 7.956 8.308 5.285) 12.659 4.106 ( 1.737 -0.572 -8.888) 9.075 4.161 ( 2.027 2.746 -0.424) 3.439 4.211 ( -1.969 -0.711 5.085) 5.499 4.917 ( 11.538 20.021 -3.167) 23.324 6.864 ( -2.892 -4.948 0.436) 5.747 7.402 ( 2.664 2.433 8.341) 9.087 8.954 ( 2.689 3.130 -0.225) 4.132 9.014 ( -5.929 -14.239 -3.205) 15.754 9.257 ( -0.591 1.411 1.803) 2.365 9.292 ( -0.460 3.315 1.460) 3.651 9.884 ( -3.457 -4.689 -0.788) 5.879 10.012 ( 3.275 2.350 -2.575) 4.783 11.427 ( -17.585 -11.128 -4.845) 21.366 11.770 ( 1.111 -10.414 -0.318) 10.478 12.241 ( 3.786 -2.036 -10.707) 11.538 13.969 ( 9.891 6.399 4.316) 12.546 14.082 ( -6.004 4.736 25.768) 26.879======================= Grid point 18 (11/344) =======================q-point: ( 0.20 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.666 ( 14.311 23.041 5.068) 27.593 1.782 ( 18.828 22.772 4.132) 29.835 2.847 ( 11.440 5.654 -11.034) 16.870 2.924 ( 3.847 8.506 3.936) 10.131 2.995 ( 8.755 15.508 -3.905) 18.231 3.057 ( 16.650 22.085 3.055) 27.827 3.590 ( 11.578 8.567 7.871) 16.413 4.072 ( -0.866 -2.082 -2.268) 3.199 4.238 ( 2.566 5.347 -0.127) 5.932 4.286 ( 7.114 4.734 0.279) 8.550 5.378 ( 17.919 19.982 -3.457) 27.062 6.723 ( -6.177 -7.259 -0.559) 9.547 7.515 ( 5.161 3.168 4.083) 7.304 8.759 ( -7.368 -9.930 0.389) 12.371 9.054 ( 3.710 4.884 0.764) 6.181 9.274 ( 1.064 1.179 0.469) 1.656 9.342 ( 0.966 4.821 -1.190) 5.059 9.762 ( -6.247 -1.792 -1.056) 6.584 10.081 ( 3.635 0.318 -0.901) 3.759 11.006 ( -16.658 -8.743 -2.157) 18.936 11.680 ( 3.764 -18.788 0.921) 19.183 12.218 ( -4.182 5.438 -2.205) 7.206 14.061 ( -3.640 4.423 10.246) 11.738 14.264 ( 11.971 6.438 0.178) 13.593======================= Grid point 19 (12/344) =======================q-point: ( 0.27 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.081 ( 7.909 18.713 2.741) 20.500 2.297 ( 15.841 16.823 1.610) 23.164 2.945 ( 0.567 5.118 4.241) 6.671 3.098 ( 4.886 6.905 -9.097) 12.422 3.139 ( 6.282 11.107 -3.285) 13.177 3.603 ( 10.808 8.557 -0.960) 13.819 3.846 ( 6.214 1.215 6.777) 9.275 4.250 ( 18.195 13.824 -0.055) 22.851 4.367 ( 5.330 9.448 -0.622) 10.866 4.508 ( 11.949 6.552 2.509) 13.856 5.856 ( 15.251 14.884 -2.753) 21.488 6.534 ( -4.952 -6.883 -0.885) 8.525 7.651 ( 6.419 2.340 2.865) 7.409 8.587 ( -3.994 -4.995 0.821) 6.448 9.174 ( 3.375 5.881 0.895) 6.839 9.302 ( -2.735 3.453 1.241) 4.576 9.418 ( 3.505 5.437 -3.553) 7.380 9.651 ( -4.690 1.158 -0.786) 4.895 10.143 ( 3.833 -0.711 1.293) 4.107 10.699 ( -9.219 -6.834 -0.100) 11.476 11.523 ( 0.533 -19.144 -0.796) 19.168 12.228 ( -3.144 9.756 -1.079) 10.307 14.066 ( -2.489 4.473 2.556) 5.721 14.507 ( 10.481 2.163 1.595) 10.820======================= Grid point 20 (13/344) =======================q-point: ( 0.33 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.321 ( 0.821 14.096 0.253) 14.122 2.626 ( 7.530 7.048 -0.980) 10.360 3.038 ( -1.615 12.538 5.778) 13.899 3.264 ( 9.069 7.226 -4.207) 12.335 3.376 ( 7.384 12.882 -3.232) 15.196 3.650 ( -2.390 -2.605 -0.968) 3.666 4.040 ( 11.280 3.229 5.071) 12.782 4.479 ( 3.842 7.165 0.234) 8.134 4.635 ( 9.564 2.854 -4.982) 11.155 4.961 ( 20.057 15.983 4.797) 26.091 6.058 ( -1.030 3.181 -2.107) 3.952 6.550 ( 10.471 1.557 1.083) 10.641 7.801 ( 7.915 1.984 2.398) 8.505 8.517 ( -0.576 -1.973 -0.494) 2.114 9.207 ( -12.059 4.991 0.075) 13.051 9.287 ( 2.517 5.792 1.167) 6.422 9.578 ( 8.130 6.659 -3.897) 11.208 9.643 ( 0.811 2.839 -0.277) 2.965 10.207 ( 3.783 -0.914 4.168) 5.703 10.543 ( -2.327 -4.942 -0.429) 5.479 11.330 ( -1.265 -17.020 -1.794) 17.161 12.284 ( -2.778 11.410 -1.049) 11.790 14.078 ( -0.654 2.960 0.126) 3.034 14.675 ( 7.704 -0.780 1.744) 7.937======================= Grid point 21 (14/344) =======================q-point: ( 0.40 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.420 ( -3.402 11.780 -0.480) 12.271 2.730 ( 2.028 0.658 -0.977) 2.345 3.138 ( -4.777 15.814 3.142) 16.816 3.489 ( 6.922 3.791 -2.995) 8.441 3.580 ( 0.686 -0.207 -0.861) 1.120 3.637 ( 6.612 12.919 1.354) 14.576 4.275 ( 10.950 2.951 3.250) 11.797 4.603 ( 2.111 6.944 0.273) 7.263 4.759 ( 4.863 0.004 -3.341) 5.900 5.261 ( 0.063 3.642 0.708) 3.711 6.138 ( 9.112 6.694 -1.034) 11.353 6.759 ( 9.048 0.255 3.698) 9.778 7.975 ( 9.087 1.682 1.263) 9.328 8.510 ( 1.194 -0.594 -1.395) 1.929 9.036 ( -12.758 5.649 0.063) 13.953 9.379 ( 1.444 5.072 0.555) 5.303 9.694 ( 1.820 2.500 -0.341) 3.112 9.786 ( 7.815 6.980 -4.094) 11.250 10.265 ( 2.072 -1.101 7.210) 7.582 10.511 ( 3.692 -3.120 -2.023) 5.240 11.136 ( -2.096 -15.066 -1.931) 15.333 12.345 ( -3.861 12.475 -0.984) 13.096 14.102 ( 0.982 1.098 -0.397) 1.526 14.771 ( 5.357 -2.833 1.269) 6.191======================= Grid point 22 (15/344) =======================q-point: ( 0.47 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.456 ( -5.268 11.141 -0.309) 12.327 2.744 ( 0.670 -1.036 -0.317) 1.274 3.199 ( -7.256 16.260 1.491) 17.867 3.485 ( 0.135 -4.159 -0.246) 4.169 3.696 ( 1.900 8.504 -1.846) 8.907 3.859 ( 5.986 5.960 1.397) 8.562 4.490 ( 9.069 3.498 1.962) 9.916 4.687 ( -0.013 5.815 0.188) 5.818 4.812 ( 2.803 0.199 -2.176) 3.554 5.146 ( -10.643 -1.399 0.177) 10.736 6.415 ( 11.929 5.919 -1.854) 13.445 6.858 ( 3.098 -3.217 5.123) 6.796 8.130 ( 7.114 -0.384 0.035) 7.124 8.528 ( 1.370 -0.205 -1.167) 1.812 8.901 ( -9.669 6.863 0.032) 11.857 9.437 ( -0.073 4.001 0.316) 4.014 9.740 ( 0.943 1.688 -0.144) 1.939 9.948 ( 4.675 4.730 -4.036) 7.779 10.280 ( -0.138 -1.841 6.081) 6.355 10.598 ( 8.530 -1.031 -0.987) 8.649 10.948 ( -2.571 -13.589 -1.588) 13.921 12.390 ( -5.506 12.897 -0.600) 14.036 14.128 ( 1.627 -0.608 -0.160) 1.745 14.816 ( 3.761 -4.142 0.443) 5.612======================= Grid point 23 (16/344) =======================q-point: (-0.47 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.466 ( -6.164 10.780 -0.021) 12.418 2.744 ( 0.767 -1.220 0.152) 1.449 3.218 ( -9.307 15.721 0.524) 18.277 3.465 ( 1.873 -3.209 0.153) 3.719 3.756 ( -3.661 6.888 -1.049) 7.871 3.942 ( 0.154 -0.798 0.151) 0.826 4.607 ( 0.049 -0.854 0.149) 0.868 4.716 ( -2.408 4.067 -0.223) 4.732 4.872 ( 0.996 -0.483 0.342) 1.159 4.987 ( -2.940 4.756 0.457) 5.610 6.571 ( 1.542 -1.158 -0.576) 2.012 6.852 ( 0.942 -4.125 2.632) 4.983 8.192 ( 2.097 -3.674 -0.719) 4.291 8.541 ( 0.602 -0.630 -0.345) 0.937 8.850 ( -5.284 9.188 0.238) 10.602 9.457 ( -1.728 2.921 0.161) 3.398 9.757 ( -0.398 0.729 -0.011) 0.830 10.016 ( -0.021 1.777 -1.541) 2.352 10.264 ( -0.289 -1.872 1.567) 2.458 10.729 ( 0.718 -2.098 -0.335) 2.242 10.800 ( 7.166 -10.793 -0.027) 12.955 12.408 ( -7.080 12.467 -0.011) 14.337 14.140 ( 1.032 -1.680 0.362) 2.004 14.826 ( 2.702 -4.893 -0.544) 5.616======================= Grid point 24 (17/344) =======================q-point: (-0.40 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.458 ( -6.850 10.064 0.289) 12.178 2.747 ( 0.773 -1.178 0.604) 1.533 3.193 ( -11.054 14.452 -0.375) 18.199 3.488 ( 3.583 -1.901 0.467) 4.083 3.702 ( -8.140 3.329 0.056) 8.795 3.851 ( -7.958 -3.244 -1.292) 8.690 4.480 ( -8.072 -6.079 -1.263) 10.184 4.685 ( -5.019 2.903 -0.316) 5.807 4.825 ( -1.425 -2.036 1.737) 3.033 5.148 ( 6.687 8.340 0.780) 10.718 6.428 ( -11.110 -7.578 2.082) 13.608 6.836 ( 0.665 -4.595 -1.535) 4.890 8.125 ( -3.347 -6.426 -1.340) 7.368 8.535 ( 0.012 -1.472 0.822) 1.686 8.902 ( -1.418 12.242 0.352) 12.329 9.437 ( -3.511 2.068 0.133) 4.077 9.740 ( -1.883 0.020 0.066) 1.884 9.971 ( -5.672 -1.258 2.583) 6.358 10.243 ( 0.245 -1.616 -4.651) 4.930 10.604 ( -2.593 -7.795 0.664) 8.242 10.958 ( 13.092 -4.253 1.243) 13.822 12.394 ( -8.232 11.224 0.494) 13.928 14.131 ( -0.276 -1.610 0.858) 1.845 14.809 ( 1.567 -5.439 -1.442) 5.841======================= Grid point 25 (18/344) =======================q-point: (-0.33 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.424 ( -8.351 8.606 0.626) 12.008 2.737 ( -1.271 -1.611 1.091) 2.324 3.121 ( -12.447 12.256 -1.860) 17.567 3.508 ( -6.228 -3.719 2.675) 7.731 3.582 ( -0.177 0.224 -0.369) 0.467 3.628 ( -13.696 -0.321 -1.495) 13.781 4.257 ( -8.728 -7.864 -2.097) 11.934 4.601 ( -7.091 1.676 -0.225) 7.290 4.775 ( -1.992 -4.211 1.529) 4.903 5.261 ( -3.787 1.435 0.782) 4.125 6.147 ( -10.367 -4.816 1.487) 11.527 6.741 ( -4.451 -7.583 -1.675) 8.951 7.963 ( -6.330 -7.061 -2.231) 9.742 8.522 ( 0.287 -1.936 1.898) 2.726 9.036 ( 0.943 14.458 -0.125) 14.489 9.378 ( -5.188 1.321 0.440) 5.372 9.695 ( -3.002 -0.299 0.064) 3.017 9.815 ( -9.975 -3.340 4.408) 11.405 10.213 ( 0.052 -2.266 -8.278) 8.583 10.528 ( 1.084 -4.999 2.755) 5.810 11.147 ( 14.039 -5.506 1.359) 15.141 12.351 ( -8.744 9.493 0.669) 12.924 14.107 ( -1.589 -0.213 1.062) 1.923 14.760 ( -0.284 -6.129 -1.997) 6.452======================= Grid point 26 (19/344) =======================q-point: (-0.27 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.321 ( -12.868 5.786 0.475) 14.117 2.634 ( -10.088 -3.247 1.346) 10.683 3.002 ( -11.518 8.108 -4.989) 14.944 3.288 ( -9.813 -3.872 2.755) 10.903 3.396 ( -13.439 0.332 2.682) 13.708 3.654 ( 4.042 0.756 0.271) 4.121 4.012 ( -9.428 -8.231 -3.312) 12.946 4.478 ( -8.133 0.288 -0.277) 8.143 4.660 ( -5.912 -6.682 2.256) 9.203 4.939 ( -25.933 -10.075 -1.734) 27.876 6.071 ( -1.878 2.448 1.579) 3.465 6.545 ( -6.049 -8.044 -0.627) 10.084 7.782 ( -5.999 -5.605 -3.155) 8.795 8.525 ( 1.926 -1.381 1.951) 3.069 9.194 ( 0.292 12.473 -3.211) 12.883 9.294 ( -5.441 1.276 2.877) 6.285 9.607 ( -9.885 -3.601 4.813) 11.569 9.645 ( -2.863 0.854 0.220) 2.996 10.167 ( -0.077 -2.973 -7.770) 8.320 10.557 ( 5.251 -1.155 3.500) 6.415 11.339 ( 15.152 -7.347 0.745) 16.856 12.289 ( -8.432 8.011 0.484) 11.640 14.080 ( -2.689 1.997 0.724) 3.426 14.662 ( -3.124 -7.048 -1.991) 7.962======================= Grid point 27 (20/344) =======================q-point: (-0.20 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.069 ( -20.834 1.821 -0.801) 20.929 2.292 ( -23.440 -5.503 0.311) 24.079 2.905 ( -5.022 4.613 -7.204) 9.920 3.146 ( -6.199 -0.405 4.733) 7.810 3.173 ( -12.668 -2.025 6.462) 14.365 3.610 ( -13.548 -5.732 1.113) 14.753 3.805 ( -4.768 -4.262 -5.338) 8.330 4.253 ( -21.711 -9.328 0.639) 23.639 4.371 ( -12.435 0.138 0.668) 12.454 4.491 ( -9.314 -6.551 -2.384) 11.634 5.870 ( -20.236 -5.799 1.342) 21.093 6.539 ( 8.648 0.973 0.383) 8.711 7.631 ( -5.567 -3.748 -3.275) 7.468 8.587 ( 6.056 0.281 0.759) 6.110 9.161 ( -6.692 1.049 -2.684) 7.286 9.303 ( -1.521 2.723 1.205) 3.343 9.446 ( -6.892 -0.924 4.682) 8.383 9.657 ( 1.187 5.338 1.110) 5.580 10.120 ( -0.283 -2.742 -5.508) 6.159 10.714 ( 10.806 3.779 4.179) 12.187 11.522 ( 15.811 -10.052 -0.959) 18.761 12.232 ( -6.834 7.698 0.126) 10.294 14.055 ( -3.809 3.926 -0.537) 5.496 14.498 ( -6.857 -7.824 -1.093) 10.461======================= Grid point 28 (21/344) =======================q-point: (-0.13 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.644 ( -27.729 -1.044 -1.444) 27.786 1.766 ( -29.911 -5.215 -0.570) 30.368 2.865 ( -5.218 3.363 -10.416) 12.125 2.912 ( -19.722 -8.093 7.564) 22.620 3.032 ( -24.367 -3.360 5.591) 25.225 3.057 ( -15.945 -2.691 2.177) 16.317 3.546 ( -13.700 -4.530 -4.846) 15.221 4.080 ( 3.256 0.500 0.003) 3.294 4.238 ( -6.076 0.556 0.018) 6.102 4.283 ( -7.902 -3.921 -0.430) 8.832 5.393 ( -26.010 -5.504 0.931) 26.603 6.726 ( 9.195 1.665 0.239) 9.348 7.493 ( -6.226 -2.042 -2.462) 7.000 8.757 ( 12.371 1.687 -0.443) 12.493 9.048 ( -6.073 -0.093 -1.200) 6.191 9.276 ( -1.376 -1.172 0.982) 2.058 9.353 ( -4.831 0.186 2.125) 5.281 9.769 ( 4.439 4.675 1.106) 6.541 10.075 ( -1.422 -1.677 -2.577) 3.387 11.032 ( 17.360 8.180 5.381) 19.931 11.666 ( 13.734 -11.958 -3.156) 18.482 12.224 ( -2.397 7.235 -0.405) 7.633 14.016 ( -5.240 4.107 -3.022) 7.312 14.267 ( -10.899 -6.964 1.063) 12.978======================= Grid point 29 (22/344) =======================q-point: (-0.07 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.114 ( -31.391 -0.000 0.000) 31.391 1.184 ( -33.085 -0.000 0.000) 33.085 2.043 ( -55.049 -0.000 0.000) 55.049 2.744 ( -10.420 -0.000 0.000) 10.420 2.807 ( -8.078 -0.000 0.000) 8.078 2.963 ( -2.455 -0.000 0.000) 2.455 3.302 ( -10.995 -0.000 0.000) 10.995 4.155 ( -4.146 -0.000 0.000) 4.146 4.158 ( -1.303 -0.000 0.000) 1.303 4.179 ( 3.605 0.000 -0.000) 3.605 4.927 ( -23.167 -0.000 0.000) 23.167 6.863 ( 5.548 0.000 -0.000) 5.548 7.373 ( -5.659 -0.000 0.000) 5.659 8.954 ( -4.243 -0.000 0.000) 4.243 9.026 ( 16.501 0.000 -0.000) 16.501 9.250 ( -1.099 -0.000 0.000) 1.099 9.287 ( -3.093 -0.000 0.000) 3.093 9.886 ( 5.834 0.000 -0.000) 5.834 10.021 ( -3.681 -0.000 0.000) 3.681 11.444 ( 20.703 0.000 -0.000) 20.703 11.770 ( 8.306 0.000 -0.000) 8.306 12.280 ( 3.835 0.000 -0.000) 3.835 13.931 ( -6.425 -0.000 0.000) 6.425 14.013 ( -13.516 -0.000 0.000) 13.516======================= Grid point 32 (23/344) =======================q-point: ( 0.13 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.270 ( -0.000 27.679 6.900) 28.526 1.395 ( -0.000 31.614 7.718) 32.543 2.415 ( -0.000 53.253 11.291) 54.437 2.631 ( -0.000 4.190 -14.202) 14.807 2.892 ( -0.000 12.185 -7.715) 14.422 3.047 ( 0.000 3.250 9.996) 10.511 3.363 ( -0.000 12.573 3.364) 13.015 4.065 ( -0.000 -0.825 -9.496) 9.531 4.165 ( -0.000 3.074 -0.688) 3.150 4.243 ( 0.000 1.966 3.656) 4.151 5.042 ( -0.000 25.334 -4.240) 25.686 6.831 ( 0.000 -6.984 0.464) 6.999 7.421 ( 0.000 3.209 5.243) 6.147 8.908 ( 0.000 -13.388 -4.155) 14.018 8.956 ( -0.000 3.592 -1.542) 3.909 9.291 ( 0.000 2.765 1.543) 3.166 9.346 ( 0.000 3.083 6.431) 7.132 9.842 ( 0.000 -8.116 1.954) 8.348 9.987 ( -0.000 2.002 -8.458) 8.691 11.360 ( 0.000 -21.333 11.169) 24.080 11.950 ( -0.000 -6.065 -20.344) 21.229 11.966 ( -0.000 3.439 -1.573) 3.782 13.950 ( 0.000 4.391 7.469) 8.664 14.248 ( 0.000 5.447 19.889) 20.622======================= Grid point 33 (24/344) =======================q-point: ( 0.20 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.676 ( 12.451 24.039 6.259) 27.787 1.808 ( 9.667 28.400 6.831) 30.768 2.704 ( 7.466 3.953 -13.023) 15.523 2.969 ( 2.628 14.345 -3.842) 15.082 3.053 ( 6.740 29.570 2.420) 30.425 3.134 ( 3.548 13.894 8.567) 16.704 3.552 ( 5.409 12.339 5.355) 14.498 4.047 ( 0.677 0.164 -4.267) 4.324 4.236 ( 3.831 5.007 -0.489) 6.323 4.283 ( 0.026 6.390 -0.154) 6.392 5.370 ( 8.375 25.728 -4.323) 27.400 6.722 ( -3.315 -9.097 -0.382) 9.690 7.488 ( 2.542 3.926 1.872) 5.038 8.752 ( -3.556 -9.710 -0.322) 10.346 9.030 ( 4.157 4.330 -1.353) 6.154 9.304 ( -1.716 2.158 3.061) 4.119 9.390 ( -0.303 5.498 3.336) 6.438 9.781 ( 0.670 -5.085 0.188) 5.132 10.006 ( 3.047 -0.817 -6.855) 7.546 11.128 ( -7.600 -17.553 8.176) 20.802 11.602 ( -12.968 -5.600 -6.226) 15.437 12.188 ( 9.188 0.301 -4.407) 10.195 14.066 ( 6.692 0.920 8.410) 10.787 14.306 ( -3.871 9.756 5.508) 11.853======================= Grid point 34 (25/344) =======================q-point: ( 0.27 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.125 ( 11.403 19.405 4.664) 22.986 2.273 ( 11.043 22.867 3.537) 25.639 2.891 ( 10.449 6.171 -6.842) 13.931 3.076 ( 3.443 7.808 -9.981) 13.132 3.228 ( 0.783 11.851 5.810) 13.222 3.553 ( 7.353 15.610 1.948) 17.365 3.772 ( 5.654 3.454 4.162) 7.825 4.170 ( 8.348 15.816 1.196) 17.924 4.374 ( 3.119 7.749 -1.679) 8.520 4.418 ( 8.675 10.636 1.752) 13.837 5.786 ( 12.179 21.355 -3.171) 24.788 6.543 ( -5.658 -9.790 -1.105) 11.361 7.587 ( 4.232 3.285 0.954) 5.442 8.608 ( -4.119 -5.447 2.523) 7.280 9.167 ( 5.346 5.967 -0.618) 8.036 9.328 ( 1.666 3.697 1.094) 4.200 9.459 ( 0.019 6.876 1.142) 6.970 9.745 ( -2.805 0.786 -1.498) 3.275 10.043 ( 5.037 -3.556 -2.541) 6.669 10.811 ( -12.070 -11.095 4.137) 16.909 11.363 ( -4.430 -12.124 -2.420) 13.133 12.306 ( 3.410 4.963 -1.919) 6.320 14.165 ( 0.176 1.956 5.168) 5.529 14.386 ( 3.963 5.709 0.639) 6.979======================= Grid point 35 (26/344) =======================q-point: ( 0.33 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.451 ( 4.615 16.025 2.306) 16.835 2.598 ( 5.700 11.083 -0.681) 12.482 3.135 ( 7.025 12.957 -1.170) 14.785 3.256 ( 6.772 13.461 -4.931) 15.854 3.392 ( 3.132 12.993 1.784) 13.484 3.662 ( -0.981 -0.299 -1.317) 1.669 3.907 ( 8.086 3.305 5.421) 10.281 4.455 ( 7.965 7.294 -2.848) 11.170 4.510 ( 5.501 4.951 -1.989) 7.663 4.842 ( 16.590 22.466 5.848) 28.533 6.126 ( 2.717 12.481 -1.434) 12.853 6.396 ( 3.526 -6.003 -0.191) 6.965 7.705 ( 5.754 2.675 1.575) 6.538 8.518 ( -2.162 -2.618 2.019) 3.950 9.304 ( 2.850 7.030 -0.716) 7.619 9.438 ( 0.012 8.062 1.231) 8.155 9.520 ( 1.436 6.103 -2.440) 6.728 9.700 ( -3.550 4.425 -1.235) 5.806 10.101 ( 6.419 -4.072 1.024) 7.670 10.555 ( -6.744 -8.122 2.787) 10.919 11.170 ( -1.921 -14.764 -2.465) 15.091 12.416 ( 1.212 9.764 -1.010) 9.890 14.160 ( -3.770 3.704 0.663) 5.326 14.521 ( 7.694 -1.203 1.591) 7.948======================= Grid point 36 (27/344) =======================q-point: ( 0.40 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.627 ( -2.263 15.618 0.535) 15.790 2.716 ( 1.535 3.032 -0.951) 3.529 3.378 ( 4.910 12.445 -2.266) 13.569 3.460 ( -1.779 17.691 0.202) 17.782 3.539 ( 2.240 0.035 -0.403) 2.277 3.713 ( 3.958 14.315 1.547) 14.932 4.116 ( 10.910 2.829 3.352) 11.758 4.611 ( 4.464 4.389 -1.459) 6.428 4.643 ( 6.642 0.974 -2.587) 7.194 5.283 ( 7.945 14.397 2.688) 16.662 6.133 ( -2.095 5.455 -0.196) 5.847 6.571 ( 12.508 -0.854 2.930) 12.875 7.849 ( 7.377 2.397 1.823) 7.968 8.487 ( 0.207 -1.173 -0.032) 1.192 9.349 ( -12.264 9.230 -3.306) 15.701 9.427 ( -0.413 6.724 2.645) 7.237 9.671 ( 5.562 3.780 -3.105) 7.407 9.748 ( 3.051 7.849 -0.972) 8.477 10.188 ( 6.675 -2.783 4.189) 8.358 10.423 ( -0.607 -7.177 1.360) 7.330 10.991 ( -0.931 -14.847 -2.878) 15.152 12.535 ( -1.098 13.740 -0.737) 13.803 14.129 ( -2.792 1.970 -0.614) 3.472 14.621 ( 7.013 -5.123 1.413) 8.799======================= Grid point 37 (28/344) =======================q-point: ( 0.47 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.708 ( -6.314 16.142 0.192) 17.334 2.743 ( -0.222 1.357 -0.224) 1.393 3.427 ( 0.202 -5.399 -0.896) 5.476 3.547 ( -8.262 22.164 -0.613) 23.662 3.696 ( 6.757 9.077 -1.256) 11.385 3.918 ( 0.271 13.129 3.342) 13.550 4.356 ( 11.392 4.738 1.817) 12.471 4.698 ( 2.889 0.827 -1.227) 3.246 4.745 ( 4.892 0.784 -2.218) 5.429 5.364 ( -9.465 7.845 1.441) 12.378 6.278 ( 9.456 6.699 -0.447) 11.597 6.732 ( 7.958 -5.058 5.443) 10.888 8.002 ( 7.266 0.960 1.188) 7.424 8.494 ( 1.622 -0.713 -1.529) 2.340 9.196 ( -13.794 9.782 -1.133) 16.948 9.497 ( -0.419 6.231 0.578) 6.272 9.743 ( 1.220 2.277 -0.468) 2.625 9.909 ( 5.276 6.702 -4.060) 9.446 10.264 ( 1.862 -2.117 7.467) 7.982 10.406 ( 7.622 -6.813 -1.087) 10.281 10.830 ( -0.749 -13.093 -2.840) 13.419 12.639 ( -4.428 16.570 -0.537) 17.159 14.105 ( -0.548 -0.654 -0.425) 0.953 14.671 ( 5.937 -7.493 0.617) 9.580======================= Grid point 38 (29/344) =======================q-point: ( 0.53 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.742 ( -8.431 15.885 -0.025) 17.983 2.746 ( -0.955 1.826 0.371) 2.094 3.384 ( 1.949 -5.697 -0.203) 6.025 3.599 ( -11.037 21.824 -0.612) 24.464 3.865 ( 2.496 8.516 -2.816) 9.311 3.982 ( -4.343 5.588 3.616) 7.948 4.565 ( 5.683 2.776 1.070) 6.414 4.726 ( 1.701 -2.079 -0.778) 2.797 4.828 ( 3.596 1.994 -1.649) 4.430 5.237 ( -13.435 10.989 2.009) 17.473 6.481 ( 7.530 1.178 -1.685) 7.805 6.772 ( 3.091 -7.764 5.820) 10.184 8.102 ( 4.117 -1.961 0.199) 4.565 8.512 ( 1.571 -0.859 -1.844) 2.571 9.093 ( -9.770 11.657 0.235) 15.212 9.534 ( -2.076 5.277 0.353) 5.682 9.771 ( 0.050 1.316 -0.060) 1.318 10.020 ( 2.187 4.162 -4.290) 6.364 10.252 ( -0.495 -3.413 5.051) 6.116 10.509 ( 11.125 -9.350 0.524) 14.541 10.697 ( -0.915 -7.804 -2.202) 8.160 12.702 ( -8.070 17.434 -0.241) 19.213 14.096 ( 1.267 -2.378 0.339) 2.716 14.685 ( 5.221 -8.756 -0.455) 10.204======================= Grid point 39 (30/344) =======================q-point: (-0.40 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.736 ( -6.817 10.494 -0.469) 12.523 2.753 ( -3.733 6.419 0.979) 7.490 3.386 ( 4.070 -4.212 0.141) 5.858 3.598 ( -13.216 20.411 -0.633) 24.324 3.903 ( -9.339 3.322 2.201) 10.154 3.934 ( -2.699 4.720 -2.819) 6.124 4.554 ( -5.853 -3.742 -0.420) 6.960 4.729 ( 0.865 -1.640 -0.304) 1.879 4.848 ( -2.186 -2.143 1.212) 3.292 5.232 ( -3.171 16.857 1.166) 17.192 6.497 ( -3.666 -5.757 0.136) 6.827 6.743 ( 2.459 -7.915 2.206) 8.577 8.096 ( -0.727 -5.027 -0.802) 5.142 8.516 ( 0.536 -1.344 -1.148) 1.847 9.102 ( -4.810 14.860 1.442) 15.686 9.534 ( -3.604 4.517 0.444) 5.796 9.771 ( -1.129 0.620 -0.033) 1.288 10.044 ( -2.211 1.507 -1.829) 3.241 10.217 ( -0.485 -3.247 0.833) 3.387 10.499 ( 2.781 -14.345 -1.032) 14.648 10.719 ( 8.377 -2.536 0.975) 8.807 12.704 ( -10.816 15.724 0.060) 19.085 14.102 ( 1.679 -1.937 1.179) 2.822 14.678 ( 4.582 -9.206 -1.502) 10.393======================= Grid point 40 (31/344) =======================q-point: (-0.33 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.707 ( -10.349 12.991 -0.071) 16.609 2.750 ( -1.225 1.210 0.727) 1.869 3.434 ( 3.801 -1.159 -0.016) 3.973 3.549 ( -13.804 17.153 -0.179) 22.019 3.722 ( -12.037 -1.994 2.564) 12.467 3.869 ( -10.802 6.284 -3.864) 13.081 4.343 ( -10.647 -6.853 -0.017) 12.662 4.705 ( -2.540 -0.874 0.006) 2.686 4.763 ( -2.651 -4.989 0.481) 5.670 5.365 ( -1.976 11.841 1.382) 12.084 6.289 ( -10.853 -5.942 1.005) 12.414 6.688 ( 0.159 -9.495 -0.394) 9.504 7.985 ( -4.697 -6.263 -1.390) 7.951 8.502 ( -0.003 -1.662 -0.123) 1.667 9.216 ( -1.814 17.593 1.630) 17.762 9.500 ( -5.401 3.738 0.970) 6.640 9.745 ( -2.392 0.362 -0.151) 2.424 9.959 ( -7.690 -1.344 2.740) 8.273 10.168 ( -0.701 -3.701 -6.081) 7.153 10.418 ( 3.408 -10.126 0.685) 10.706 10.860 ( 11.633 -5.331 1.556) 12.890 12.645 ( -11.890 11.972 0.210) 16.874 14.120 ( 0.754 0.610 1.705) 1.962 14.651 ( 3.333 -9.180 -2.176) 10.006======================= Grid point 41 (32/344) =======================q-point: (-0.27 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.623 ( -12.627 9.156 0.056) 15.598 2.728 ( -3.029 0.274 0.595) 3.099 3.392 ( -17.114 11.570 -0.346) 20.661 3.458 ( -11.810 -0.010 0.270) 11.813 3.557 ( 0.133 -0.656 1.869) 1.985 3.687 ( -12.800 3.996 -2.218) 13.591 4.089 ( -9.664 -7.867 -0.552) 12.474 4.616 ( -6.733 -0.428 -0.319) 6.754 4.666 ( -2.655 -6.266 0.332) 6.813 5.271 ( -18.262 -0.622 0.832) 18.292 6.139 ( -2.813 3.926 0.723) 4.884 6.545 ( -4.616 -10.951 -0.598) 11.899 7.825 ( -6.061 -5.041 -1.662) 8.056 8.491 ( 0.599 -1.421 0.560) 1.641 9.360 ( -2.807 14.682 -1.867) 15.064 9.432 ( -6.344 4.405 3.364) 8.424 9.697 ( -3.611 -0.200 0.647) 3.674 9.784 ( -10.328 -1.030 4.374) 11.263 10.100 ( 0.611 -5.647 -8.257) 10.022 10.431 ( 6.385 -5.008 1.927) 8.340 11.018 ( 13.007 -6.420 1.121) 14.548 12.541 ( -11.162 7.667 0.165) 13.542 14.145 ( -0.874 3.636 1.640) 4.083 14.595 ( 0.980 -8.684 -2.185) 9.008======================= Grid point 42 (33/344) =======================q-point: (-0.20 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.432 ( -17.111 3.296 -0.355) 17.429 2.608 ( -13.221 0.171 0.806) 13.247 3.130 ( -17.180 3.932 -1.447) 17.684 3.291 ( -9.854 3.384 -0.708) 10.443 3.402 ( -13.270 -1.746 3.197) 13.761 3.671 ( 2.057 0.820 0.011) 2.214 3.857 ( -8.829 -4.807 -1.582) 10.176 4.467 ( -10.307 -0.955 -0.484) 10.363 4.537 ( -5.784 -4.775 1.030) 7.571 4.793 ( -30.095 -3.156 -0.754) 30.269 6.141 ( -11.563 3.089 0.734) 11.991 6.396 ( 4.669 -5.400 -0.228) 7.142 7.685 ( -5.281 -2.490 -1.362) 5.995 8.508 ( 2.818 -0.630 0.485) 2.928 9.302 ( -7.737 1.576 -0.947) 7.953 9.421 ( -7.101 5.651 -0.950) 9.124 9.566 ( -7.335 -2.499 3.685) 8.581 9.726 ( -1.955 5.914 2.721) 6.797 10.056 ( 2.177 -4.333 -5.584) 7.396 10.551 ( 10.394 -0.573 1.877) 10.578 11.187 ( 13.280 -5.506 0.110) 14.376 12.423 ( -8.828 3.903 0.045) 9.652 14.161 ( -2.686 4.517 0.831) 5.320 14.501 ( -2.522 -6.622 -1.304) 7.205======================= Grid point 43 (34/344) =======================q-point: (-0.13 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.093 ( -23.481 -0.000 0.000) 23.481 2.248 ( -26.820 -0.000 0.000) 26.820 2.947 ( -6.467 -0.000 0.000) 6.467 3.155 ( -14.228 -0.000 0.000) 14.228 3.172 ( -6.338 -0.000 0.000) 6.338 3.537 ( -19.064 -0.000 0.000) 19.064 3.741 ( -7.215 -0.000 0.000) 7.215 4.160 ( -18.082 -0.000 0.000) 18.082 4.395 ( -7.818 -0.000 0.000) 7.818 4.396 ( -12.027 -0.000 0.000) 12.027 5.808 ( -23.728 -0.000 0.000) 23.728 6.552 ( 11.320 0.000 -0.000) 11.320 7.581 ( -5.383 -0.000 0.000) 5.383 8.590 ( 7.245 0.000 -0.000) 7.245 9.171 ( -7.860 -0.000 0.000) 7.860 9.322 ( -4.917 -0.000 0.000) 4.917 9.450 ( -5.899 -0.000 0.000) 5.899 9.755 ( 0.837 0.000 -0.000) 0.837 10.062 ( 1.232 0.000 -0.000) 1.232 10.782 ( 15.524 0.000 -0.000) 15.524 11.379 ( 12.723 0.000 -0.000) 12.723 12.320 ( -5.367 -0.000 0.000) 5.367 14.128 ( -4.405 -0.000 0.000) 4.405 14.381 ( -6.778 -0.000 0.000) 6.778======================= Grid point 48 (35/344) =======================q-point: ( 0.20 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.805 ( -0.000 22.063 7.559) 23.322 2.029 ( -0.000 27.962 7.947) 29.070 2.638 ( -0.000 3.090 -12.094) 12.482 3.037 ( -0.000 7.494 -9.830) 12.361 3.178 ( 0.000 5.489 6.231) 8.304 3.389 ( -0.000 33.592 5.827) 34.093 3.665 ( -0.000 14.068 4.478) 14.763 4.076 ( -0.000 10.564 -0.370) 10.571 4.246 ( -0.000 5.259 -0.494) 5.283 4.362 ( -0.000 9.264 -2.364) 9.561 5.559 ( -0.000 26.670 -4.532) 27.052 6.655 ( 0.000 -9.836 -0.573) 9.853 7.515 ( -0.000 5.145 -0.324) 5.155 8.703 ( 0.000 -5.987 1.083) 6.084 9.021 ( -0.000 3.429 -2.350) 4.157 9.356 ( 0.000 2.234 3.620) 4.253 9.469 ( 0.000 6.000 7.794) 9.836 9.682 ( 0.000 -7.828 1.284) 7.933 9.957 ( -0.000 0.057 -12.053) 12.053 11.027 ( 0.000 -16.178 10.932) 19.525 11.743 ( -0.000 -8.119 -8.709) 11.907 12.035 ( -0.000 4.133 -1.958) 4.573 14.030 ( 0.000 1.190 6.458) 6.567 14.449 ( 0.000 8.546 4.077) 9.469======================= Grid point 49 (36/344) =======================q-point: ( 0.27 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.120 ( 10.112 16.734 5.738) 20.376 2.363 ( 5.600 22.489 6.287) 24.013 2.744 ( 10.286 6.733 -7.596) 14.451 3.089 ( 1.037 6.573 -9.985) 11.999 3.288 ( 4.358 7.154 3.975) 9.272 3.635 ( 0.962 9.835 0.397) 9.890 3.789 ( 0.018 9.112 4.450) 10.140 4.273 ( 0.969 17.900 0.405) 17.931 4.384 ( 6.490 12.686 -0.374) 14.254 4.468 ( 1.096 16.348 1.593) 16.462 5.846 ( 5.546 21.464 -3.637) 22.466 6.531 ( -3.621 -7.671 -0.635) 8.506 7.582 ( 1.561 5.550 -0.770) 5.816 8.634 ( -3.213 -3.310 3.227) 5.630 9.102 ( 6.067 3.226 -2.366) 7.267 9.364 ( -1.076 1.953 4.132) 4.695 9.536 ( -0.373 6.944 3.072) 7.603 9.703 ( 6.303 -2.671 3.833) 7.846 9.936 ( 1.048 -1.307 -11.011) 11.138 10.858 ( -5.690 -12.616 8.065) 16.017 11.461 ( -14.933 -6.343 -4.776) 16.912 12.208 ( 10.457 2.903 -2.185) 11.070 14.102 ( 5.020 0.239 4.392) 6.675 14.498 ( -3.966 7.792 1.160) 8.820======================= Grid point 50 (37/344) =======================q-point: ( 0.33 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.460 ( 10.776 12.054 2.838) 16.415 2.619 ( 4.015 9.589 0.096) 10.397 3.112 ( 16.580 17.596 0.584) 24.184 3.188 ( 5.261 8.291 -8.403) 12.924 3.473 ( 5.333 9.963 2.892) 11.664 3.656 ( 0.111 -2.633 -1.374) 2.972 3.902 ( 0.570 9.993 5.348) 11.348 4.423 ( 2.680 8.600 -4.156) 9.921 4.518 ( 1.830 7.188 -1.728) 7.616 4.868 ( 10.465 27.607 6.640) 30.261 6.136 ( 9.494 10.019 -1.393) 13.872 6.391 ( -7.261 -0.047 0.044) 7.261 7.674 ( 2.767 5.410 0.479) 6.095 8.549 ( -3.653 -2.526 3.093) 5.412 9.270 ( 8.606 4.312 -1.868) 9.806 9.420 ( 3.236 4.859 0.736) 5.884 9.612 ( 0.220 6.816 0.644) 6.850 9.796 ( 0.664 4.951 2.530) 5.599 9.927 ( 4.992 -5.526 -4.846) 8.884 10.624 ( -9.407 -9.020 4.679) 13.847 11.156 ( -10.585 -8.065 -3.152) 13.676 12.410 ( 8.271 6.028 -1.236) 10.309 14.191 ( 3.645 -0.389 1.764) 4.068 14.492 ( -3.377 4.355 0.540) 5.538======================= Grid point 51 (38/344) =======================q-point: ( 0.40 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.717 ( 2.208 5.038 0.012) 5.500 2.742 ( 6.189 10.010 0.038) 11.769 3.360 ( 5.239 8.817 -5.556) 11.664 3.502 ( 3.531 3.733 -0.075) 5.139 3.672 ( 8.115 19.705 1.995) 21.404 3.732 ( 7.669 9.039 1.863) 11.999 4.026 ( 3.054 6.790 3.631) 8.283 4.528 ( 4.005 3.520 -4.616) 7.053 4.612 ( 2.100 4.423 -0.087) 4.897 5.304 ( 9.724 19.765 3.664) 22.330 6.265 ( -1.820 -0.940 0.895) 2.235 6.390 ( 4.706 8.030 2.117) 9.545 7.790 ( 4.210 5.072 2.084) 6.914 8.483 ( -1.638 -1.895 0.493) 2.553 9.440 ( 4.712 6.090 -0.407) 7.711 9.565 ( 6.554 5.148 -3.162) 8.914 9.649 ( -4.939 6.922 -0.682) 8.530 9.815 ( -2.178 5.618 -2.149) 6.397 10.011 ( 9.102 -3.583 3.884) 10.524 10.412 ( -5.986 -7.301 3.284) 9.996 10.915 ( -6.273 -9.719 -3.261) 12.019 12.614 ( 6.103 10.356 -0.635) 12.038 14.208 ( -2.217 0.960 -0.817) 2.551 14.486 ( 1.564 -2.624 1.502) 3.404======================= Grid point 52 (39/344) =======================q-point: ( 0.47 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.762 ( 0.499 2.288 -0.338) 2.366 2.930 ( 0.291 13.957 0.524) 13.970 3.375 ( -1.303 -5.438 -2.059) 5.959 3.650 ( 6.828 9.906 -1.992) 12.196 3.890 ( -1.927 18.032 1.701) 18.214 4.051 ( 1.509 15.847 2.784) 16.160 4.213 ( 12.729 8.302 0.919) 15.225 4.621 ( 5.089 0.873 -3.027) 5.985 4.670 ( 2.539 -0.164 -0.269) 2.559 5.569 ( 0.174 13.283 1.759) 13.400 6.269 ( -0.338 7.030 1.170) 7.134 6.535 ( 8.289 -4.366 4.756) 10.507 7.923 ( 4.933 3.950 2.982) 6.988 8.457 ( 0.682 -1.532 -2.317) 2.860 9.527 ( -11.318 9.787 -3.534) 15.375 9.562 ( -0.442 5.566 2.072) 5.955 9.717 ( 4.356 2.152 -2.603) 5.512 9.880 ( 4.461 3.709 -2.281) 6.234 10.153 ( 8.263 -1.212 4.665) 9.566 10.289 ( -1.469 -6.573 3.259) 7.482 10.731 ( -2.776 -9.497 -3.942) 10.651 12.818 ( 2.786 14.572 -0.339) 14.839 14.148 ( -4.471 0.348 -1.260) 4.658 14.491 ( 4.601 -8.148 1.259) 9.442======================= Grid point 53 (40/344) =======================q-point: ( 0.53 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.787 ( -0.746 3.219 0.184) 3.310 3.035 ( -5.122 15.390 0.407) 16.225 3.295 ( 0.401 -6.945 -0.748) 6.996 3.844 ( 4.251 9.155 -4.091) 10.891 4.004 ( -6.378 18.833 2.021) 19.986 4.134 ( -2.916 5.887 2.903) 7.182 4.502 ( 6.884 7.986 0.603) 10.560 4.659 ( 1.582 -3.051 -1.552) 3.771 4.771 ( 6.714 4.720 -1.128) 8.284 5.598 ( -11.222 13.762 2.215) 17.895 6.373 ( 5.056 2.578 -0.648) 5.713 6.607 ( 6.859 -9.722 5.797) 13.235 8.034 ( 3.378 1.454 2.594) 4.500 8.462 ( 2.168 -1.304 -3.536) 4.348 9.397 ( -11.993 10.206 -0.248) 15.749 9.622 ( -1.134 5.754 0.333) 5.874 9.774 ( 1.292 1.029 -0.706) 1.796 9.995 ( 4.961 2.629 -4.026) 6.908 10.223 ( 0.357 -6.641 2.207) 7.007 10.271 ( 6.177 -3.672 4.902) 8.699 10.620 ( 0.350 -6.411 -3.704) 7.412 12.983 ( -2.779 17.539 -0.213) 17.759 14.076 ( -2.160 -1.935 -0.229) 2.909 14.486 ( 5.625 -10.890 0.052) 12.257======================= Grid point 54 (41/344) =======================q-point: (-0.40 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.798 ( -2.092 3.571 0.234) 4.145 3.067 ( -8.621 14.875 0.459) 17.199 3.264 ( 3.809 -5.950 -0.122) 7.066 3.931 ( -3.636 8.440 -6.274) 11.127 4.066 ( -7.333 13.601 5.220) 16.310 4.103 ( -5.721 5.342 0.132) 7.829 4.589 ( -0.683 -0.764 -0.774) 1.284 4.659 ( 3.355 -3.207 0.565) 4.676 4.891 ( -2.069 5.325 -0.170) 5.715 5.545 ( -10.771 17.085 1.946) 20.290 6.442 ( 3.099 -4.138 -1.924) 5.516 6.606 ( 3.764 -10.962 5.053) 12.644 8.065 ( -0.150 -1.794 0.802) 1.971 8.481 ( 1.813 -1.106 -2.579) 3.341 9.348 ( -6.683 12.971 1.590) 14.678 9.642 ( -2.715 4.995 0.366) 5.697 9.789 ( -0.235 0.588 -0.138) 0.648 10.069 ( 1.162 2.532 -4.894) 5.632 10.168 ( 1.650 -8.233 2.239) 8.690 10.299 ( 2.871 -7.976 2.142) 8.744 10.604 ( 3.473 -2.639 -1.156) 4.512 13.050 ( -9.548 16.603 -0.202) 19.154 14.052 ( 1.757 -1.838 1.213) 2.817 14.472 ( 6.156 -11.736 -1.312) 13.318======================= Grid point 55 (42/344) =======================q-point: (-0.33 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.789 ( -2.233 2.296 0.188) 3.208 3.035 ( -10.946 12.060 0.359) 16.291 3.308 ( 6.360 -3.379 0.260) 7.206 3.860 ( -9.313 2.357 -3.534) 10.236 3.987 ( -11.053 7.721 1.450) 13.560 4.105 ( -7.621 11.136 0.459) 13.502 4.493 ( -9.696 -1.259 -0.167) 9.778 4.683 ( 1.947 -2.640 0.480) 3.315 4.786 ( -7.464 -4.278 0.344) 8.610 5.588 ( -6.273 16.392 1.300) 17.599 6.376 ( -4.501 -4.811 -1.067) 6.674 6.556 ( 2.674 -11.328 2.196) 11.845 8.003 ( -3.544 -3.463 -0.508) 4.981 8.485 ( 0.461 -1.090 -1.069) 1.595 9.427 ( -2.126 15.958 2.216) 16.251 9.631 ( -4.198 4.494 1.329) 6.291 9.779 ( -1.261 0.202 -0.241) 1.299 10.028 ( -3.052 -4.231 -3.315) 6.181 10.150 ( 0.387 -3.402 0.465) 3.456 10.244 ( 2.033 -8.423 -0.402) 8.675 10.667 ( 6.650 -2.726 0.822) 7.234 12.984 ( -13.561 11.040 -0.128) 17.488 14.102 ( 3.112 1.948 2.176) 4.268 14.460 ( 6.109 -11.087 -2.256) 12.858======================= Grid point 56 (43/344) =======================q-point: (-0.27 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.770 ( -1.798 0.795 0.210) 1.977 2.926 ( -12.545 6.550 0.062) 14.152 3.405 ( 6.806 -0.996 0.336) 6.887 3.668 ( -12.354 -0.721 -0.658) 12.392 3.862 ( -12.151 6.801 -0.192) 13.926 4.015 ( -17.471 10.774 -0.446) 20.531 4.212 ( -14.862 -7.203 0.646) 16.528 4.647 ( -2.062 -4.494 -0.378) 4.959 4.677 ( -1.488 -1.693 0.206) 2.263 5.562 ( -12.229 5.534 0.921) 13.454 6.253 ( -5.828 2.714 -0.291) 6.435 6.478 ( 0.092 -9.944 0.297) 9.949 7.887 ( -5.717 -2.549 -0.611) 6.289 8.476 ( -0.005 -0.709 -0.165) 0.728 9.529 ( -4.248 6.874 -1.041) 8.147 9.619 ( -4.453 11.477 4.211) 13.010 9.751 ( -2.467 -0.072 0.606) 2.541 9.912 ( -2.425 -5.798 -0.628) 6.316 10.037 ( -5.982 -5.218 -3.362) 8.621 10.268 ( 6.547 -3.753 0.117) 7.547 10.781 ( 9.431 -2.546 0.807) 9.802 12.822 ( -13.758 4.821 -0.020) 14.578 14.184 ( 1.437 4.304 1.904) 4.921 14.454 ( 4.869 -8.054 -2.026) 9.627======================= Grid point 57 (44/344) =======================q-point: (-0.20 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.709 ( -10.791 -0.000 0.000) 10.791 2.752 ( -6.963 -0.000 0.000) 6.963 3.433 ( -14.162 -0.000 0.000) 14.162 3.499 ( 2.610 0.000 -0.000) 2.610 3.644 ( -25.813 -0.000 0.000) 25.813 3.710 ( -8.869 -0.000 0.000) 8.869 3.986 ( -8.886 -0.000 0.000) 8.886 4.584 ( -2.878 -0.000 0.000) 2.878 4.607 ( -6.020 -0.000 0.000) 6.020 5.263 ( -24.069 -0.000 0.000) 24.069 6.255 ( 2.729 0.000 -0.000) 2.729 6.361 ( -7.114 -0.000 0.000) 7.114 7.768 ( -6.065 -0.000 0.000) 6.065 8.477 ( 0.683 0.000 -0.000) 0.683 9.441 ( -7.284 -0.000 0.000) 7.284 9.612 ( -8.380 -0.000 0.000) 8.380 9.657 ( -5.260 -0.000 0.000) 5.260 9.849 ( -7.494 -0.000 0.000) 7.494 9.948 ( 4.996 0.000 -0.000) 4.996 10.379 ( 8.494 0.000 -0.000) 8.494 10.949 ( 11.440 0.000 -0.000) 11.440 12.622 ( -11.740 -0.000 0.000) 11.740 14.219 ( -0.732 -0.000 0.000) 0.732 14.467 ( 1.730 0.000 -0.000) 1.730======================= Grid point 64 (45/344) =======================q-point: ( 0.27 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.181 ( 0.000 11.394 5.081) 12.475 2.550 ( -0.000 19.043 6.865) 20.243 2.695 ( -0.000 7.808 -4.859) 9.197 3.129 ( -0.000 8.309 -9.092) 12.316 3.301 ( -0.000 5.016 0.813) 5.082 3.673 ( -0.000 -0.141 -1.898) 1.903 3.926 ( 0.000 13.076 6.052) 14.408 4.366 ( -0.000 6.687 -0.009) 6.687 4.488 ( -0.000 13.674 -6.415) 15.104 4.708 ( -0.000 30.927 7.957) 31.934 5.968 ( -0.000 12.316 -3.554) 12.819 6.528 ( -0.000 1.611 0.522) 1.694 7.633 ( -0.000 7.324 -1.502) 7.477 8.657 ( 0.000 -0.833 3.493) 3.591 9.048 ( -0.000 -0.624 -2.076) 2.167 9.385 ( 0.000 -1.798 6.446) 6.692 9.592 ( -0.000 0.016 -1.683) 1.683 9.648 ( 0.000 7.890 7.418) 10.830 9.912 ( -0.000 1.812 -11.668) 11.808 10.813 ( 0.000 -9.559 7.074) 11.891 11.545 ( -0.000 -8.870 -4.085) 9.766 12.110 ( -0.000 4.174 -1.970) 4.615 14.076 ( 0.000 1.533 3.157) 3.510 14.610 ( -0.000 6.397 0.524) 6.418======================= Grid point 65 (46/344) =======================q-point: ( 0.33 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.362 ( 9.705 6.032 1.605) 11.539 2.677 ( -0.641 7.938 1.281) 8.066 2.953 ( 15.464 11.921 1.043) 19.553 3.240 ( 2.076 14.575 -4.271) 15.329 3.417 ( 7.543 5.152 -1.103) 9.201 3.636 ( -1.438 -3.161 -1.366) 3.732 4.052 ( -1.611 12.371 5.720) 13.724 4.465 ( 2.667 7.465 -0.984) 7.988 4.574 ( -0.788 8.561 -5.876) 10.413 5.052 ( 3.082 26.427 6.832) 27.470 6.065 ( 3.794 2.287 -1.928) 4.832 6.568 ( -4.168 12.062 2.000) 12.917 7.714 ( 0.654 7.944 -0.832) 8.014 8.608 ( -4.626 -1.700 2.967) 5.752 9.114 ( 9.362 -1.545 -1.705) 9.640 9.410 ( 2.954 0.823 4.440) 5.396 9.624 ( 2.108 2.358 -1.594) 3.541 9.767 ( 3.795 4.595 3.371) 6.846 9.913 ( -1.360 5.467 -6.098) 8.302 10.692 ( -5.906 -7.077 4.504) 10.259 11.303 ( -13.440 -7.650 -3.031) 15.759 12.271 ( 11.429 3.851 -1.538) 12.158 14.126 ( 2.918 0.940 1.819) 3.565 14.626 ( -4.474 4.856 -0.003) 6.603======================= Grid point 66 (47/344) =======================q-point: ( 0.40 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.631 ( 13.829 4.925 -0.030) 14.679 2.729 ( 0.911 3.097 -0.117) 3.230 3.306 ( 10.330 6.550 -4.615) 13.073 3.501 ( 5.438 12.505 1.363) 13.704 3.604 ( 8.112 3.693 2.385) 9.226 3.647 ( 10.776 7.001 -0.551) 12.863 4.150 ( -2.173 11.822 4.371) 12.790 4.559 ( -0.762 7.591 -4.429) 8.822 4.631 ( 1.056 4.688 -1.385) 5.001 5.353 ( 6.659 14.841 4.020) 16.756 6.158 ( 5.170 1.721 0.335) 5.459 6.607 ( -7.492 13.520 3.668) 15.887 7.810 ( 1.503 7.621 1.049) 7.838 8.510 ( -3.910 -2.495 0.491) 4.664 9.300 ( 12.827 -0.767 -1.863) 12.984 9.518 ( 5.406 3.682 2.222) 6.908 9.686 ( 3.162 1.211 -1.375) 3.655 9.836 ( 1.026 0.172 -5.799) 5.892 9.982 ( 0.277 10.712 5.312) 11.960 10.497 ( -9.635 -5.465 2.516) 11.359 10.993 ( -12.134 -7.229 -2.863) 14.411 12.529 ( 12.537 6.106 -0.843) 13.970 14.181 ( 2.674 -0.792 0.306) 2.805 14.560 ( -7.059 2.311 0.300) 7.434======================= Grid point 67 (48/344) =======================q-point: ( 0.47 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.759 ( 1.911 1.390 -0.551) 2.426 2.935 ( 11.599 7.603 0.564) 13.880 3.359 ( -2.539 -3.701 -2.665) 5.220 3.627 ( 6.567 8.144 -1.453) 10.563 3.906 ( 10.433 6.872 1.886) 12.634 4.049 ( 18.747 12.331 2.628) 22.593 4.243 ( -1.944 14.440 1.387) 14.637 4.593 ( -0.464 5.211 -3.426) 6.253 4.670 ( -0.789 1.814 -0.337) 2.006 5.608 ( 8.696 8.319 2.006) 12.201 6.272 ( 4.744 2.506 1.406) 5.546 6.580 ( -9.343 8.239 4.806) 13.351 7.922 ( 2.453 6.687 3.496) 7.934 8.435 ( -1.422 -2.506 -2.945) 4.120 9.505 ( 10.858 0.207 -0.948) 10.901 9.657 ( 4.514 4.794 -0.666) 6.618 9.751 ( 4.448 -0.202 -1.216) 4.616 9.799 ( -5.152 1.929 -3.425) 6.480 10.119 ( 1.966 8.854 4.873) 10.296 10.296 ( -6.586 -5.636 2.759) 9.096 10.739 ( -8.139 -6.652 -3.706) 11.146 12.815 ( 11.348 9.570 -0.353) 14.848 14.194 ( 0.061 -1.611 -1.391) 2.129 14.441 ( -6.419 -2.342 1.350) 6.965======================= Grid point 68 (49/344) =======================q-point: ( 0.53 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.814 ( 1.889 3.022 0.138) 3.567 3.170 ( 4.817 8.964 0.363) 10.183 3.248 ( -2.861 -5.616 -1.200) 6.416 3.829 ( 6.690 8.267 -1.708) 10.772 4.121 ( 6.029 4.597 3.941) 8.545 4.258 ( -1.031 7.530 -1.105) 7.680 4.481 ( 6.137 8.971 -0.869) 10.904 4.638 ( -1.561 -1.974 -0.314) 2.536 4.714 ( 7.493 12.849 -0.769) 14.894 5.814 ( 3.305 9.631 1.508) 10.294 6.360 ( 3.732 -0.838 1.361) 4.060 6.480 ( -6.820 -0.746 4.317) 8.106 8.031 ( 1.733 4.895 5.097) 7.276 8.401 ( 1.423 -2.357 -5.347) 6.014 9.658 ( 3.644 2.728 1.550) 4.808 9.688 ( -9.569 6.094 -1.293) 11.419 9.736 ( 2.291 1.095 -2.236) 3.383 9.849 ( 7.676 -2.142 -2.669) 8.405 10.179 ( -0.191 -3.695 1.091) 3.857 10.235 ( 0.166 3.171 6.650) 7.369 10.571 ( -3.039 -4.868 -4.763) 7.458 13.100 ( 7.899 13.138 -0.059) 15.330 14.137 ( -4.937 -0.565 -1.951) 5.339 14.321 ( -0.570 -9.024 1.645) 9.190======================= Grid point 69 (50/344) =======================q-point: ( 0.60 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.874 ( -0.573 5.338 0.344) 5.379 3.145 ( 0.791 -7.233 -0.400) 7.287 3.299 ( -2.026 9.638 0.176) 9.850 3.991 ( 2.792 7.082 -2.385) 7.977 4.180 ( -1.315 -1.294 2.125) 2.815 4.316 ( -3.222 11.276 0.172) 11.728 4.565 ( 1.686 -0.829 -1.021) 2.138 4.589 ( 0.475 -2.930 0.368) 2.991 5.001 ( 3.534 15.084 -0.650) 15.506 5.888 ( -8.127 13.165 2.118) 15.616 6.365 ( -1.368 -2.950 -1.201) 3.467 6.413 ( 6.014 -10.866 4.150) 13.095 8.080 ( -1.260 1.543 3.251) 3.812 8.416 ( 3.414 -1.280 -4.065) 5.460 9.585 ( -7.807 7.908 1.723) 11.246 9.717 ( -1.118 3.185 -0.323) 3.391 9.784 ( 1.886 0.719 -0.604) 2.107 9.935 ( 7.502 -5.746 -2.825) 9.863 10.151 ( -2.381 -0.437 -0.293) 2.438 10.244 ( -0.072 -2.146 4.555) 5.036 10.526 ( 2.132 -1.943 -2.752) 3.987 13.315 ( -0.781 14.792 -0.100) 14.813 14.037 ( -3.002 -1.601 0.257) 3.412 14.254 ( 4.181 -11.335 -0.406) 12.089======================= Grid point 70 (51/344) =======================q-point: (-0.33 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.872 ( -4.315 2.932 0.119) 5.218 3.156 ( 6.713 -3.627 0.100) 7.631 3.298 ( -7.517 6.456 0.128) 9.909 4.010 ( -6.464 2.703 -1.867) 7.251 4.129 ( -2.671 -0.602 0.159) 2.742 4.336 ( -5.960 8.075 1.140) 10.101 4.554 ( -0.022 -1.382 -0.888) 1.643 4.609 ( 3.259 -2.190 0.730) 3.994 5.013 ( -14.229 4.896 0.063) 15.048 5.873 ( -8.302 12.629 1.297) 15.169 6.319 ( 2.896 -6.314 -2.254) 7.303 6.418 ( 3.071 -7.325 2.939) 8.469 8.042 ( -3.442 -0.690 0.516) 3.549 8.454 ( 2.114 -0.510 -1.284) 2.525 9.601 ( -1.752 10.494 2.450) 10.918 9.713 ( -1.402 0.935 -0.518) 1.763 9.794 ( -0.641 0.088 -0.267) 0.700 9.971 ( 2.735 -8.328 -0.504) 8.780 10.080 ( -1.878 0.290 -2.814) 3.396 10.235 ( -0.916 -1.263 2.213) 2.708 10.561 ( 3.778 -1.181 -0.378) 3.976 13.313 ( -12.441 8.042 -0.228) 14.815 14.066 ( 4.793 3.481 2.204) 6.320 14.230 ( 6.058 -10.748 -2.096) 12.514======================= Grid point 71 (52/344) =======================q-point: (-0.27 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.817 ( -3.158 -0.000 0.000) 3.158 3.168 ( -11.079 -0.000 0.000) 11.079 3.270 ( 7.682 0.000 -0.000) 7.682 3.863 ( -10.474 -0.000 0.000) 10.474 4.046 ( -7.151 -0.000 0.000) 7.151 4.269 ( -7.086 -0.000 0.000) 7.086 4.494 ( -10.845 -0.000 0.000) 10.845 4.652 ( 2.484 0.000 -0.000) 2.484 4.720 ( -14.445 -0.000 0.000) 14.445 5.790 ( -9.763 -0.000 0.000) 9.763 6.365 ( 4.972 0.000 -0.000) 4.972 6.367 ( -4.077 -0.000 0.000) 4.077 7.966 ( -4.719 -0.000 0.000) 4.719 8.470 ( 0.451 0.000 -0.000) 0.451 9.638 ( -3.934 -0.000 0.000) 3.934 9.747 ( 4.070 0.000 -0.000) 4.070 9.780 ( -0.345 -0.000 0.000) 0.345 9.851 ( -6.532 -0.000 0.000) 6.532 10.111 ( 1.405 0.000 -0.000) 1.405 10.184 ( -2.325 -0.000 0.000) 2.325 10.637 ( 6.084 0.000 -0.000) 6.084 13.101 ( -15.144 -0.000 0.000) 15.144 14.185 ( 2.312 0.000 -0.000) 2.312 14.278 ( 8.661 0.000 -0.000) 8.661======================= Grid point 80 (53/344) =======================q-point: ( 0.33 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.311 ( -0.000 2.333 -0.106) 2.336 2.770 ( -0.000 2.609 -1.098) 2.830 2.903 ( -0.000 11.246 4.758) 12.211 3.381 ( -0.000 18.126 -0.485) 18.132 3.383 ( -0.000 3.994 -3.945) 5.614 3.615 ( 0.000 -3.257 -1.253) 3.490 4.199 ( 0.000 11.322 5.241) 12.477 4.501 ( -0.000 6.365 0.371) 6.376 4.659 ( -0.000 8.045 -6.361) 10.256 5.248 ( -0.000 13.345 4.626) 14.124 6.074 ( -0.000 7.481 -0.761) 7.519 6.750 ( -0.000 14.770 3.922) 15.282 7.793 ( -0.000 8.982 -1.588) 9.121 8.658 ( 0.000 -0.982 1.903) 2.141 8.965 ( 0.000 -6.489 0.113) 6.490 9.387 ( 0.000 0.436 3.515) 3.542 9.636 ( -0.000 3.651 -1.324) 3.884 9.783 ( -0.000 3.789 -3.796) 5.364 9.999 ( -0.000 9.894 1.337) 9.984 10.694 ( 0.000 -4.820 2.820) 5.584 11.348 ( 0.000 -9.466 -2.302) 9.742 12.181 ( -0.000 3.608 -1.643) 3.965 14.125 ( 0.000 2.347 1.359) 2.712 14.710 ( -0.000 3.723 -0.273) 3.733======================= Grid point 81 (54/344) =======================q-point: ( 0.40 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.429 ( 11.252 1.667 -0.595) 11.391 2.749 ( -1.280 0.320 -1.553) 2.038 3.153 ( 12.558 8.007 3.422) 15.281 3.474 ( 6.073 2.004 -5.502) 8.436 3.576 ( 2.041 1.225 -0.066) 2.382 3.603 ( 3.093 15.431 3.088) 16.038 4.305 ( -1.338 10.603 4.253) 11.502 4.596 ( 3.238 5.733 -0.278) 6.590 4.698 ( -2.254 6.374 -4.910) 8.355 5.344 ( 3.879 -0.077 2.691) 4.722 6.192 ( 0.426 13.262 0.297) 13.272 6.863 ( -4.740 13.172 5.573) 15.067 7.880 ( 0.246 8.530 -0.782) 8.569 8.571 ( -5.918 -2.757 0.092) 6.530 9.032 ( 12.596 -5.465 -0.094) 13.731 9.445 ( 4.623 1.231 2.285) 5.302 9.676 ( 0.743 3.290 -1.208) 3.582 9.817 ( 1.350 2.660 -5.543) 6.294 10.110 ( -0.397 11.339 4.985) 12.393 10.605 ( -6.273 -2.972 1.049) 7.020 11.128 ( -11.664 -8.675 -2.187) 14.700 12.339 ( 12.718 3.335 -1.123) 13.196 14.157 ( 0.631 1.543 0.680) 1.800 14.697 ( -4.954 2.422 -0.216) 5.519======================= Grid point 82 (55/344) =======================q-point: ( 0.47 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.692 ( 12.472 1.932 -0.144) 12.621 2.762 ( 6.190 0.608 -0.802) 6.271 3.362 ( 0.562 0.275 -1.600) 1.718 3.540 ( 8.595 1.465 -1.128) 8.791 3.762 ( 13.156 5.157 -1.511) 14.211 3.891 ( 11.196 12.245 5.438) 17.461 4.395 ( -1.138 10.745 2.418) 11.073 4.692 ( 1.375 4.249 -0.863) 4.548 4.694 ( -3.458 5.350 -3.553) 7.294 5.448 ( 11.064 -4.070 2.174) 11.987 6.315 ( -1.083 11.080 0.318) 11.138 6.865 ( -9.829 9.586 5.748) 14.884 7.972 ( 1.152 7.511 1.885) 7.829 8.448 ( -4.158 -3.149 -2.714) 5.880 9.233 ( 15.551 -4.533 -0.729) 16.214 9.565 ( 7.159 0.571 1.371) 7.311 9.717 ( 0.667 2.838 -1.302) 3.193 9.855 ( 1.134 2.598 -3.702) 4.663 10.226 ( -0.423 10.432 5.385) 11.748 10.426 ( -11.301 -2.119 0.197) 11.499 10.835 ( -11.032 -7.401 -2.743) 13.564 12.635 ( 16.385 4.520 -0.558) 17.006 14.169 ( -0.092 -0.427 -0.118) 0.453 14.591 ( -9.002 0.789 0.182) 9.038======================= Grid point 83 (56/344) =======================q-point: ( 0.53 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.781 ( 3.710 0.899 -0.110) 3.819 3.048 ( 15.710 3.588 0.208) 16.116 3.274 ( -5.349 -3.252 -1.104) 6.357 3.750 ( 10.044 4.339 -1.320) 11.021 4.027 ( 10.483 4.766 0.501) 11.526 4.196 ( 11.443 2.792 2.674) 12.078 4.498 ( 1.167 7.723 0.449) 7.823 4.670 ( -2.692 1.262 -1.119) 3.177 4.758 ( 1.868 9.432 -1.456) 9.724 5.662 ( 16.026 -2.025 1.622) 16.234 6.362 ( -2.983 4.658 0.549) 5.558 6.739 ( -14.208 5.124 3.890) 15.597 8.078 ( 1.625 6.590 5.435) 8.696 8.355 ( -1.508 -3.607 -5.893) 7.072 9.457 ( 14.666 -3.386 -0.633) 15.065 9.684 ( 5.744 -1.277 0.054) 5.884 9.748 ( 0.060 2.541 -0.747) 2.649 9.893 ( -0.432 5.273 -1.573) 5.520 10.198 ( -10.065 -3.822 0.396) 10.773 10.320 ( -0.867 7.458 5.273) 9.174 10.605 ( -7.202 -5.310 -4.102) 9.843 12.976 ( 16.501 6.135 -0.163) 17.606 14.147 ( -0.681 -2.066 -0.944) 2.371 14.409 ( -11.563 -1.308 0.789) 11.664======================= Grid point 84 (57/344) =======================q-point: ( 0.60 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.875 ( 5.235 2.374 0.219) 5.752 3.134 ( -6.128 -3.550 -0.480) 7.099 3.306 ( 8.841 3.299 0.084) 9.436 3.949 ( 8.273 3.692 -0.770) 9.092 4.172 ( 1.853 0.401 1.310) 2.305 4.358 ( 6.269 2.516 -0.245) 6.760 4.538 ( -0.343 0.208 -0.027) 0.402 4.614 ( -4.049 -0.064 -0.357) 4.065 4.997 ( 11.094 9.982 -0.614) 14.936 5.932 ( 13.573 1.543 0.969) 13.694 6.311 ( -4.033 -1.829 1.256) 4.603 6.512 ( -15.057 0.909 0.948) 15.114 8.149 ( -2.321 3.732 5.365) 6.935 8.321 ( 3.897 -2.556 -5.600) 7.286 9.659 ( 11.462 -1.729 0.118) 11.592 9.724 ( 0.213 -0.104 0.976) 1.004 9.751 ( -1.715 0.902 -0.945) 2.156 9.898 ( -6.715 5.285 -2.586) 8.928 10.091 ( 4.420 -4.527 2.095) 6.665 10.332 ( -6.374 2.701 3.143) 7.603 10.485 ( -0.205 -1.913 -3.363) 3.875 13.308 ( 13.617 6.376 0.046) 15.035 14.109 ( -1.258 -1.315 -2.001) 2.705 14.185 ( -10.485 -3.988 1.807) 11.363======================= Grid point 85 (58/344) =======================q-point: (-0.33 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.992 ( -6.693 -0.000 0.000) 6.693 3.007 ( 7.254 0.000 -0.000) 7.254 3.401 ( -0.214 -0.000 0.000) 0.214 4.090 ( 5.003 0.000 -0.000) 5.003 4.134 ( -4.749 -0.000 0.000) 4.749 4.451 ( -0.250 -0.000 0.000) 0.250 4.532 ( 0.500 0.000 -0.000) 0.500 4.555 ( -0.319 -0.000 0.000) 0.319 5.184 ( 1.034 0.000 -0.000) 1.034 6.065 ( -3.081 -0.000 0.000) 3.081 6.290 ( 5.954 0.000 -0.000) 5.954 6.296 ( -7.694 -0.000 0.000) 7.694 8.107 ( -3.917 -0.000 0.000) 3.917 8.391 ( 4.599 0.000 -0.000) 4.599 9.700 ( -3.074 -0.000 0.000) 3.074 9.724 ( -0.908 -0.000 0.000) 0.908 9.822 ( -2.778 -0.000 0.000) 2.778 9.827 ( 8.303 0.000 -0.000) 8.303 10.150 ( -0.808 -0.000 0.000) 0.808 10.230 ( -2.649 -0.000 0.000) 2.649 10.503 ( 2.391 0.000 -0.000) 2.391 13.493 ( 0.181 0.000 -0.000) 0.181 14.024 ( -1.341 -0.000 0.000) 1.341 14.107 ( 1.391 0.000 -0.000) 1.391======================= Grid point 96 (59/344) =======================q-point: ( 0.40 0.40 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.330 ( -0.000 0.415 -0.969) 1.054 2.750 ( -0.000 -1.801 -3.581) 4.008 3.127 ( 0.000 7.420 8.421) 11.224 3.428 ( -0.000 2.992 -6.966) 7.581 3.547 ( 0.000 -2.475 -0.636) 2.556 3.747 ( -0.000 15.499 2.828) 15.755 4.424 ( -0.000 9.358 3.419) 9.963 4.613 ( -0.000 4.461 0.434) 4.482 4.769 ( -0.000 5.533 -4.091) 6.881 5.263 ( 0.000 -8.435 1.478) 8.564 6.347 ( -0.000 15.540 -0.051) 15.540 7.042 ( 0.000 11.123 6.711) 12.991 7.957 ( -0.000 7.583 -1.653) 7.761 8.624 ( 0.000 -2.427 -0.934) 2.601 8.831 ( 0.000 -6.288 0.811) 6.340 9.422 ( 0.000 1.550 1.300) 2.023 9.699 ( -0.000 2.852 -0.593) 2.913 9.821 ( -0.000 2.704 -4.905) 5.601 10.237 ( 0.000 10.580 5.483) 11.916 10.642 ( -0.000 -0.716 -0.444) 0.842 11.146 ( 0.000 -9.868 -1.613) 9.999 12.236 ( -0.000 2.466 -1.074) 2.690 14.177 ( -0.000 2.254 0.548) 2.320 14.762 ( -0.000 1.679 -0.286) 1.703======================= Grid point 97 (60/344) =======================q-point: ( 0.47 0.40 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.448 ( 12.787 0.677 -0.380) 12.811 2.721 ( 0.091 -1.386 -2.107) 2.524 3.299 ( 8.813 4.308 5.478) 11.235 3.447 ( 0.324 -1.265 -4.580) 4.763 3.591 ( 8.729 1.682 -1.598) 9.032 3.910 ( 2.841 10.635 3.115) 11.440 4.513 ( -0.751 8.498 2.137) 8.795 4.681 ( 2.524 2.547 0.031) 3.586 4.796 ( -1.833 5.589 -3.164) 6.679 5.219 ( 6.435 -9.888 1.517) 11.894 6.466 ( -2.021 11.065 -0.405) 11.256 7.104 ( -5.696 7.779 5.791) 11.247 8.026 ( 0.745 5.869 -0.327) 5.925 8.507 ( -6.539 -2.841 -1.761) 7.343 8.928 ( 13.349 -4.272 0.080) 14.016 9.475 ( 4.083 0.980 0.736) 4.263 9.729 ( 0.674 2.114 -0.396) 2.254 9.845 ( 1.082 1.971 -3.177) 3.892 10.339 ( -0.455 7.772 5.047) 9.278 10.591 ( -6.518 2.409 -1.167) 7.047 10.938 ( -10.375 -9.331 -1.707) 14.057 12.388 ( 13.739 1.886 -0.613) 13.881 14.188 ( -1.086 1.216 0.215) 1.645 14.728 ( -5.291 0.863 -0.127) 5.363======================= Grid point 98 (61/344) =======================q-point: ( 0.53 0.40 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.720 ( 5.968 0.822 0.570) 6.051 2.757 ( 15.796 -0.328 -1.071) 15.836 3.344 ( -4.696 -0.714 -0.321) 4.760 3.567 ( 12.806 0.933 -0.392) 12.846 3.833 ( 15.137 2.099 -0.781) 15.302 4.071 ( 6.515 3.898 2.419) 7.968 4.571 ( -1.167 5.076 0.854) 5.278 4.707 ( -0.671 -0.105 -0.241) 0.721 4.821 ( -1.022 5.361 -1.938) 5.791 5.336 ( 15.712 -5.280 1.240) 16.622 6.489 ( -4.480 4.890 -0.188) 6.634 7.021 ( -11.493 3.604 2.872) 12.383 8.106 ( 2.562 4.120 1.980) 5.240 8.372 ( -5.330 -2.432 -2.779) 6.485 9.154 ( 15.957 -2.354 -0.203) 16.131 9.574 ( 6.088 0.124 0.231) 6.094 9.760 ( 0.782 1.274 -0.151) 1.503 9.884 ( 2.292 1.125 -1.273) 2.853 10.367 ( -5.441 0.322 1.873) 5.764 10.477 ( -9.802 8.116 1.568) 12.822 10.670 ( -8.344 -7.804 -2.618) 11.720 12.696 ( 18.813 1.657 -0.206) 18.887 14.164 ( -2.247 -0.092 -0.083) 2.250 14.599 ( -9.912 0.124 0.072) 9.913======================= Grid point 99 (62/344) =======================q-point: (-0.40 -0.60 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.791 ( 4.823 0.000 -0.000) 4.823 3.084 ( 17.328 0.000 -0.000) 17.328 3.237 ( -6.606 -0.000 0.000) 6.606 3.789 ( 11.604 0.000 -0.000) 11.604 4.083 ( 10.504 0.000 -0.000) 10.504 4.223 ( 8.698 0.000 -0.000) 8.698 4.568 ( -1.861 -0.000 0.000) 1.861 4.677 ( -2.738 -0.000 0.000) 2.738 4.880 ( 5.848 0.000 -0.000) 5.848 5.627 ( 19.172 0.000 -0.000) 19.172 6.415 ( -6.346 -0.000 0.000) 6.346 6.801 ( -15.733 -0.000 0.000) 15.733 8.202 ( 4.996 0.000 -0.000) 4.996 8.260 ( -5.090 -0.000 0.000) 5.090 9.415 ( 15.069 0.000 -0.000) 15.069 9.672 ( 4.690 0.000 -0.000) 4.690 9.773 ( -0.142 -0.000 0.000) 0.142 9.953 ( 5.332 0.000 -0.000) 5.332 10.151 ( -14.819 -0.000 0.000) 14.819 10.463 ( -0.808 -0.000 0.000) 0.808 10.489 ( -7.530 -0.000 0.000) 7.530 13.040 ( 18.999 0.000 -0.000) 18.999 14.121 ( -2.066 -0.000 0.000) 2.066 14.397 ( -13.015 -0.000 0.000) 13.015======================= Grid point 113 (63/344) =======================q-point: ( 0.47 0.47 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.330 ( -0.000 0.078 -0.393) 0.400 2.705 ( -0.000 -1.041 -1.625) 1.930 3.258 ( 0.000 2.327 5.155) 5.656 3.444 ( -0.000 1.278 -4.581) 4.756 3.510 ( 0.000 -0.948 -0.164) 0.962 3.979 ( -0.000 5.856 1.464) 6.036 4.597 ( -0.000 5.803 1.145) 5.915 4.676 ( -0.000 1.597 0.190) 1.608 4.857 ( -0.000 5.013 -1.725) 5.301 5.062 ( 0.000 -9.958 0.818) 9.992 6.573 ( -0.000 6.051 -0.462) 6.069 7.227 ( 0.000 4.336 3.688) 5.693 8.062 ( -0.000 3.062 -0.703) 3.142 8.572 ( -0.000 -1.574 -1.162) 1.956 8.743 ( 0.000 -2.445 0.357) 2.471 9.450 ( 0.000 0.682 0.334) 0.759 9.737 ( -0.000 1.033 -0.168) 1.047 9.847 ( -0.000 1.164 -1.676) 2.041 10.411 ( 0.000 3.735 3.051) 4.823 10.677 ( -0.000 4.303 -0.999) 4.417 10.953 ( 0.000 -7.728 -0.862) 7.776 12.267 ( -0.000 0.878 -0.372) 0.954 14.212 ( -0.000 0.941 0.145) 0.952 14.781 ( -0.000 0.435 -0.101) 0.446======================= Grid point 114 (64/344) =======================q-point: (-0.47 -0.53 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.454 ( 13.507 0.000 -0.000) 13.507 2.699 ( 0.494 0.000 -0.000) 0.494 3.365 ( 9.621 0.000 -0.000) 9.621 3.412 ( -3.106 -0.000 0.000) 3.106 3.607 ( 10.598 0.000 -0.000) 10.598 4.026 ( 2.084 0.000 -0.000) 2.084 4.621 ( -0.981 -0.000 0.000) 0.981 4.700 ( 1.119 0.000 -0.000) 1.119 4.876 ( -1.641 -0.000 0.000) 1.641 5.078 ( 9.233 0.000 -0.000) 9.233 6.579 ( -2.626 -0.000 0.000) 2.626 7.199 ( -6.207 -0.000 0.000) 6.207 8.090 ( 1.502 0.000 -0.000) 1.502 8.468 ( -6.992 -0.000 0.000) 6.992 8.883 ( 13.301 0.000 -0.000) 13.301 9.487 ( 3.757 0.000 -0.000) 3.757 9.750 ( 0.810 0.000 -0.000) 0.810 9.860 ( 0.994 0.000 -0.000) 0.994 10.422 ( -1.249 -0.000 0.000) 1.249 10.679 ( -2.977 -0.000 0.000) 2.977 10.782 ( -12.811 -0.000 0.000) 12.811 12.406 ( 14.109 0.000 -0.000) 14.109 14.202 ( -1.712 -0.000 0.000) 1.712 14.735 ( -5.414 -0.000 0.000) 5.414======================= Grid point 245 (65/344) =======================q-point: ( 0.07 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 344Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.217 ( 0.000 -0.000 32.370) 32.370 0.217 ( 0.000 -0.000 32.370) 32.370 0.398 ( 0.000 -0.000 59.785) 59.785 2.524 ( -0.000 0.000 -8.692) 8.692 2.524 ( -0.000 0.000 -8.692) 8.692 2.986 ( 0.000 0.000 5.866) 5.866 2.986 ( 0.000 -0.000 5.866) 5.866 4.112 ( -0.000 0.000 -0.606) 0.606 4.112 ( -0.000 0.000 -0.606) 0.606 4.269 ( -0.000 0.000 -6.271) 6.271 4.526 ( -0.000 0.000 -3.121) 3.121 6.957 ( 0.000 -0.000 2.132) 2.132 8.882 ( 0.000 0.000 0.057) 0.057 8.882 ( 0.000 -0.000 0.057) 0.057 9.223 ( 0.000 0.000 0.014) 0.014 9.223 ( -0.000 -0.000 0.014) 0.014 9.385 ( 0.000 -0.000 1.511) 1.511 9.869 ( -0.000 0.000 -1.330) 1.330 10.017 ( 0.000 0.000 0.694) 0.694 10.017 ( 0.000 -0.000 0.694) 0.694 11.895 ( -0.000 0.000 -0.538) 0.538 11.895 ( -0.000 -0.000 -0.538) 0.538 13.676 ( -0.000 0.000 -0.000) 0.000 16.958 ( 0.000 -0.000 0.040) 0.040======================= Grid point 246 (66/344) =======================q-point: ( 0.13 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.712 ( 24.743 14.285 13.841) 31.747 0.757 ( 26.890 15.525 13.945) 34.037 1.299 ( 46.765 27.000 21.153) 57.995 2.581 ( 5.888 3.399 -9.928) 12.033 2.599 ( 8.185 4.725 -11.882) 15.182 2.975 ( -1.504 -0.868 6.482) 6.711 3.205 ( 9.273 5.354 5.092) 11.856 4.098 ( -0.049 -0.029 -5.647) 5.647 4.124 ( 1.204 0.695 -0.617) 1.521 4.240 ( -1.087 -0.628 -0.916) 1.554 4.628 ( 12.309 7.107 -3.034) 14.533 6.930 ( -2.744 -1.584 2.091) 3.796 7.480 ( -10.301 -5.947 33.439) 35.491 8.911 ( 2.265 1.308 0.627) 2.690 9.205 ( -1.354 -0.782 -7.842) 7.996 9.234 ( 1.100 0.635 -0.338) 1.315 9.298 ( -10.493 -6.058 5.608) 13.351 9.936 ( 5.426 3.133 -4.768) 7.874 9.963 ( -4.469 -2.580 0.385) 5.175 11.477 ( -4.978 -2.874 -32.121) 32.631 11.919 ( 1.933 1.116 -0.371) 2.263 12.148 ( 15.836 9.143 -31.237) 36.196 13.799 ( 10.566 6.100 -0.630) 12.217 14.442 ( -43.102 -24.885 99.995) 111.697======================= Grid point 247 (67/344) =======================q-point: ( 0.20 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.295 ( 22.895 13.218 8.898) 27.894 1.404 ( 26.458 15.275 8.303) 31.659 2.403 ( 44.140 25.484 9.885) 51.918 2.734 ( 9.006 5.200 -11.893) 15.798 2.799 ( 10.739 6.200 -12.502) 17.609 2.950 ( -1.917 -1.107 8.293) 8.584 3.462 ( 11.414 6.590 9.058) 15.992 4.101 ( -0.304 -0.175 -7.216) 7.224 4.169 ( 2.826 1.632 -0.363) 3.283 4.224 ( 2.302 1.329 2.569) 3.697 5.031 ( 22.000 12.702 -5.232) 25.937 6.831 ( -6.252 -3.610 0.634) 7.247 7.482 ( 2.917 1.684 10.286) 10.823 8.953 ( -13.108 -7.568 -1.082) 15.174 8.985 ( 3.879 2.240 0.891) 4.567 9.261 ( 1.762 1.017 -0.415) 2.076 9.267 ( 1.584 0.915 -0.368) 1.866 9.826 ( -7.031 -4.059 0.498) 8.133 10.041 ( 4.414 2.548 -3.997) 6.477 11.155 ( -15.035 -8.681 -6.289) 18.465 11.977 ( 3.005 1.735 -0.617) 3.524 12.124 ( -8.984 -5.187 -5.816) 11.893 14.062 ( 0.173 0.100 12.286) 12.287 14.140 ( 6.158 3.555 15.983) 17.493======================= Grid point 248 (68/344) =======================q-point: ( 0.27 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.784 ( 17.502 10.105 5.492) 20.942 1.995 ( 22.980 13.268 4.856) 26.976 2.909 ( 4.262 2.460 -7.192) 8.714 2.953 ( 4.651 2.685 4.751) 7.170 2.967 ( 8.617 4.975 -11.257) 15.024 3.334 ( 28.940 16.708 2.667) 33.523 3.774 ( 13.089 7.557 9.226) 17.708 4.078 ( 4.199 2.424 -0.482) 4.872 4.254 ( 4.549 2.626 0.009) 5.253 4.391 ( 10.462 6.040 -0.793) 12.107 5.558 ( 22.994 13.276 -4.301) 26.897 6.653 ( -8.470 -4.890 -0.829) 9.816 7.604 ( 5.679 3.279 4.366) 7.878 8.696 ( -8.657 -4.998 0.930) 10.039 9.088 ( 4.743 2.738 0.637) 5.513 9.285 ( -0.792 -0.457 0.521) 1.052 9.326 ( 4.241 2.449 -1.915) 5.259 9.670 ( -5.605 -3.236 0.470) 6.489 10.125 ( 3.602 2.079 -2.549) 4.878 10.830 ( -11.776 -6.799 0.738) 13.618 11.859 ( -11.805 -6.815 -1.832) 13.753 12.050 ( 3.339 1.928 -1.111) 4.012 14.028 ( -1.127 -0.651 7.288) 7.404 14.424 ( 11.267 6.505 2.098) 13.179======================= Grid point 249 (69/344) =======================q-point: ( 0.33 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.111 ( 10.052 5.804 1.739) 11.737 2.455 ( 15.373 8.876 1.090) 17.785 2.936 ( 0.677 0.391 7.475) 7.516 3.142 ( 9.516 5.494 -5.847) 12.447 3.153 ( 10.335 5.967 -7.343) 14.012 3.665 ( 2.105 1.215 -2.435) 3.440 3.977 ( 8.046 4.645 7.531) 11.959 4.372 ( 5.423 3.131 0.253) 6.267 4.483 ( 18.935 10.932 -5.299) 22.498 4.699 ( 18.769 10.836 6.521) 22.632 5.967 ( 9.852 5.688 -3.229) 11.825 6.525 ( 0.992 0.573 -0.176) 1.159 7.752 ( 6.491 3.748 2.444) 7.884 8.559 ( -3.604 -2.081 0.325) 4.175 9.185 ( -1.420 -0.820 -4.942) 5.207 9.214 ( -0.588 -0.340 7.396) 7.427 9.458 ( 7.599 4.387 -2.535) 9.134 9.610 ( 0.399 0.230 -0.353) 0.581 10.201 ( 3.338 1.927 -0.136) 3.856 10.627 ( -6.207 -3.584 1.989) 7.438 11.595 ( -10.570 -6.103 -1.957) 12.362 12.122 ( 3.163 1.826 -1.504) 3.950 14.039 ( 0.969 0.560 1.895) 2.201 14.644 ( 7.399 4.272 1.747) 8.720======================= Grid point 250 (70/344) =======================q-point: ( 0.40 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.270 ( 4.181 2.414 -0.479) 4.852 2.690 ( 5.634 3.253 -1.659) 6.714 2.980 ( 1.467 0.847 6.618) 6.832 3.375 ( 9.684 5.591 -4.958) 12.232 3.411 ( 13.800 7.968 -0.611) 15.947 3.621 ( -3.234 -1.867 -1.142) 3.905 4.208 ( 9.563 5.521 5.253) 12.228 4.495 ( 4.924 2.843 0.364) 5.697 4.718 ( 6.015 3.473 -5.547) 8.889 5.162 ( 12.731 7.350 3.556) 15.124 6.042 ( 3.779 2.182 -1.722) 4.691 6.705 ( 9.939 5.738 2.767) 11.805 7.919 ( 7.606 4.391 1.196) 8.864 8.516 ( -0.370 -0.214 -1.225) 1.298 9.021 ( -7.899 -4.561 1.158) 9.194 9.306 ( 3.818 2.204 1.469) 4.647 9.652 ( 2.580 1.489 -0.537) 3.027 9.652 ( 9.307 5.374 -3.353) 11.258 10.276 ( 2.551 1.473 3.885) 4.876 10.543 ( -1.245 -0.719 -0.099) 1.441 11.361 ( -9.410 -5.433 -1.908) 11.032 12.187 ( 2.644 1.526 -1.514) 3.408 14.076 ( 1.893 1.093 0.351) 2.213 14.779 ( 4.153 2.398 1.149) 4.931======================= Grid point 251 (71/344) =======================q-point: ( 0.47 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.329 ( 1.502 0.867 -0.751) 1.890 2.757 ( 1.286 0.743 -1.332) 1.995 3.023 ( 1.085 0.627 4.474) 4.646 3.547 ( -2.597 -1.500 0.222) 3.007 3.560 ( 6.795 3.923 -3.154) 8.456 3.724 ( 12.033 6.947 0.127) 13.895 4.424 ( 8.225 4.749 3.494) 10.120 4.593 ( 3.323 1.919 0.454) 3.864 4.797 ( 2.338 1.350 -3.384) 4.329 5.207 ( -6.174 -3.565 0.359) 7.139 6.268 ( 13.476 7.781 -1.081) 15.599 6.882 ( 3.981 2.298 5.769) 7.376 8.095 ( 7.062 4.077 -0.522) 8.171 8.522 ( 0.910 0.525 -1.570) 1.889 8.860 ( -5.908 -3.411 1.056) 6.903 9.383 ( 2.508 1.448 0.769) 2.996 9.708 ( 2.178 1.257 -0.338) 2.537 9.845 ( 7.614 4.396 -4.206) 9.746 10.317 ( -0.315 -0.182 6.814) 6.823 10.577 ( 4.341 2.506 -1.985) 5.391 11.149 ( -8.623 -4.978 -1.545) 10.076 12.236 ( 1.840 1.063 -1.075) 2.381 14.121 ( 1.847 1.066 0.165) 2.139 14.848 ( 1.846 1.066 0.321) 2.156======================= Grid point 252 (72/344) =======================q-point: ( 0.53 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.349 ( 0.472 0.272 -0.399) 0.675 2.769 ( 0.279 0.161 -0.437) 0.543 3.045 ( 0.013 0.008 2.682) 2.682 3.505 ( -1.001 -0.578 0.366) 1.212 3.664 ( 2.600 1.501 -2.366) 3.823 3.926 ( 4.687 2.706 -0.039) 5.412 4.590 ( 4.597 2.654 1.512) 5.519 4.646 ( 1.129 0.652 0.525) 1.405 4.847 ( 3.369 1.945 -0.598) 3.936 5.016 ( -8.295 -4.789 -0.099) 9.578 6.531 ( 7.830 4.521 -1.761) 9.211 6.917 ( -1.615 -0.932 6.592) 6.851 8.214 ( 2.957 1.707 -1.793) 3.857 8.542 ( 0.850 0.491 -0.386) 1.055 8.764 ( -2.330 -1.345 0.234) 2.701 9.423 ( 0.825 0.476 0.395) 1.031 9.744 ( 0.846 0.488 -0.120) 0.984 9.970 ( 3.733 2.155 -3.791) 5.740 10.301 ( -1.828 -1.055 4.816) 5.258 10.706 ( 5.788 3.342 -0.758) 6.726 10.965 ( -6.276 -3.623 -0.889) 7.301 12.265 ( 0.796 0.459 -0.359) 0.986 14.154 ( 0.816 0.471 0.474) 1.055 14.872 ( 0.377 0.218 -0.625) 0.761======================= Grid point 253 (73/344) =======================q-point: (-0.40 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.352 ( -0.144 -0.083 0.067) 0.179 2.775 ( 0.302 0.174 0.521) 0.627 3.033 ( -1.380 -0.797 1.080) 1.924 3.504 ( 0.874 0.504 0.340) 1.065 3.668 ( -1.848 -1.067 -1.825) 2.808 3.924 ( -4.777 -2.758 -0.480) 5.537 4.574 ( -5.952 -3.436 -0.698) 6.908 4.646 ( -1.244 -0.718 0.500) 1.521 4.858 ( -2.286 -1.320 1.120) 2.867 5.023 ( 8.480 4.896 0.628) 9.812 6.553 ( -6.508 -3.758 1.097) 7.595 6.886 ( -1.217 -0.703 2.572) 2.931 8.210 ( -2.966 -1.712 -2.372) 4.166 8.555 ( 0.195 0.113 1.554) 1.571 8.758 ( 1.836 1.060 -0.670) 2.223 9.422 ( -0.974 -0.563 0.241) 1.150 9.745 ( -0.749 -0.433 0.026) 0.866 9.994 ( -1.327 -0.766 -0.719) 1.693 10.264 ( -1.772 -1.023 -0.152) 2.051 10.711 ( -4.963 -2.866 -0.048) 5.731 10.975 ( 6.872 3.968 0.467) 7.949 12.270 ( -0.396 -0.228 0.313) 0.554 14.157 ( -0.710 -0.410 0.890) 1.210 14.866 ( -0.699 -0.404 -1.516) 1.718======================= Grid point 254 (74/344) =======================q-point: (-0.33 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.339 ( -1.216 -0.702 0.679) 1.559 2.778 ( -0.700 -0.404 1.721) 1.902 2.985 ( -2.797 -1.615 -1.023) 3.388 3.546 ( 2.423 1.399 0.343) 2.819 3.576 ( -5.602 -3.234 -0.736) 6.510 3.723 ( -11.623 -6.711 -0.600) 13.435 4.386 ( -9.100 -5.254 -1.912) 10.681 4.592 ( -3.443 -1.988 0.334) 3.989 4.827 ( -1.569 -0.906 1.184) 2.164 5.214 ( 5.767 3.330 1.048) 6.741 6.293 ( -14.091 -8.135 2.374) 16.443 6.839 ( -4.044 -2.335 -0.132) 4.671 8.078 ( -7.461 -4.308 -2.895) 9.089 8.558 ( -0.445 -0.257 3.415) 3.454 8.843 ( 5.585 3.225 -1.301) 6.579 9.380 ( -2.632 -1.520 0.394) 3.065 9.711 ( -2.091 -1.207 0.070) 2.416 9.899 ( -7.020 -4.053 3.355) 8.773 10.223 ( -1.131 -0.653 -6.538) 6.667 10.606 ( -3.351 -1.935 2.149) 4.426 11.166 ( 8.838 5.103 0.826) 10.239 12.248 ( -1.580 -0.912 0.639) 1.933 14.128 ( -1.892 -1.092 1.152) 2.469 14.831 ( -2.067 -1.194 -2.117) 3.190======================= Grid point 255 (75/344) =======================q-point: (-0.27 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.283 ( -4.430 -2.558 1.421) 5.310 2.718 ( -6.012 -3.471 2.633) 7.425 2.905 ( -3.354 -1.936 -4.297) 5.785 3.418 ( -12.139 -7.009 0.003) 14.017 3.419 ( -7.744 -4.471 1.637) 9.090 3.630 ( 3.465 2.001 0.221) 4.008 4.155 ( -10.583 -6.110 -2.459) 12.465 4.493 ( -5.032 -2.905 0.056) 5.810 4.760 ( -4.795 -2.768 0.485) 5.558 5.143 ( -15.308 -8.838 1.034) 17.706 6.064 ( -3.322 -1.918 1.451) 4.101 6.682 ( -9.086 -5.246 -0.308) 10.496 7.883 ( -8.161 -4.712 -3.774) 10.151 8.556 ( -0.250 -0.145 4.248) 4.258 8.997 ( 7.606 4.392 -2.088) 9.028 9.307 ( -3.635 -2.099 1.494) 4.455 9.655 ( -2.565 -1.481 -0.059) 2.962 9.708 ( -9.570 -5.525 4.865) 12.074 10.181 ( -0.971 -0.560 -9.288) 9.355 10.580 ( 0.596 0.344 4.428) 4.481 11.378 ( 9.368 5.409 0.484) 10.828 12.201 ( -2.589 -1.495 0.494) 3.030 14.081 ( -2.294 -1.324 1.107) 2.871 14.755 ( -4.203 -2.427 -2.206) 5.332======================= Grid point 256 (76/344) =======================q-point: (-0.20 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.108 ( -11.589 -6.691 1.417) 13.457 2.457 ( -17.222 -9.943 1.744) 19.963 2.831 ( -1.529 -0.883 -7.900) 8.095 3.204 ( -6.398 -3.694 2.382) 7.762 3.240 ( -8.250 -4.763 5.257) 10.880 3.687 ( -1.252 -0.723 0.711) 1.611 3.897 ( -9.967 -5.754 -3.751) 12.104 4.369 ( -5.447 -3.145 -0.221) 6.294 4.557 ( -26.711 -15.421 5.825) 31.388 4.616 ( -12.290 -7.096 -5.732) 15.306 5.997 ( -9.632 -5.561 0.939) 11.162 6.526 ( -0.072 -0.042 -0.047) 0.096 7.702 ( -6.701 -3.869 -4.494) 8.948 8.580 ( 2.134 1.232 3.204) 4.042 9.125 ( 1.358 0.784 -5.657) 5.871 9.259 ( 0.877 0.506 5.926) 6.012 9.512 ( -7.908 -4.565 5.437) 10.627 9.611 ( -0.518 -0.299 -0.298) 0.669 10.137 ( -1.039 -0.600 -8.956) 9.036 10.661 ( 5.690 3.285 6.257) 9.073 11.602 ( 10.080 5.819 -1.020) 11.684 12.133 ( -3.275 -1.891 -0.018) 3.781 14.030 ( -2.244 -1.295 0.735) 2.693 14.621 ( -7.154 -4.130 -1.477) 8.392======================= Grid point 257 (77/344) =======================q-point: (-0.13 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.750 ( -19.284 -11.134 0.703) 22.278 1.968 ( -24.458 -14.121 1.101) 28.263 2.795 ( -0.404 -0.233 -11.360) 11.370 3.072 ( -7.321 -4.227 9.583) 12.779 3.078 ( -6.965 -4.021 3.801) 8.895 3.332 ( -31.181 -18.002 2.394) 36.084 3.668 ( -13.865 -8.005 -5.231) 16.842 4.081 ( -3.984 -2.300 -0.155) 4.603 4.252 ( -4.429 -2.557 -0.355) 5.126 4.385 ( -9.506 -5.488 -1.219) 11.044 5.589 ( -22.514 -12.999 0.133) 25.997 6.661 ( 8.326 4.807 0.037) 9.614 7.545 ( -6.194 -3.576 -3.864) 8.129 8.692 ( 7.605 4.391 0.379) 8.789 9.059 ( -3.902 -2.253 -3.061) 5.446 9.308 ( -0.027 -0.015 3.255) 3.255 9.378 ( -4.810 -2.777 5.600) 7.887 9.670 ( 5.732 3.309 0.472) 6.635 10.092 ( -1.433 -0.827 -7.212) 7.399 10.888 ( 12.769 7.372 8.681) 17.110 11.838 ( 10.864 6.272 -4.858) 13.453 12.053 ( -3.485 -2.012 -0.609) 4.070 13.978 ( -2.521 -1.456 0.390) 2.938 14.416 ( -10.469 -6.044 0.867) 12.120======================= Grid point 258 (78/344) =======================q-point: (-0.07 0.07 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.242 ( -24.387 -14.080 1.374) 28.193 1.362 ( -27.983 -16.156 2.198) 32.387 2.362 ( -47.182 -27.241 4.262) 54.648 2.719 ( -4.207 -2.429 -11.750) 12.715 2.912 ( -10.216 -5.898 1.798) 11.933 2.978 ( -2.363 -1.364 10.130) 10.491 3.363 ( -11.001 -6.351 -3.428) 13.157 4.122 ( 2.911 1.681 -7.282) 8.020 4.169 ( -2.653 -1.532 -0.376) 3.087 4.214 ( -3.772 -2.178 4.639) 6.363 5.059 ( -21.821 -12.598 -0.955) 25.214 6.830 ( 5.787 3.341 0.024) 6.683 7.404 ( -5.218 -3.013 -0.374) 6.037 8.933 ( 13.014 7.514 -3.318) 15.389 8.967 ( -3.423 -1.976 -1.663) 4.288 9.281 ( -2.009 -1.160 1.459) 2.740 9.306 ( -2.642 -1.525 5.443) 6.240 9.831 ( 7.018 4.052 1.284) 8.205 10.033 ( -2.611 -1.508 -5.122) 5.944 11.283 ( 18.783 10.844 11.597) 24.594 11.975 ( -3.025 -1.747 -0.953) 3.621 12.070 ( 10.473 6.047 -14.569) 18.934 13.910 ( -3.708 -2.141 2.310) 4.865 14.156 ( -12.153 -7.016 8.548) 16.431======================= Grid point 261 (79/344) =======================q-point: ( 0.13 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.727 ( 0.000 27.428 15.268) 31.391 0.794 ( 0.000 29.696 17.183) 34.310 1.369 ( 0.000 52.342 26.573) 58.701 2.510 ( -0.000 3.855 -13.899) 14.423 2.617 ( -0.000 11.582 -11.652) 16.430 3.032 ( 0.000 0.897 8.994) 9.038 3.162 ( -0.000 8.705 3.662) 9.444 4.063 ( -0.000 -2.597 -7.951) 8.364 4.121 ( -0.000 1.289 -0.941) 1.596 4.250 ( -0.000 0.803 -0.289) 0.854 4.619 ( -0.000 13.801 -4.977) 14.671 6.937 ( 0.000 -3.301 2.995) 4.457 7.539 ( 0.000 -19.092 35.215) 40.057 8.897 ( -0.000 1.872 -0.576) 1.958 9.138 ( -0.000 -7.802 -8.579) 11.596 9.245 ( -0.000 1.861 0.549) 1.940 9.356 ( 0.000 -4.485 5.486) 7.086 9.907 ( -0.000 4.318 -6.852) 8.099 9.978 ( 0.000 -4.609 1.749) 4.929 11.651 ( -0.000 18.503 -41.760) 45.676 11.828 ( -0.000 0.931 -14.228) 14.258 11.908 ( -0.000 1.853 -1.336) 2.285 13.788 ( -0.000 9.947 0.323) 9.952 14.717 ( 0.000 -56.585 96.487) 111.855======================= Grid point 262 (80/344) =======================q-point: ( 0.20 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.193 ( 15.224 24.872 11.385) 31.305 1.266 ( 14.739 26.569 11.857) 32.615 2.162 ( 23.743 44.438 17.006) 53.176 2.601 ( 8.484 5.100 -14.749) 17.763 2.740 ( 3.070 11.917 -12.883) 17.816 3.034 ( -2.879 3.300 9.070) 10.072 3.365 ( 9.268 8.035 7.562) 14.410 4.044 ( 2.297 -0.758 -9.768) 10.063 4.157 ( 2.057 2.809 -0.903) 3.597 4.235 ( -1.630 -0.236 2.276) 2.810 4.884 ( 11.658 20.158 -6.865) 24.278 6.871 ( -3.285 -5.507 1.983) 6.712 7.478 ( 0.678 -2.732 13.976) 14.257 8.951 ( 2.650 1.852 -0.676) 3.303 8.986 ( -3.428 -11.910 -5.049) 13.383 9.269 ( -0.100 1.992 1.529) 2.514 9.309 ( -3.301 2.943 3.907) 5.901 9.873 ( -3.125 -4.243 -2.840) 5.986 9.991 ( 3.614 1.588 -3.110) 5.025 11.386 ( -19.395 -3.403 -6.971) 20.889 11.764 ( 4.222 -12.604 -1.389) 13.365 12.158 ( 8.077 2.382 -12.750) 15.280 13.982 ( 9.574 10.162 0.905) 13.991 14.327 ( -14.743 -13.168 43.486) 47.768======================= Grid point 263 (81/344) =======================q-point: ( 0.27 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.711 ( 13.438 22.177 8.228) 27.205 1.821 ( 17.805 21.717 7.407) 29.043 2.766 ( 11.428 5.655 -13.039) 18.237 2.883 ( 4.492 8.893 -12.557) 16.030 3.023 ( 8.695 14.596 8.963) 19.209 3.095 ( 14.641 22.155 7.684) 27.645 3.646 ( 11.968 7.944 8.539) 16.711 4.053 ( 1.130 -0.721 -3.225) 3.492 4.236 ( 2.579 5.209 -0.362) 5.824 4.283 ( 6.596 4.444 -1.452) 8.084 5.347 ( 18.350 20.457 -5.711) 28.069 6.720 ( -6.545 -7.647 -0.092) 10.066 7.546 ( 4.594 1.394 5.028) 6.952 8.761 ( -6.534 -9.235 0.065) 11.313 9.057 ( 4.008 4.625 0.103) 6.121 9.282 ( 0.361 1.438 2.157) 2.618 9.338 ( 0.035 5.192 -0.049) 5.193 9.755 ( -5.680 -2.406 -1.162) 6.277 10.065 ( 4.147 0.889 -3.758) 5.667 11.004 ( -16.494 -7.044 1.402) 17.990 11.678 ( 3.739 -19.080 -1.647) 19.512 12.196 ( -2.811 5.986 -4.059) 7.759 14.144 ( -8.233 1.568 13.529) 15.915 14.272 ( 12.723 5.355 2.734) 14.072======================= Grid point 264 (82/344) =======================q-point: ( 0.33 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.105 ( 6.705 18.071 4.284) 19.745 2.313 ( 14.858 15.685 3.213) 21.843 2.955 ( 5.656 5.294 -1.317) 7.858 3.030 ( 6.612 8.017 -10.919) 15.074 3.133 ( 1.749 11.707 1.663) 11.953 3.597 ( 9.207 7.714 -0.925) 12.046 3.893 ( 6.584 0.703 7.238) 9.810 4.250 ( 16.784 12.753 -0.074) 21.080 4.362 ( 4.808 8.258 -0.752) 9.585 4.525 ( 14.264 9.170 2.598) 17.155 5.834 ( 15.585 15.395 -3.817) 22.237 6.528 ( -4.738 -6.807 -0.936) 8.346 7.668 ( 6.454 1.835 1.974) 6.994 8.597 ( -4.439 -4.747 2.289) 6.891 9.173 ( 3.015 5.607 -1.198) 6.478 9.319 ( -2.195 3.787 3.557) 5.640 9.400 ( 2.766 5.132 -1.720) 6.078 9.647 ( -4.349 0.726 -0.626) 4.453 10.138 ( 4.629 0.189 -2.768) 5.397 10.713 ( -9.489 -6.740 4.007) 12.310 11.512 ( 0.433 -19.254 -2.596) 19.433 12.218 ( -2.913 9.889 -1.832) 10.471 14.088 ( -3.882 3.302 4.032) 6.499 14.519 ( 10.538 2.048 1.875) 10.897======================= Grid point 265 (83/344) =======================q-point: ( 0.40 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.324 ( 0.100 13.903 0.841) 13.929 2.620 ( 7.036 6.678 -0.629) 9.721 3.078 ( -1.387 11.296 6.078) 12.902 3.232 ( 10.041 8.041 -5.231) 13.887 3.354 ( 7.840 13.959 -2.963) 16.282 3.641 ( -1.944 -1.948 -1.649) 3.208 4.078 ( 10.676 2.409 6.160) 12.559 4.481 ( 3.998 7.059 0.152) 8.115 4.596 ( 9.898 3.717 -6.581) 12.454 5.000 ( 18.714 14.727 6.437) 24.669 6.044 ( -0.748 3.740 -2.263) 4.435 6.558 ( 11.313 2.072 1.298) 11.574 7.813 ( 7.837 1.914 1.141) 8.147 8.519 ( -1.449 -1.964 1.219) 2.728 9.196 ( -9.426 4.680 -2.746) 10.876 9.309 ( -0.133 5.394 4.826) 7.239 9.556 ( 7.987 6.207 -2.750) 10.482 9.641 ( 0.881 3.022 -0.443) 3.179 10.221 ( 5.154 0.102 -0.224) 5.160 10.553 ( -3.320 -5.305 3.322) 7.086 11.315 ( -1.134 -17.139 -2.666) 17.382 12.276 ( -2.799 11.597 -1.440) 12.017 14.082 ( -1.005 2.494 0.945) 2.850 14.685 ( 7.595 -0.816 1.214) 7.735======================= Grid point 266 (84/344) =======================q-point: ( 0.47 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.418 ( -3.603 11.954 -0.283) 12.488 2.724 ( 2.086 1.015 -0.859) 2.474 3.162 ( -4.992 14.487 4.161) 15.878 3.467 ( 7.520 4.515 -3.811) 9.563 3.572 ( 1.247 0.032 -1.536) 1.979 3.647 ( 6.251 13.228 1.524) 14.710 4.300 ( 10.591 2.293 4.033) 11.563 4.605 ( 2.205 6.766 0.291) 7.122 4.731 ( 5.356 0.585 -4.958) 7.321 5.271 ( -0.845 3.211 2.275) 4.025 6.133 ( 9.068 6.892 -0.379) 11.396 6.789 ( 9.790 0.682 4.885) 10.963 7.979 ( 8.669 1.738 0.085) 8.842 8.504 ( 0.746 -0.566 -0.590) 1.106 9.036 ( -12.280 5.078 -0.049) 13.289 9.386 ( 1.123 4.877 1.518) 5.229 9.691 ( 2.101 2.553 -0.717) 3.383 9.761 ( 7.301 6.803 -3.346) 10.525 10.306 ( 3.261 -0.304 4.633) 5.674 10.503 ( 2.710 -3.434 -0.236) 4.381 11.122 ( -1.844 -15.207 -2.229) 15.479 12.338 ( -3.834 12.678 -1.130) 13.293 14.102 ( 0.979 0.918 0.314) 1.378 14.777 ( 5.181 -2.871 0.350) 5.934======================= Grid point 267 (85/344) =======================q-point: ( 0.53 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.454 ( -5.302 11.345 -0.285) 12.526 2.743 ( 0.713 -0.772 -0.203) 1.070 3.213 ( -7.300 15.299 2.500) 17.135 3.484 ( 0.519 -4.150 -0.373) 4.199 3.678 ( 2.228 8.427 -3.309) 9.323 3.870 ( 5.255 6.708 1.765) 8.702 4.505 ( 8.705 3.065 2.355) 9.525 4.688 ( 0.039 5.501 0.012) 5.501 4.796 ( 3.566 0.373 -2.626) 4.444 5.151 ( -10.925 -0.969 1.434) 11.061 6.405 ( 11.520 5.761 -0.989) 12.918 6.901 ( 3.161 -3.313 7.480) 8.770 8.126 ( 6.715 -0.115 -1.211) 6.824 8.520 ( 1.525 -0.273 -1.390) 2.081 8.902 ( -9.509 6.632 0.377) 11.599 9.441 ( -0.199 3.907 0.738) 3.981 9.739 ( 0.999 1.748 -0.221) 2.025 9.919 ( 4.823 4.753 -4.441) 8.098 10.322 ( -0.844 -2.176 6.256) 6.677 10.591 ( 8.911 -0.531 -1.269) 9.017 10.937 ( -2.253 -13.746 -1.679) 14.030 12.386 ( -5.378 13.057 -0.601) 14.134 14.129 ( 1.719 -0.632 0.553) 1.913 14.815 ( 3.559 -4.208 -0.620) 5.546======================= Grid point 268 (86/344) =======================q-point: (-0.40 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.465 ( -6.123 10.895 -0.092) 12.498 2.745 ( 0.855 -1.104 0.243) 1.417 3.225 ( -9.365 15.050 1.520) 17.791 3.466 ( 1.939 -3.152 0.292) 3.713 3.742 ( -3.203 7.077 -2.944) 8.307 3.945 ( -0.586 -0.623 0.690) 1.099 4.609 ( -0.533 -1.237 0.378) 1.399 4.713 ( -2.230 3.589 -0.523) 4.257 4.876 ( 2.243 -0.008 0.668) 2.341 4.993 ( -3.702 5.077 1.458) 6.450 6.565 ( 2.492 -0.701 -1.063) 2.798 6.885 ( -0.676 -5.204 7.010) 8.756 8.182 ( 1.840 -3.334 -2.011) 4.307 8.536 ( 1.214 -0.894 -1.027) 1.824 8.853 ( -5.387 9.443 0.659) 10.891 9.459 ( -1.798 2.904 0.472) 3.448 9.757 ( -0.368 0.754 -0.046) 0.840 9.998 ( 1.128 2.251 -3.833) 4.586 10.283 ( -1.938 -2.683 3.894) 5.110 10.724 ( 0.239 -2.623 -0.927) 2.792 10.799 ( 8.297 -9.960 -0.131) 12.964 12.408 ( -6.909 12.546 -0.031) 14.322 14.145 ( 1.110 -1.613 1.040) 2.217 14.819 ( 2.522 -4.978 -1.558) 5.794======================= Grid point 269 (87/344) =======================q-point: (-0.33 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.460 ( -6.705 10.069 0.160) 12.098 2.752 ( 0.966 -1.223 0.708) 1.712 3.194 ( -11.341 14.060 0.723) 18.078 3.492 ( 3.606 -1.666 0.648) 4.025 3.697 ( -7.820 4.207 -1.737) 9.048 3.843 ( -8.148 -4.020 -0.912) 9.131 4.474 ( -8.446 -5.970 -0.425) 10.352 4.683 ( -4.777 2.654 -0.320) 5.474 4.835 ( -1.625 -2.062 1.231) 2.900 5.155 ( 6.705 8.505 1.330) 10.911 6.441 ( -10.664 -7.610 1.718) 13.213 6.840 ( -0.448 -5.302 2.789) 6.007 8.112 ( -3.583 -6.136 -2.458) 7.518 8.539 ( 0.905 -1.905 0.353) 2.138 8.906 ( -1.834 12.756 0.685) 12.905 9.439 ( -3.528 2.142 0.574) 4.167 9.741 ( -1.862 -0.008 -0.036) 1.862 9.980 ( -4.040 -0.514 -0.219) 4.079 10.221 ( -2.081 -2.775 -1.713) 3.869 10.607 ( -1.750 -7.668 0.331) 7.873 10.964 ( 13.140 -4.008 0.702) 13.755 12.397 ( -8.097 11.207 0.302) 13.829 14.139 ( -0.278 -1.509 1.442) 2.106 14.797 ( 1.466 -5.504 -2.238) 6.120======================= Grid point 270 (88/344) =======================q-point: (-0.27 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.428 ( -8.099 8.459 0.624) 11.727 2.744 ( -0.998 -1.859 1.087) 2.373 3.113 ( -13.325 12.173 -0.481) 18.055 3.526 ( -6.505 -3.385 2.725) 7.823 3.575 ( -0.725 1.275 -1.629) 2.192 3.616 ( -11.977 -1.280 -2.052) 12.219 4.248 ( -9.285 -7.630 -0.643) 12.035 4.600 ( -7.031 1.550 -0.170) 7.202 4.779 ( -1.974 -4.360 -0.237) 4.792 5.271 ( -3.970 1.445 1.882) 4.625 6.158 ( -10.524 -5.168 1.709) 11.848 6.738 ( -4.698 -7.795 0.906) 9.147 7.946 ( -6.701 -6.782 -2.860) 9.954 8.535 ( 1.077 -2.596 2.056) 3.483 9.035 ( 0.237 14.795 -0.132) 14.798 9.384 ( -5.037 1.574 1.347) 5.447 9.695 ( -2.978 -0.351 -0.182) 3.005 9.844 ( -9.471 -3.084 4.059) 10.756 10.158 ( -0.749 -2.633 -8.045) 8.498 10.547 ( 1.846 -4.996 2.884) 6.057 11.154 ( 13.933 -5.379 0.607) 14.948 12.354 ( -8.695 9.409 0.242) 12.814 14.116 ( -1.706 -0.136 1.571) 2.323 14.745 ( -0.266 -6.130 -2.423) 6.597======================= Grid point 271 (89/344) =======================q-point: (-0.20 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.327 ( -12.764 5.307 1.222) 13.878 2.644 ( -9.767 -3.540 1.682) 10.524 2.973 ( -13.450 8.253 -3.641) 16.195 3.299 ( -9.293 -3.741 0.458) 10.028 3.411 ( -11.950 0.987 1.755) 12.118 3.654 ( 4.314 0.665 -0.306) 4.375 3.998 ( -10.185 -8.204 -0.932) 13.111 4.476 ( -8.116 0.175 -0.330) 8.125 4.663 ( -5.177 -6.348 -1.248) 8.286 4.940 ( -27.092 -10.686 2.173) 29.204 6.079 ( -1.842 2.425 0.738) 3.133 6.543 ( -6.021 -8.099 0.092) 10.092 7.760 ( -6.431 -5.150 -3.297) 8.874 8.541 ( 2.176 -2.210 2.940) 4.273 9.170 ( -1.395 11.106 -3.669) 11.779 9.319 ( -4.210 2.404 4.241) 6.441 9.636 ( -6.100 -2.202 2.117) 6.822 9.652 ( -6.485 -0.085 3.552) 7.394 10.107 ( 0.188 -2.447 -9.796) 10.099 10.587 ( 5.796 -1.604 5.082) 7.874 11.340 ( 14.788 -7.363 -0.356) 16.523 12.290 ( -8.470 7.937 -0.161) 11.609 14.088 ( -2.938 1.974 1.453) 3.827 14.649 ( -2.936 -6.946 -1.914) 7.780======================= Grid point 272 (90/344) =======================q-point: (-0.13 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.071 ( -20.982 1.202 1.400) 21.063 2.301 ( -23.813 -5.699 2.505) 24.614 2.853 ( -6.415 5.533 -8.208) 11.795 3.161 ( -5.601 -1.314 -0.230) 5.758 3.217 ( -10.906 -1.512 6.467) 12.769 3.619 ( -13.230 -5.867 1.489) 14.549 3.777 ( -5.597 -3.911 -2.743) 7.358 4.259 ( -21.171 -9.473 1.219) 23.226 4.376 ( -14.408 -0.058 0.842) 14.433 4.476 ( -8.165 -6.247 -1.981) 10.470 5.874 ( -20.299 -5.856 -0.315) 21.129 6.539 ( 8.743 1.010 -0.275) 8.805 7.609 ( -5.772 -2.931 -3.013) 7.141 8.596 ( 5.621 -0.380 2.083) 6.007 9.141 ( -6.359 2.303 -3.252) 7.504 9.316 ( -1.546 0.878 2.749) 3.274 9.479 ( -7.095 -1.860 4.995) 8.874 9.667 ( 0.965 6.193 1.696) 6.493 10.072 ( 0.350 -1.447 -8.637) 8.764 10.752 ( 11.531 2.797 6.935) 13.743 11.511 ( 15.015 -10.001 -2.512) 18.215 12.230 ( -6.995 7.729 -0.850) 10.459 14.059 ( -4.191 3.731 1.582) 5.830 14.493 ( -6.344 -7.637 -0.416) 9.937======================= Grid point 273 (91/344) =======================q-point: (-0.07 0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.647 ( -27.705 -1.142 2.418) 27.833 1.775 ( -30.014 -5.495 3.162) 30.676 2.789 ( -6.373 4.189 -12.167) 14.360 2.955 ( -24.066 -7.996 5.230) 25.893 3.060 ( -20.154 -5.769 -1.134) 20.994 3.079 ( -14.079 -2.807 7.521) 16.207 3.531 ( -13.859 -2.837 0.535) 14.157 4.071 ( 2.182 0.734 -2.670) 3.525 4.238 ( -6.148 0.727 -0.178) 6.194 4.282 ( -7.071 -3.696 0.184) 7.980 5.390 ( -26.073 -5.546 -1.698) 26.710 6.725 ( 9.240 1.653 -0.341) 9.393 7.483 ( -5.983 -0.923 -0.353) 6.064 8.754 ( 11.601 1.807 -0.360) 11.747 9.039 ( -5.978 0.710 -1.390) 6.178 9.286 ( -1.102 -2.001 2.200) 3.172 9.370 ( -4.881 -1.375 2.780) 5.783 9.776 ( 4.251 4.236 0.984) 6.081 10.048 ( -0.993 0.437 -5.492) 5.598 11.076 ( 18.457 5.381 7.436) 20.613 11.639 ( 12.677 -10.527 -4.900) 17.191 12.213 ( -3.302 7.781 -2.873) 8.927 14.021 ( -5.450 4.188 4.259) 8.086 14.279 ( -9.551 -7.459 2.674) 12.410======================= Grid point 277 (92/344) =======================q-point: ( 0.20 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.333 ( 0.000 26.450 11.846) 28.981 1.463 ( -0.000 30.063 12.601) 32.597 2.511 ( -0.000 50.434 17.467) 53.373 2.532 ( -0.000 4.482 -15.430) 16.068 2.815 ( -0.000 12.588 -14.598) 19.276 3.109 ( 0.000 2.913 8.632) 9.111 3.402 ( 0.000 12.561 7.677) 14.721 3.999 ( -0.000 0.741 -10.093) 10.121 4.160 ( -0.000 3.160 -0.906) 3.287 4.259 ( 0.000 0.943 0.921) 1.319 5.002 ( -0.000 25.869 -7.564) 26.952 6.839 ( 0.000 -7.805 1.964) 8.048 7.471 ( 0.000 -1.409 9.392) 9.497 8.879 ( 0.000 -11.375 -4.517) 12.239 8.947 ( -0.000 3.274 -1.182) 3.481 9.301 ( -0.000 3.208 1.372) 3.489 9.390 ( 0.000 3.324 6.885) 7.645 9.857 ( 0.000 -8.125 2.319) 8.449 9.923 ( -0.000 1.138 -10.354) 10.416 11.430 ( 0.000 -19.610 9.670) 21.865 11.810 ( -0.000 0.235 -20.701) 20.702 11.954 ( -0.000 3.350 -1.939) 3.871 13.992 ( 0.000 7.035 4.865) 8.553 14.417 ( 0.000 -9.367 29.560) 31.009======================= Grid point 278 (93/344) =======================q-point: ( 0.27 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.730 ( 11.739 23.054 9.812) 27.669 1.865 ( 8.692 27.522 10.009) 30.548 2.615 ( 8.069 4.977 -13.593) 16.573 2.903 ( 1.219 9.904 -13.799) 17.029 3.099 ( 6.901 31.382 9.811) 33.596 3.191 ( 3.728 13.761 8.282) 16.488 3.596 ( 5.486 11.427 7.615) 14.787 4.017 ( 1.963 3.269 -4.685) 6.041 4.232 ( 3.902 5.171 -0.703) 6.516 4.277 ( -0.189 5.064 -1.926) 5.421 5.333 ( 8.685 26.443 -6.535) 28.590 6.722 ( -3.590 -9.716 0.380) 10.365 7.508 ( 2.378 1.659 3.810) 4.788 8.749 ( -2.801 -8.072 -0.394) 8.554 9.021 ( 4.507 3.935 -1.122) 6.087 9.326 ( -1.557 2.528 3.284) 4.427 9.415 ( -2.199 5.629 4.110) 7.308 9.776 ( -0.654 -3.870 -2.086) 4.445 9.962 ( 5.480 -2.410 -5.881) 8.392 11.183 ( -10.191 -16.062 8.097) 20.674 11.556 ( -10.178 -5.558 -7.333) 13.721 12.156 ( 9.594 1.819 -4.811) 10.885 14.122 ( 7.488 0.704 7.872) 10.887 14.356 ( -6.847 4.241 9.778) 12.668======================= Grid point 279 (94/344) =======================q-point: ( 0.33 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.163 ( 10.667 18.406 6.599) 22.273 2.301 ( 9.393 21.630 4.681) 24.041 2.843 ( 12.685 8.578 -7.217) 16.928 3.000 ( 3.705 8.604 -12.504) 15.624 3.267 ( 0.358 10.970 5.764) 12.397 3.567 ( 5.645 13.753 2.088) 15.012 3.803 ( 6.057 2.547 5.074) 8.302 4.177 ( 7.602 14.837 0.916) 16.696 4.362 ( 3.308 7.410 -1.893) 8.332 4.430 ( 10.158 13.453 2.010) 16.977 5.761 ( 12.696 22.181 -4.320) 25.920 6.536 ( -5.777 -9.867 -0.899) 11.469 7.595 ( 4.411 2.613 1.400) 5.315 8.628 ( -3.959 -4.860 3.116) 7.000 9.162 ( 5.754 5.660 -0.931) 8.125 9.338 ( 0.686 3.155 2.010) 3.804 9.467 ( -0.634 7.221 1.351) 7.374 9.732 ( -3.014 1.259 -2.396) 4.051 10.024 ( 6.355 -3.643 -2.776) 7.834 10.844 ( -13.205 -10.625 5.609) 17.853 11.342 ( -3.686 -12.409 -3.869) 13.511 12.292 ( 3.832 5.451 -2.388) 7.078 14.205 ( -1.396 -0.298 6.476) 6.631 14.391 ( 4.213 5.750 0.835) 7.177======================= Grid point 280 (95/344) =======================q-point: ( 0.40 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.468 ( 3.671 15.585 2.720) 16.241 2.594 ( 5.288 10.166 -0.374) 11.465 3.120 ( 7.658 11.485 -3.517) 14.245 3.224 ( 9.765 15.905 -4.205) 19.132 3.409 ( 0.955 13.562 3.115) 13.948 3.652 ( -0.820 0.291 -1.723) 1.930 3.946 ( 7.915 2.480 6.156) 10.329 4.428 ( 8.719 6.134 -4.957) 11.756 4.500 ( 4.547 6.289 -1.103) 7.839 4.885 ( 16.312 21.653 6.704) 27.927 6.116 ( 2.849 13.435 -1.607) 13.828 6.394 ( 4.254 -5.572 -0.234) 7.014 7.715 ( 5.945 2.788 1.341) 6.702 8.535 ( -2.784 -2.986 2.932) 5.026 9.296 ( 2.034 7.298 -1.577) 7.738 9.444 ( 3.319 6.276 0.401) 7.111 9.511 ( -1.990 6.539 -0.082) 6.836 9.694 ( -2.911 4.531 -0.829) 5.449 10.101 ( 7.010 -3.081 -1.148) 7.743 10.581 ( -7.176 -8.343 4.852) 12.027 11.150 ( -1.830 -14.848 -3.534) 15.372 12.408 ( 1.323 9.998 -1.269) 10.165 14.167 ( -4.378 2.859 1.318) 5.392 14.531 ( 7.748 -1.215 1.318) 7.953======================= Grid point 281 (96/344) =======================q-point: ( 0.47 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.631 ( -2.662 15.656 0.640) 15.893 2.710 ( 1.757 3.138 -0.791) 3.682 3.360 ( 6.878 9.703 -3.177) 12.311 3.459 ( -2.729 16.853 -0.359) 17.076 3.542 ( 1.538 3.240 1.308) 3.818 3.721 ( 4.454 15.238 0.904) 15.902 4.141 ( 10.492 1.962 4.270) 11.496 4.593 ( 6.604 2.326 -4.085) 8.106 4.629 ( 4.757 3.609 -1.517) 6.161 5.306 ( 7.168 13.487 4.002) 15.789 6.132 ( -2.048 6.131 0.134) 6.465 6.592 ( 13.467 -0.250 3.168) 13.837 7.861 ( 7.133 2.737 1.609) 7.807 8.487 ( -0.416 -1.839 0.209) 1.897 9.326 ( -10.300 9.020 -3.447) 14.119 9.449 ( -2.252 6.211 3.761) 7.602 9.649 ( 6.515 4.102 -3.319) 8.384 9.745 ( 1.991 7.264 -0.270) 7.537 10.205 ( 7.826 -1.735 1.008) 8.079 10.440 ( -1.700 -7.351 3.680) 8.395 10.970 ( -0.733 -15.048 -3.336) 15.431 12.529 ( -1.104 13.936 -0.852) 14.006 14.128 ( -2.763 1.570 0.074) 3.178 14.628 ( 6.794 -5.075 0.664) 8.506======================= Grid point 282 (97/344) =======================q-point: ( 0.53 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.710 ( -6.424 16.322 0.300) 17.544 2.743 ( -0.103 1.452 -0.098) 1.459 3.420 ( 0.688 -5.338 -1.318) 5.541 3.541 ( -6.914 20.211 -1.168) 21.393 3.691 ( 4.841 10.504 -0.261) 11.569 3.939 ( 0.455 13.684 2.841) 13.983 4.370 ( 11.300 4.066 2.515) 12.270 4.687 ( 3.734 0.096 -2.079) 4.275 4.729 ( 4.286 1.805 -2.456) 5.260 5.378 ( -9.529 7.868 2.797) 12.670 6.277 ( 8.928 6.581 0.160) 11.093 6.772 ( 8.569 -4.937 6.381) 11.770 8.010 ( 6.658 1.449 1.133) 6.908 8.480 ( 1.498 -1.256 -2.393) 3.090 9.190 ( -13.214 9.717 -0.455) 16.409 9.504 ( -0.675 5.999 1.265) 6.169 9.738 ( 1.689 2.302 -0.840) 2.976 9.883 ( 4.650 6.529 -3.670) 8.816 10.311 ( 2.266 -1.528 6.366) 6.928 10.399 ( 7.121 -6.746 -0.912) 9.851 10.810 ( -0.416 -13.438 -2.941) 13.763 12.636 ( -4.408 16.724 -0.569) 17.304 14.105 ( -0.334 -0.792 0.337) 0.923 14.672 ( 5.655 -7.484 -0.348) 9.386======================= Grid point 283 (98/344) =======================q-point: ( 0.60 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.740 ( -6.573 11.743 -0.231) 13.459 2.750 ( -2.848 6.125 0.718) 6.793 3.382 ( 2.082 -5.541 -0.490) 5.940 3.593 ( -10.104 20.263 -1.099) 22.669 3.848 ( 1.274 9.570 -2.314) 9.928 4.005 ( -4.389 5.688 3.482) 7.984 4.572 ( 5.221 2.292 1.093) 5.806 4.720 ( 1.951 -2.028 -0.956) 2.972 4.817 ( 4.206 2.574 -1.642) 5.197 5.255 ( -13.528 10.879 3.186) 17.650 6.471 ( 7.289 1.003 -1.160) 7.448 6.818 ( 2.980 -8.311 7.812) 11.789 8.103 ( 3.450 -1.546 0.105) 3.782 8.495 ( 1.942 -1.050 -3.309) 3.978 9.097 ( -9.471 11.846 1.082) 15.205 9.538 ( -2.127 5.203 0.733) 5.669 9.770 ( 0.128 1.338 -0.136) 1.351 9.989 ( 2.304 4.117 -4.922) 6.818 10.288 ( -1.019 -3.896 5.339) 6.688 10.512 ( 11.046 -8.982 0.323) 14.241 10.681 ( -0.377 -7.696 -2.516) 8.106 12.700 ( -7.985 17.500 -0.276) 19.238 14.101 ( 1.460 -2.320 1.080) 2.946 14.679 ( 4.961 -8.809 -1.410) 10.208======================= Grid point 284 (99/344) =======================q-point: (-0.33 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.733 ( -6.399 9.796 -0.538) 11.713 2.760 ( -4.146 7.157 1.103) 8.345 3.386 ( 3.992 -3.938 -0.295) 5.616 3.593 ( -12.175 18.817 -1.013) 22.435 3.899 ( -6.819 9.313 -2.871) 11.894 3.935 ( -6.322 -0.179 2.915) 6.964 4.553 ( -5.800 -3.791 -0.040) 6.929 4.726 ( 0.692 -1.184 -0.681) 1.531 4.854 ( -1.751 -2.308 0.698) 2.980 5.244 ( -3.438 16.665 2.407) 17.185 6.494 ( -2.656 -5.620 -0.666) 6.252 6.772 ( 0.971 -9.059 6.189) 11.014 8.090 ( -1.163 -4.763 -0.941) 4.993 8.504 ( 1.119 -1.260 -2.423) 2.952 9.113 ( -4.806 15.137 1.873) 15.991 9.539 ( -3.577 4.611 0.838) 5.895 9.770 ( -1.147 0.576 -0.117) 1.289 10.021 ( -0.830 1.750 -4.606) 4.996 10.233 ( -2.317 -3.862 3.700) 5.829 10.491 ( 2.818 -14.298 -1.215) 14.624 10.723 ( 8.972 -2.393 0.185) 9.287 12.704 ( -10.711 15.698 -0.060) 19.004 14.112 ( 1.752 -1.769 1.756) 3.047 14.665 ( 4.421 -9.280 -2.243) 10.521======================= Grid point 285 (100/344) =======================q-point: (-0.27 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.706 ( -9.820 12.479 -0.251) 15.881 2.755 ( -1.668 1.609 0.835) 2.463 3.430 ( 2.589 0.099 -1.159) 2.838 3.548 ( -11.449 14.282 -0.091) 18.305 3.742 ( -12.893 -0.750 3.237) 13.314 3.844 ( -10.975 6.608 -3.504) 13.282 4.346 ( -10.733 -6.593 0.811) 12.622 4.704 ( -2.538 -0.525 -0.375) 2.619 4.763 ( -2.864 -5.410 -0.525) 6.144 5.377 ( -1.965 11.742 2.244) 12.115 6.295 ( -10.574 -6.384 0.945) 12.388 6.697 ( -0.575 -10.066 2.964) 10.509 7.975 ( -4.974 -5.969 -1.361) 7.887 8.499 ( 0.601 -1.665 -0.793) 1.940 9.226 ( -2.235 17.575 1.328) 17.766 9.509 ( -5.276 4.148 1.711) 6.926 9.743 ( -2.384 0.300 -0.423) 2.440 9.968 ( -5.510 -0.825 -0.417) 5.587 10.138 ( -3.459 -4.649 -2.493) 6.309 10.422 ( 4.298 -10.065 0.422) 10.952 10.868 ( 11.655 -5.223 0.625) 12.787 12.645 ( -11.828 11.909 -0.028) 16.784 14.133 ( 0.686 0.750 2.013) 2.255 14.635 ( 3.318 -9.184 -2.528) 10.087======================= Grid point 286 (101/344) =======================q-point: (-0.20 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.625 ( -12.570 9.056 0.338) 15.496 2.730 ( -2.907 0.064 0.208) 2.915 3.385 ( -16.012 12.790 -1.869) 20.578 3.462 ( -12.933 -2.873 0.984) 13.285 3.570 ( 0.089 0.786 1.855) 2.017 3.672 ( -12.404 4.462 -2.081) 13.345 4.090 ( -10.146 -7.794 1.057) 12.838 4.612 ( -6.804 -0.797 -0.973) 6.919 4.663 ( -2.604 -5.659 -0.983) 6.307 5.282 ( -18.424 -1.125 2.343) 18.607 6.144 ( -2.734 3.715 0.827) 4.686 6.547 ( -4.948 -11.247 1.155) 12.342 7.815 ( -6.352 -4.576 -1.309) 7.938 8.495 ( 1.078 -1.735 0.761) 2.180 9.345 ( -4.145 12.975 -2.384) 13.829 9.457 ( -5.923 5.475 3.731) 8.887 9.699 ( -3.161 0.618 -0.004) 3.221 9.816 ( -9.882 -1.093 5.190) 11.216 10.043 ( 0.224 -5.290 -8.511) 10.023 10.446 ( 7.047 -5.575 2.425) 9.307 11.022 ( 12.818 -6.443 0.066) 14.346 12.541 ( -11.170 7.642 -0.189) 13.536 14.157 ( -1.025 3.580 1.764) 4.121 14.581 ( 1.102 -8.489 -2.045) 8.801======================= Grid point 287 (102/344) =======================q-point: (-0.13 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.434 ( -17.079 3.153 0.878) 17.390 2.613 ( -12.690 -0.284 0.706) 12.713 3.120 ( -19.098 5.176 -1.492) 19.843 3.275 ( -9.015 2.348 -4.003) 10.139 3.426 ( -12.609 -1.886 3.931) 13.342 3.669 ( 2.417 1.026 -0.593) 2.692 3.856 ( -9.365 -4.583 1.167) 10.492 4.460 ( -9.954 -0.969 -1.566) 10.123 4.538 ( -5.772 -4.330 -0.704) 7.250 4.800 ( -30.456 -3.627 2.712) 30.791 6.144 ( -11.874 2.907 0.139) 12.225 6.394 ( 4.732 -5.407 -0.324) 7.193 7.677 ( -5.514 -1.688 -0.904) 5.837 8.515 ( 3.002 -1.226 1.664) 3.645 9.294 ( -7.862 2.912 -1.518) 8.520 9.417 ( -6.929 4.120 -0.387) 8.071 9.588 ( -7.190 -3.481 2.930) 8.509 9.747 ( -2.603 5.084 3.617) 6.760 10.014 ( 2.587 -1.478 -6.795) 7.419 10.569 ( 10.924 -1.986 3.393) 11.610 11.184 ( 12.954 -5.368 -1.020) 14.059 12.422 ( -8.899 3.980 -0.495) 9.761 14.169 ( -2.741 4.091 1.404) 5.120 14.494 ( -2.329 -6.104 -0.790) 6.581======================= Grid point 288 (103/344) =======================q-point: (-0.07 0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.101 ( -23.239 0.137 2.401) 23.363 2.254 ( -26.451 -0.942 1.905) 26.536 2.930 ( -7.804 3.916 -4.651) 9.893 3.130 ( -9.255 -0.153 -6.210) 11.146 3.193 ( -10.682 -4.100 4.582) 12.325 3.542 ( -18.620 -0.720 1.311) 18.680 3.749 ( -6.746 1.776 2.416) 7.382 4.163 ( -18.110 -0.376 0.771) 18.130 4.385 ( -8.920 -1.519 -1.580) 9.185 4.406 ( -11.372 2.092 1.648) 11.680 5.803 ( -23.947 -0.093 -1.653) 24.004 6.549 ( 11.304 0.016 -0.764) 11.329 7.583 ( -5.275 1.132 0.470) 5.416 8.595 ( 7.130 -0.487 1.417) 7.285 9.170 ( -7.859 0.874 -0.290) 7.912 9.323 ( -4.684 -0.056 0.410) 4.702 9.452 ( -5.925 -1.963 0.673) 6.278 9.753 ( 0.820 -1.623 -0.697) 1.948 10.057 ( 1.044 3.513 -1.540) 3.976 10.790 ( 15.554 -2.768 2.218) 15.953 11.375 ( 12.730 1.191 -1.130) 12.836 12.317 ( -5.538 0.261 -1.072) 5.647 14.138 ( -3.709 -0.454 2.870) 4.712 14.383 ( -6.817 0.309 0.345) 6.832======================= Grid point 293 (104/344) =======================q-point: ( 0.27 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.866 ( 0.000 21.062 10.521) 23.543 2.092 ( -0.000 27.128 10.690) 29.158 2.556 ( -0.000 4.787 -12.246) 13.148 2.954 ( -0.000 8.261 -14.542) 16.725 3.213 ( 0.000 4.144 4.467) 6.093 3.432 ( -0.000 29.652 6.821) 30.427 3.704 ( 0.000 12.352 6.835) 14.117 4.076 ( -0.000 15.194 0.471) 15.202 4.243 ( -0.000 5.416 -0.462) 5.435 4.342 ( -0.000 8.856 -3.747) 9.616 5.523 ( -0.000 27.446 -6.184) 28.134 6.653 ( 0.000 -10.226 0.064) 10.227 7.520 ( 0.000 3.583 1.725) 3.976 8.710 ( 0.000 -4.555 1.033) 4.671 9.008 ( -0.000 3.143 -1.546) 3.503 9.379 ( 0.000 3.315 2.992) 4.466 9.523 ( 0.000 6.286 8.523) 10.591 9.691 ( 0.000 -8.611 1.485) 8.738 9.874 ( -0.000 -0.352 -12.793) 12.798 11.096 ( 0.000 -16.876 9.528) 19.380 11.683 ( -0.000 -5.658 -8.892) 10.539 12.021 ( -0.000 4.142 -2.200) 4.690 14.076 ( 0.000 -0.151 6.929) 6.931 14.481 ( 0.000 5.508 5.425) 7.731======================= Grid point 294 (105/344) =======================q-point: ( 0.33 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.164 ( 9.255 15.230 7.200) 19.221 2.407 ( 4.047 20.632 6.676) 22.060 2.698 ( 11.651 10.142 -5.939) 16.549 3.012 ( 1.399 8.026 -12.717) 15.102 3.310 ( 4.768 5.728 2.537) 7.873 3.634 ( 0.771 6.939 -0.531) 7.002 3.827 ( -0.152 10.238 6.868) 12.329 4.272 ( 0.185 14.559 -0.931) 14.590 4.376 ( 4.760 9.396 -1.730) 10.674 4.488 ( 3.743 23.566 4.042) 24.202 5.818 ( 5.952 22.239 -4.642) 23.485 6.528 ( -3.760 -7.399 -0.251) 8.303 7.582 ( 1.793 4.935 0.657) 5.292 8.655 ( -2.929 -2.754 3.046) 5.044 9.089 ( 6.118 2.967 -1.578) 6.980 9.392 ( -1.925 2.171 4.258) 5.153 9.551 ( -1.227 5.396 1.379) 5.703 9.731 ( 5.419 0.189 4.426) 7.000 9.864 ( 3.206 -2.633 -10.249) 11.057 10.909 ( -6.360 -13.472 7.086) 16.497 11.427 ( -14.452 -5.439 -5.292) 16.323 12.193 ( 10.580 3.322 -2.316) 11.329 14.132 ( 4.812 -1.188 4.600) 6.762 14.508 ( -4.342 6.917 1.808) 8.365======================= Grid point 295 (106/344) =======================q-point: ( 0.40 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.480 ( 10.519 10.777 2.972) 15.350 2.619 ( 3.028 8.872 0.042) 9.375 3.118 ( 18.121 16.436 -0.473) 24.470 3.132 ( 4.208 12.747 -6.749) 15.025 3.490 ( 6.030 8.983 2.049) 11.012 3.646 ( 0.408 -2.397 -1.533) 2.874 3.942 ( 0.112 9.582 6.331) 11.485 4.391 ( 2.035 8.327 -5.178) 10.015 4.507 ( 2.864 7.213 -1.445) 7.894 4.913 ( 9.843 27.042 6.799) 29.570 6.124 ( 10.294 10.772 -1.953) 15.027 6.392 ( -7.407 0.868 0.262) 7.463 7.679 ( 3.212 5.426 1.167) 6.413 8.570 ( -3.964 -3.082 3.141) 5.922 9.258 ( 9.029 4.019 -1.644) 10.019 9.426 ( 1.606 4.914 1.019) 5.269 9.613 ( 0.586 6.036 -0.238) 6.069 9.799 ( -2.549 6.024 -2.102) 6.870 9.911 ( 8.800 -5.411 0.380) 10.337 10.656 ( -9.826 -9.666 4.718) 14.568 11.132 ( -10.426 -7.754 -3.984) 13.590 12.401 ( 8.480 6.257 -1.311) 10.619 14.202 ( 2.987 -1.247 1.517) 3.575 14.497 ( -3.157 4.207 1.111) 5.376======================= Grid point 296 (107/344) =======================q-point: ( 0.47 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.714 ( 1.648 3.502 -0.773) 3.947 2.747 ( 6.625 11.333 1.089) 13.173 3.323 ( 5.813 8.786 -5.378) 11.828 3.501 ( 3.220 4.721 -0.249) 5.720 3.684 ( 7.625 18.283 1.775) 19.889 3.745 ( 8.383 10.363 1.933) 13.469 4.053 ( 2.550 6.072 4.149) 7.784 4.495 ( 4.298 4.054 -5.203) 7.873 4.611 ( 2.248 4.369 -0.300) 4.922 5.329 ( 9.129 18.815 3.986) 21.290 6.271 ( -1.521 -0.547 0.986) 1.893 6.403 ( 5.214 9.222 1.788) 10.744 7.805 ( 4.490 5.412 2.496) 7.462 8.486 ( -2.300 -2.970 0.399) 3.777 9.436 ( 4.803 6.291 -0.800) 7.955 9.545 ( 5.706 5.129 -2.820) 8.175 9.647 ( -5.007 6.391 0.094) 8.119 9.800 ( -0.655 4.016 -2.419) 4.734 10.035 ( 8.370 -1.289 3.154) 9.037 10.437 ( -5.896 -7.716 4.153) 10.561 10.891 ( -6.387 -9.703 -3.963) 12.273 12.610 ( 6.190 10.503 -0.665) 12.209 14.202 ( -2.455 0.468 -0.675) 2.589 14.496 ( 1.586 -2.542 1.414) 3.313======================= Grid point 297 (108/344) =======================q-point: ( 0.53 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.760 ( 0.661 2.444 -0.134) 2.535 2.934 ( 0.212 13.904 0.642) 13.920 3.362 ( -0.705 -4.914 -2.032) 5.364 3.636 ( 6.032 9.973 -2.183) 11.858 3.900 ( -2.124 18.401 1.475) 18.582 4.070 ( 2.224 15.379 2.748) 15.780 4.221 ( 12.399 7.123 1.437) 14.371 4.599 ( 5.239 1.642 -3.650) 6.593 4.668 ( 2.466 -0.125 -0.230) 2.479 5.583 ( 0.206 12.866 2.403) 13.090 6.277 ( -0.737 7.033 1.205) 7.173 6.567 ( 8.901 -3.966 4.629) 10.788 7.945 ( 4.713 4.537 3.604) 7.469 8.438 ( 0.295 -2.489 -3.163) 4.036 9.506 ( -9.498 9.989 -2.667) 14.040 9.579 ( -1.816 5.211 2.888) 6.229 9.700 ( 4.972 2.339 -2.672) 6.110 9.864 ( 4.085 3.126 -2.587) 5.758 10.176 ( 7.776 -0.826 2.309) 8.153 10.317 ( -1.474 -6.044 5.041) 8.007 10.703 ( -2.707 -9.810 -4.381) 11.080 12.816 ( 2.789 14.701 -0.358) 14.968 14.142 ( -4.083 -0.012 -0.604) 4.128 14.497 ( 4.154 -7.948 0.560) 8.985======================= Grid point 298 (109/344) =======================q-point: ( 0.60 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.789 ( -0.723 3.280 0.224) 3.366 3.038 ( -5.132 15.392 0.575) 16.235 3.290 ( 0.645 -6.863 -0.787) 6.938 3.816 ( 2.749 10.048 -4.355) 11.291 4.015 ( -5.607 18.192 1.422) 19.089 4.155 ( -2.664 5.311 3.310) 6.801 4.506 ( 7.155 7.316 0.551) 10.248 4.649 ( 1.794 -2.443 -1.257) 3.281 4.763 ( 6.527 5.050 -1.208) 8.341 5.615 ( -11.002 13.594 2.852) 17.719 6.370 ( 4.467 2.289 -0.387) 5.035 6.648 ( 7.232 -10.107 6.180) 13.880 8.054 ( 2.526 1.895 3.453) 4.679 8.433 ( 2.469 -1.611 -5.111) 5.900 9.399 ( -11.490 10.549 0.783) 15.617 9.626 ( -1.255 5.476 0.851) 5.682 9.768 ( 1.783 1.039 -0.882) 2.244 9.967 ( 4.543 2.711 -4.030) 6.651 10.228 ( 2.243 -7.875 -0.128) 8.189 10.312 ( 3.656 -2.410 6.778) 8.069 10.593 ( 0.938 -6.474 -4.253) 7.803 12.982 ( -2.806 17.616 -0.274) 17.840 14.077 ( -1.690 -1.999 0.587) 2.683 14.483 ( 5.171 -10.841 -0.809) 12.038======================= Grid point 299 (110/344) =======================q-point: (-0.33 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.799 ( -2.130 3.577 0.135) 4.165 3.071 ( -8.659 14.906 0.624) 17.250 3.262 ( 3.983 -5.948 -0.387) 7.169 3.890 ( -4.268 9.402 -5.916) 11.901 4.089 ( -5.010 13.777 0.957) 14.691 4.115 ( -7.720 4.048 3.990) 9.587 4.583 ( -0.588 -1.268 -0.886) 1.655 4.663 ( 3.350 -2.668 0.631) 4.329 4.889 ( -1.696 5.597 -0.229) 5.853 5.561 ( -10.999 16.742 2.712) 20.214 6.429 ( 3.015 -4.389 -1.664) 5.579 6.645 ( 3.670 -11.848 6.436) 13.974 8.073 ( -1.012 -1.759 1.573) 2.568 8.458 ( 2.411 -0.666 -4.140) 4.837 9.361 ( -6.490 13.222 2.227) 14.896 9.645 ( -2.524 4.855 0.646) 5.510 9.788 ( -0.151 0.532 -0.270) 0.616 10.037 ( 0.619 2.796 -4.750) 5.546 10.177 ( 3.196 -10.030 0.559) 10.542 10.319 ( 0.771 -6.865 3.610) 7.795 10.594 ( 4.416 -2.209 -1.911) 5.294 13.049 ( -9.522 16.587 -0.303) 19.129 14.062 ( 2.028 -1.660 1.860) 3.214 14.461 ( 5.859 -11.809 -2.014) 13.336======================= Grid point 300 (111/344) =======================q-point: (-0.27 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.789 ( -2.238 2.300 -0.029) 3.209 3.037 ( -11.007 11.977 0.481) 16.274 3.307 ( 6.424 -3.337 -0.338) 7.247 3.832 ( -9.057 4.532 -4.414) 11.048 3.998 ( -10.233 4.546 1.718) 11.328 4.113 ( -8.796 12.413 1.872) 15.328 4.493 ( -9.146 -1.384 -0.018) 9.250 4.684 ( 1.676 -2.541 -0.036) 3.044 4.787 ( -7.675 -4.328 -0.072) 8.812 5.600 ( -6.302 16.052 2.125) 17.375 6.367 ( -3.719 -5.261 -1.283) 6.569 6.581 ( 1.718 -12.074 4.989) 13.177 8.003 ( -3.924 -3.378 0.306) 5.187 8.473 ( 0.892 -0.567 -2.320) 2.550 9.441 ( -2.434 15.745 1.890) 16.044 9.642 ( -3.696 4.928 1.863) 6.436 9.776 ( -1.312 0.148 -0.606) 1.453 9.997 ( -2.579 -3.880 -5.253) 7.021 10.162 ( 0.922 -4.817 2.651) 5.575 10.242 ( 0.606 -7.656 -0.024) 7.680 10.669 ( 7.043 -2.688 -0.312) 7.545 12.983 ( -13.501 11.037 -0.234) 17.440 14.118 ( 3.088 2.067 2.321) 4.381 14.444 ( 6.062 -11.098 -2.494) 12.889======================= Grid point 301 (112/344) =======================q-point: (-0.20 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.771 ( -1.768 0.760 -0.196) 1.934 2.927 ( -12.608 6.448 0.225) 14.163 3.403 ( 6.717 -0.931 -0.844) 6.833 3.660 ( -12.029 0.204 -1.495) 12.123 3.866 ( -11.555 5.584 1.157) 12.885 4.015 ( -18.517 11.495 0.497) 21.800 4.217 ( -14.511 -7.580 0.992) 16.402 4.642 ( -2.258 -4.270 -1.201) 4.978 4.677 ( -1.476 -1.597 -0.151) 2.180 5.570 ( -12.237 4.865 1.468) 13.250 6.252 ( -5.392 2.532 0.230) 5.961 6.488 ( -0.483 -10.515 2.750) 10.879 7.886 ( -5.865 -2.280 0.216) 6.297 8.473 ( 0.300 -0.473 -0.821) 0.994 9.523 ( -4.662 7.206 -0.905) 8.630 9.643 ( -5.108 10.049 2.878) 11.634 9.754 ( -2.121 1.061 0.334) 2.395 9.895 ( 0.751 -7.121 -4.202) 8.302 10.031 ( -8.878 -3.759 1.522) 9.760 10.270 ( 6.974 -3.929 0.435) 8.017 10.783 ( 9.477 -2.773 -0.434) 9.884 12.821 ( -13.748 4.858 -0.170) 14.582 14.195 ( 1.271 3.706 1.333) 4.138 14.442 ( 5.017 -7.359 -1.478) 9.028======================= Grid point 302 (113/344) =======================q-point: (-0.13 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.710 ( -10.342 -0.239 0.452) 10.355 2.750 ( -7.336 0.127 -0.572) 7.359 3.422 ( -12.653 -0.807 -3.047) 13.040 3.500 ( 0.353 1.743 0.289) 1.802 3.648 ( -24.937 -1.634 1.162) 25.018 3.713 ( -9.237 0.980 0.851) 9.328 3.991 ( -8.693 -0.306 1.448) 8.819 4.576 ( -3.594 1.131 -2.287) 4.407 4.609 ( -5.436 -0.602 0.532) 5.495 5.268 ( -23.790 -0.641 1.475) 23.844 6.256 ( 2.585 -0.568 0.340) 2.668 6.365 ( -7.386 0.151 1.171) 7.480 7.771 ( -6.102 0.462 0.715) 6.161 8.478 ( 0.886 -0.195 0.267) 0.945 9.442 ( -7.323 0.432 0.003) 7.336 9.604 ( -8.290 2.754 -2.101) 8.985 9.657 ( -4.999 -4.437 -0.104) 6.685 9.843 ( -6.284 -5.644 -1.783) 8.633 9.959 ( 3.373 7.626 3.016) 8.867 10.383 ( 8.614 -0.837 1.059) 8.719 10.945 ( 11.458 -0.211 -1.157) 11.518 12.621 ( -11.775 0.047 -0.271) 11.778 14.217 ( -0.597 -1.149 -0.481) 1.381 14.470 ( 1.690 1.259 0.760) 2.241======================= Grid point 303 (114/344) =======================q-point: (-0.07 0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.438 ( -16.798 -3.575 1.467) 17.237 2.603 ( -13.105 -0.487 -0.786) 13.138 3.137 ( -15.781 -2.133 0.489) 15.932 3.284 ( -11.917 -2.786 -2.966) 12.593 3.388 ( -13.333 -0.465 -0.687) 13.359 3.669 ( 1.438 -0.692 -0.696) 1.741 3.876 ( -7.892 5.076 3.911) 10.166 4.467 ( -10.492 1.655 -0.789) 10.651 4.525 ( -6.351 4.096 -2.276) 7.893 4.809 ( -28.940 3.034 3.863) 29.354 6.134 ( -11.653 -3.457 -1.151) 12.210 6.396 ( 4.176 5.656 0.004) 7.031 7.695 ( -5.159 3.190 1.587) 6.270 8.509 ( 2.935 -0.009 0.808) 3.044 9.306 ( -7.636 -0.863 0.177) 7.686 9.429 ( -7.035 -5.885 1.318) 9.266 9.541 ( -6.949 0.753 -3.619) 7.871 9.711 ( -1.820 -5.772 -1.864) 6.333 10.086 ( 1.393 6.460 3.496) 7.476 10.545 ( 10.223 -0.835 0.311) 10.262 11.183 ( 13.562 5.619 -1.281) 14.736 12.421 ( -8.886 -3.851 -0.578) 9.702 14.158 ( -2.176 -4.875 -0.099) 5.340 14.510 ( -2.697 7.026 1.586) 7.692======================= Grid point 309 (115/344) =======================q-point: ( 0.33 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.214 ( 0.000 8.997 4.591) 10.101 2.595 ( -0.000 16.800 6.331) 17.954 2.670 ( -0.000 11.238 -2.371) 11.485 3.065 ( -0.000 11.126 -9.808) 14.832 3.301 ( -0.000 3.652 -0.626) 3.705 3.658 ( -0.000 -0.224 -2.263) 2.274 3.972 ( 0.000 12.633 7.688) 14.789 4.367 ( -0.000 6.824 0.069) 6.825 4.445 ( -0.000 12.036 -6.650) 13.751 4.760 ( -0.000 31.809 7.472) 32.675 5.942 ( -0.000 13.106 -4.150) 13.747 6.532 ( -0.000 2.396 0.769) 2.517 7.628 ( -0.000 6.875 0.115) 6.876 8.677 ( 0.000 -0.737 2.608) 2.710 9.038 ( -0.000 -0.361 -0.955) 1.021 9.428 ( 0.000 -1.722 6.179) 6.415 9.579 ( -0.000 -0.438 -2.371) 2.411 9.692 ( 0.000 5.546 5.036) 7.492 9.842 ( -0.000 4.391 -8.483) 9.552 10.855 ( 0.000 -10.666 5.353) 11.934 11.517 ( -0.000 -7.910 -4.120) 8.919 12.096 ( -0.000 4.277 -2.081) 4.756 14.097 ( 0.000 0.588 2.953) 3.011 14.616 ( -0.000 5.748 1.210) 5.874======================= Grid point 310 (116/344) =======================q-point: ( 0.40 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.371 ( 9.592 4.711 0.838) 10.719 2.683 ( -1.131 7.061 0.650) 7.180 2.960 ( 14.447 12.009 0.925) 18.809 3.218 ( 2.946 18.100 -2.125) 18.460 3.407 ( 8.101 3.995 -2.014) 9.254 3.626 ( -1.158 -2.672 -1.565) 3.306 4.095 ( -1.796 11.702 6.813) 13.659 4.455 ( 1.248 8.006 -1.904) 8.324 4.537 ( 0.653 8.352 -5.158) 9.838 5.095 ( 2.886 25.221 6.077) 26.103 6.050 ( 4.169 3.306 -2.279) 5.788 6.581 ( -4.236 13.115 1.817) 13.901 7.712 ( 1.069 7.703 0.447) 7.789 8.625 ( -4.648 -2.303 2.109) 5.600 9.105 ( 8.919 -1.208 -0.939) 9.049 9.439 ( 2.222 0.470 3.992) 4.593 9.611 ( 2.269 2.458 -2.169) 3.987 9.763 ( 3.346 0.549 -4.625) 5.735 9.903 ( -0.338 9.769 3.014) 10.229 10.718 ( -6.027 -8.046 3.312) 10.584 11.282 ( -13.522 -7.148 -3.292) 15.645 12.260 ( 11.635 4.012 -1.551) 12.405 14.136 ( 2.684 0.411 1.264) 2.995 14.629 ( -4.427 4.540 0.859) 6.399======================= Grid point 311 (117/344) =======================q-point: ( 0.47 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.630 ( 13.599 4.524 -0.116) 14.332 2.728 ( 1.311 3.040 -0.297) 3.323 3.279 ( 8.757 7.686 -3.349) 12.123 3.504 ( 4.275 8.540 -0.502) 9.563 3.624 ( 11.095 8.330 3.560) 14.323 3.643 ( 10.668 6.386 -0.583) 12.447 4.180 ( -2.732 11.084 4.677) 12.336 4.528 ( -1.291 7.939 -4.957) 9.448 4.623 ( 1.954 4.815 -0.998) 5.292 5.378 ( 6.317 13.853 3.415) 15.603 6.159 ( 5.644 2.236 -0.011) 6.071 6.629 ( -7.546 14.668 2.912) 16.750 7.820 ( 2.197 7.676 1.931) 8.214 8.512 ( -4.441 -3.575 0.095) 5.702 9.289 ( 12.648 -0.563 -1.503) 12.749 9.531 ( 4.377 4.102 1.731) 6.244 9.675 ( 3.485 0.759 -2.219) 4.200 9.797 ( 0.998 1.063 -5.391) 5.585 10.022 ( 0.808 10.233 6.297) 12.042 10.513 ( -9.413 -6.198 2.354) 11.514 10.971 ( -12.355 -6.993 -3.381) 14.594 12.523 ( 12.714 6.209 -0.804) 14.173 14.181 ( 2.217 -0.946 -0.433) 2.449 14.565 ( -6.785 2.097 1.214) 7.204======================= Grid point 312 (118/344) =======================q-point: ( 0.53 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.757 ( 2.128 1.540 -0.246) 2.638 2.939 ( 11.613 7.437 0.536) 13.801 3.343 ( -2.136 -2.990 -2.052) 4.209 3.618 ( 6.453 7.856 -1.258) 10.244 3.916 ( 11.451 6.751 1.203) 13.347 4.067 ( 17.550 12.721 2.711) 21.844 4.251 ( -2.916 13.504 1.186) 13.866 4.570 ( 0.255 5.688 -3.373) 6.617 4.668 ( -0.774 1.840 -0.277) 2.015 5.620 ( 8.464 8.025 1.637) 11.778 6.281 ( 5.057 2.377 1.285) 5.733 6.608 ( -9.338 8.696 3.565) 13.248 7.948 ( 3.040 7.142 4.196) 8.824 8.414 ( -2.104 -3.590 -3.278) 5.297 9.498 ( 11.502 0.112 -1.002) 11.546 9.652 ( 2.749 5.776 -0.701) 6.435 9.739 ( 5.298 -1.367 -2.485) 6.009 9.782 ( -4.820 3.260 -1.404) 5.985 10.148 ( 1.222 7.983 3.626) 8.853 10.319 ( -5.487 -5.602 4.084) 8.841 10.712 ( -8.573 -6.646 -4.292) 11.666 12.813 ( 11.450 9.643 -0.295) 14.973 14.183 ( -0.363 -1.623 -1.780) 2.436 14.452 ( -6.115 -2.459 1.815) 6.837======================= Grid point 313 (119/344) =======================q-point: ( 0.60 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.815 ( 1.978 3.080 0.292) 3.672 3.173 ( 4.884 8.903 0.517) 10.168 3.241 ( -2.763 -5.486 -1.030) 6.229 3.818 ( 6.394 8.492 -1.490) 10.734 4.147 ( 6.865 4.275 3.786) 8.929 4.249 ( -1.952 7.407 -1.672) 7.841 4.475 ( 5.908 8.727 -0.779) 10.567 4.636 ( -1.557 -2.024 -0.124) 2.556 4.708 ( 7.813 13.307 -0.742) 15.449 5.824 ( 3.568 9.466 1.388) 10.211 6.369 ( 3.036 -0.173 1.377) 3.338 6.506 ( -6.245 -2.002 3.308) 7.345 8.069 ( 1.471 5.384 6.207) 8.347 8.361 ( 1.394 -2.939 -6.415) 7.192 9.665 ( 4.781 3.232 0.316) 5.780 9.688 ( -9.452 6.154 1.457) 11.372 9.722 ( 1.703 1.320 -1.792) 2.802 9.827 ( 7.218 -2.338 -3.813) 8.491 10.183 ( -0.142 -2.154 0.441) 2.204 10.284 ( 0.128 1.212 7.674) 7.770 10.536 ( -3.039 -4.787 -5.623) 7.986 13.099 ( 7.904 13.214 -0.042) 15.398 14.126 ( -4.174 -1.013 -1.469) 4.539 14.330 ( -1.352 -8.607 1.207) 8.796======================= Grid point 314 (120/344) =======================q-point: ( 0.67 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.877 ( -0.632 5.362 0.321) 5.409 3.142 ( 0.942 -7.273 -0.403) 7.345 3.301 ( -1.994 9.620 0.249) 9.828 3.975 ( 2.088 7.598 -2.284) 8.204 4.191 ( -1.803 -1.499 1.112) 2.595 4.320 ( -2.330 10.982 0.882) 11.261 4.557 ( 1.216 -0.741 -1.172) 1.844 4.593 ( 1.104 -2.828 0.627) 3.100 4.997 ( 3.621 15.042 -0.502) 15.480 5.903 ( -7.825 12.904 2.233) 15.256 6.357 ( -1.920 -3.096 -1.247) 3.850 6.441 ( 6.279 -11.843 4.142) 14.030 8.104 ( -2.368 0.894 4.127) 4.842 8.385 ( 4.214 -0.327 -5.125) 6.643 9.600 ( -7.700 8.306 2.535) 11.606 9.715 ( -1.145 2.612 -0.367) 2.875 9.780 ( 1.928 1.030 -0.473) 2.236 9.915 ( 8.314 -5.348 -3.029) 10.339 10.146 ( -3.947 -0.164 -1.053) 4.088 10.277 ( 0.068 -3.757 5.176) 6.396 10.506 ( 2.865 -0.987 -3.177) 4.390 13.314 ( -0.907 14.831 -0.181) 14.860 14.041 ( -2.130 -1.618 0.951) 2.839 14.249 ( 3.423 -11.273 -1.037) 11.826======================= Grid point 315 (121/344) =======================q-point: (-0.27 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.873 ( -4.376 2.891 0.070) 5.245 3.155 ( 6.790 -3.629 -0.395) 7.709 3.299 ( -7.526 6.370 0.261) 9.864 3.996 ( -6.371 3.981 -2.424) 7.894 4.134 ( -3.106 -0.789 1.115) 3.393 4.343 ( -5.662 7.347 1.083) 9.339 4.549 ( 0.053 -1.022 -0.746) 1.266 4.613 ( 3.151 -2.507 0.402) 4.047 5.013 ( -14.037 4.888 -0.197) 14.865 5.884 ( -8.493 11.992 1.882) 14.815 6.306 ( 2.575 -5.717 -1.395) 6.424 6.439 ( 3.567 -8.989 3.369) 10.241 8.049 ( -3.821 -1.204 1.573) 4.304 8.441 ( 2.386 0.579 -2.513) 3.513 9.618 ( -2.005 10.379 2.572) 10.880 9.710 ( -0.684 0.165 -0.409) 0.814 9.791 ( -0.622 0.152 -0.809) 1.031 9.964 ( 2.043 -8.094 -1.456) 8.474 10.066 ( -1.546 1.769 -1.351) 2.710 10.251 ( -1.261 -2.640 2.543) 3.877 10.555 ( 4.061 -0.741 -1.264) 4.317 13.312 ( -12.423 8.156 -0.251) 14.863 14.082 ( 5.050 3.528 2.455) 6.631 14.214 ( 5.769 -10.805 -2.425) 12.487======================= Grid point 316 (122/344) =======================q-point: (-0.20 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.816 ( -3.196 -0.026 -0.173) 3.201 3.168 ( -10.977 -0.195 -0.052) 10.978 3.269 ( 7.537 0.064 -0.530) 7.556 3.860 ( -10.468 0.932 -0.944) 10.552 4.053 ( -7.132 0.532 1.943) 7.411 4.269 ( -7.009 -1.240 -0.154) 7.120 4.493 ( -10.906 0.294 -0.256) 10.913 4.650 ( 2.417 0.008 -0.608) 2.492 4.721 ( -14.345 -0.140 0.064) 14.345 5.792 ( -9.796 -0.882 0.490) 9.848 6.353 ( 0.065 5.885 -1.267) 6.020 6.388 ( 1.012 -6.569 3.902) 7.707 7.970 ( -4.750 -0.083 1.155) 4.889 8.466 ( 0.513 0.692 -1.246) 1.515 9.639 ( -3.885 -0.056 0.303) 3.897 9.739 ( 3.341 -5.594 -2.285) 6.905 9.775 ( -1.018 0.097 -1.219) 1.591 9.857 ( -5.356 5.909 1.295) 8.080 10.118 ( 1.777 -0.084 2.069) 2.729 10.185 ( -2.573 -0.383 0.320) 2.621 10.633 ( 6.058 -0.052 -1.306) 6.198 13.101 ( -15.158 0.109 -0.036) 15.159 14.180 ( 2.494 -2.907 -1.523) 4.122 14.283 ( 8.485 2.914 1.391) 9.079======================= Grid point 317 (123/344) =======================q-point: (-0.13 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.768 ( -1.889 -0.815 -0.475) 2.111 2.926 ( -12.446 -6.626 0.123) 14.100 3.399 ( 6.546 1.092 -1.260) 6.755 3.668 ( -12.409 1.360 -0.445) 12.492 3.868 ( -13.023 -8.321 1.289) 15.508 4.021 ( -16.286 -9.501 1.429) 18.909 4.209 ( -14.817 6.930 -0.193) 16.358 4.646 ( -2.222 4.489 -0.642) 5.050 4.674 ( -1.378 1.891 -0.427) 2.379 5.558 ( -12.109 -6.094 -0.144) 13.556 6.256 ( -6.070 -3.020 0.685) 6.814 6.484 ( 0.315 9.518 2.161) 9.765 7.894 ( -5.659 2.671 1.379) 6.408 8.475 ( -0.007 0.943 -0.545) 1.089 9.537 ( -3.593 -7.200 1.240) 8.142 9.589 ( -4.351 -11.338 -4.661) 13.008 9.745 ( -2.910 1.037 -1.293) 3.349 9.907 ( -5.111 3.947 -1.568) 6.646 10.071 ( -3.455 6.740 6.281) 9.839 10.268 ( 6.318 3.325 0.365) 7.149 10.772 ( 9.431 2.382 -2.007) 9.932 12.821 ( -13.812 -4.811 -0.133) 14.626 14.171 ( 1.618 -4.510 -2.030) 5.203 14.468 ( 4.771 8.362 2.114) 9.857======================= Grid point 318 (124/344) =======================q-point: (-0.07 0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.624 ( -12.544 -9.416 0.276) 15.687 2.723 ( -3.196 -0.298 -0.885) 3.329 3.390 ( -15.533 -6.885 -1.004) 17.020 3.458 ( -13.181 -5.796 0.193) 14.400 3.545 ( -0.109 1.899 -1.500) 2.422 3.701 ( -13.481 -3.778 2.008) 14.143 4.097 ( -8.861 7.953 2.082) 12.087 4.616 ( -6.526 0.540 -0.292) 6.555 4.659 ( -3.153 6.331 -1.798) 7.298 5.271 ( -17.536 0.098 0.946) 17.562 6.135 ( -3.154 -4.215 -0.498) 5.288 6.554 ( -4.824 10.960 2.059) 12.150 7.837 ( -5.836 5.263 1.828) 8.068 8.488 ( 0.520 1.077 -0.299) 1.233 9.365 ( -1.298 -16.988 -0.824) 17.058 9.418 ( -6.953 -2.225 -0.462) 7.315 9.688 ( -4.653 1.575 -1.935) 5.280 9.760 ( -9.690 -0.029 -2.636) 10.042 10.151 ( 0.203 6.352 6.837) 9.334 10.421 ( 6.156 4.134 -0.746) 7.453 11.007 ( 13.184 6.470 -2.091) 14.834 12.539 ( -11.225 -7.730 -0.493) 13.638 14.136 ( -0.623 -3.567 -1.224) 3.822 14.609 ( 0.921 8.730 1.953) 8.993======================= Grid point 325 (125/344) =======================q-point: ( 0.40 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.308 ( -0.000 1.760 -0.727) 1.904 2.755 ( -0.000 1.358 -3.270) 3.541 2.942 ( 0.000 12.730 6.794) 14.429 3.353 ( -0.000 2.902 -4.980) 5.764 3.384 ( -0.000 19.843 1.278) 19.884 3.606 ( -0.000 -2.888 -1.559) 3.282 4.238 ( 0.000 10.521 6.244) 12.235 4.503 ( -0.000 6.427 0.314) 6.435 4.615 ( -0.000 8.708 -6.555) 10.899 5.276 ( -0.000 11.822 3.693) 12.385 6.067 ( -0.000 8.543 -1.249) 8.634 6.774 ( -0.000 15.985 3.143) 16.291 7.787 ( -0.000 8.592 -0.028) 8.592 8.665 ( 0.000 -1.641 0.242) 1.659 8.968 ( 0.000 -6.134 0.760) 6.181 9.409 ( 0.000 -0.538 2.867) 2.917 9.627 ( -0.000 4.041 -1.330) 4.254 9.747 ( -0.000 2.947 -6.228) 6.890 10.022 ( 0.000 11.384 5.204) 12.517 10.708 ( 0.000 -5.722 1.466) 5.907 11.333 ( 0.000 -9.105 -2.330) 9.398 12.170 ( -0.000 3.781 -1.654) 4.127 14.132 ( -0.000 2.056 0.687) 2.167 14.712 ( -0.000 3.462 0.740) 3.540======================= Grid point 326 (126/344) =======================q-point: ( 0.47 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.425 ( 11.491 1.636 -0.598) 11.622 2.736 ( -0.613 -0.036 -2.293) 2.374 3.181 ( 10.187 8.931 4.867) 14.395 3.436 ( 6.673 1.739 -5.974) 9.124 3.575 ( 1.866 -0.602 -0.261) 1.978 3.624 ( 4.389 17.544 3.263) 18.377 4.335 ( -1.570 9.747 4.653) 10.914 4.593 ( 2.542 6.073 -0.539) 6.606 4.665 ( -1.681 6.781 -4.704) 8.422 5.360 ( 3.994 -0.783 1.883) 4.485 6.191 ( 0.541 13.466 -0.474) 13.485 6.895 ( -4.842 14.161 3.901) 15.466 7.880 ( 0.831 8.291 0.687) 8.361 8.569 ( -6.073 -3.470 -0.756) 7.035 9.032 ( 12.083 -5.303 -0.102) 13.195 9.458 ( 4.653 0.654 1.511) 4.935 9.668 ( 0.474 3.661 -1.205) 3.883 9.782 ( 1.607 3.165 -4.851) 6.011 10.147 ( -0.314 11.429 5.953) 12.890 10.609 ( -6.145 -3.739 0.237) 7.197 11.113 ( -11.897 -8.434 -2.292) 14.762 12.331 ( 12.885 3.483 -1.083) 13.392 14.159 ( 0.460 1.462 -0.124) 1.537 14.699 ( -4.865 2.207 0.910) 5.420======================= Grid point 327 (127/344) =======================q-point: ( 0.53 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.693 ( 12.215 2.144 0.522) 12.413 2.755 ( 7.021 0.421 -1.183) 7.133 3.356 ( -0.606 0.518 -0.122) 0.807 3.532 ( 8.991 1.882 -1.362) 9.286 3.752 ( 13.502 5.178 -1.624) 14.552 3.925 ( 11.394 11.809 4.583) 17.038 4.411 ( -1.663 10.133 2.252) 10.513 4.666 ( -2.996 7.647 -3.975) 9.124 4.691 ( 1.078 2.464 -0.114) 2.692 5.460 ( 11.059 -4.155 1.226) 11.878 6.316 ( -0.821 10.861 -0.212) 10.894 6.895 ( -10.062 9.780 3.352) 14.427 7.988 ( 2.142 7.580 2.641) 8.308 8.431 ( -4.861 -3.781 -2.369) 6.598 9.227 ( 15.297 -4.293 -1.070) 15.924 9.571 ( 7.007 0.211 0.229) 7.014 9.709 ( 0.439 3.454 -0.895) 3.595 9.835 ( 1.679 3.068 -2.186) 4.124 10.261 ( -0.802 10.378 5.084) 11.584 10.428 ( -10.633 -2.890 0.358) 11.025 10.815 ( -11.462 -7.278 -2.971) 13.899 12.631 ( 16.517 4.610 -0.473) 17.155 14.165 ( -0.391 -0.288 -1.012) 1.123 14.596 ( -8.806 0.534 1.305) 8.918======================= Grid point 328 (128/344) =======================q-point: ( 0.60 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.781 ( 3.808 0.909 0.226) 3.921 3.049 ( 15.810 3.514 0.088) 16.196 3.269 ( -5.371 -3.009 -0.387) 6.169 3.744 ( 10.012 4.557 -0.462) 11.010 4.030 ( 11.605 4.459 0.236) 12.434 4.210 ( 10.010 2.409 1.437) 10.395 4.502 ( 0.704 7.747 0.533) 7.797 4.661 ( -2.399 1.949 -1.438) 3.409 4.750 ( 2.181 9.145 -0.916) 9.446 5.670 ( 15.956 -2.096 0.716) 16.109 6.365 ( -2.534 4.400 0.446) 5.097 6.757 ( -14.509 4.561 1.596) 15.293 8.115 ( 2.821 6.900 5.308) 9.151 8.317 ( -2.669 -4.075 -4.901) 6.910 9.451 ( 14.759 -3.154 -1.125) 15.135 9.680 ( 5.425 -1.043 -1.139) 5.641 9.746 ( 0.083 2.869 -0.038) 2.871 9.887 ( -0.418 5.326 -0.271) 5.350 10.202 ( -9.494 -3.501 0.614) 10.138 10.356 ( -0.570 6.613 5.272) 8.477 10.576 ( -7.874 -5.268 -4.415) 10.452 12.975 ( 16.590 6.175 -0.040) 17.702 14.137 ( -1.108 -1.670 -1.819) 2.707 14.418 ( -11.228 -1.703 1.771) 11.494======================= Grid point 329 (129/344) =======================q-point: ( 0.67 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.877 ( 5.295 2.262 0.251) 5.763 3.132 ( -6.205 -3.376 -0.030) 7.064 3.306 ( 8.877 3.268 -0.037) 9.460 3.945 ( 8.051 4.056 -0.216) 9.017 4.181 ( 1.864 -0.453 1.176) 2.250 4.355 ( 6.313 2.897 -0.807) 6.992 4.539 ( -0.419 0.300 0.163) 0.541 4.611 ( -3.928 0.084 -0.558) 3.968 4.994 ( 11.108 10.188 -0.350) 15.077 5.936 ( 13.650 1.185 0.222) 13.703 6.320 ( -3.402 -2.592 1.413) 4.504 6.514 ( -15.501 0.487 -0.468) 15.516 8.183 ( -4.034 1.071 4.121) 5.866 8.287 ( 5.473 0.182 -3.968) 6.763 9.657 ( 11.763 -1.747 -0.732) 11.914 9.725 ( 1.338 -0.370 -0.732) 1.569 9.753 ( -2.086 1.049 1.262) 2.654 9.883 ( -7.354 6.178 -1.720) 9.758 10.105 ( 4.223 -4.975 1.970) 6.817 10.350 ( -7.688 0.779 2.078) 8.001 10.465 ( 0.970 0.016 -2.488) 2.671 13.308 ( 13.624 6.359 0.151) 15.036 14.094 ( -1.933 -0.786 -2.479) 3.240 14.199 ( -9.835 -4.428 2.300) 11.029======================= Grid point 330 (130/344) =======================q-point: (-0.27 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.993 ( -6.246 -2.440 0.059) 6.706 3.007 ( 6.715 2.469 -0.066) 7.155 3.401 ( -0.194 -0.082 0.004) 0.211 4.090 ( 4.572 2.322 -0.068) 5.129 4.134 ( -4.306 -2.060 0.100) 4.774 4.451 ( -0.266 -0.284 -0.022) 0.390 4.532 ( 0.497 0.376 0.029) 0.623 4.555 ( -0.285 -0.085 -0.055) 0.303 5.184 ( 0.943 0.412 0.042) 1.030 6.065 ( -2.844 -1.392 -0.029) 3.167 6.289 ( 3.482 -1.181 -0.175) 3.681 6.296 ( -5.039 0.629 0.177) 5.081 8.107 ( -3.570 -1.562 -0.005) 3.897 8.391 ( 4.200 1.866 0.016) 4.595 9.694 ( -2.641 -2.920 -1.150) 4.102 9.732 ( -1.171 1.839 1.844) 2.856 9.813 ( 1.168 -2.067 -1.682) 2.910 9.834 ( 4.053 3.772 0.994) 5.625 10.150 ( -0.673 -0.022 0.001) 0.673 10.230 ( -2.494 -1.429 -0.024) 2.875 10.503 ( 2.184 0.974 0.009) 2.391 13.493 ( 0.163 0.064 -0.000) 0.175 14.024 ( -1.236 -0.600 -0.003) 1.374 14.107 ( 1.283 0.623 0.003) 1.426======================= Grid point 331 (131/344) =======================q-point: (-0.20 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.872 ( -4.306 -3.006 -0.083) 5.252 3.155 ( 6.488 3.663 -0.436) 7.463 3.297 ( -7.445 -6.498 -0.012) 9.882 4.019 ( -6.840 -1.288 0.466) 6.975 4.133 ( -1.661 -0.009 1.309) 2.115 4.328 ( -6.354 -8.579 -1.064) 10.728 4.560 ( -0.132 1.756 0.925) 1.990 4.603 ( 3.234 1.880 -1.058) 3.887 5.012 ( -14.445 -4.851 -0.309) 15.241 5.867 ( -8.036 -13.219 -0.396) 15.475 6.336 ( 3.508 6.808 2.971) 8.215 6.400 ( 2.845 5.767 -2.330) 6.839 8.042 ( -2.946 0.153 0.464) 2.986 8.458 ( 1.693 1.513 -0.024) 2.271 9.587 ( -1.816 -10.590 -1.802) 10.894 9.716 ( -2.026 -1.640 0.409) 2.638 9.795 ( -0.709 0.201 -0.203) 0.764 9.971 ( 2.871 8.534 -0.499) 9.017 10.102 ( -1.500 0.856 3.795) 4.170 10.222 ( -0.391 -0.015 -1.655) 1.700 10.560 ( 3.264 1.632 -0.512) 3.685 13.315 ( -12.451 -7.967 0.169) 14.783 14.053 ( 4.373 -3.305 -1.750) 5.754 14.242 ( 6.468 10.592 1.583) 12.511======================= Grid point 332 (132/344) =======================q-point: (-0.13 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.787 ( -2.275 -2.298 -0.196) 3.240 3.033 ( -10.869 -12.104 -0.135) 16.268 3.305 ( 6.202 3.456 -0.604) 7.125 3.875 ( -9.585 0.428 0.658) 9.617 3.982 ( -11.969 -12.523 0.239) 17.325 4.107 ( -6.148 -8.962 0.897) 10.905 4.495 ( -10.154 1.302 0.342) 10.243 4.678 ( 2.130 2.801 -1.081) 3.681 4.783 ( -7.354 4.070 -0.621) 8.428 5.583 ( -6.277 -16.630 -0.148) 17.776 6.380 ( -5.146 4.222 0.116) 6.657 6.554 ( 3.837 10.833 1.369) 11.573 8.009 ( -3.271 3.322 1.177) 4.808 8.487 ( 0.185 1.601 -0.322) 1.643 9.413 ( -2.114 -15.938 -2.012) 16.203 9.624 ( -4.488 -4.171 -0.735) 6.171 9.779 ( -1.270 -0.085 -0.110) 1.278 10.036 ( -4.225 4.206 -0.950) 6.037 10.161 ( 1.693 2.315 3.894) 4.836 10.247 ( 2.369 8.961 0.513) 9.283 10.658 ( 6.220 2.868 -1.907) 7.110 12.985 ( -13.640 -11.068 0.004) 17.566 14.089 ( 3.046 -1.686 -1.711) 3.880 14.474 ( 6.242 10.937 1.693) 12.706======================= Grid point 333 (133/344) =======================q-point: (-0.07 0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.708 ( -10.659 -13.316 0.078) 17.057 2.746 ( -1.040 -0.994 -0.490) 1.520 3.432 ( 4.442 2.156 -0.557) 4.969 3.549 ( -15.051 -18.622 -0.080) 23.944 3.707 ( -11.392 2.336 -1.971) 11.795 3.895 ( -11.038 -6.213 3.729) 13.203 4.347 ( -10.314 7.173 0.937) 12.598 4.703 ( -2.425 1.375 -0.567) 2.845 4.757 ( -2.715 4.499 -1.420) 5.444 5.359 ( -2.023 -11.984 -0.093) 12.154 6.282 ( -10.809 5.384 -0.866) 12.107 6.701 ( 0.487 9.276 3.395) 9.890 7.994 ( -4.519 6.223 1.290) 7.798 8.501 ( -0.289 1.685 -0.652) 1.829 9.205 ( -1.576 -17.313 -1.567) 17.455 9.496 ( -5.375 -3.518 -0.178) 6.427 9.745 ( -2.444 -0.304 -0.135) 2.467 9.936 ( -8.468 1.464 -3.936) 9.452 10.214 ( 0.586 3.033 7.459) 8.073 10.413 ( 2.620 10.124 -0.932) 10.499 10.847 ( 11.647 5.553 -2.332) 13.112 12.643 ( -11.998 -12.046 -0.411) 17.007 14.111 ( 0.806 -0.397 -1.142) 1.453 14.664 ( 3.407 9.076 1.500) 9.809======================= Grid point 341 (134/344) =======================q-point: ( 0.47 0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.323 ( -0.000 0.534 -0.808) 0.969 2.728 ( -0.000 -1.426 -2.929) 3.257 3.185 ( 0.000 7.171 8.555) 11.163 3.381 ( -0.000 2.961 -6.984) 7.586 3.543 ( 0.000 -2.309 -0.669) 2.404 3.765 ( -0.000 15.488 2.303) 15.659 4.448 ( -0.000 8.459 3.652) 9.213 4.615 ( -0.000 4.451 0.207) 4.456 4.742 ( -0.000 6.389 -4.072) 7.576 5.270 ( 0.000 -8.678 0.821) 8.716 6.343 ( -0.000 15.406 -1.075) 15.443 7.078 ( -0.000 11.552 3.852) 12.177 7.952 ( -0.000 7.344 0.311) 7.350 8.613 ( -0.000 -2.661 -2.202) 3.454 8.838 ( 0.000 -6.423 1.137) 6.523 9.429 ( 0.000 1.236 0.724) 1.432 9.696 ( -0.000 3.005 -0.429) 3.035 9.792 ( -0.000 3.508 -3.626) 5.045 10.274 ( 0.000 10.352 5.704) 11.819 10.637 ( -0.000 -1.284 -1.238) 1.783 11.135 ( 0.000 -9.676 -1.515) 9.794 12.229 ( -0.000 2.682 -1.039) 2.876 14.178 ( -0.000 2.239 -0.273) 2.256 14.764 ( 0.000 1.478 0.940) 1.752======================= Grid point 342 (135/344) =======================q-point: ( 0.53 0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.446 ( 13.029 0.781 -0.139) 13.053 2.710 ( 0.404 -1.007 -1.050) 1.510 3.335 ( 7.851 3.746 4.778) 9.924 3.416 ( 0.891 -0.489 -4.280) 4.399 3.583 ( 8.409 1.655 -0.754) 8.604 3.927 ( 3.236 10.065 1.887) 10.740 4.527 ( -0.892 7.781 2.050) 8.096 4.681 ( 2.455 2.554 0.036) 3.542 4.775 ( -2.001 6.244 -2.995) 7.209 5.226 ( 6.611 -9.908 0.546) 11.924 6.461 ( -1.900 11.107 -1.250) 11.338 7.130 ( -5.855 7.286 2.043) 9.568 8.029 ( 1.274 5.719 1.169) 5.975 8.496 ( -6.709 -2.731 -1.376) 7.373 8.927 ( 13.048 -4.255 -0.256) 13.726 9.478 ( 4.037 0.815 0.127) 4.121 9.727 ( 0.666 2.262 -0.158) 2.363 9.829 ( 1.233 2.705 -1.602) 3.377 10.371 ( -0.444 6.841 4.460) 8.179 10.583 ( -6.323 2.499 -1.322) 6.926 10.927 ( -10.690 -9.118 -1.540) 14.134 12.384 ( 13.824 2.067 -0.557) 13.989 14.187 ( -1.180 1.306 -0.662) 1.880 14.731 ( -5.240 0.640 1.130) 5.398======================= Grid point 343 (136/344) =======================q-point: ( 0.60 0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.725 ( 3.608 0.485 0.925) 3.756 2.751 ( 18.302 0.170 -0.618) 18.313 3.345 ( -4.925 -0.690 0.423) 4.991 3.566 ( 12.906 1.144 -0.007) 12.957 3.828 ( 15.047 2.559 -0.595) 15.275 4.081 ( 6.676 2.708 0.675) 7.236 4.576 ( -1.292 4.583 0.782) 4.825 4.706 ( -0.888 0.035 -0.102) 0.895 4.809 ( -0.732 6.309 -1.603) 6.551 5.340 ( 15.681 -5.645 -0.018) 16.666 6.486 ( -4.302 5.061 -0.692) 6.678 7.028 ( -11.562 2.564 -0.638) 11.860 8.116 ( 3.155 3.196 0.952) 4.591 8.363 ( -5.853 -1.418 0.122) 6.024 9.150 ( 15.854 -2.090 -0.866) 16.015 9.573 ( 5.977 0.137 -0.461) 5.996 9.760 ( 0.797 1.327 0.135) 1.554 9.880 ( 2.440 1.632 0.268) 2.948 10.375 ( -6.473 -0.949 0.571) 6.567 10.489 ( -8.341 8.572 2.117) 12.147 10.653 ( -8.801 -7.486 -2.180) 11.758 12.695 ( 18.870 1.768 -0.103) 18.953 14.160 ( -2.369 0.164 -1.052) 2.597 14.604 ( -9.845 -0.184 1.300) 9.932======================= Grid point 344 (137/344) =======================q-point: (-0.33 -0.53 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.792 ( 4.764 -0.062 0.307) 4.774 3.083 ( 17.314 -0.025 -0.139) 17.315 3.239 ( -6.660 0.199 0.654) 6.695 3.793 ( 11.576 0.246 1.116) 11.632 4.083 ( 10.563 0.067 0.112) 10.564 4.217 ( 8.798 -0.803 -1.661) 8.990 4.569 ( -1.825 -0.306 0.153) 1.856 4.676 ( -2.804 0.437 -0.218) 2.846 4.881 ( 5.848 0.687 0.240) 5.893 5.624 ( 19.217 -0.544 -0.992) 19.250 6.415 ( -6.272 -0.102 -0.084) 6.273 6.793 ( -15.527 -0.888 -2.501) 15.753 8.176 ( 2.439 -3.871 -5.727) 7.330 8.291 ( -2.691 3.876 6.845) 8.314 9.412 ( 15.062 0.375 -0.785) 15.087 9.670 ( 4.699 0.195 -0.647) 4.747 9.775 ( -0.067 0.030 0.403) 0.410 9.956 ( 5.100 0.409 0.941) 5.202 10.153 ( -14.654 -0.468 0.765) 14.682 10.442 ( -2.911 -5.049 -4.503) 7.365 10.509 ( -5.431 4.919 3.973) 8.335 13.041 ( 19.006 0.018 0.153) 19.007 14.117 ( -2.116 0.579 -1.162) 2.483 14.402 ( -12.997 -0.536 1.252) 13.068======================= Grid point 345 (138/344) =======================q-point: (-0.27 -0.53 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.874 ( 5.096 -2.451 -0.123) 5.656 3.139 ( -6.177 3.707 0.862) 7.255 3.305 ( 8.871 -3.318 -0.203) 9.473 3.956 ( 8.278 -3.395 1.288) 9.039 4.163 ( 1.670 -1.299 -1.442) 2.560 4.358 ( 6.678 -2.147 -0.259) 7.019 4.539 ( -0.351 -0.152 0.201) 0.432 4.615 ( -4.085 0.342 0.141) 4.102 5.002 ( 11.086 -9.797 0.755) 14.814 5.923 ( 13.637 -1.782 -1.576) 13.843 6.304 ( -4.611 1.018 -0.897) 4.806 6.502 ( -14.156 -1.274 -2.191) 14.382 8.115 ( -0.997 -4.526 -4.852) 6.710 8.358 ( 2.491 3.359 5.432) 6.855 9.656 ( 11.020 1.896 -0.878) 11.216 9.716 ( -0.906 -0.110 -1.184) 1.495 9.761 ( -0.667 -0.693 1.784) 2.027 9.916 ( -6.522 -4.420 2.858) 8.380 10.078 ( 4.317 3.674 -1.928) 5.988 10.310 ( -5.107 -3.505 -3.254) 6.997 10.507 ( -1.147 2.894 3.286) 4.527 13.308 ( 13.566 -6.428 0.067) 15.012 14.117 ( 0.275 3.198 0.322) 3.226 14.177 ( -12.000 2.220 -0.146) 12.205======================= Grid point 346 (139/344) =======================q-point: (-0.20 -0.53 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.873 ( -0.535 -5.319 -0.232) 5.351 3.148 ( 0.506 7.216 0.475) 7.249 3.298 ( -2.012 -9.634 -0.110) 9.843 4.006 ( 3.271 -6.668 2.008) 7.694 4.164 ( -0.818 0.445 -2.698) 2.854 4.317 ( -3.879 -10.949 0.431) 11.624 4.569 ( 2.221 0.754 0.058) 2.346 4.590 ( -0.243 3.266 0.545) 3.321 5.005 ( 3.386 -15.092 0.671) 15.482 5.876 ( -8.174 -13.386 -1.556) 15.761 6.372 ( -0.750 3.121 0.454) 3.242 6.387 ( 6.161 9.691 -3.024) 11.875 8.061 ( -0.185 -1.964 -2.325) 3.049 8.439 ( 2.498 1.871 2.781) 4.181 9.578 ( -7.983 -7.515 -0.543) 10.977 9.718 ( -0.950 -3.409 0.092) 3.540 9.788 ( 1.511 -0.493 0.669) 1.725 9.952 ( 6.843 6.182 2.256) 9.494 10.147 ( -0.161 0.661 -1.733) 1.862 10.220 ( -0.758 0.577 -2.253) 2.446 10.542 ( 1.326 2.684 2.123) 3.669 13.316 ( -0.692 -14.765 0.006) 14.782 14.038 ( -3.812 1.690 0.463) 4.195 14.255 ( 4.872 11.290 -0.275) 12.299======================= Grid point 347 (140/344) =======================q-point: (-0.13 0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.796 ( -2.078 -3.585 -0.111) 4.145 3.065 ( -8.586 -14.852 -0.169) 17.155 3.264 ( 3.586 5.983 0.018) 6.976 3.970 ( -2.193 -5.438 4.845) 7.606 4.031 ( -9.314 -15.058 -4.565) 18.285 4.104 ( -4.733 -7.088 0.096) 8.524 4.593 ( -0.384 0.143 0.322) 0.521 4.656 ( 2.873 3.919 -0.243) 4.865 4.892 ( -2.548 -5.016 0.067) 5.626 5.536 ( -10.383 -17.428 -0.710) 20.299 6.452 ( 2.788 4.119 1.000) 5.074 6.581 ( 4.730 10.050 -2.086) 11.301 8.062 ( 0.571 1.662 -0.241) 1.774 8.492 ( 1.243 1.491 0.877) 2.130 9.341 ( -7.036 -12.690 -0.578) 14.521 9.640 ( -2.858 -5.048 -0.117) 5.802 9.790 ( -0.311 -0.602 0.041) 0.679 10.098 ( 0.504 -2.665 3.300) 4.272 10.150 ( 1.791 7.058 -2.447) 7.682 10.290 ( 4.529 8.728 -0.654) 9.855 10.609 ( 2.481 3.152 0.386) 4.029 13.051 ( -9.573 -16.605 0.071) 19.168 14.046 ( 1.419 2.041 -0.421) 2.521 14.478 ( 6.485 11.604 0.455) 13.301======================= Grid point 348 (141/344) =======================q-point: (-0.07 0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.739 ( -7.932 -12.234 0.496) 14.589 2.747 ( -2.648 -4.696 -0.600) 5.424 3.385 ( 4.050 4.395 -0.192) 5.980 3.601 ( -13.635 -20.998 0.031) 25.036 3.884 ( -8.699 -1.504 -2.966) 9.313 3.957 ( -2.693 -6.331 3.719) 7.821 4.558 ( -5.676 3.657 0.805) 6.800 4.730 ( 0.977 2.129 -0.279) 2.359 4.839 ( -2.800 2.051 -1.500) 3.781 5.229 ( -2.960 -17.022 0.419) 17.283 6.492 ( -4.549 5.935 -1.307) 7.591 6.744 ( 4.086 6.964 2.328) 8.403 8.100 ( -0.469 4.965 0.489) 5.011 8.519 ( 0.152 1.513 -0.305) 1.551 9.094 ( -4.954 -14.555 -0.683) 15.390 9.533 ( -3.589 -4.461 -0.042) 5.726 9.771 ( -1.133 -0.634 -0.015) 1.299 10.043 ( -3.945 -0.754 -2.057) 4.513 10.224 ( 1.818 2.127 3.005) 4.106 10.505 ( 2.684 14.369 0.779) 14.638 10.710 ( 7.768 2.777 -1.666) 8.416 12.703 ( -10.941 -15.727 -0.166) 19.159 14.097 ( 1.565 2.116 -0.447) 2.670 14.685 ( 4.775 9.075 0.559) 10.269======================= Grid point 357 (142/344) =======================q-point: ( 0.53 0.53 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.329 ( -0.000 0.259 -0.007) 0.259 2.701 ( 0.000 -0.365 0.298) 0.471 3.271 ( -0.000 0.131 -1.755) 1.760 3.434 ( 0.000 3.121 2.177) 3.805 3.508 ( 0.000 -0.808 -0.281) 0.855 3.984 ( -0.000 5.219 0.041) 5.219 4.605 ( -0.000 5.052 1.023) 5.154 4.677 ( -0.000 1.544 -0.144) 1.550 4.846 ( -0.000 5.805 -1.533) 6.005 5.064 ( 0.000 -10.020 -0.030) 10.020 6.566 ( -0.000 6.467 -1.359) 6.609 7.236 ( -0.000 3.057 -1.021) 3.223 8.065 ( 0.000 3.040 1.424) 3.357 8.564 ( -0.000 -0.840 -1.158) 1.430 8.746 ( 0.000 -2.727 0.591) 2.791 9.451 ( -0.000 0.557 -0.119) 0.569 9.737 ( -0.000 1.113 -0.012) 1.113 9.841 ( -0.000 1.932 -0.021) 1.932 10.427 ( 0.000 1.992 1.565) 2.533 10.672 ( -0.000 5.017 -0.531) 5.045 10.948 ( 0.000 -7.348 -0.541) 7.368 12.265 ( -0.000 1.116 -0.350) 1.170 14.210 ( -0.000 1.027 -0.713) 1.250 14.785 ( 0.000 0.218 1.200) 1.220======================= Grid point 358 (143/344) =======================q-point: (-0.40 -0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.455 ( 13.438 0.057 0.206) 13.440 2.705 ( 0.382 0.489 1.458) 1.584 3.344 ( 8.856 -1.654 -4.782) 10.200 3.429 ( -2.017 1.294 3.582) 4.310 3.612 ( 10.470 0.475 1.586) 10.600 4.021 ( 2.034 -0.847 -1.560) 2.700 4.621 ( -0.982 -0.739 -0.114) 1.235 4.700 ( 1.224 0.019 0.121) 1.230 4.877 ( -1.646 1.622 0.156) 2.316 5.074 ( 9.173 -0.828 -1.197) 9.288 6.577 ( -2.587 0.490 -0.733) 2.733 7.184 ( -6.072 -1.401 -4.409) 7.633 8.094 ( 1.166 -0.267 1.218) 1.708 8.472 ( -6.688 0.681 1.257) 6.839 8.881 ( 13.198 0.069 -0.377) 13.204 9.486 ( 3.735 -0.094 -0.466) 3.765 9.751 ( 0.817 0.055 0.150) 0.832 9.865 ( 0.992 0.689 1.633) 2.031 10.417 ( -1.240 -1.585 -1.661) 2.610 10.682 ( -2.999 -0.313 0.669) 3.088 10.783 ( -12.761 1.320 0.379) 12.835 12.406 ( 14.120 0.199 0.027) 14.121 14.199 ( -1.726 0.140 -0.886) 1.945 14.740 ( -5.419 -0.246 1.284) 5.575======================= Grid point 359 (144/344) =======================q-point: (-0.33 -0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.718 ( 7.806 -0.882 0.015) 7.855 2.764 ( 13.548 0.474 1.008) 13.594 3.349 ( -4.329 0.840 1.151) 4.557 3.570 ( 13.261 -0.788 0.602) 13.298 3.839 ( 14.848 -1.693 1.095) 14.984 4.050 ( 6.293 -4.950 -3.832) 8.876 4.565 ( -1.004 -5.571 -0.808) 5.718 4.710 ( -0.597 0.144 0.368) 0.716 4.834 ( -1.233 -4.352 1.904) 4.908 5.324 ( 15.800 4.969 -2.291) 16.721 6.489 ( -4.516 -4.724 -0.179) 6.538 6.991 ( -11.068 -4.469 -6.063) 13.387 8.093 ( 1.213 -4.420 -1.818) 4.931 8.397 ( -4.328 2.672 4.359) 6.699 9.153 ( 16.008 2.661 -0.488) 16.235 9.570 ( 6.119 -0.196 -0.862) 6.182 9.762 ( 0.818 -1.152 0.373) 1.462 9.897 ( 2.071 -0.637 2.780) 3.524 10.349 ( -3.979 -2.050 -3.225) 5.517 10.470 ( -11.578 -6.942 -0.479) 13.508 10.687 ( -7.857 7.850 2.527) 11.390 12.698 ( 18.784 -1.547 0.274) 18.849 14.161 ( -2.176 0.364 -0.909) 2.386 14.603 ( -9.993 -0.452 1.176) 10.072======================= Grid point 360 (145/344) =======================q-point: (-0.27 -0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.782 ( 3.531 -0.883 0.391) 3.660 3.046 ( 15.662 -3.642 -0.323) 16.083 3.283 ( -5.497 3.501 1.557) 6.700 3.761 ( 9.993 -4.288 2.205) 11.096 4.023 ( 9.416 -5.249 -0.782) 10.809 4.176 ( 12.963 -2.880 -3.422) 13.713 4.496 ( 1.723 -7.807 -0.326) 8.002 4.676 ( -2.815 -0.716 0.735) 2.996 4.768 ( 1.361 -9.454 1.609) 9.686 5.649 ( 16.202 2.035 -2.260) 16.485 6.358 ( -3.261 -4.928 -0.381) 5.921 6.706 ( -13.593 -5.492 -5.714) 15.734 8.045 ( 0.791 -6.166 -4.250) 7.530 8.393 ( -0.970 2.875 5.511) 6.291 9.459 ( 14.629 3.812 0.084) 15.118 9.680 ( 5.972 1.109 -1.191) 6.190 9.755 ( 0.219 -2.024 1.221) 2.374 9.908 ( -0.644 -5.048 2.849) 5.832 10.196 ( -10.485 3.789 -0.403) 11.155 10.287 ( -1.032 -8.021 -4.621) 9.314 10.630 ( -6.723 5.293 3.401) 9.208 12.977 ( 16.416 -6.114 0.259) 17.520 14.149 ( -0.223 2.627 -0.222) 2.646 14.408 ( -11.981 0.751 0.455) 12.013======================= Grid point 361 (146/344) =======================q-point: (-0.20 -0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.814 ( 1.758 -2.951 0.077) 3.435 3.168 ( 4.889 -9.183 -0.146) 10.404 3.256 ( -3.128 5.913 1.180) 6.793 3.841 ( 6.786 -8.177 1.721) 10.764 4.095 ( 5.258 -5.060 -3.834) 8.243 4.264 ( 0.079 -7.401 0.654) 7.430 4.486 ( 6.166 -9.169 0.772) 11.077 4.641 ( -1.441 1.959 0.588) 2.502 4.718 ( 7.184 -12.530 0.535) 14.453 5.804 ( 3.296 -9.591 -1.339) 10.229 6.352 ( 4.325 1.509 -0.892) 4.667 6.449 ( -6.938 -0.438 -4.834) 8.468 8.002 ( 2.017 -4.552 -3.740) 6.227 8.432 ( 1.199 1.808 3.976) 4.530 9.648 ( 2.146 -3.077 -1.210) 3.942 9.702 ( -8.656 -4.695 2.510) 10.162 9.751 ( 2.165 -0.995 2.205) 3.247 9.862 ( 8.332 1.767 1.108) 8.589 10.165 ( -0.723 5.311 -3.391) 6.343 10.201 ( 0.593 -5.391 -3.222) 6.308 10.599 ( -3.065 5.005 3.728) 6.953 13.100 ( 7.852 -13.084 0.067) 15.260 14.151 ( -5.329 0.281 2.257) 5.794 14.308 ( -0.164 9.275 -1.957) 9.481======================= Grid point 362 (147/344) =======================q-point: (-0.13 -0.47 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.787 ( -0.804 -3.170 0.017) 3.270 3.033 ( -5.095 -15.416 -0.145) 16.237 3.300 ( 0.124 7.010 0.725) 7.049 3.867 ( 5.613 -8.157 2.567) 10.229 3.990 ( -6.649 -18.549 -1.941) 19.800 4.117 ( -3.588 -7.483 -2.048) 8.547 4.498 ( 6.539 -8.249 -0.508) 10.538 4.669 ( 1.456 3.300 1.491) 3.903 4.778 ( 6.941 -4.471 0.891) 8.305 5.586 ( -11.319 -13.810 -1.124) 17.892 6.378 ( 5.726 -2.671 0.596) 6.346 6.573 ( 6.905 9.308 -4.268) 12.350 8.019 ( 4.055 -1.214 -1.838) 4.615 8.480 ( 1.777 1.088 1.880) 2.806 9.402 ( -12.449 -9.936 1.283) 15.980 9.621 ( -1.162 -5.926 0.184) 6.042 9.777 ( 0.854 -1.077 0.435) 1.441 10.020 ( 5.478 -2.301 3.360) 6.826 10.195 ( -0.114 3.883 -5.502) 6.735 10.252 ( 7.189 6.083 -1.227) 9.497 10.642 ( -0.183 6.566 2.888) 7.175 12.984 ( -2.764 -17.444 0.116) 17.662 14.080 ( -2.607 1.866 1.029) 3.367 14.482 ( 6.031 10.899 -0.921) 12.490======================= Grid point 373 (148/344) =======================q-point: (-0.40 -0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.334 ( 0.000 0.077 0.700) 0.704 2.721 ( 0.000 1.539 2.992) 3.364 3.213 ( -0.000 -3.352 -7.648) 8.351 3.485 ( 0.000 -0.574 7.041) 7.064 3.510 ( -0.000 1.096 0.073) 1.098 3.966 ( 0.000 -6.355 -2.462) 6.815 4.590 ( 0.000 -6.531 -1.126) 6.627 4.674 ( 0.000 -1.632 -0.508) 1.709 4.868 ( 0.000 -4.262 1.504) 4.519 5.054 ( -0.000 9.983 -1.363) 10.076 6.573 ( 0.000 -5.669 -0.316) 5.678 7.188 ( -0.000 -5.286 -7.819) 9.439 8.074 ( 0.000 -3.085 2.700) 4.099 8.579 ( -0.000 2.014 0.843) 2.183 8.741 ( -0.000 2.171 -0.064) 2.171 9.446 ( -0.000 -0.829 -0.704) 1.087 9.739 ( 0.000 -0.949 0.275) 0.988 9.863 ( 0.000 -0.423 3.199) 3.227 10.387 ( -0.000 -5.031 -4.069) 6.470 10.685 ( 0.000 -3.961 1.175) 4.131 10.959 ( -0.000 8.053 1.025) 8.118 12.270 ( 0.000 -0.634 0.329) 0.715 14.209 ( -0.000 -0.850 -0.971) 1.291 14.786 ( 0.000 -0.662 1.376) 1.527======================= Grid point 374 (149/344) =======================q-point: (-0.33 -0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.451 ( 12.533 -0.584 0.556) 12.559 2.736 ( -0.428 1.431 2.251) 2.702 3.265 ( 10.988 -4.206 -4.687) 12.664 3.474 ( -1.085 1.784 3.187) 3.810 3.605 ( 8.987 -2.060 2.824) 9.643 3.888 ( 2.365 -10.944 -3.619) 11.767 4.499 ( -0.644 -9.180 -1.945) 9.406 4.680 ( 2.748 -2.557 -0.040) 3.754 4.816 ( -1.644 -4.893 2.750) 5.849 5.207 ( 6.118 9.928 -2.101) 11.849 6.467 ( -2.045 -11.096 -0.277) 11.286 7.055 ( -5.398 -7.785 -8.653) 12.830 8.034 ( -0.117 -5.965 1.824) 6.238 8.518 ( -5.974 2.546 1.717) 6.717 8.926 ( 13.459 4.329 -0.432) 14.145 9.469 ( 4.052 -1.215 -1.160) 4.387 9.732 ( 0.723 -1.949 0.495) 2.137 9.871 ( 0.948 -1.325 4.488) 4.775 10.304 ( -0.491 -8.232 -5.191) 9.744 10.598 ( -6.579 -2.674 0.925) 7.161 10.949 ( -10.125 9.483 1.575) 13.962 12.392 ( 13.675 -1.697 0.563) 13.791 14.184 ( -1.023 -1.114 -1.049) 1.841 14.733 ( -5.352 -1.110 1.350) 5.630======================= Grid point 375 (150/344) =======================q-point: (-0.27 -0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.695 ( 13.020 -1.826 0.610) 13.161 2.765 ( 5.155 -0.818 0.183) 5.222 3.377 ( 1.340 0.221 2.855) 3.162 3.546 ( 9.043 -1.326 0.574) 9.158 3.772 ( 12.316 -5.425 1.427) 13.533 3.854 ( 11.018 -12.265 -5.343) 17.331 4.379 ( -0.710 -11.367 -2.273) 11.614 4.694 ( 1.174 -2.423 0.399) 2.722 4.720 ( -3.394 -6.613 3.649) 8.280 5.431 ( 11.087 4.034 -2.724) 12.108 6.312 ( -1.164 -11.344 -0.661) 11.422 6.821 ( -9.453 -8.975 -7.236) 14.909 7.963 ( 0.016 -7.419 -0.720) 7.454 8.466 ( -3.420 2.259 2.493) 4.797 9.236 ( 15.839 4.976 0.296) 16.604 9.553 ( 7.116 -1.017 -2.123) 7.495 9.725 ( 0.937 -2.396 1.269) 2.869 9.884 ( 0.716 -2.157 4.959) 5.455 10.190 ( -0.358 -10.330 -5.186) 11.564 10.425 ( -11.531 1.279 -0.067) 11.602 10.851 ( -10.708 7.488 2.148) 13.242 12.639 ( 16.274 -4.430 0.549) 16.876 14.167 ( 0.170 0.613 -0.820) 1.038 14.594 ( -9.224 -1.104 0.990) 9.342======================= Grid point 376 (151/344) =======================q-point: (-0.20 -0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.764 ( 1.701 -1.269 0.685) 2.230 2.932 ( 11.672 -7.717 -0.499) 14.001 3.378 ( -3.168 4.407 2.665) 6.047 3.637 ( 6.669 -8.689 1.647) 11.076 3.892 ( 9.856 -7.072 -2.290) 12.345 4.033 ( 19.536 -11.692 -2.108) 22.865 4.233 ( -0.951 -15.290 -1.376) 15.381 4.614 ( -1.239 -4.755 2.883) 5.697 4.672 ( -0.754 -1.853 0.391) 2.038 5.594 ( 9.132 -8.450 -2.039) 12.608 6.263 ( 4.590 -2.722 -1.231) 5.477 6.546 ( -9.229 -7.520 -5.219) 12.999 7.903 ( 1.898 -6.399 -2.357) 7.078 8.453 ( -0.945 1.493 2.256) 2.866 9.511 ( 10.076 -0.318 0.875) 10.119 9.660 ( 6.756 -3.358 0.113) 7.545 9.756 ( 3.912 -0.150 0.277) 3.924 9.827 ( -6.064 -1.651 4.838) 7.931 10.085 ( 2.160 -9.458 -5.237) 11.025 10.282 ( -7.067 5.169 -1.582) 8.897 10.761 ( -7.756 6.697 2.774) 10.616 12.817 ( 11.241 -9.512 0.352) 14.729 14.201 ( 0.848 1.885 0.619) 2.157 14.435 ( -7.131 1.933 -0.514) 7.406======================= Grid point 377 (152/344) =======================q-point: (-0.13 -0.40 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.765 ( 0.339 -2.155 0.503) 2.239 2.927 ( 0.382 -14.025 -0.330) 14.034 3.389 ( -1.891 5.877 1.824) 6.438 3.662 ( 7.359 -9.908 1.389) 12.420 3.878 ( -1.441 -16.965 -1.739) 17.114 4.034 ( 0.689 -17.127 -2.289) 17.293 4.209 ( 13.081 -9.049 -0.347) 15.910 4.638 ( 5.013 -0.198 1.917) 5.371 4.672 ( 2.484 0.030 0.364) 2.510 5.560 ( 0.372 -13.514 -0.817) 13.544 6.262 ( 0.086 -6.958 -0.979) 7.027 6.505 ( 7.995 4.764 -3.954) 10.112 7.906 ( 5.098 -3.642 -2.176) 6.632 8.469 ( 0.849 0.856 1.381) 1.833 9.544 ( -9.709 -7.328 -0.363) 12.170 9.560 ( -2.353 -8.340 3.138) 9.217 9.733 ( 3.421 -2.021 2.088) 4.489 9.895 ( 5.196 -3.682 2.070) 6.696 10.115 ( 7.974 1.325 -6.403) 10.312 10.274 ( -0.869 6.833 -1.390) 7.027 10.755 ( -2.749 9.366 3.088) 10.238 12.820 ( 2.768 -14.454 0.260) 14.719 14.158 ( -4.700 -0.650 1.776) 5.066 14.481 ( 4.855 8.273 -1.817) 9.763======================= Grid point 389 (153/344) =======================q-point: (-0.33 -0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.336 ( 0.000 -0.414 0.906) 0.996 2.773 ( 0.000 1.682 3.016) 3.453 3.074 ( -0.000 -7.073 -7.321) 10.180 3.473 ( 0.000 -3.488 6.315) 7.214 3.551 ( -0.000 2.731 0.600) 2.796 3.729 ( 0.000 -15.264 -2.507) 15.468 4.403 ( 0.000 -10.090 -2.817) 10.475 4.610 ( 0.000 -4.427 -0.625) 4.470 4.795 ( 0.000 -4.624 3.514) 5.808 5.252 ( -0.000 8.121 -1.734) 8.304 6.344 ( 0.000 -15.706 -0.849) 15.729 6.991 ( -0.000 -10.126 -8.356) 13.129 7.973 ( 0.000 -7.893 3.215) 8.523 8.625 ( -0.000 1.939 -0.489) 2.000 8.827 ( -0.000 6.190 -0.353) 6.200 9.413 ( -0.000 -1.930 -1.585) 2.497 9.703 ( 0.000 -2.697 0.601) 2.763 9.856 ( 0.000 -2.269 5.422) 5.878 10.202 ( -0.000 -10.320 -4.631) 11.311 10.643 ( -0.000 -0.048 -0.284) 0.288 11.156 ( -0.000 10.039 1.426) 10.140 12.243 ( 0.000 -2.233 0.924) 2.416 14.171 ( -0.000 -2.250 -1.258) 2.578 14.768 ( 0.000 -1.917 1.437) 2.396======================= Grid point 390 (154/344) =======================q-point: (-0.27 -0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.432 ( 11.118 -1.854 0.366) 11.277 2.756 ( -1.682 -0.929 0.424) 1.968 3.135 ( 14.693 -7.155 -2.288) 16.502 3.509 ( 5.537 -2.147 4.805) 7.640 3.578 ( 2.322 -5.295 0.682) 5.822 3.583 ( 1.625 -10.881 -2.846) 11.364 4.279 ( -1.251 -11.299 -3.454) 11.881 4.597 ( 3.743 -5.546 0.165) 6.694 4.729 ( -2.554 -5.743 4.364) 7.652 5.325 ( 3.732 -0.747 -3.045) 4.874 6.188 ( 0.398 -12.932 -0.953) 12.973 6.823 ( -4.633 -11.789 -6.163) 14.086 7.889 ( -0.467 -8.816 2.014) 9.055 8.568 ( -5.450 1.902 -0.866) 5.837 9.033 ( 12.978 5.834 0.080) 14.230 9.429 ( 4.505 -1.865 -2.603) 5.527 9.683 ( 0.923 -3.046 1.008) 3.338 9.852 ( 1.402 -3.118 4.516) 5.664 10.084 ( -0.737 -10.257 -2.543) 10.593 10.595 ( -6.201 2.052 -1.725) 6.756 11.141 ( -11.528 8.914 1.733) 14.675 12.346 ( 12.577 -3.169 0.970) 13.006 14.150 ( 0.760 -1.588 -1.356) 2.222 14.702 ( -5.043 -2.692 1.281) 5.858======================= Grid point 391 (155/344) =======================q-point: (-0.20 -0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.630 ( 13.999 -5.534 -0.248) 15.055 2.730 ( 0.895 -2.903 0.131) 3.040 3.338 ( 12.570 -5.937 4.727) 14.683 3.488 ( 6.433 -14.920 -2.421) 16.427 3.592 ( 4.435 -0.300 -1.562) 4.711 3.652 ( 10.901 -7.626 0.940) 13.336 4.123 ( -1.791 -12.394 -3.632) 13.039 4.585 ( 0.433 -7.173 3.227) 7.877 4.642 ( -0.544 -4.677 1.766) 5.029 5.326 ( 7.150 -15.731 -4.009) 17.739 6.155 ( 4.797 -1.191 -0.614) 4.981 6.582 ( -7.421 -12.172 -3.638) 14.713 7.806 ( 0.710 -7.661 -0.090) 7.695 8.506 ( -3.289 1.476 -0.755) 3.684 9.314 ( 12.957 1.168 2.150) 13.186 9.501 ( 6.482 -3.116 -2.772) 7.708 9.694 ( 2.817 -1.577 0.784) 3.322 9.864 ( 2.823 -2.005 1.312) 3.703 9.961 ( -2.215 -8.886 0.323) 9.163 10.480 ( -9.485 4.674 -2.576) 10.883 11.009 ( -12.012 7.462 2.016) 14.284 12.534 ( 12.376 -6.001 0.739) 13.774 14.177 ( 3.122 0.742 -1.023) 3.368 14.561 ( -7.391 -2.630 0.685) 7.875======================= Grid point 392 (156/344) =======================q-point: (-0.13 -0.33 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.714 ( 3.916 -7.772 -0.627) 8.726 2.745 ( 4.649 -7.469 0.746) 8.829 3.395 ( 4.962 -9.648 4.855) 11.886 3.502 ( 3.141 -1.670 -0.148) 3.561 3.659 ( 9.267 -21.241 -1.845) 23.248 3.721 ( 6.630 -8.005 -1.498) 10.502 4.005 ( 3.590 -7.355 -2.702) 8.618 4.556 ( 3.536 -3.036 3.623) 5.903 4.612 ( 2.018 -4.608 -0.244) 5.036 5.282 ( 10.511 -20.524 -2.763) 23.224 6.259 ( -1.935 1.435 -0.658) 2.497 6.376 ( 4.231 -6.983 -1.939) 8.392 7.778 ( 3.855 -4.970 -1.433) 6.451 8.480 ( -1.056 1.108 -0.449) 1.595 9.441 ( 4.421 -6.040 0.111) 7.486 9.586 ( 7.034 -5.266 3.037) 9.296 9.654 ( -3.751 -7.127 0.645) 8.079 9.829 ( -3.149 -7.260 2.118) 8.192 9.984 ( 8.410 5.711 -4.058) 10.946 10.393 ( -5.681 7.030 -2.174) 9.297 10.934 ( -6.105 9.757 2.272) 11.732 12.618 ( 6.011 -10.240 0.496) 11.884 14.213 ( -1.616 -1.198 0.773) 2.155 14.477 ( 1.110 2.483 -1.294) 3.012======================= Grid point 405 (157/344) =======================q-point: (-0.27 -0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.309 ( 0.000 -3.175 -0.650) 3.241 2.770 ( 0.000 -4.370 -1.216) 4.536 2.880 ( 0.000 -9.387 -2.304) 9.666 3.390 ( 0.000 -16.132 1.896) 16.243 3.406 ( 0.000 -5.178 2.774) 5.874 3.622 ( -0.000 3.646 0.908) 3.757 4.169 ( 0.000 -11.970 -3.774) 12.551 4.498 ( 0.000 -6.255 -0.391) 6.268 4.699 ( 0.000 -7.274 5.629) 9.197 5.216 ( 0.000 -15.006 -4.940) 15.798 6.077 ( 0.000 -6.259 0.208) 6.262 6.724 ( 0.000 -13.338 -3.854) 13.883 7.808 ( 0.000 -9.349 2.857) 9.776 8.640 ( -0.000 0.422 -3.264) 3.291 8.967 ( -0.000 6.967 0.609) 6.993 9.363 ( -0.000 -1.462 -3.601) 3.886 9.644 ( 0.000 -3.357 1.077) 3.526 9.792 ( 0.000 -6.742 -1.055) 6.824 10.010 ( 0.000 -6.390 4.637) 7.895 10.671 ( -0.000 3.731 -3.871) 5.376 11.362 ( -0.000 9.871 1.888) 10.050 12.191 ( 0.000 -3.411 1.352) 3.669 14.114 ( -0.000 -2.575 -1.781) 3.131 14.715 ( 0.000 -4.059 1.209) 4.235======================= Grid point 406 (158/344) =======================q-point: (-0.20 -0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.350 ( 10.018 -7.271 -1.966) 12.534 2.667 ( 0.157 -8.738 -1.621) 8.889 2.949 ( 15.525 -11.157 -0.068) 19.118 3.270 ( 1.568 -11.777 4.299) 12.635 3.421 ( 7.137 -6.569 0.127) 9.701 3.644 ( -1.618 3.624 1.086) 4.114 4.020 ( -1.578 -12.901 -4.017) 13.604 4.470 ( 3.469 -7.189 0.609) 8.006 4.613 ( -1.712 -8.337 5.475) 10.120 5.006 ( 3.422 -27.620 -6.644) 28.614 6.075 ( 3.437 -1.356 1.221) 3.891 6.555 ( -4.110 -10.892 -1.670) 11.761 7.723 ( 0.096 -8.135 1.994) 8.377 8.586 ( -4.329 1.204 -3.410) 5.640 9.128 ( 9.736 2.114 2.479) 10.267 9.380 ( 3.621 -1.149 -4.637) 5.995 9.633 ( 1.894 -2.391 1.039) 3.222 9.732 ( 3.383 -7.601 -6.343) 10.462 9.970 ( -1.562 -2.394 9.908) 10.312 10.659 ( -5.520 6.010 -5.274) 9.716 11.321 ( -13.485 8.182 2.349) 15.947 12.280 ( 11.256 -3.670 1.264) 11.907 14.113 ( 3.096 -1.345 -2.056) 3.952 14.629 ( -4.514 -5.259 0.844) 6.982======================= Grid point 407 (159/344) =======================q-point: (-0.13 -0.27 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.444 ( 11.051 -12.858 -2.033) 17.076 2.617 ( 5.111 -10.454 -0.430) 11.644 3.112 ( 15.557 -15.662 0.674) 22.086 3.239 ( 5.625 -7.197 6.662) 11.306 3.452 ( 4.855 -10.945 -3.592) 12.501 3.664 ( -0.151 2.737 1.054) 2.937 3.872 ( 0.806 -10.330 -3.623) 10.976 4.446 ( 3.491 -8.867 2.826) 9.940 4.530 ( 0.415 -7.146 1.660) 7.348 4.827 ( 11.295 -28.063 -5.318) 30.715 6.142 ( 8.828 -9.362 0.617) 12.883 6.392 ( -7.130 0.903 0.210) 7.190 7.673 ( 2.099 -5.479 0.258) 5.873 8.529 ( -3.163 2.136 -2.573) 4.603 9.282 ( 7.711 -4.766 1.834) 9.249 9.416 ( 5.116 -4.527 -0.223) 6.835 9.604 ( 0.174 -7.582 -1.776) 7.789 9.773 ( 4.092 -1.872 -3.980) 6.008 9.967 ( 0.552 3.400 6.839) 7.658 10.594 ( -8.491 8.590 -4.269) 12.811 11.174 ( -10.836 8.313 2.117) 13.821 12.417 ( 8.064 -5.836 0.947) 10.000 14.180 ( 4.337 -0.170 -1.728) 4.672 14.490 ( -3.729 -4.661 0.135) 5.971======================= Grid point 421 (160/344) =======================q-point: (-0.20 -0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.148 ( 0.000 -12.881 -4.437) 13.624 2.508 ( 0.000 -20.075 -5.729) 20.876 2.733 ( 0.000 -5.125 6.442) 8.232 3.181 ( 0.000 -6.857 6.048) 9.143 3.290 ( 0.000 -6.481 -2.288) 6.873 3.683 ( 0.000 -0.095 1.245) 1.249 3.894 ( 0.000 -13.218 -3.383) 13.644 4.367 ( 0.000 -6.536 0.083) 6.537 4.530 ( 0.000 -16.269 6.139) 17.389 4.655 ( 0.000 -28.868 -7.720) 29.883 5.988 ( 0.000 -11.695 2.291) 11.917 6.526 ( 0.000 -0.785 -0.162) 0.802 7.648 ( 0.000 -7.631 3.016) 8.205 8.631 ( -0.000 1.169 -3.983) 4.151 9.066 ( 0.000 0.913 3.273) 3.398 9.342 ( -0.000 1.674 -6.461) 6.674 9.598 ( -0.000 -8.683 -7.281) 11.332 9.602 ( 0.000 -0.326 1.122) 1.168 9.992 ( 0.000 -0.958 11.995) 12.033 10.762 ( -0.000 8.347 -7.969) 11.540 11.571 ( -0.000 9.904 3.438) 10.484 12.122 ( 0.000 -4.042 1.528) 4.322 14.056 ( -0.000 -2.273 -2.816) 3.619 14.609 ( 0.000 -7.107 0.241) 7.111======================= Grid point 422 (161/344) =======================q-point: (-0.13 -0.20 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.088 ( 10.890 -17.465 -3.671) 20.907 2.325 ( 6.562 -23.340 -4.676) 24.691 2.798 ( 9.137 -4.372 8.272) 13.077 3.142 ( 1.081 -5.719 5.535) 8.032 3.257 ( 4.129 -8.645 -5.321) 10.958 3.629 ( 1.232 -12.703 -1.386) 12.838 3.771 ( -0.108 -7.751 -0.827) 7.796 4.267 ( 1.736 -21.122 -1.212) 21.228 4.382 ( 7.548 -14.030 -0.763) 15.950 4.466 ( -0.905 -11.155 0.852) 11.224 5.866 ( 5.233 -20.866 2.068) 21.612 6.536 ( -3.537 7.952 0.686) 8.730 7.592 ( 1.063 -6.074 2.101) 6.515 8.613 ( -3.295 3.964 -2.923) 5.926 9.120 ( 5.776 -3.665 2.998) 7.469 9.338 ( 0.099 -1.574 -3.635) 3.963 9.510 ( 0.827 -7.429 -4.424) 8.686 9.681 ( 5.796 3.817 -2.643) 7.426 10.008 ( -0.334 0.493 10.406) 10.423 10.803 ( -4.615 11.878 -8.119) 15.110 11.489 ( -15.567 7.208 3.799) 17.571 12.221 ( 10.322 -2.496 1.669) 10.750 14.076 ( 5.211 -1.332 -3.340) 6.331 14.493 ( -3.652 -8.609 -0.370) 9.359======================= Grid point 437 (162/344) =======================q-point: (-0.13 -0.13 0.07)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.766 ( 0.000 -22.464 -4.188) 22.851 1.987 ( 0.000 -28.337 -4.564) 28.702 2.717 ( 0.000 -1.685 11.797) 11.916 3.081 ( 0.000 -7.474 3.114) 8.097 3.130 ( -0.000 -6.919 -7.946) 10.536 3.355 ( 0.000 -35.440 -4.366) 35.708 3.649 ( 0.000 -15.561 0.151) 15.562 4.079 ( 0.000 -6.840 0.542) 6.861 4.249 ( 0.000 -5.153 0.455) 5.173 4.375 ( 0.000 -10.146 1.590) 10.270 5.582 ( 0.000 -26.182 2.257) 26.279 6.659 ( -0.000 9.672 0.573) 9.689 7.524 ( 0.000 -6.408 2.345) 6.824 8.696 ( -0.000 7.455 -0.880) 7.506 9.039 ( 0.000 -3.882 2.942) 4.871 9.331 ( -0.000 -1.099 -3.777) 3.934 9.420 ( -0.000 -5.766 -6.838) 8.944 9.675 ( -0.000 7.122 -0.917) 7.181 10.032 ( 0.000 -0.691 10.333) 10.356 10.954 ( -0.000 15.435 -10.790) 18.832 11.797 ( 0.000 10.564 7.317) 12.850 12.046 ( 0.000 -4.091 1.394) 4.322 13.994 ( -0.000 -2.552 -4.201) 4.915 14.427 ( 0.000 -10.697 -2.442) 10.973======================= Grid point 486 (163/344) =======================q-point: ( 0.13 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 344Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.431 ( 0.000 -0.000 31.863) 31.863 0.431 ( 0.000 -0.000 31.863) 31.863 0.798 ( 0.000 -0.000 60.022) 60.022 2.447 ( -0.000 0.000 -14.091) 14.091 2.447 ( -0.000 0.000 -14.091) 14.091 3.035 ( 0.000 0.000 8.426) 8.426 3.035 ( 0.000 -0.000 8.426) 8.426 4.106 ( -0.000 0.000 -1.134) 1.134 4.106 ( -0.000 0.000 -1.134) 1.134 4.206 ( -0.000 0.000 -12.889) 12.889 4.495 ( -0.000 0.000 -5.949) 5.949 6.978 ( 0.000 -0.000 4.276) 4.276 8.882 ( 0.000 0.000 0.087) 0.087 8.882 ( 0.000 -0.000 0.087) 0.087 9.223 ( 0.000 0.000 0.040) 0.040 9.223 ( -0.000 -0.000 0.040) 0.040 9.400 ( 0.000 -0.000 2.906) 2.906 9.856 ( -0.000 0.000 -2.680) 2.680 10.024 ( 0.000 0.000 1.277) 1.277 10.024 ( 0.000 -0.000 1.277) 1.277 11.890 ( -0.000 0.000 -0.991) 0.991 11.890 ( -0.000 -0.000 -0.991) 0.991 13.676 ( 0.000 -0.000 0.002) 0.002 16.959 ( 0.000 -0.000 0.078) 0.078======================= Grid point 487 (164/344) =======================q-point: ( 0.20 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.826 ( 21.415 12.364 19.615) 31.562 0.872 ( 23.657 13.658 19.965) 33.835 1.484 ( 39.257 22.665 33.463) 56.343 2.496 ( 5.947 3.434 -15.156) 16.640 2.507 ( 8.155 4.709 -15.230) 17.907 3.028 ( -1.423 -0.821 8.881) 9.032 3.242 ( 10.867 6.274 5.933) 13.880 4.046 ( -1.289 -0.744 -9.952) 10.063 4.119 ( 1.299 0.750 -1.073) 1.844 4.234 ( 1.328 0.767 -0.954) 1.806 4.590 ( 11.558 6.673 -8.598) 15.875 6.952 ( -3.251 -1.877 4.382) 5.770 7.721 ( -23.753 -13.714 36.665) 45.788 8.915 ( 2.361 1.363 0.367) 2.750 9.147 ( -3.251 -1.877 -9.295) 10.024 9.233 ( 1.060 0.612 -0.075) 1.227 9.336 ( -8.078 -4.664 5.486) 10.821 9.893 ( 5.683 3.281 -7.620) 10.056 9.968 ( -4.539 -2.621 1.148) 5.365 11.259 ( 13.443 7.761 -30.321) 34.063 11.915 ( 1.957 1.130 -0.959) 2.454 11.996 ( 13.171 7.604 -15.575) 21.769 13.797 ( 10.237 5.911 -0.029) 11.821 15.074 ( -66.489 -38.387 84.670) 114.295======================= Grid point 488 (165/344) =======================q-point: ( 0.27 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.368 ( 21.282 12.287 12.667) 27.647 1.474 ( 24.581 14.192 12.646) 31.073 2.484 ( 38.685 22.335 13.154) 46.566 2.638 ( 9.045 5.222 -16.115) 19.203 2.716 ( 13.104 7.566 -11.253) 18.857 3.013 ( -1.556 -0.898 9.859) 10.021 3.520 ( 11.782 6.803 8.210) 15.890 4.050 ( 2.084 1.203 -8.082) 8.433 4.165 ( 2.981 1.721 -0.696) 3.512 4.230 ( 1.067 0.616 -0.753) 1.444 4.986 ( 22.635 13.069 -8.172) 27.385 6.840 ( -7.093 -4.095 2.233) 8.489 7.558 ( -0.802 -0.463 12.265) 12.300 8.936 ( -11.139 -6.431 -4.010) 13.473 8.989 ( 3.869 2.234 0.095) 4.469 9.267 ( 1.702 0.982 0.457) 2.017 9.270 ( 0.358 0.207 3.036) 3.064 9.832 ( -7.059 -4.076 1.354) 8.263 10.002 ( 4.995 2.884 -7.550) 9.502 11.128 ( -11.883 -6.861 -1.885) 13.851 11.970 ( 2.941 1.698 -1.321) 3.644 12.066 ( -5.191 -2.997 -10.891) 12.432 14.083 ( 10.945 6.319 0.183) 12.640 14.336 ( -15.837 -9.144 35.213) 39.678======================= Grid point 489 (166/344) =======================q-point: ( 0.33 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.828 ( 16.017 9.247 7.819) 20.079 2.036 ( 21.520 12.424 7.305) 25.900 2.828 ( 9.936 5.737 -13.938) 18.053 2.888 ( 9.901 5.716 -12.300) 16.793 3.011 ( -0.112 -0.065 9.404) 9.405 3.359 ( 25.660 14.815 4.782) 30.013 3.834 ( 12.780 7.379 8.769) 17.166 4.075 ( 5.582 3.223 -0.168) 6.447 4.254 ( 4.686 2.705 -0.201) 5.414 4.378 ( 11.416 6.591 -3.018) 13.523 5.524 ( 23.664 13.663 -5.729) 27.919 6.649 ( -8.858 -5.114 -0.272) 10.232 7.630 ( 4.546 2.625 3.524) 6.323 8.703 ( -8.137 -4.698 1.214) 9.474 9.086 ( 4.441 2.564 -1.204) 5.268 9.297 ( -0.097 -0.056 2.760) 2.763 9.321 ( 3.667 2.117 0.591) 4.275 9.674 ( -5.923 -3.420 0.913) 6.900 10.094 ( 4.459 2.575 -6.590) 8.363 10.851 ( -11.241 -6.490 5.200) 13.983 11.836 ( -11.038 -6.373 -4.873) 13.645 12.040 ( 3.275 1.891 -1.776) 4.178 14.082 ( -3.854 -2.225 8.496) 9.591 14.444 ( 10.389 5.998 3.760) 12.572======================= Grid point 490 (167/344) =======================q-point: ( 0.40 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.127 ( 8.827 5.096 2.885) 10.593 2.465 ( 13.938 8.047 1.951) 16.212 2.979 ( 2.630 1.518 4.459) 5.395 3.104 ( 11.532 6.658 -5.551) 14.427 3.107 ( 9.335 5.389 -5.626) 12.159 3.648 ( 2.086 1.204 -2.811) 3.702 4.029 ( 7.579 4.375 7.965) 11.833 4.374 ( 5.500 3.175 0.186) 6.353 4.447 ( 16.062 9.274 -5.735) 19.414 4.743 ( 20.969 12.107 6.574) 25.090 5.944 ( 10.258 5.923 -3.708) 12.412 6.524 ( 1.637 0.945 -0.018) 1.891 7.762 ( 6.281 3.626 0.492) 7.270 8.568 ( -4.111 -2.373 2.424) 5.330 9.154 ( -0.469 -0.271 -4.523) 4.555 9.266 ( -1.374 -0.793 7.940) 8.097 9.447 ( 7.145 4.125 -0.775) 8.286 9.607 ( 0.210 0.121 -0.720) 0.759 10.185 ( 4.631 2.674 -4.476) 6.973 10.654 ( -6.841 -3.950 5.921) 9.872 11.578 ( -10.311 -5.953 -3.217) 12.333 12.111 ( 3.178 1.835 -1.958) 4.160 14.055 ( -0.003 -0.002 2.790) 2.790 14.655 ( 7.167 4.138 1.451) 8.402======================= Grid point 491 (168/344) =======================q-point: ( 0.47 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.268 ( 3.766 2.174 0.022) 4.349 2.680 ( 5.340 3.083 -1.275) 6.296 3.026 ( 0.943 0.545 7.247) 7.329 3.337 ( 10.460 6.039 -6.437) 13.686 3.408 ( 14.619 8.440 -0.135) 16.881 3.612 ( -2.807 -1.621 -1.484) 3.565 4.246 ( 8.885 5.130 5.899) 11.835 4.498 ( 4.966 2.867 0.474) 5.754 4.675 ( 6.770 3.908 -7.089) 10.553 5.190 ( 11.085 6.400 4.885) 13.700 6.031 ( 4.479 2.586 -1.355) 5.346 6.725 ( 10.960 6.328 3.217) 13.058 7.920 ( 7.371 4.255 -0.779) 8.546 8.515 ( -1.005 -0.580 1.059) 1.571 9.026 ( -7.439 -4.295 0.210) 8.592 9.321 ( 3.099 1.789 2.951) 4.638 9.633 ( 8.826 5.096 -2.290) 10.446 9.647 ( 2.671 1.542 -0.826) 3.193 10.287 ( 4.496 2.596 -0.511) 5.216 10.555 ( -2.695 -1.556 3.402) 4.611 11.347 ( -9.220 -5.323 -2.264) 10.885 12.176 ( 2.766 1.597 -1.682) 3.609 14.080 ( 1.627 0.939 1.036) 2.145 14.784 ( 3.973 2.294 0.291) 4.597======================= Grid point 492 (169/344) =======================q-point: ( 0.53 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.324 ( 1.506 0.870 -0.628) 1.849 2.748 ( 1.478 0.853 -1.294) 2.142 3.057 ( 0.450 0.260 5.726) 5.750 3.533 ( 7.279 4.202 -4.947) 9.752 3.547 ( -2.364 -1.365 -0.436) 2.765 3.729 ( 11.980 6.917 1.240) 13.889 4.448 ( 7.631 4.406 3.575) 9.510 4.597 ( 3.344 1.931 0.731) 3.930 4.771 ( 3.275 1.891 -4.229) 5.673 5.213 ( -6.659 -3.845 1.472) 7.829 6.264 ( 13.177 7.608 0.067) 15.216 6.926 ( 4.673 2.698 7.064) 8.889 8.085 ( 6.761 3.903 -2.336) 8.149 8.516 ( 0.781 0.451 -0.102) 0.908 8.866 ( -6.016 -3.473 0.612) 6.973 9.389 ( 2.247 1.297 1.281) 2.893 9.706 ( 2.274 1.313 -0.439) 2.662 9.819 ( 7.320 4.226 -3.790) 9.264 10.358 ( 0.292 0.169 5.189) 5.200 10.566 ( 4.005 2.312 -1.161) 4.768 11.139 ( -8.464 -4.887 -1.547) 9.896 12.229 ( 2.038 1.177 -1.029) 2.569 14.125 ( 1.824 1.053 0.822) 2.261 14.846 ( 1.671 0.965 -0.726) 2.062======================= Grid point 493 (170/344) =======================q-point: ( 0.60 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.346 ( 0.580 0.335 -0.513) 0.844 2.765 ( 0.531 0.307 -0.779) 0.992 3.068 ( -0.564 -0.326 4.354) 4.402 3.507 ( -0.926 -0.535 0.207) 1.089 3.642 ( 2.931 1.692 -4.282) 5.457 3.927 ( 4.409 2.546 0.610) 5.128 4.600 ( 3.989 2.303 1.404) 4.815 4.651 ( 1.111 0.641 0.897) 1.565 4.843 ( 4.312 2.489 -0.719) 5.030 5.018 ( -8.467 -4.888 0.827) 9.812 6.522 ( 7.695 4.443 -0.809) 8.922 6.971 ( -1.933 -1.116 9.178) 9.445 8.196 ( 2.890 1.669 -3.526) 4.855 8.541 ( 1.187 0.685 0.171) 1.381 8.765 ( -2.554 -1.474 -0.074) 2.950 9.426 ( 0.711 0.410 0.672) 1.061 9.743 ( 0.906 0.523 -0.165) 1.059 9.942 ( 4.005 2.312 -4.458) 6.424 10.336 ( -2.576 -1.487 5.374) 6.142 10.700 ( 6.075 3.508 -1.129) 7.105 10.959 ( -5.989 -3.458 -0.894) 6.973 12.263 ( 0.997 0.576 -0.288) 1.187 14.160 ( 0.869 0.501 1.104) 1.491 14.864 ( 0.213 0.123 -1.646) 1.664======================= Grid point 494 (171/344) =======================q-point: (-0.33 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.352 ( 0.016 0.009 -0.207) 0.208 2.778 ( 0.654 0.378 0.009) 0.755 3.047 ( -2.031 -1.173 3.073) 3.866 3.507 ( 0.892 0.515 0.503) 1.146 3.649 ( -1.458 -0.842 -3.727) 4.089 3.921 ( -4.937 -2.850 -0.265) 5.707 4.572 ( -6.425 -3.709 -0.100) 7.419 4.650 ( -1.314 -0.759 0.871) 1.750 4.866 ( -2.262 -1.306 1.304) 2.919 5.027 ( 8.723 5.036 0.522) 10.086 6.558 ( -5.427 -3.133 0.441) 6.282 6.919 ( -3.075 -1.775 7.229) 8.054 8.189 ( -2.896 -1.672 -3.896) 5.135 8.566 ( 0.749 0.432 1.601) 1.819 8.753 ( 1.655 0.955 -0.728) 2.045 9.424 ( -0.997 -0.576 0.543) 1.273 9.745 ( -0.722 -0.417 -0.051) 0.835 9.980 ( -0.002 -0.001 -3.305) 3.305 10.272 ( -3.702 -2.137 2.595) 5.001 10.709 ( -4.492 -2.593 -0.406) 5.203 10.977 ( 7.090 4.093 0.075) 8.187 12.272 ( -0.265 -0.153 0.205) 0.368 14.165 ( -0.668 -0.386 1.442) 1.635 14.853 ( -0.810 -0.468 -2.340) 2.520======================= Grid point 495 (172/344) =======================q-point: (-0.27 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.343 ( -0.959 -0.554 0.355) 1.163 2.788 ( -0.252 -0.145 1.294) 1.326 2.985 ( -3.771 -2.177 1.148) 4.503 3.549 ( 2.444 1.411 0.736) 2.917 3.565 ( -4.933 -2.848 -2.524) 6.230 3.717 ( -11.736 -6.776 -0.971) 13.586 4.378 ( -9.347 -5.397 -0.601) 10.810 4.595 ( -3.554 -2.052 0.629) 4.152 4.831 ( -1.837 -1.060 0.049) 2.121 5.221 ( 5.957 3.440 1.222) 6.987 6.309 ( -14.153 -8.171 2.380) 16.515 6.850 ( -4.902 -2.830 3.466) 6.637 8.055 ( -7.464 -4.309 -3.919) 9.468 8.581 ( 0.018 0.010 3.419) 3.419 8.835 ( 5.443 3.143 -1.074) 6.376 9.384 ( -2.508 -1.448 0.917) 3.038 9.711 ( -2.101 -1.213 -0.105) 2.428 9.916 ( -5.630 -3.250 1.234) 6.617 10.186 ( -3.198 -1.846 -4.239) 5.622 10.619 ( -2.537 -1.465 1.879) 3.480 11.170 ( 8.876 5.125 0.225) 10.252 12.251 ( -1.559 -0.900 0.236) 1.816 14.137 ( -1.908 -1.101 1.612) 2.730 14.815 ( -2.074 -1.198 -2.602) 3.537======================= Grid point 496 (173/344) =======================q-point: (-0.20 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.293 ( -4.126 -2.382 1.552) 5.011 2.737 ( -5.821 -3.361 2.949) 7.340 2.882 ( -4.744 -2.739 -2.481) 6.013 3.414 ( -11.987 -6.921 -1.090) 13.884 3.425 ( -6.662 -3.846 0.024) 7.693 3.630 ( 3.475 2.006 -0.237) 4.020 4.145 ( -10.795 -6.232 -0.356) 12.470 4.494 ( -5.156 -2.977 0.242) 5.958 4.754 ( -4.953 -2.860 -2.185) 6.122 5.158 ( -15.267 -8.814 3.173) 17.912 6.072 ( -3.686 -2.128 0.960) 4.363 6.686 ( -9.479 -5.473 1.400) 11.035 7.856 ( -8.316 -4.801 -4.040) 10.418 8.585 ( -0.215 -0.124 4.572) 4.579 8.984 ( 7.087 4.092 -1.858) 8.391 9.321 ( -2.969 -1.714 2.543) 4.268 9.653 ( -2.626 -1.516 -0.387) 3.056 9.742 ( -9.175 -5.297 5.008) 11.718 10.117 ( -1.489 -0.860 -9.677) 9.828 10.611 ( 1.285 0.742 4.814) 5.038 11.378 ( 9.168 5.293 -0.379) 10.593 12.202 ( -2.663 -1.538 -0.186) 3.081 14.090 ( -2.370 -1.368 1.631) 3.185 14.740 ( -4.055 -2.341 -2.241) 5.191======================= Grid point 497 (174/344) =======================q-point: (-0.13 0.13 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.123 ( -11.683 -6.745 3.086) 13.839 2.476 ( -17.561 -10.139 3.780) 20.628 2.780 ( -2.731 -1.577 -7.393) 8.037 3.207 ( -5.708 -3.295 -1.715) 6.810 3.270 ( -6.932 -4.002 3.785) 8.854 3.689 ( -0.570 -0.329 -0.318) 0.731 3.883 ( -10.987 -6.343 -0.216) 12.688 4.368 ( -5.539 -3.198 -0.156) 6.397 4.569 ( -20.643 -11.918 -4.939) 24.342 4.608 ( -18.594 -10.735 5.956) 22.282 5.998 ( -9.788 -5.651 -0.674) 11.322 6.526 ( -0.175 -0.101 -0.065) 0.212 7.672 ( -6.717 -3.878 -4.123) 8.784 8.605 ( 1.491 0.861 3.940) 4.300 9.091 ( 1.059 0.612 -4.492) 4.656 9.300 ( 1.217 0.703 6.268) 6.424 9.552 ( -7.812 -4.510 6.519) 11.130 9.608 ( -0.447 -0.258 -0.670) 0.846 10.069 ( -0.681 -0.393 -11.132) 11.160 10.709 ( 6.283 3.628 7.831) 10.676 11.590 ( 9.412 5.434 -2.368) 11.123 12.130 ( -3.381 -1.952 -0.839) 3.994 14.040 ( -2.304 -1.330 1.963) 3.306 14.613 ( -6.721 -3.880 -0.947) 7.818======================= Grid point 502 (175/344) =======================q-point: ( 0.20 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.850 ( 0.000 23.433 20.956) 31.437 0.927 ( 0.000 26.000 22.006) 34.063 1.582 ( 0.000 44.002 36.641) 57.260 2.408 ( -0.000 3.624 -16.482) 16.876 2.522 ( -0.000 11.799 -16.353) 20.166 3.092 ( 0.000 1.092 8.807) 8.874 3.199 ( 0.000 9.538 6.743) 11.681 3.999 ( -0.000 -3.936 -11.645) 12.292 4.113 ( -0.000 1.348 -1.295) 1.869 4.246 ( -0.000 3.277 -0.808) 3.375 4.567 ( -0.000 13.105 -10.342) 16.694 6.964 ( 0.000 -3.760 5.136) 6.365 7.781 ( 0.000 -33.229 35.529) 48.646 8.894 ( -0.000 1.648 -0.361) 1.687 9.078 ( -0.000 -8.060 -9.091) 12.150 9.248 ( -0.000 2.071 0.448) 2.119 9.390 ( 0.000 -2.792 4.613) 5.392 9.855 ( -0.000 3.585 -8.213) 8.962 9.991 ( 0.000 -4.419 2.022) 4.859 11.357 ( -0.000 41.845 -37.841) 56.418 11.809 ( 0.000 -9.175 0.096) 9.175 11.899 ( -0.000 1.695 -1.579) 2.317 13.790 ( -0.000 10.347 0.314) 10.352 15.293 ( 0.000 -75.251 74.068) 105.588======================= Grid point 503 (176/344) =======================q-point: ( 0.27 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.284 ( 14.145 22.987 15.496) 31.123 1.360 ( 13.129 24.473 16.115) 32.109 2.293 ( 19.745 38.746 20.848) 48.226 2.502 ( 9.558 7.148 -14.087) 18.463 2.641 ( 3.649 12.143 -15.933) 20.362 3.095 ( -2.715 3.236 8.953) 9.900 3.417 ( 9.576 8.387 7.674) 14.864 3.974 ( 3.188 -0.114 -11.174) 11.620 4.150 ( 2.125 2.892 -1.181) 3.778 4.241 ( -1.745 -0.292 -0.593) 1.866 4.827 ( 12.152 20.854 -10.060) 26.149 6.891 ( -3.898 -6.389 3.941) 8.458 7.581 ( -2.176 -8.652 16.413) 18.681 8.937 ( -1.491 -7.209 -4.851) 8.816 8.958 ( 2.223 -1.140 -2.046) 3.230 9.277 ( 0.394 2.825 0.949) 3.006 9.342 ( -4.865 2.261 5.649) 7.790 9.843 ( -1.157 -3.469 -6.133) 7.141 9.976 ( 1.985 0.561 -1.264) 2.419 11.340 ( -16.723 3.161 -6.298) 18.147 11.750 ( 5.124 -13.660 -2.901) 14.875 12.081 ( 8.782 5.197 -10.041) 14.316 13.987 ( 8.945 11.179 0.610) 14.330 14.625 ( -21.389 -27.223 44.115) 56.078======================= Grid point 504 (177/344) =======================q-point: ( 0.33 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.774 ( 12.156 21.036 10.752) 26.569 1.880 ( 16.474 20.180 10.276) 28.004 2.675 ( 11.802 6.763 -14.176) 19.646 2.787 ( 5.539 9.671 -15.573) 19.150 3.088 ( 5.775 11.538 10.039) 16.348 3.155 ( 14.451 21.877 10.392) 28.203 3.701 ( 12.186 7.750 7.823) 16.424 4.031 ( 3.493 1.039 -3.293) 4.911 4.233 ( 2.599 5.004 -0.837) 5.700 4.265 ( 6.230 4.670 -4.057) 8.779 5.303 ( 19.052 21.186 -7.219) 29.393 6.723 ( -7.175 -8.342 0.949) 11.045 7.580 ( 3.319 -0.584 5.238) 6.229 8.760 ( -5.310 -7.868 -0.445) 9.502 9.056 ( 3.963 4.489 -0.643) 6.023 9.303 ( -0.238 1.326 3.892) 4.118 9.342 ( -0.486 5.371 1.130) 5.510 9.746 ( -4.401 -3.291 -1.695) 5.751 10.034 ( 3.482 1.935 -5.158) 6.517 11.024 ( -15.552 -5.937 4.468) 17.236 11.658 ( 3.586 -18.935 -4.217) 19.728 12.166 ( -1.475 6.920 -4.772) 8.535 14.216 ( -5.300 4.506 6.032) 9.208 14.319 ( 5.488 -2.483 12.441) 13.822======================= Grid point 505 (178/344) =======================q-point: ( 0.40 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.137 ( 5.293 17.046 5.324) 18.626 2.339 ( 13.510 14.195 4.620) 20.133 2.930 ( 10.356 9.055 -5.924) 14.978 2.955 ( 8.221 7.772 -11.120) 15.863 3.158 ( -1.749 10.566 5.154) 11.885 3.591 ( 7.214 6.493 -0.716) 9.732 3.941 ( 7.195 0.509 7.058) 10.091 4.247 ( 14.794 11.006 -1.065) 18.470 4.357 ( 4.485 7.302 -0.940) 8.621 4.542 ( 17.122 12.476 2.762) 21.365 5.806 ( 16.114 16.087 -4.393) 23.189 6.523 ( -4.628 -6.854 -0.539) 8.288 7.677 ( 6.063 1.508 0.866) 6.308 8.616 ( -4.452 -4.364 3.279) 7.044 9.160 ( 1.973 5.585 -2.448) 6.409 9.347 ( -0.276 3.472 4.562) 5.740 9.396 ( 1.664 4.775 0.611) 5.093 9.643 ( -4.166 0.309 -0.563) 4.215 10.109 ( 4.789 1.355 -5.526) 7.437 10.750 ( -9.475 -7.029 6.885) 13.659 11.489 ( 0.576 -19.083 -4.187) 19.545 12.205 ( -2.623 10.135 -2.255) 10.709 14.118 ( -5.328 2.052 4.683) 7.384 14.532 ( 10.305 1.649 1.894) 10.606======================= Grid point 506 (179/344) =======================q-point: ( 0.47 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.331 ( -0.638 13.495 1.227) 13.566 2.618 ( 6.407 6.147 -0.181) 8.880 3.118 ( -0.436 10.311 5.952) 11.913 3.194 ( 10.935 9.052 -6.226) 15.501 3.338 ( 7.709 14.833 -1.854) 16.819 3.629 ( -1.495 -1.308 -2.075) 2.872 4.121 ( 10.160 1.691 6.658) 12.265 4.481 ( 4.428 6.825 -0.099) 8.137 4.549 ( 9.607 4.313 -7.371) 12.854 5.045 ( 17.857 13.913 6.904) 23.667 6.029 ( -0.334 4.450 -2.059) 4.915 6.567 ( 12.292 2.607 1.362) 12.639 7.816 ( 7.589 2.222 -0.332) 7.915 8.532 ( -2.191 -2.347 2.799) 4.260 9.175 ( -7.321 4.747 -3.289) 9.325 9.346 ( -2.134 4.596 6.058) 7.898 9.541 ( 7.652 5.469 -1.565) 9.535 9.637 ( 0.914 3.371 -0.589) 3.542 10.207 ( 6.182 1.276 -3.598) 7.266 10.585 ( -4.112 -5.908 5.864) 9.284 11.295 ( -0.798 -17.142 -3.198) 17.456 12.265 ( -2.782 11.838 -1.586) 12.264 14.091 ( -1.377 2.007 1.590) 2.907 14.690 ( 7.362 -0.916 0.481) 7.434======================= Grid point 507 (180/344) =======================q-point: ( 0.53 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.417 ( -3.837 12.047 -0.107) 12.644 2.718 ( 2.108 1.331 -0.848) 2.633 3.193 ( -5.009 13.013 4.908) 14.782 3.438 ( 7.858 5.522 -4.903) 10.783 3.562 ( 1.218 0.462 -1.362) 1.884 3.657 ( 6.625 13.246 1.546) 14.891 4.328 ( 10.097 1.700 4.439) 11.160 4.607 ( 2.341 6.496 0.271) 6.910 4.694 ( 6.019 1.239 -6.027) 8.608 5.290 ( -1.809 2.840 3.425) 4.803 6.133 ( 9.242 7.126 0.411) 11.678 6.823 ( 10.878 1.245 5.223) 12.131 7.976 ( 8.101 2.180 -1.127) 8.465 8.503 ( 0.249 -1.218 0.375) 1.299 9.036 ( -11.677 4.825 -0.171) 12.636 9.399 ( 0.540 4.580 2.306) 5.156 9.684 ( 2.751 2.626 -1.182) 3.983 9.742 ( 6.298 6.462 -2.293) 9.310 10.324 ( 5.365 1.109 0.869) 5.547 10.510 ( 0.883 -4.365 2.346) 5.034 11.107 ( -1.518 -15.310 -2.169) 15.537 12.331 ( -3.772 12.895 -1.081) 13.478 14.106 ( 0.970 0.759 0.965) 1.564 14.776 ( 4.952 -2.922 -0.629) 5.784======================= Grid point 508 (181/344) =======================q-point: ( 0.60 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.452 ( -5.387 11.551 -0.269) 12.748 2.741 ( 0.728 -0.446 -0.519) 0.999 3.232 ( -7.106 13.951 3.358) 16.013 3.480 ( 1.002 -3.875 -0.896) 4.101 3.653 ( 2.042 8.591 -4.150) 9.757 3.884 ( 4.760 7.209 2.377) 8.960 4.521 ( 8.203 2.701 2.347) 8.949 4.687 ( 0.128 4.992 -0.137) 4.996 4.778 ( 4.616 0.694 -2.808) 5.447 5.165 ( -11.288 -0.457 2.514) 11.574 6.402 ( 11.099 5.472 0.211) 12.376 6.955 ( 3.733 -3.223 8.580) 9.897 8.114 ( 6.093 0.490 -2.184) 6.491 8.510 ( 1.701 -0.994 -1.481) 2.465 8.906 ( -9.443 6.708 0.626) 11.600 9.447 ( -0.401 3.804 1.086) 3.977 9.737 ( 1.099 1.809 -0.309) 2.139 9.890 ( 4.612 4.547 -4.227) 7.733 10.361 ( -0.976 -2.122 5.506) 5.981 10.581 ( 9.098 -0.275 -1.411) 9.211 10.926 ( -1.963 -13.912 -1.485) 14.128 12.382 ( -5.244 13.194 -0.499) 14.207 14.135 ( 1.797 -0.635 1.186) 2.244 14.808 ( 3.351 -4.262 -1.601) 5.653======================= Grid point 509 (182/344) =======================q-point: (-0.33 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.464 ( -6.143 11.051 -0.218) 12.645 2.746 ( 0.938 -0.861 -0.178) 1.286 3.238 ( -9.100 13.872 2.406) 16.764 3.468 ( 2.043 -2.967 0.093) 3.604 3.717 ( -2.944 7.317 -4.283) 8.975 3.952 ( -1.433 -0.252 1.645) 2.196 4.612 ( -0.934 -1.538 0.461) 1.857 4.709 ( -1.876 2.915 -0.565) 3.512 4.879 ( 3.478 0.367 0.412) 3.521 5.006 ( -4.772 5.563 2.447) 7.727 6.559 ( 2.807 -0.670 -0.559) 2.940 6.942 ( -1.345 -5.894 9.687) 11.419 8.166 ( 1.384 -2.704 -2.906) 4.204 8.527 ( 1.990 -1.536 -1.664) 3.015 8.859 ( -5.588 9.870 0.934) 11.380 9.463 ( -1.868 2.911 0.745) 3.538 9.756 ( -0.344 0.778 -0.107) 0.857 9.968 ( 1.569 2.299 -4.800) 5.549 10.313 ( -2.780 -3.043 4.864) 6.375 10.717 ( 0.129 -3.020 -1.335) 3.304 10.798 ( 8.969 -9.365 -0.324) 12.971 12.407 ( -6.774 12.585 -0.047) 14.292 14.154 ( 1.164 -1.540 1.579) 2.494 14.805 ( 2.373 -5.028 -2.358) 6.039======================= Grid point 510 (183/344) =======================q-point: (-0.27 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.460 ( -6.603 10.140 -0.089) 12.101 2.756 ( 1.169 -1.144 0.375) 1.679 3.202 ( -11.261 13.162 1.693) 17.405 3.495 ( 3.613 -1.449 0.393) 3.912 3.680 ( -7.374 5.023 -3.219) 9.485 3.840 ( -8.822 -4.350 0.230) 9.839 4.474 ( -8.598 -5.805 0.376) 10.381 4.681 ( -4.423 2.248 -0.211) 4.966 4.841 ( -2.019 -2.360 0.432) 3.135 5.165 ( 6.542 8.927 1.691) 11.196 6.451 ( -9.914 -7.505 1.222) 12.494 6.872 ( -1.821 -6.256 6.750) 9.382 8.093 ( -3.896 -5.572 -3.181) 7.506 8.539 ( 2.008 -2.446 -0.212) 3.172 8.911 ( -2.260 13.232 0.882) 13.453 9.444 ( -3.486 2.282 0.964) 4.277 9.740 ( -1.868 -0.056 -0.172) 1.877 9.967 ( -2.239 0.146 -3.289) 3.981 10.221 ( -4.573 -3.837 1.653) 6.194 10.608 ( -0.912 -7.530 -0.004) 7.585 10.967 ( 13.188 -3.851 0.050) 13.739 12.398 ( -8.034 11.167 0.058) 13.756 14.150 ( -0.296 -1.426 1.819) 2.331 14.780 ( 1.424 -5.512 -2.703) 6.302======================= Grid point 511 (184/344) =======================q-point: (-0.20 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.432 ( -7.767 8.433 0.410) 11.472 2.751 ( -0.725 -2.103 0.908) 2.403 3.114 ( -13.787 11.728 0.706) 18.114 3.544 ( -8.614 -3.112 2.697) 9.548 3.561 ( -0.599 1.999 -2.621) 3.350 3.601 ( -9.767 -1.684 -2.383) 10.194 4.249 ( -9.580 -7.342 0.911) 12.105 4.599 ( -6.919 1.283 -0.130) 7.038 4.772 ( -2.353 -4.611 -1.868) 5.503 5.286 ( -3.717 1.770 2.586) 4.862 6.169 ( -10.777 -5.537 1.687) 12.234 6.753 ( -5.470 -8.318 3.493) 10.551 7.926 ( -7.021 -6.264 -3.067) 9.896 8.548 ( 2.116 -3.173 1.899) 4.261 9.034 ( -0.476 14.827 -0.108) 14.835 9.396 ( -4.729 1.990 2.065) 5.531 9.693 ( -2.987 -0.436 -0.444) 3.051 9.866 ( -8.055 -2.355 2.426) 8.736 10.109 ( -2.649 -3.511 -6.114) 7.532 10.565 ( 2.839 -4.866 2.684) 6.240 11.155 ( 13.796 -5.338 -0.226) 14.794 12.354 ( -8.733 9.343 -0.225) 12.790 14.127 ( -1.778 -0.090 1.826) 2.550 14.729 ( -0.169 -6.055 -2.461) 6.538======================= Grid point 512 (185/344) =======================q-point: (-0.13 0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.337 ( -12.246 5.021 1.794) 13.356 2.655 ( -8.854 -3.880 1.799) 9.833 2.954 ( -15.628 8.153 -1.795) 17.718 3.293 ( -9.582 -3.945 -2.314) 10.618 3.419 ( -10.516 1.884 0.814) 10.715 3.650 ( 4.261 0.533 -0.744) 4.359 4.000 ( -10.517 -8.051 1.695) 13.353 4.473 ( -8.061 -0.102 -0.428) 8.073 4.645 ( -5.587 -6.037 -4.018) 9.155 4.966 ( -26.723 -10.933 5.196) 29.337 6.080 ( -2.182 2.389 -0.268) 3.246 6.546 ( -6.515 -8.449 0.946) 10.711 7.740 ( -6.828 -4.587 -2.868) 8.711 8.563 ( 2.642 -2.825 3.415) 5.159 9.147 ( -2.431 10.187 -3.196) 10.950 9.349 ( -3.426 2.735 4.614) 6.364 9.638 ( -3.149 0.052 -0.469) 3.184 9.689 ( -9.023 -1.617 6.382) 11.169 10.039 ( -0.190 -2.250 -10.518) 10.758 10.623 ( 6.797 -1.792 5.539) 8.950 11.334 ( 14.329 -7.443 -1.417) 16.208 12.287 ( -8.602 7.902 -0.777) 11.706 14.099 ( -2.946 1.980 1.926) 4.039 14.637 ( -2.643 -6.766 -1.515) 7.420======================= Grid point 518 (186/344) =======================q-point: ( 0.27 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.426 ( 0.000 24.808 15.775) 29.399 1.560 ( 0.000 28.064 16.123) 32.366 2.426 ( -0.000 5.155 -16.295) 17.091 2.642 ( -0.000 45.547 18.681) 49.229 2.708 ( -0.000 13.601 -14.463) 19.854 3.161 ( 0.000 2.295 6.894) 7.266 3.459 ( 0.000 12.714 8.958) 15.553 3.929 ( -0.000 2.518 -11.098) 11.380 4.153 ( -0.000 3.311 -0.989) 3.455 4.255 ( -0.000 0.156 -2.093) 2.099 4.943 ( -0.000 26.927 -9.755) 28.640 6.858 ( 0.000 -9.015 3.673) 9.735 7.542 ( 0.000 -6.592 11.718) 13.445 8.849 ( -0.000 -9.222 -4.531) 10.275 8.940 ( -0.000 3.038 -0.685) 3.114 9.309 ( -0.000 3.584 1.028) 3.728 9.437 ( 0.000 3.856 6.980) 7.974 9.852 ( -0.000 0.335 -10.958) 10.963 9.872 ( 0.000 -8.122 2.296) 8.440 11.489 ( 0.000 -17.339 8.114) 19.143 11.679 ( -0.000 4.644 -18.492) 19.066 11.941 ( -0.000 3.240 -1.981) 3.797 14.018 ( -0.000 9.388 2.991) 9.853 14.622 ( 0.000 -22.883 30.684) 38.277======================= Grid point 519 (187/344) =======================q-point: ( 0.33 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.806 ( 10.787 21.721 12.831) 27.437 1.940 ( 7.419 26.156 12.295) 29.839 2.523 ( 8.730 6.410 -13.963) 17.671 2.798 ( 1.651 10.731 -17.352) 20.469 3.170 ( 4.037 21.822 10.521) 24.559 3.247 ( 5.513 17.976 9.185) 20.926 3.649 ( 5.035 10.778 7.904) 14.283 3.986 ( 3.408 7.057 -4.566) 9.070 4.226 ( 3.839 5.402 -1.001) 6.703 4.256 ( -0.225 4.304 -4.160) 5.990 5.285 ( 9.102 27.428 -7.657) 29.897 6.728 ( -4.005 -10.681 1.445) 11.498 7.538 ( 1.786 -0.736 5.139) 5.490 8.746 ( -2.080 -6.281 -0.508) 6.636 9.015 ( 4.615 3.682 -0.747) 5.951 9.346 ( -0.718 3.173 2.734) 4.249 9.446 ( -4.313 5.163 5.232) 8.523 9.750 ( -1.354 -2.394 -5.804) 6.422 9.932 ( 7.109 -3.945 -2.865) 8.621 11.236 ( -11.981 -14.684 7.780) 20.486 11.504 ( -7.644 -5.413 -8.318) 12.527 12.126 ( 9.599 3.077 -4.323) 10.968 14.166 ( 7.770 2.949 5.193) 9.800 14.433 ( -9.156 -3.999 12.760) 16.207======================= Grid point 520 (188/344) =======================q-point: ( 0.40 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.212 ( 9.468 17.037 7.888) 21.026 2.334 ( 7.721 19.612 5.340) 21.743 2.797 ( 14.452 11.717 -6.568) 19.730 2.912 ( 4.578 9.756 -13.846) 17.545 3.303 ( 0.514 9.808 5.006) 11.024 3.580 ( 3.844 11.099 2.019) 11.918 3.838 ( 6.266 2.546 5.379) 8.642 4.180 ( 6.289 12.550 -0.212) 14.039 4.349 ( 3.847 7.779 -2.011) 8.908 4.445 ( 11.795 17.011 2.372) 20.836 5.730 ( 13.335 23.134 -4.799) 27.130 6.531 ( -5.992 -10.087 -0.380) 11.739 7.606 ( 4.140 2.069 1.678) 4.923 8.649 ( -3.534 -4.210 3.142) 6.332 9.155 ( 5.779 5.510 -1.111) 8.061 9.354 ( -0.331 2.393 2.839) 3.728 9.476 ( -0.748 7.106 1.339) 7.270 9.714 ( -2.280 1.600 -3.189) 4.234 10.007 ( 6.306 -3.066 -2.387) 7.407 10.885 ( -13.639 -10.699 6.592) 18.546 11.312 ( -3.078 -12.375 -5.259) 13.794 12.275 ( 4.174 6.013 -2.422) 7.710 14.249 ( -2.961 -2.855 6.611) 7.786 14.397 ( 4.388 5.857 0.893) 7.373======================= Grid point 521 (189/344) =======================q-point: ( 0.47 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.486 ( 2.613 15.037 2.515) 15.468 2.594 ( 4.909 9.019 0.357) 10.275 3.089 ( 8.518 11.011 -5.714) 15.048 3.203 ( 11.634 18.168 -2.234) 21.689 3.432 ( -0.114 13.500 3.573) 13.966 3.640 ( -0.864 0.751 -1.790) 2.124 3.988 ( 7.855 1.876 6.266) 10.222 4.391 ( 8.626 5.559 -6.137) 11.957 4.494 ( 4.296 6.870 -0.678) 8.131 4.929 ( 16.229 21.113 6.539) 27.421 6.105 ( 3.237 14.527 -1.626) 14.972 6.393 ( 4.825 -5.278 -0.108) 7.152 7.723 ( 5.866 3.181 0.905) 6.734 8.556 ( -3.221 -3.563 3.352) 5.858 9.284 ( 1.065 7.658 -2.152) 8.026 9.444 ( 5.487 4.545 -0.294) 7.131 9.519 ( -3.617 6.523 2.158) 7.764 9.689 ( -2.334 4.656 -0.554) 5.238 10.088 ( 6.778 -1.735 -2.637) 7.477 10.618 ( -7.243 -8.915 6.003) 12.961 11.124 ( -1.584 -14.788 -4.251) 15.468 12.399 ( 1.423 10.283 -1.307) 10.463 14.177 ( -4.867 1.941 1.740) 5.521 14.538 ( 7.600 -1.212 0.819) 7.740======================= Grid point 522 (190/344) =======================q-point: ( 0.53 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.635 ( -2.959 15.636 0.526) 15.922 2.706 ( 1.839 3.263 -0.454) 3.773 3.337 ( 7.934 8.538 -3.678) 12.221 3.456 ( -2.326 13.858 -0.457) 14.059 3.555 ( 0.336 6.842 2.570) 7.316 3.725 ( 4.945 16.246 0.112) 16.982 4.172 ( 10.132 1.171 4.749) 11.251 4.559 ( 7.795 1.898 -5.701) 9.842 4.622 ( 3.734 4.696 -0.767) 6.048 5.335 ( 6.654 12.611 4.561) 14.971 6.134 ( -1.911 6.753 0.445) 7.032 6.613 ( 14.591 0.370 2.908) 14.882 7.870 ( 6.802 3.452 1.113) 7.708 8.489 ( -1.110 -2.945 0.423) 3.176 9.305 ( -9.047 9.050 -2.847) 13.109 9.476 ( -3.202 5.654 4.301) 7.792 9.628 ( 6.736 4.079 -2.895) 8.390 9.744 ( 1.544 6.775 -0.149) 6.950 10.203 ( 8.381 -0.503 -1.432) 8.518 10.469 ( -2.354 -7.687 4.818) 9.372 10.947 ( -0.382 -15.232 -3.270) 15.584 12.524 ( -1.098 14.142 -0.818) 14.208 14.130 ( -2.691 1.182 0.722) 3.026 14.629 ( 6.476 -5.012 -0.181) 8.191======================= Grid point 523 (191/344) =======================q-point: ( 0.60 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.712 ( -6.505 16.472 0.315) 17.713 2.742 ( -0.079 1.638 -0.216) 1.654 3.409 ( 1.012 -4.830 -1.794) 5.251 3.532 ( -5.096 17.389 -1.388) 18.174 3.693 ( 2.522 12.254 0.800) 12.537 3.956 ( 0.812 14.196 2.194) 14.388 4.389 ( 11.060 3.403 2.888) 11.926 4.670 ( 5.040 -0.205 -2.976) 5.857 4.714 ( 3.329 2.587 -1.918) 4.631 5.400 ( -9.543 7.802 3.544) 12.826 6.280 ( 8.614 6.358 0.785) 10.735 6.814 ( 9.511 -4.750 6.315) 12.366 8.017 ( 5.940 2.301 1.035) 6.454 8.462 ( 1.235 -2.245 -2.992) 3.939 9.190 ( -12.591 9.835 0.269) 15.979 9.514 ( -1.090 5.752 1.850) 6.139 9.732 ( 2.305 2.371 -1.177) 3.510 9.861 ( 3.836 6.155 -3.016) 7.854 10.345 ( 5.123 0.155 3.190) 6.037 10.397 ( 4.270 -7.675 0.673) 8.809 10.792 ( -0.063 -13.866 -2.478) 14.086 12.632 ( -4.377 16.850 -0.501) 17.416 14.110 ( -0.132 -0.894 1.043) 1.380 14.666 ( 5.345 -7.456 -1.264) 9.261======================= Grid point 524 (192/344) =======================q-point: ( 0.67 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.739 ( -5.720 9.744 -0.265) 11.302 2.754 ( -3.783 8.388 0.431) 9.212 3.377 ( 2.098 -5.190 -1.042) 5.694 3.585 ( -8.749 17.942 -1.237) 19.999 3.835 ( -0.336 11.042 -1.567) 11.158 4.028 ( -4.240 5.826 3.381) 7.960 4.579 ( 4.709 1.721 0.828) 5.081 4.714 ( 2.029 -1.804 -0.810) 2.833 4.807 ( 4.930 3.097 -1.369) 5.980 5.278 ( -13.539 10.744 3.666) 17.669 6.466 ( 6.974 0.618 -0.257) 7.006 6.873 ( 3.473 -8.726 8.503) 12.669 8.104 ( 2.567 -0.831 0.294) 2.714 8.468 ( 2.354 -1.483 -4.495) 5.287 9.107 ( -9.290 12.089 1.668) 15.337 9.544 ( -2.221 5.135 1.064) 5.695 9.769 ( 0.249 1.363 -0.249) 1.408 9.956 ( 2.044 3.951 -4.727) 6.491 10.321 ( -0.880 -4.432 4.640) 6.476 10.514 ( 10.850 -8.162 0.174) 13.579 10.664 ( -0.005 -7.965 -2.487) 8.344 12.698 ( -7.912 17.524 -0.266) 19.229 14.110 ( 1.607 -2.243 1.678) 3.230 14.667 ( 4.729 -8.826 -2.177) 10.247======================= Grid point 525 (193/344) =======================q-point: (-0.27 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.729 ( -6.078 9.171 -0.673) 11.022 2.766 ( -4.490 7.929 0.856) 9.152 3.381 ( 3.737 -3.522 -1.118) 5.255 3.586 ( -10.696 16.522 -1.025) 19.709 3.879 ( -6.624 10.118 -2.982) 12.456 3.960 ( -7.796 0.620 4.183) 8.869 4.554 ( -5.572 -3.802 0.271) 6.751 4.721 ( 0.543 -0.843 -0.760) 1.258 4.856 ( -1.597 -2.484 -0.042) 2.953 5.263 ( -3.695 16.468 3.141) 17.167 6.490 ( -2.034 -5.684 -0.591) 6.066 6.822 ( 0.236 -10.090 8.561) 13.234 8.084 ( -1.798 -4.213 -0.733) 4.639 8.484 ( 1.885 -1.266 -3.490) 4.164 9.126 ( -4.934 15.324 1.924) 16.213 9.546 ( -3.513 4.748 1.169) 6.021 9.769 ( -1.185 0.502 -0.241) 1.309 9.987 ( -0.448 1.671 -5.400) 5.670 10.262 ( -2.957 -4.095 4.733) 6.922 10.483 ( 2.714 -14.250 -1.249) 14.559 10.722 ( 9.515 -2.347 -0.641) 9.822 12.703 ( -10.643 15.653 -0.174) 18.930 14.125 ( 1.769 -1.639 2.083) 3.186 14.649 ( 4.324 -9.285 -2.661) 10.583======================= Grid point 526 (194/344) =======================q-point: (-0.20 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.704 ( -9.143 11.783 -0.543) 14.924 2.761 ( -2.273 2.248 0.750) 3.284 3.418 ( 1.134 1.231 -2.546) 3.047 3.548 ( -8.731 11.034 0.100) 14.071 3.765 ( -13.160 1.151 3.375) 13.634 3.825 ( -11.994 6.768 -2.053) 13.924 4.354 ( -10.548 -6.414 1.470) 12.432 4.701 ( -2.519 -0.318 -0.520) 2.591 4.756 ( -3.225 -5.763 -1.630) 6.802 5.394 ( -2.000 11.686 2.723) 12.164 6.301 ( -10.083 -6.649 0.866) 12.109 6.727 ( -1.522 -10.896 5.776) 12.426 7.967 ( -5.351 -5.395 -1.049) 7.671 8.492 ( 1.458 -1.684 -1.407) 2.635 9.233 ( -2.742 17.257 0.803) 17.492 9.522 ( -5.046 4.687 2.244) 7.244 9.739 ( -2.399 0.156 -0.709) 2.506 9.952 ( -2.990 -0.476 -4.059) 5.063 10.136 ( -6.610 -5.291 1.870) 8.671 10.424 ( 5.212 -9.940 0.198) 11.226 10.869 ( 11.703 -5.220 -0.364) 12.819 12.644 ( -11.822 11.868 -0.261) 16.754 14.146 ( 0.603 0.782 1.982) 2.215 14.618 ( 3.374 -9.075 -2.462) 9.990======================= Grid point 527 (195/344) =======================q-point: (-0.13 0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.628 ( -12.299 9.146 0.424) 15.332 2.731 ( -2.871 -0.306 -0.072) 2.888 3.366 ( -13.315 10.682 -3.615) 17.449 3.472 ( -15.424 -2.613 2.003) 15.772 3.581 ( -0.432 2.159 1.625) 2.737 3.660 ( -12.264 5.103 -1.587) 13.378 4.102 ( -10.200 -7.752 2.508) 13.054 4.602 ( -6.711 -1.748 -1.918) 7.196 4.654 ( -3.003 -4.471 -1.747) 5.662 5.301 ( -18.017 -1.494 3.429) 18.401 6.150 ( -2.951 3.592 0.787) 4.715 6.560 ( -5.748 -11.801 2.722) 13.406 7.809 ( -6.663 -3.939 -0.727) 7.775 8.500 ( 1.879 -1.973 0.842) 2.851 9.329 ( -4.960 12.227 -2.348) 13.402 9.481 ( -5.901 5.092 3.340) 8.480 9.697 ( -2.926 1.168 -0.372) 3.172 9.850 ( -8.106 -0.093 4.433) 9.240 9.990 ( -1.514 -5.602 -7.016) 9.105 10.462 ( 7.909 -5.861 2.573) 10.175 11.019 ( 12.635 -6.526 -1.004) 14.256 12.539 ( -11.249 7.660 -0.508) 13.619 14.168 ( -1.045 3.387 1.549) 3.868 14.569 ( 1.262 -8.151 -1.522) 8.388======================= Grid point 534 (196/344) =======================q-point: ( 0.33 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.944 ( 0.000 19.405 12.788) 23.240 2.169 ( 0.000 25.836 12.357) 28.639 2.475 ( -0.000 6.943 -12.158) 14.001 2.847 ( -0.000 9.517 -17.197) 19.655 3.237 ( 0.000 2.896 2.653) 3.927 3.478 ( -0.000 23.659 6.833) 24.626 3.753 ( 0.000 11.360 7.636) 13.688 4.083 ( -0.000 19.856 1.663) 19.925 4.240 ( -0.000 5.598 -0.352) 5.609 4.312 ( -0.000 9.385 -5.408) 10.832 5.479 ( -0.000 28.390 -6.684) 29.166 6.656 ( 0.000 -10.871 0.839) 10.903 7.537 ( 0.000 1.953 3.392) 3.914 8.717 ( 0.000 -3.296 0.833) 3.399 9.001 ( -0.000 2.990 -0.681) 3.066 9.396 ( 0.000 4.220 2.066) 4.699 9.582 ( 0.000 6.664 9.041) 11.232 9.701 ( 0.000 -9.313 1.418) 9.421 9.788 ( -0.000 -0.674 -12.883) 12.900 11.151 ( 0.000 -17.415 6.697) 18.658 11.627 ( -0.000 -3.562 -7.544) 8.342 12.006 ( -0.000 4.115 -2.066) 4.604 14.120 ( 0.000 -0.868 6.130) 6.191 14.519 ( 0.000 1.869 5.892) 6.182======================= Grid point 535 (197/344) =======================q-point: ( 0.40 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.213 ( 8.403 12.715 7.430) 16.955 2.448 ( 2.245 17.676 5.419) 18.624 2.668 ( 13.033 14.669 -2.936) 19.841 2.924 ( 2.002 10.254 -13.490) 17.062 3.322 ( 5.311 4.418 1.043) 6.987 3.629 ( 0.664 4.609 -1.040) 4.771 3.877 ( -0.503 10.900 8.088) 13.583 4.260 ( -0.564 11.762 -2.493) 12.037 4.363 ( 4.003 7.679 -1.987) 8.885 4.518 ( 5.329 28.553 4.935) 29.462 5.787 ( 6.357 23.076 -4.768) 24.406 6.528 ( -3.935 -7.277 0.129) 8.274 7.590 ( 1.766 4.312 1.883) 5.026 8.674 ( -2.520 -2.347 2.459) 4.231 9.081 ( 5.996 2.827 -0.741) 6.671 9.420 ( -2.379 2.396 3.901) 5.159 9.554 ( -1.680 3.275 -0.314) 3.694 9.749 ( 0.702 5.277 -1.292) 5.478 9.812 ( 8.515 -5.629 -2.779) 10.579 10.950 ( -6.431 -14.338 5.239) 16.565 11.392 ( -14.343 -4.558 -4.987) 15.854 12.178 ( 10.677 3.676 -2.050) 11.476 14.161 ( 4.611 -2.643 4.027) 6.668 14.521 ( -4.707 6.099 2.145) 7.997======================= Grid point 536 (198/344) =======================q-point: ( 0.47 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.498 ( 10.338 9.208 2.240) 14.024 2.620 ( 2.314 8.346 0.469) 8.674 3.070 ( 8.001 11.160 -8.229) 16.009 3.136 ( 14.467 21.275 2.405) 25.839 3.501 ( 6.904 8.062 1.119) 10.673 3.636 ( 0.713 -2.110 -1.486) 2.678 3.985 ( -0.506 9.188 6.657) 11.357 4.355 ( 1.653 8.145 -5.591) 10.017 4.499 ( 3.458 7.227 -1.102) 8.087 4.956 ( 9.459 26.443 5.943) 28.705 6.110 ( 11.064 11.546 -2.099) 16.128 6.394 ( -7.518 1.582 0.307) 7.688 7.689 ( 3.379 5.539 1.652) 6.695 8.589 ( -4.064 -3.719 2.673) 6.123 9.248 ( 9.056 3.854 -1.205) 9.915 9.433 ( 0.262 4.785 0.978) 4.891 9.610 ( 1.257 5.392 -0.803) 5.594 9.773 ( -1.179 3.644 -4.816) 6.153 9.927 ( 7.636 -1.878 3.747) 8.711 10.686 ( -9.711 -10.435 4.294) 14.888 11.104 ( -10.422 -7.369 -4.315) 13.474 12.393 ( 8.654 6.481 -1.163) 10.874 14.211 ( 2.502 -2.241 1.022) 3.511 14.506 ( -3.133 4.227 1.481) 5.466======================= Grid point 537 (199/344) =======================q-point: ( 0.53 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.709 ( 2.007 3.611 -0.789) 4.206 2.755 ( 6.199 11.024 1.305) 12.715 3.289 ( 6.290 9.234 -4.468) 12.033 3.499 ( 2.784 4.955 -0.331) 5.694 3.695 ( 7.643 17.126 1.349) 18.802 3.758 ( 8.684 11.690 1.695) 14.661 4.080 ( 2.134 5.268 4.118) 7.019 4.460 ( 4.428 4.684 -5.114) 8.228 4.609 ( 2.388 4.378 -0.367) 5.001 5.355 ( 8.816 17.842 3.603) 20.225 6.277 ( -1.129 -0.292 0.893) 1.468 6.413 ( 5.722 10.301 1.206) 11.845 7.822 ( 4.658 5.971 2.453) 7.961 8.488 ( -2.943 -4.188 0.230) 5.124 9.429 ( 4.679 6.590 -1.021) 8.146 9.528 ( 4.829 5.137 -2.189) 7.383 9.651 ( -4.152 5.763 1.195) 7.202 9.782 ( 0.674 2.600 -2.758) 3.850 10.053 ( 6.945 0.783 2.232) 7.336 10.466 ( -5.549 -8.096 4.396) 10.755 10.863 ( -6.408 -9.727 -4.108) 12.351 12.606 ( 6.258 10.653 -0.580) 12.369 14.199 ( -2.353 -0.165 -0.455) 2.402 14.505 ( 1.235 -2.278 1.117) 2.822======================= Grid point 538 (200/344) =======================q-point: ( 0.60 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.760 ( 0.753 2.613 -0.036) 2.720 2.939 ( 0.151 13.871 0.620) 13.886 3.349 ( -0.253 -4.328 -1.796) 4.693 3.622 ( 5.203 9.993 -1.922) 11.429 3.909 ( -2.077 18.138 1.206) 18.296 4.087 ( 2.798 15.757 2.159) 16.148 4.232 ( 12.141 5.598 1.775) 13.487 4.574 ( 5.365 2.511 -3.596) 6.929 4.667 ( 2.347 0.001 -0.194) 2.355 5.600 ( 0.448 12.341 2.536) 12.607 6.284 ( -1.024 6.969 1.042) 7.120 6.595 ( 9.721 -3.643 3.845) 11.070 7.970 ( 4.564 5.420 3.656) 7.973 8.415 ( -0.326 -3.675 -3.532) 5.107 9.492 ( -8.363 10.217 -1.594) 13.299 9.601 ( -2.364 4.957 3.507) 6.516 9.683 ( 5.130 2.525 -2.296) 6.162 9.846 ( 4.112 2.261 -2.906) 5.520 10.185 ( 6.870 -0.391 0.760) 6.923 10.352 ( -1.238 -5.195 5.125) 7.402 10.674 ( -2.502 -10.380 -4.051) 11.420 12.813 ( 2.779 14.819 -0.315) 15.080 14.140 ( -3.581 -0.391 0.084) 3.603 14.499 ( 3.565 -7.683 -0.170) 8.471======================= Grid point 539 (201/344) =======================q-point: ( 0.67 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.790 ( -0.766 3.374 0.044) 3.460 3.042 ( -5.126 15.417 0.597) 16.258 3.284 ( 0.773 -6.727 -0.870) 6.827 3.788 ( 1.512 10.636 -3.835) 11.408 4.023 ( -4.808 17.030 0.856) 17.717 4.177 ( -2.634 5.535 3.190) 6.910 4.509 ( 7.264 6.335 0.317) 9.644 4.642 ( 2.155 -1.569 -0.662) 2.746 4.755 ( 6.374 5.414 -1.068) 8.431 5.634 ( -10.713 13.343 2.898) 17.356 6.368 ( 4.112 1.881 -0.119) 4.523 6.688 ( 7.926 -10.440 5.709) 14.298 8.080 ( 1.650 2.589 4.262) 5.253 8.395 ( 2.632 -2.077 -6.311) 7.146 9.406 ( -11.017 10.893 1.537) 15.569 9.633 ( -1.513 5.125 1.367) 5.516 9.762 ( 2.209 1.134 -0.931) 2.652 9.942 ( 4.331 2.631 -3.703) 6.276 10.225 ( 2.680 -8.193 -0.746) 8.653 10.356 ( 2.580 -1.520 6.284) 6.961 10.564 ( 1.481 -7.015 -4.269) 8.344 12.980 ( -2.843 17.659 -0.291) 17.889 14.083 ( -1.244 -2.048 1.327) 2.739 14.475 ( 4.713 -10.756 -1.563) 11.847======================= Grid point 540 (202/344) =======================q-point: (-0.27 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.799 ( -2.205 3.639 -0.133) 4.257 3.075 ( -8.683 14.924 0.633) 17.278 3.259 ( 4.033 -5.907 -0.765) 7.193 3.853 ( -4.705 9.873 -4.963) 12.011 4.089 ( -5.051 10.731 -0.376) 11.867 4.146 ( -7.306 6.453 4.822) 10.875 4.578 ( -0.308 -1.579 -0.767) 1.782 4.667 ( 3.065 -2.361 0.573) 3.911 4.888 ( -1.507 5.775 -0.290) 5.976 5.580 ( -11.032 16.460 2.905) 20.027 6.420 ( 2.878 -4.720 -1.011) 5.620 6.689 ( 4.155 -12.685 6.731) 14.949 8.087 ( -1.981 -1.606 2.620) 3.656 8.426 ( 3.040 -0.202 -5.502) 6.289 9.377 ( -6.483 13.388 2.384) 15.065 9.650 ( -2.320 4.661 0.919) 5.287 9.786 ( -0.078 0.438 -0.428) 0.617 10.007 ( -0.112 3.235 -4.062) 5.194 10.176 ( 4.611 -11.404 -0.715) 12.321 10.346 ( -0.903 -6.175 4.510) 7.700 10.579 ( 5.266 -1.883 -2.630) 6.180 13.046 ( -9.502 16.560 -0.355) 19.096 14.076 ( 2.185 -1.522 2.268) 3.498 14.446 ( 5.646 -11.823 -2.457) 13.331======================= Grid point 541 (203/344) =======================q-point: (-0.20 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.788 ( -2.299 2.349 -0.314) 3.302 3.041 ( -11.030 11.863 0.495) 16.206 3.303 ( 6.336 -3.258 -1.036) 7.199 3.803 ( -8.863 5.696 -4.050) 11.287 4.008 ( -9.643 3.768 1.417) 10.449 4.130 ( -9.431 12.277 2.997) 15.769 4.493 ( -8.587 -1.640 0.101) 8.743 4.683 ( 1.397 -2.550 -0.324) 2.925 4.785 ( -8.007 -4.201 -0.674) 9.067 5.616 ( -6.347 15.675 2.549) 17.102 6.360 ( -3.168 -5.485 -0.783) 6.382 6.620 ( 1.370 -12.975 6.466) 14.562 8.008 ( -4.424 -3.133 1.385) 5.595 8.454 ( 1.470 -0.067 -3.492) 3.790 9.452 ( -2.945 15.346 1.247) 15.675 9.656 ( -3.080 5.363 2.116) 6.536 9.771 ( -1.413 -0.055 -0.961) 1.710 9.962 ( -2.914 -3.572 -5.078) 6.858 10.180 ( 3.955 -6.225 2.401) 7.756 10.246 ( -2.472 -6.507 1.212) 7.065 10.663 ( 7.388 -2.747 -1.434) 8.012 12.981 ( -13.469 11.059 -0.299) 17.430 14.132 ( 2.949 1.995 2.054) 4.111 14.428 ( 6.138 -10.938 -2.294) 12.751======================= Grid point 542 (204/344) =======================q-point: (-0.13 0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.768 ( -1.814 0.765 -0.550) 2.044 2.929 ( -12.603 6.335 0.375) 14.110 3.393 ( 6.221 -0.780 -1.979) 6.574 3.649 ( -11.482 0.983 -1.763) 11.658 3.877 ( -11.202 4.962 2.089) 12.429 4.022 ( -19.347 11.586 1.355) 22.591 4.225 ( -13.792 -8.015 1.236) 16.000 4.631 ( -2.777 -3.899 -2.049) 5.207 4.675 ( -1.359 -1.569 -0.366) 2.107 5.581 ( -12.122 4.210 1.836) 12.962 6.256 ( -4.949 2.499 0.795) 5.601 6.513 ( -1.207 -11.151 4.522) 12.093 7.891 ( -6.116 -1.927 1.203) 6.524 8.465 ( 0.895 -0.251 -1.510) 1.773 9.517 ( -4.999 7.822 -0.852) 9.322 9.656 ( -5.851 7.300 1.158) 9.427 9.756 ( -1.975 2.386 0.232) 3.106 9.862 ( 1.714 -6.936 -5.430) 8.974 10.052 ( -9.544 -3.188 4.329) 10.954 10.274 ( 7.508 -3.865 0.850) 8.488 10.776 ( 9.561 -3.049 -1.652) 10.170 12.819 ( -13.783 4.913 -0.287) 14.635 14.201 ( 1.176 2.746 0.397) 3.014 14.435 ( 5.161 -6.323 -0.539) 8.180======================= Grid point 550 (205/344) =======================q-point: ( 0.40 0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.239 ( 0.000 6.140 2.790) 6.745 2.629 ( -0.000 13.012 3.312) 13.427 2.666 ( -0.000 14.985 1.094) 15.025 3.005 ( -0.000 15.550 -7.465) 17.249 3.292 ( -0.000 2.426 -2.022) 3.158 3.643 ( -0.000 -0.273 -2.356) 2.372 4.027 ( 0.000 12.153 8.612) 14.895 4.367 ( -0.000 6.928 0.150) 6.930 4.400 ( -0.000 10.978 -6.777) 12.901 4.806 ( -0.000 32.037 6.248) 32.640 5.915 ( -0.000 13.906 -3.942) 14.454 6.538 ( -0.000 2.947 0.713) 3.033 7.634 ( -0.000 6.387 1.607) 6.586 8.691 ( 0.000 -0.908 1.411) 1.678 9.035 ( 0.000 -0.137 0.053) 0.147 9.467 ( 0.000 -1.318 5.649) 5.800 9.560 ( -0.000 -1.132 -3.180) 3.376 9.694 ( -0.000 0.856 -5.320) 5.388 9.820 ( -0.000 9.490 2.926) 9.931 10.883 ( 0.000 -11.472 2.922) 11.839 11.492 ( -0.000 -7.206 -3.351) 7.947 12.083 ( -0.000 4.332 -1.830) 4.703 14.114 ( 0.000 -0.411 2.261) 2.298 14.625 ( -0.000 5.283 1.685) 5.545======================= Grid point 551 (206/344) =======================q-point: ( 0.47 0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.373 ( 9.700 3.728 0.010) 10.392 2.684 ( -1.083 5.794 -0.670) 5.932 2.967 ( 12.521 12.875 1.353) 18.010 3.212 ( 3.888 20.594 0.299) 20.960 3.391 ( 8.833 3.300 -2.703) 9.809 3.616 ( -0.828 -2.247 -1.596) 2.877 4.142 ( -2.134 10.978 7.336) 13.375 4.437 ( -0.708 8.923 -3.612) 9.652 4.509 ( 2.631 7.706 -3.128) 8.723 5.131 ( 2.793 24.083 4.559) 24.670 6.035 ( 4.507 4.182 -2.241) 6.544 6.591 ( -4.300 13.880 1.210) 14.581 7.719 ( 1.293 7.497 1.656) 7.786 8.635 ( -4.415 -2.955 0.872) 5.384 9.102 ( 8.436 -1.068 -0.197) 8.505 9.463 ( 1.608 -0.015 3.144) 3.531 9.595 ( 2.277 2.707 -2.696) 4.448 9.721 ( 2.964 0.602 -7.079) 7.698 9.939 ( 0.554 10.227 6.932) 12.368 10.735 ( -5.836 -8.785 1.703) 10.684 11.261 ( -13.758 -6.767 -2.941) 15.612 12.251 ( 11.837 4.124 -1.295) 12.602 14.142 ( 2.437 -0.157 0.498) 2.493 14.637 ( -4.385 4.369 1.574) 6.387======================= Grid point 552 (207/344) =======================q-point: ( 0.53 0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.630 ( 13.468 4.440 0.082) 14.181 2.725 ( 1.952 2.792 -0.678) 3.473 3.263 ( 7.347 9.006 -1.410) 11.707 3.496 ( 4.425 5.647 -1.740) 7.382 3.636 ( 9.330 5.831 -1.000) 11.048 3.652 ( 13.584 11.614 3.904) 18.294 4.211 ( -3.457 10.245 4.306) 11.638 4.495 ( -1.332 8.291 -4.466) 9.511 4.618 ( 2.361 4.964 -0.647) 5.535 5.397 ( 6.152 12.908 2.214) 14.469 6.158 ( 6.152 2.631 -0.367) 6.701 6.645 ( -7.555 15.434 1.713) 17.269 7.835 ( 2.660 7.826 2.446) 8.620 8.511 ( -4.782 -4.534 -0.334) 6.598 9.280 ( 12.439 -0.546 -1.062) 12.497 9.541 ( 3.606 4.275 1.266) 5.734 9.656 ( 3.644 0.369 -3.243) 4.892 9.767 ( 1.602 2.322 -3.586) 4.563 10.064 ( 0.474 9.689 6.087) 11.452 10.527 ( -8.803 -6.776 1.905) 11.271 10.949 ( -12.685 -6.798 -3.354) 14.778 12.519 ( 12.878 6.293 -0.629) 14.347 14.176 ( 1.860 -1.178 -1.046) 2.437 14.576 ( -6.643 2.025 1.868) 7.192======================= Grid point 553 (208/344) =======================q-point: ( 0.60 0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.756 ( 2.269 1.704 0.054) 2.838 2.942 ( 11.708 7.264 0.399) 13.784 3.333 ( -2.068 -2.369 -1.102) 3.333 3.611 ( 6.407 7.810 -0.944) 10.146 3.922 ( 12.660 6.746 0.509) 14.354 4.084 ( 16.234 12.789 2.250) 20.789 4.258 ( -3.689 12.626 0.646) 13.170 4.550 ( 0.826 6.149 -2.509) 6.692 4.666 ( -0.755 1.895 -0.204) 2.050 5.629 ( 8.471 7.631 0.899) 11.437 6.288 ( 5.464 2.306 0.912) 6.000 6.627 ( -9.193 8.846 1.925) 12.902 7.976 ( 3.623 7.680 3.880) 9.336 8.393 ( -2.935 -4.544 -2.805) 6.093 9.492 ( 11.962 -0.004 -0.936) 11.998 9.648 ( 1.515 6.402 -0.394) 6.591 9.718 ( 5.743 -2.133 -3.618) 7.115 9.780 ( -4.252 4.258 0.640) 6.051 10.168 ( 0.081 6.908 2.254) 7.267 10.349 ( -4.049 -5.000 4.622) 7.922 10.683 ( -9.041 -6.732 -4.253) 12.048 12.811 ( 11.531 9.720 -0.188) 15.082 14.171 ( -0.407 -1.854 -1.831) 2.637 14.465 ( -6.218 -2.327 1.932) 6.915======================= Grid point 554 (209/344) =======================q-point: ( 0.67 0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.817 ( 1.986 3.138 0.284) 3.724 3.176 ( 5.070 9.038 0.479) 10.374 3.235 ( -2.885 -5.544 -0.705) 6.290 3.810 ( 5.993 8.780 -1.037) 10.681 4.171 ( 7.736 4.400 3.453) 9.546 4.236 ( -2.591 6.767 -2.198) 7.573 4.471 ( 5.549 8.557 -0.530) 10.213 4.636 ( -1.462 -2.096 -0.037) 2.556 4.704 ( 8.050 13.758 -0.505) 15.948 5.832 ( 4.029 9.152 0.977) 10.047 6.377 ( 2.229 0.489 1.002) 2.492 6.524 ( -5.184 -3.264 2.038) 6.456 8.112 ( 1.595 6.201 6.463) 9.098 8.317 ( 0.814 -3.714 -6.595) 7.612 9.665 ( 2.545 4.523 -0.262) 5.196 9.701 ( -1.364 3.872 1.145) 4.262 9.717 ( -3.621 2.819 1.123) 4.725 9.799 ( 7.011 -2.508 -4.482) 8.691 10.185 ( -0.274 -1.479 0.204) 1.518 10.335 ( 0.297 0.572 7.560) 7.587 10.496 ( -3.184 -4.997 -6.139) 8.532 13.099 ( 7.866 13.299 -0.024) 15.451 14.118 ( -3.181 -1.579 -0.903) 3.665 14.337 ( -2.366 -8.064 0.728) 8.436======================= Grid point 555 (210/344) =======================q-point: ( 0.73 0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.878 ( -0.704 5.422 0.174) 5.471 3.139 ( 0.908 -7.271 -0.465) 7.342 3.302 ( -1.913 9.558 0.285) 9.751 3.961 ( 1.345 8.111 -1.819) 8.421 4.195 ( -2.145 -0.938 0.106) 2.343 4.328 ( -1.461 9.974 1.418) 10.180 4.550 ( 0.966 -0.559 -0.970) 1.479 4.597 ( 1.488 -2.904 0.672) 3.332 4.994 ( 3.631 14.983 -0.312) 15.420 5.917 ( -7.352 12.656 1.938) 14.764 6.348 ( -2.143 -3.351 -1.321) 4.191 6.467 ( 6.753 -12.656 3.742) 14.825 8.134 ( -3.349 -0.148 4.805) 5.858 8.349 ( 4.795 1.094 -5.794) 7.599 9.618 ( -7.668 8.706 2.781) 11.930 9.713 ( -1.063 1.911 -0.096) 2.189 9.777 ( 1.601 1.154 -0.531) 2.043 9.895 ( 9.251 -4.967 -2.666) 10.833 10.138 ( -5.022 0.097 -1.341) 5.199 10.311 ( 0.046 -5.401 4.846) 7.256 10.485 ( 3.366 0.256 -3.229) 4.672 13.313 ( -1.047 14.877 -0.237) 14.916 14.050 ( -1.259 -1.727 1.570) 2.652 14.241 ( 2.639 -11.121 -1.579) 11.538======================= Grid point 556 (211/344) =======================q-point: (-0.20 0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.873 ( -4.482 2.920 0.020) 5.349 3.151 ( 6.695 -3.602 -0.832) 7.647 3.301 ( -7.462 6.240 0.332) 9.733 3.980 ( -6.533 4.856 -2.273) 8.451 4.143 ( -3.005 -0.475 1.501) 3.393 4.350 ( -5.426 6.456 0.916) 8.483 4.544 ( 0.091 -0.705 -0.563) 0.907 4.615 ( 2.924 -2.835 0.177) 4.077 5.011 ( -13.927 4.842 -0.473) 14.752 5.897 ( -8.571 11.439 2.097) 14.447 6.300 ( 2.565 -5.055 -0.501) 5.691 6.462 ( 4.277 -10.557 3.451) 11.902 8.064 ( -4.026 -1.756 2.705) 5.158 8.420 ( 2.471 1.705 -3.660) 4.734 9.635 ( -2.572 10.303 2.221) 10.849 9.708 ( -0.039 -0.529 -0.004) 0.530 9.784 ( -0.585 -0.014 -1.342) 1.464 9.952 ( 1.080 -7.830 -2.215) 8.209 10.062 ( -0.734 3.279 0.137) 3.363 10.269 ( -1.360 -3.978 2.808) 5.056 10.544 ( 4.080 -0.320 -2.092) 4.596 13.310 ( -12.400 8.290 -0.230) 14.917 14.099 ( 4.975 3.506 2.388) 6.538 14.198 ( 5.775 -10.821 -2.441) 12.506======================= Grid point 557 (212/344) =======================q-point: (-0.13 0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.815 ( -3.300 -0.013 -0.210) 3.306 3.168 ( -10.712 -0.325 -0.013) 10.717 3.264 ( 7.157 0.147 -0.949) 7.221 3.852 ( -10.463 1.563 -1.509) 10.686 4.071 ( -7.077 1.204 3.245) 7.878 4.267 ( -6.790 -2.464 -0.352) 7.231 4.491 ( -11.017 0.560 -0.533) 11.044 4.645 ( 2.365 -0.103 -0.779) 2.492 4.720 ( -14.265 -0.145 -0.164) 14.267 5.797 ( -9.874 -1.571 0.962) 10.045 6.349 ( -0.486 5.257 -0.018) 5.280 6.417 ( 2.054 -6.551 4.694) 8.317 7.981 ( -4.834 -0.242 2.394) 5.400 8.454 ( 0.691 1.352 -2.570) 2.986 9.642 ( -3.772 -0.035 0.697) 3.836 9.720 ( 1.731 -8.546 -2.993) 9.219 9.765 ( -1.642 0.909 -1.844) 2.631 9.864 ( -3.715 7.989 0.539) 8.827 10.139 ( 3.057 0.556 3.830) 4.932 10.189 ( -3.517 -1.059 0.893) 3.780 10.620 ( 5.983 -0.102 -2.563) 6.510 13.100 ( -15.198 0.201 -0.060) 15.199 14.167 ( 2.762 -4.286 -2.215) 5.559 14.295 ( 8.234 4.300 1.976) 9.497======================= Grid point 566 (213/344) =======================q-point: ( 0.47 0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.302 ( -0.000 1.541 -1.082) 1.883 2.730 ( -0.000 1.094 -4.195) 4.335 2.993 ( 0.000 13.754 8.225) 16.026 3.317 ( -0.000 1.927 -5.877) 6.185 3.396 ( -0.000 20.815 2.190) 20.930 3.595 ( -0.000 -2.630 -1.620) 3.089 4.282 ( 0.000 9.600 6.707) 11.711 4.505 ( -0.000 6.435 0.230) 6.440 4.572 ( -0.000 9.329 -6.191) 11.197 5.296 ( -0.000 10.575 2.266) 10.815 6.058 ( -0.000 9.249 -1.614) 9.388 6.791 ( -0.000 16.781 1.792) 16.876 7.793 ( -0.000 8.289 1.603) 8.442 8.661 ( -0.000 -2.319 -1.544) 2.786 8.975 ( 0.000 -5.920 1.268) 6.054 9.424 ( 0.000 -1.312 1.535) 2.019 9.619 ( -0.000 4.439 -0.918) 4.533 9.705 ( -0.000 3.598 -6.095) 7.078 10.063 ( 0.000 11.464 6.705) 13.281 10.713 ( 0.000 -6.345 -0.132) 6.347 11.318 ( 0.000 -8.864 -1.907) 9.067 12.159 ( -0.000 3.900 -1.375) 4.135 14.134 ( -0.000 1.747 -0.098) 1.750 14.720 ( 0.000 3.322 1.624) 3.698======================= Grid point 567 (214/344) =======================q-point: ( 0.53 0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.421 ( 11.803 1.730 -0.450) 11.938 2.721 ( 0.031 0.110 -2.129) 2.132 3.218 ( 7.957 9.594 6.081) 13.869 3.395 ( 7.418 1.549 -6.208) 9.796 3.572 ( 1.722 -1.042 -0.760) 2.152 3.645 ( 5.388 17.923 2.886) 18.936 4.366 ( -1.959 8.794 4.355) 10.007 4.588 ( 1.319 6.803 -0.997) 7.002 4.638 ( -0.424 6.717 -3.415) 7.547 5.368 ( 4.057 -1.326 0.677) 4.322 6.186 ( 0.733 13.495 -1.240) 13.572 6.914 ( -4.897 14.606 1.685) 15.497 7.889 ( 1.158 8.137 2.035) 8.467 8.561 ( -5.856 -3.891 -1.543) 7.198 9.031 ( 11.489 -5.350 -0.069) 12.674 9.464 ( 4.583 0.236 0.322) 4.600 9.660 ( 0.171 4.150 -0.850) 4.239 9.754 ( 2.030 3.950 -3.428) 5.610 10.188 ( -0.404 11.113 6.148) 12.707 10.608 ( -5.816 -4.295 -0.741) 7.268 11.099 ( -12.200 -8.243 -1.968) 14.855 12.325 ( 13.048 3.587 -0.856) 13.559 14.155 ( 0.285 1.356 -0.880) 1.641 14.709 ( -4.801 2.089 1.852) 5.554======================= Grid point 568 (215/344) =======================q-point: ( 0.60 0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.699 ( 12.422 2.415 1.089) 12.701 2.747 ( 7.263 0.330 -1.169) 7.364 3.359 ( -1.842 0.427 1.061) 2.168 3.523 ( 9.870 2.528 -1.105) 10.248 3.740 ( 13.568 5.367 -1.863) 14.709 3.951 ( 11.573 11.135 3.188) 16.373 4.424 ( -2.239 9.673 1.493) 10.040 4.643 ( -2.864 7.783 -2.877) 8.779 4.691 ( 1.135 2.662 0.117) 2.896 5.464 ( 11.093 -4.259 -0.042) 11.882 6.312 ( -0.416 10.665 -0.803) 10.703 6.909 ( -10.096 9.555 0.677) 13.917 8.005 ( 2.713 7.494 2.507) 8.355 8.418 ( -5.310 -3.909 -1.245) 6.710 9.219 ( 15.088 -4.269 -1.299) 15.734 9.568 ( 6.655 0.086 -1.020) 6.733 9.706 ( 0.361 4.021 -0.100) 4.038 9.826 ( 2.229 3.511 -0.764) 4.228 10.293 ( -1.567 10.199 4.390) 11.213 10.430 ( -9.457 -3.504 0.295) 10.090 10.796 ( -11.968 -7.144 -2.669) 14.191 12.629 ( 16.649 4.683 -0.308) 17.298 14.156 ( -0.651 -0.229 -1.659) 1.797 14.608 ( -8.693 0.393 2.128) 8.958======================= Grid point 569 (216/344) =======================q-point: ( 0.67 0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.783 ( 3.786 0.925 0.448) 3.923 3.049 ( 15.897 3.438 -0.062) 16.265 3.269 ( -5.536 -2.805 0.301) 6.214 3.744 ( 9.896 4.915 0.503) 11.060 4.030 ( 12.817 4.309 -0.003) 13.522 4.215 ( 8.726 1.861 -0.042) 8.923 4.505 ( 0.441 7.923 0.515) 7.952 4.652 ( -2.017 2.459 -1.381) 3.467 4.746 ( 2.245 8.763 -0.277) 9.050 5.672 ( 16.017 -2.213 -0.364) 16.174 6.367 ( -1.966 4.197 0.218) 4.640 6.760 ( -14.480 3.860 -0.757) 15.005 8.141 ( 4.280 6.255 1.913) 7.817 8.296 ( -4.350 -3.406 -0.730) 5.572 9.442 ( 14.870 -3.119 -1.552) 15.272 9.670 ( 5.152 -0.503 -1.854) 5.498 9.747 ( 0.112 2.980 0.437) 3.014 9.890 ( -0.401 5.228 1.042) 5.346 10.206 ( -9.044 -3.016 0.832) 9.570 10.388 ( 0.083 5.675 4.122) 7.015 10.548 ( -8.818 -5.114 -3.779) 10.872 12.975 ( 16.668 6.228 0.085) 17.794 14.124 ( -1.372 -1.517 -2.242) 3.035 14.432 ( -11.093 -1.861 2.304) 11.481======================= Grid point 570 (217/344) =======================q-point: ( 0.73 0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.878 ( 5.262 2.160 0.182) 5.691 3.133 ( -6.385 -3.180 0.319) 7.140 3.306 ( 8.969 3.223 -0.155) 9.532 3.946 ( 7.645 4.443 0.428) 8.853 4.188 ( 1.619 -1.233 0.977) 2.257 4.348 ( 6.878 3.277 -1.300) 7.728 4.541 ( -0.557 0.398 0.395) 0.790 4.606 ( -3.741 0.099 -0.670) 3.802 4.992 ( 11.118 10.384 -0.085) 15.213 5.935 ( 13.864 0.767 -0.583) 13.897 6.329 ( -2.763 -3.190 1.438) 4.459 6.506 ( -15.490 0.071 -1.830) 15.598 8.192 ( -2.959 -3.948 -1.852) 5.270 8.280 ( 4.069 5.334 2.374) 7.116 9.649 ( 11.840 -1.883 -1.628) 12.099 9.719 ( 1.327 -0.319 -0.958) 1.668 9.763 ( -0.813 1.025 1.605) 2.070 9.877 ( -8.251 6.709 -0.206) 10.636 10.117 ( 3.804 -5.050 1.747) 6.559 10.355 ( -8.009 -1.985 -0.767) 8.287 10.456 ( 1.321 2.676 0.067) 2.985 13.310 ( 13.586 6.383 0.224) 15.013 14.077 ( -1.837 -0.919 -2.404) 3.162 14.214 ( -9.955 -4.249 2.270) 11.059======================= Grid point 571 (218/344) =======================q-point: (-0.20 0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.993 ( -4.647 -4.852 0.039) 6.718 3.006 ( 4.888 4.968 -0.043) 6.969 3.401 ( -0.140 -0.152 0.002) 0.207 4.090 ( 3.436 4.054 -0.041) 5.314 4.135 ( -3.158 -3.624 0.061) 4.807 4.451 ( -0.289 -0.460 -0.014) 0.543 4.533 ( 0.456 0.638 0.018) 0.785 4.555 ( -0.190 -0.177 -0.034) 0.262 5.184 ( 0.687 0.757 0.026) 1.022 6.065 ( -2.156 -2.500 -0.018) 3.301 6.288 ( 0.664 -1.067 -0.085) 1.259 6.297 ( -1.725 0.008 0.086) 1.727 8.106 ( -2.598 -2.862 -0.003) 3.865 8.391 ( 3.072 3.409 0.010) 4.589 9.688 ( -2.298 -3.597 -0.490) 4.296 9.743 ( -0.549 1.168 1.053) 1.666 9.803 ( 0.839 -0.825 -0.914) 1.490 9.838 ( 3.038 4.395 0.355) 5.354 10.150 ( -0.334 -0.136 0.001) 0.360 10.230 ( -2.009 -2.501 -0.015) 3.208 10.503 ( 1.600 1.778 0.006) 2.392 13.493 ( 0.114 0.119 -0.000) 0.165 14.024 ( -0.933 -1.078 -0.002) 1.426 14.107 ( 0.969 1.120 0.002) 1.481======================= Grid point 572 (219/344) =======================q-point: (-0.13 0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.872 ( -4.324 -3.075 0.055) 5.306 3.151 ( 6.217 3.804 -0.534) 7.308 3.298 ( -7.372 -6.528 0.058) 9.848 4.016 ( -7.208 -0.455 -1.048) 7.298 4.146 ( -0.413 -0.448 2.467) 2.541 4.322 ( -6.884 -8.844 -0.836) 11.238 4.566 ( -0.313 2.126 0.731) 2.269 4.596 ( 3.141 1.564 -1.147) 3.692 5.009 ( -14.633 -4.749 -0.536) 15.393 5.868 ( -7.751 -13.630 0.642) 15.693 6.358 ( 4.220 6.702 3.363) 8.604 6.387 ( 3.000 4.975 -1.587) 6.023 8.049 ( -2.341 -0.455 1.399) 2.765 8.453 ( 1.122 2.389 -1.399) 2.988 9.578 ( -2.108 -10.643 -0.728) 10.874 9.718 ( -2.416 -2.195 0.181) 3.269 9.792 ( -0.881 0.637 -0.536) 1.212 9.964 ( 2.532 8.755 -1.449) 9.228 10.128 ( -0.549 1.278 3.694) 3.947 10.215 ( 0.216 -0.852 -0.413) 0.971 10.554 ( 2.550 2.078 -1.360) 3.559 13.315 ( -12.452 -7.945 0.088) 14.771 14.043 ( 3.879 -2.965 -1.151) 5.016 14.251 ( 6.912 10.301 0.956) 12.442======================= Grid point 582 (220/344) =======================q-point: ( 0.53 0.53 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.319 ( -0.000 0.739 -0.512) 0.899 2.713 ( -0.000 -0.678 -1.399) 1.555 3.235 ( 0.000 4.948 5.533) 7.422 3.341 ( -0.000 4.834 -4.112) 6.346 3.538 ( 0.000 -2.179 -0.669) 2.279 3.776 ( -0.000 15.206 1.138) 15.249 4.472 ( 0.000 7.488 3.308) 8.186 4.616 ( -0.000 4.398 -0.043) 4.398 4.717 ( -0.000 7.146 -3.286) 7.866 5.273 ( 0.000 -8.847 -0.126) 8.848 6.333 ( -0.000 15.271 -2.040) 15.407 7.093 ( -0.000 11.354 0.530) 11.366 7.961 ( -0.000 7.203 2.220) 7.538 8.595 ( -0.000 -2.542 -3.069) 3.985 8.846 ( 0.000 -6.578 1.282) 6.701 9.432 ( -0.000 1.064 -0.046) 1.065 9.694 ( -0.000 3.109 -0.142) 3.112 9.773 ( -0.000 4.452 -2.026) 4.891 10.312 ( 0.000 9.788 5.450) 11.203 10.626 ( -0.000 -1.582 -2.043) 2.584 11.126 ( 0.000 -9.502 -1.138) 9.570 12.223 ( -0.000 2.842 -0.822) 2.959 14.174 ( -0.000 2.204 -1.016) 2.427 14.774 ( 0.000 1.354 1.969) 2.390======================= Grid point 583 (221/344) =======================q-point: ( 0.60 0.53 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.446 ( 13.182 0.876 0.064) 13.211 2.708 ( 0.470 -0.438 0.381) 0.747 3.347 ( 9.558 0.797 -2.185) 9.837 3.406 ( -1.034 2.154 2.243) 3.277 3.581 ( 8.267 2.117 0.070) 8.534 3.935 ( 3.567 9.348 0.277) 10.009 4.539 ( -1.068 7.173 1.517) 7.409 4.681 ( 2.561 2.565 0.097) 3.626 4.758 ( -2.131 6.729 -2.168) 7.384 5.226 ( 6.649 -9.964 -0.642) 11.996 6.450 ( -1.698 11.194 -2.001) 11.498 7.131 ( -5.816 6.371 -1.765) 8.806 8.041 ( 1.275 5.517 2.264) 6.098 8.489 ( -6.362 -2.180 -0.617) 6.754 8.925 ( 12.578 -4.289 -0.523) 13.300 9.477 ( 3.925 0.764 -0.515) 4.031 9.727 ( 0.718 2.334 0.131) 2.445 9.824 ( 1.355 3.479 -0.010) 3.733 10.397 ( -0.471 5.307 3.263) 6.247 10.574 ( -6.015 3.161 -1.233) 6.906 10.918 ( -11.012 -8.881 -1.082) 14.188 12.381 ( 13.915 2.208 -0.405) 14.095 14.180 ( -1.282 1.359 -1.376) 2.320 14.742 ( -5.211 0.489 2.136) 5.653======================= Grid point 584 (222/344) =======================q-point: ( 0.67 0.53 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.731 ( 2.587 -0.201 0.715) 2.692 2.750 ( 19.151 1.012 0.186) 19.179 3.350 ( -4.933 -0.688 1.038) 5.088 3.567 ( 13.510 1.320 0.419) 13.581 3.825 ( 14.529 3.111 -0.346) 14.863 4.080 ( 6.824 1.519 -1.024) 7.066 4.581 ( -1.340 4.196 0.552) 4.439 4.706 ( -1.263 0.295 0.048) 1.298 4.800 ( -0.380 6.942 -0.932) 7.015 5.336 ( 15.713 -5.979 -1.345) 16.866 6.480 ( -4.001 5.264 -1.054) 6.696 7.013 ( -11.273 1.424 -3.889) 12.010 8.118 ( 2.482 2.078 -0.398) 3.262 8.374 ( -5.397 -0.062 3.144) 6.246 9.142 ( 15.704 -1.901 -1.426) 15.883 9.568 ( 5.823 0.224 -1.007) 5.914 9.761 ( 0.854 1.290 0.351) 1.586 9.887 ( 2.498 2.167 1.730) 3.732 10.374 ( -6.456 -1.713 -0.616) 6.708 10.503 ( -8.094 8.092 1.743) 11.577 10.642 ( -8.954 -6.720 -1.037) 11.243 12.695 ( 18.944 1.863 0.015) 19.035 14.150 ( -2.508 0.341 -1.760) 3.082 14.616 ( -9.816 -0.401 2.218) 10.071======================= Grid point 585 (223/344) =======================q-point: (-0.27 -0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.794 ( 4.609 -0.102 0.464) 4.634 3.082 ( 17.289 -0.047 -0.316) 17.292 3.245 ( -6.809 0.376 1.051) 6.900 3.804 ( 11.479 0.476 2.345) 11.726 4.084 ( 10.743 0.178 0.246) 10.747 4.201 ( 9.052 -1.557 -3.102) 9.695 4.570 ( -1.711 -0.594 0.336) 1.843 4.674 ( -2.985 0.844 -0.382) 3.125 4.883 ( 5.839 1.241 0.365) 5.980 5.614 ( 19.346 -0.992 -1.894) 19.464 6.415 ( -6.070 -0.140 0.016) 6.072 6.769 ( -14.942 -1.706 -4.634) 15.737 8.138 ( 1.130 -3.836 -5.164) 6.531 8.339 ( -1.825 3.850 7.232) 8.394 9.404 ( 15.031 0.716 -1.519) 15.124 9.664 ( 4.766 0.324 -1.031) 4.887 9.778 ( 0.101 0.079 0.593) 0.607 9.966 ( 4.491 0.782 1.983) 4.971 10.160 ( -14.180 -0.889 1.258) 14.264 10.410 ( -3.628 -5.096 -4.863) 7.924 10.535 ( -4.757 4.856 3.790) 7.783 13.042 ( 19.027 0.034 0.276) 19.029 14.106 ( -2.227 0.991 -1.985) 3.144 14.413 ( -12.974 -0.911 2.143) 13.181======================= Grid point 586 (224/344) =======================q-point: (-0.20 -0.47 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.873 ( 4.920 -2.466 -0.037) 5.504 3.145 ( -6.316 3.859 1.008) 7.470 3.303 ( 8.977 -3.332 -0.302) 9.580 3.966 ( 8.021 -3.219 1.812) 8.831 4.153 ( 1.389 -2.164 -1.546) 3.000 4.355 ( 7.411 -1.792 -0.647) 7.652 4.541 ( -0.459 -0.167 0.377) 0.617 4.616 ( -4.036 0.712 -0.026) 4.099 5.007 ( 11.101 -9.672 0.695) 14.740 5.911 ( 13.847 -1.847 -1.974) 14.108 6.299 ( -5.138 0.271 -0.299) 5.154 6.484 ( -12.860 -1.516 -3.062) 13.306 8.086 ( -0.096 -4.619 -3.849) 6.013 8.392 ( 1.296 3.384 4.679) 5.918 9.647 ( 10.578 2.324 -1.587) 10.946 9.710 ( -0.993 -0.167 -0.624) 1.185 9.773 ( -0.082 -0.599 1.733) 1.835 9.935 ( -6.753 -3.679 2.698) 8.150 10.067 ( 3.894 2.459 -1.287) 4.782 10.289 ( -3.919 -3.581 -3.062) 6.128 10.528 ( -1.824 3.317 2.798) 4.707 13.309 ( 13.482 -6.505 0.166) 14.970 14.113 ( 0.757 5.293 -1.642) 5.593 14.183 ( -12.471 0.249 1.768) 12.598======================= Grid point 598 (225/344) =======================q-point: ( 0.60 0.60 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.330 ( 0.000 0.441 0.343) 0.558 2.709 ( 0.000 0.288 1.984) 2.005 3.240 ( -0.000 -1.190 -6.440) 6.549 3.467 ( 0.000 4.112 6.694) 7.856 3.506 ( 0.000 -0.696 -0.242) 0.737 3.980 ( -0.000 4.630 -1.397) 4.836 4.611 ( -0.000 4.393 0.715) 4.451 4.674 ( -0.000 1.478 -0.475) 1.552 4.837 ( -0.000 6.459 -1.003) 6.536 5.061 ( 0.000 -10.104 -0.945) 10.148 6.555 ( -0.000 6.915 -2.020) 7.204 7.215 ( -0.000 1.598 -5.302) 5.538 8.080 ( 0.000 3.036 3.204) 4.414 8.557 ( -0.000 0.016 -0.960) 0.960 8.751 ( 0.000 -2.970 0.725) 3.057 9.448 ( -0.000 0.486 -0.541) 0.727 9.737 ( -0.000 1.167 0.134) 1.175 9.847 ( 0.000 2.686 1.547) 3.100 10.431 ( -0.000 0.065 -0.319) 0.325 10.671 ( -0.000 5.938 0.187) 5.941 10.946 ( 0.000 -6.984 -0.144) 6.985 12.263 ( -0.000 1.306 -0.267) 1.333 14.203 ( -0.000 1.084 -1.398) 1.769 14.796 ( 0.000 0.057 2.235) 2.236======================= Grid point 599 (226/344) =======================q-point: (-0.33 -0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.457 ( 13.264 0.124 0.367) 13.270 2.717 ( 0.056 0.782 2.194) 2.330 3.311 ( 10.301 -1.756 -4.833) 11.513 3.450 ( -2.378 1.102 2.509) 3.628 3.628 ( 9.944 0.917 3.292) 10.515 4.006 ( 1.882 -1.505 -2.704) 3.622 4.619 ( -0.981 -1.346 -0.224) 1.681 4.701 ( 1.531 -0.002 0.227) 1.548 4.878 ( -1.658 2.983 0.262) 3.423 5.062 ( 8.983 -1.505 -2.225) 9.376 6.570 ( -2.479 0.990 -1.129) 2.898 7.142 ( -5.719 -2.669 -7.976) 10.171 8.106 ( 0.291 -0.395 2.291) 2.343 8.484 ( -5.870 1.143 2.097) 6.337 8.878 ( 12.902 0.120 -0.704) 12.922 9.481 ( 3.675 -0.166 -0.812) 3.767 9.752 ( 0.831 0.096 0.238) 0.870 9.881 ( 0.994 1.349 3.078) 3.505 10.401 ( -1.218 -2.888 -3.112) 4.417 10.688 ( -3.035 -0.674 1.186) 3.328 10.786 ( -12.644 2.422 0.624) 12.889 12.406 ( 14.150 0.364 0.047) 14.155 14.190 ( -1.763 0.245 -1.561) 2.367 14.752 ( -5.437 -0.438 2.278) 5.911======================= Grid point 600 (227/344) =======================q-point: (-0.27 -0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.720 ( 9.145 -0.828 0.495) 9.195 2.770 ( 11.692 0.399 0.479) 11.709 3.359 ( -4.139 1.077 1.786) 4.635 3.575 ( 14.542 -0.770 0.682) 14.578 3.848 ( 14.171 -1.307 1.636) 14.325 4.021 ( 5.937 -5.766 -4.628) 9.482 4.560 ( -0.830 -6.023 -0.684) 6.119 4.712 ( -0.634 0.123 0.501) 0.817 4.845 ( -1.370 -3.485 1.519) 4.041 5.306 ( 15.919 4.799 -3.022) 16.899 6.488 ( -4.416 -4.571 -0.207) 6.359 6.942 ( -10.381 -5.059 -8.333) 14.240 8.083 ( -0.282 -4.283 -0.893) 4.384 8.428 ( -3.368 2.332 4.707) 6.240 9.147 ( 15.996 2.969 -1.132) 16.309 9.563 ( 6.069 -0.336 -1.253) 6.206 9.764 ( 0.889 -1.007 0.442) 1.414 9.920 ( 1.836 -0.168 4.107) 4.502 10.324 ( -2.882 -3.566 -4.247) 6.250 10.470 ( -12.814 -5.793 0.478) 14.071 10.703 ( -7.432 7.719 2.089) 10.917 12.700 ( 18.786 -1.457 0.293) 18.845 14.152 ( -2.170 0.581 -1.676) 2.803 14.614 ( -10.071 -0.718 2.142) 10.321======================= Grid point 601 (228/344) =======================q-point: (-0.20 -0.40 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.785 ( 3.334 -0.854 0.472) 3.474 3.044 ( 15.697 -3.656 -0.429) 16.123 3.294 ( -5.754 3.717 1.527) 7.018 3.779 ( 9.806 -4.435 3.170) 11.220 4.017 ( 8.485 -5.875 -1.080) 10.377 4.152 ( 14.400 -2.605 -3.543) 15.056 4.494 ( 2.308 -7.986 -0.208) 8.315 4.680 ( -2.854 -0.348 0.492) 2.917 4.778 ( 0.817 -9.274 1.284) 9.398 5.633 ( 16.454 2.146 -2.582) 16.793 6.357 ( -3.334 -5.197 0.106) 6.175 6.664 ( -12.766 -5.584 -6.663) 15.445 8.022 ( 0.098 -5.758 -2.751) 6.383 8.427 ( -0.780 2.058 4.596) 5.096 9.458 ( 14.667 4.415 -0.545) 15.327 9.669 ( 6.132 0.667 -1.902) 6.455 9.763 ( 0.456 -1.565 1.229) 2.041 9.931 ( -1.095 -4.688 4.093) 6.319 10.191 ( -9.918 2.819 -1.092) 10.369 10.260 ( -1.871 -7.590 -3.211) 8.451 10.650 ( -6.360 5.202 2.485) 8.584 12.979 ( 16.349 -6.114 0.308) 17.458 14.144 ( 0.108 3.175 -1.324) 3.442 14.415 ( -12.328 0.212 1.586) 12.431======================= Grid point 614 (229/344) =======================q-point: (-0.33 -0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.339 ( 0.000 0.178 0.835) 0.853 2.743 ( 0.000 1.720 3.266) 3.691 3.161 ( -0.000 -3.566 -7.646) 8.437 3.511 ( -0.000 1.214 0.068) 1.216 3.533 ( 0.000 -0.595 7.201) 7.225 3.948 ( 0.000 -6.574 -2.696) 7.105 4.583 ( 0.000 -7.136 -0.994) 7.204 4.670 ( -0.000 -1.644 -0.788) 1.823 4.876 ( 0.000 -3.663 0.833) 3.756 5.044 ( -0.000 10.115 -1.426) 10.215 6.569 ( 0.000 -5.365 -0.710) 5.411 7.126 ( -0.000 -5.798 -10.523) 12.015 8.097 ( 0.000 -3.112 4.136) 5.176 8.583 ( -0.000 2.102 0.224) 2.114 8.742 ( -0.000 1.949 0.235) 1.964 9.441 ( -0.000 -0.966 -0.909) 1.327 9.741 ( 0.000 -0.881 0.298) 0.930 9.889 ( 0.000 0.224 4.361) 4.367 10.358 ( -0.000 -5.803 -4.653) 7.438 10.693 ( 0.000 -3.967 1.140) 4.128 10.966 ( -0.000 8.273 0.982) 8.331 12.271 ( 0.000 -0.426 0.230) 0.485 14.200 ( -0.000 -0.779 -1.574) 1.757 14.798 ( 0.000 -0.851 2.345) 2.494======================= Grid point 615 (230/344) =======================q-point: (-0.27 -0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.455 ( 12.320 -0.538 0.560) 12.345 2.749 ( -0.995 1.168 1.517) 2.158 3.237 ( 13.397 -3.889 -3.589) 14.404 3.490 ( -2.156 2.201 1.566) 3.456 3.628 ( 8.838 -2.582 3.880) 9.991 3.864 ( 1.793 -10.915 -3.182) 11.510 4.487 ( -0.587 -9.752 -1.571) 9.895 4.680 ( 3.112 -2.582 -0.017) 4.044 4.832 ( -1.434 -4.211 1.855) 4.820 5.192 ( 5.653 10.021 -2.237) 11.721 6.463 ( -1.968 -11.270 -0.687) 11.462 6.992 ( -5.053 -7.268 -9.937) 13.308 8.050 ( -1.096 -6.039 2.904) 6.790 8.529 ( -5.152 1.972 1.351) 5.679 8.922 ( 13.369 4.417 -0.728) 14.098 9.460 ( 3.961 -1.469 -1.325) 4.427 9.736 ( 0.785 -1.810 0.454) 2.024 9.904 ( 0.892 -0.892 5.225) 5.376 10.270 ( -0.570 -8.216 -4.882) 9.574 10.604 ( -6.505 -3.165 0.643) 7.263 10.959 ( -9.966 9.560 1.187) 13.861 12.395 ( 13.643 -1.532 0.416) 13.735 14.175 ( -1.004 -1.028 -1.647) 2.186 14.745 ( -5.408 -1.326 2.271) 6.014======================= Grid point 616 (231/344) =======================q-point: (-0.20 -0.33 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.699 ( 13.813 -1.858 0.729) 13.957 2.765 ( 4.095 -0.922 -0.401) 4.217 3.398 ( 1.407 0.866 3.265) 3.659 3.548 ( 10.739 -1.511 0.051) 10.845 3.778 ( 10.231 -7.217 -0.201) 12.522 3.825 ( 11.447 -10.608 -2.724) 15.842 4.365 ( -0.413 -11.919 -1.951) 12.084 4.697 ( 1.085 -2.324 0.495) 2.612 4.742 ( -3.411 -6.168 2.739) 7.562 5.413 ( 11.108 4.055 -2.888) 12.172 6.307 ( -1.041 -11.678 -0.809) 11.752 6.771 ( -9.035 -7.994 -7.300) 14.101 7.962 ( -1.073 -7.362 0.346) 7.448 8.481 ( -2.751 1.306 1.995) 3.640 9.236 ( 16.119 5.580 -0.225) 17.060 9.538 ( 6.907 -1.509 -2.410) 7.469 9.733 ( 1.165 -2.143 1.012) 2.641 9.920 ( 0.616 -2.015 5.391) 5.788 10.158 ( -0.595 -9.848 -4.260) 10.746 10.425 ( -11.464 0.414 -0.066) 11.472 10.863 ( -10.491 7.529 1.320) 12.980 12.642 ( 16.206 -4.354 0.445) 16.786 14.158 ( 0.334 0.789 -1.572) 1.790 14.604 ( -9.415 -1.401 1.933) 9.713======================= Grid point 630 (232/344) =======================q-point: (-0.27 -0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.341 ( 0.000 -0.547 0.596) 0.809 2.789 ( 0.000 1.135 1.528) 1.903 3.031 ( -0.000 -6.382 -5.588) 8.482 3.512 ( 0.000 -4.160 5.332) 6.763 3.554 ( -0.000 2.985 0.250) 2.996 3.716 ( 0.000 -14.810 -1.293) 14.866 4.387 ( 0.000 -10.597 -1.913) 10.768 4.605 ( 0.000 -4.349 -0.751) 4.414 4.815 ( 0.000 -3.690 2.475) 4.443 5.240 ( -0.000 7.727 -1.635) 7.898 6.336 ( 0.000 -15.932 -1.554) 16.007 6.934 ( -0.000 -8.711 -8.313) 12.041 7.998 ( 0.000 -8.211 4.125) 9.189 8.618 ( -0.000 1.313 -1.816) 2.241 8.826 ( -0.000 6.150 0.168) 6.152 9.402 ( -0.000 -2.310 -1.578) 2.797 9.707 ( 0.000 -2.568 0.484) 2.613 9.890 ( 0.000 -2.625 4.593) 5.290 10.177 ( 0.000 -9.198 -2.735) 9.596 10.639 ( -0.000 -0.949 -0.924) 1.325 11.164 ( -0.000 10.165 1.002) 10.215 12.248 ( 0.000 -2.023 0.617) 2.115 14.161 ( -0.000 -2.235 -1.704) 2.811 14.780 ( 0.000 -2.142 2.277) 3.126======================= Grid point 631 (233/344) =======================q-point: (-0.20 -0.27 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.433 ( 11.096 -2.165 -0.027) 11.306 2.755 ( -1.702 -1.426 -0.452) 2.266 3.122 ( 16.234 -6.565 -1.536) 17.578 3.538 ( 5.072 -2.423 3.804) 6.787 3.564 ( 0.493 -8.780 -2.797) 9.228 3.586 ( 2.461 -6.710 1.818) 7.374 4.260 ( -1.323 -11.775 -2.324) 12.075 4.598 ( 4.185 -5.425 0.123) 6.853 4.755 ( -2.734 -5.021 3.292) 6.597 5.304 ( 3.566 -1.603 -2.981) 4.916 6.180 ( 0.457 -12.530 -1.429) 12.620 6.783 ( -4.543 -10.263 -5.417) 12.462 7.906 ( -1.209 -9.070 2.795) 9.567 8.560 ( -4.725 1.031 -1.485) 5.059 9.033 ( 13.162 6.373 0.085) 14.624 9.411 ( 4.314 -2.505 -2.509) 5.584 9.689 ( 1.036 -2.895 0.729) 3.160 9.872 ( 1.737 -5.357 1.105) 5.739 10.081 ( -1.299 -7.414 1.917) 7.767 10.582 ( -5.969 1.045 -2.277) 6.474 11.151 ( -11.484 9.121 1.042) 14.702 12.351 ( 12.485 -3.012 0.652) 12.860 14.139 ( 0.822 -1.600 -1.759) 2.516 14.714 ( -5.114 -2.960 2.071) 6.262======================= Grid point 646 (234/344) =======================q-point: (-0.20 -0.20 0.13)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.303 ( 0.000 -4.069 -1.279) 4.265 2.756 ( -0.000 -5.879 -2.619) 6.436 2.873 ( 0.000 -7.375 0.221) 7.378 3.403 ( 0.000 -14.564 2.022) 14.703 3.420 ( 0.000 -6.423 1.454) 6.586 3.627 ( -0.000 3.919 0.593) 3.964 4.150 ( 0.000 -12.379 -1.848) 12.516 4.496 ( 0.000 -6.111 -0.355) 6.122 4.732 ( 0.000 -6.425 4.262) 7.711 5.184 ( 0.000 -16.570 -4.497) 17.169 6.077 ( 0.000 -5.112 -0.380) 5.126 6.701 ( 0.000 -11.967 -2.928) 12.320 7.830 ( 0.000 -9.579 3.703) 10.270 8.615 ( -0.000 0.002 -4.197) 4.197 8.973 ( -0.000 7.545 1.310) 7.658 9.340 ( -0.000 -2.480 -3.252) 4.089 9.650 ( 0.000 -3.158 0.737) 3.243 9.773 ( -0.000 -9.343 -4.142) 10.220 10.055 ( 0.000 -3.327 8.479) 9.108 10.643 ( -0.000 2.570 -4.565) 5.239 11.373 ( -0.000 10.258 1.206) 10.329 12.198 ( 0.000 -3.224 0.837) 3.330 14.102 ( -0.000 -2.710 -1.874) 3.295 14.726 ( 0.000 -4.401 1.899) 4.793======================= Grid point 727 (235/344) =======================q-point: ( 0.20 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 344Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.641 ( 0.000 -0.000 30.929) 30.929 0.641 ( 0.000 -0.000 30.929) 30.929 1.199 ( 0.000 -0.000 59.985) 59.985 2.342 ( -0.000 0.000 -17.115) 17.115 2.342 ( -0.000 0.000 -17.115) 17.115 3.093 ( 0.000 -0.000 8.624) 8.624 3.093 ( 0.000 -0.000 8.624) 8.624 4.094 ( -0.000 0.000 -20.970) 20.970 4.097 ( -0.000 0.000 -1.505) 1.505 4.097 ( -0.000 0.000 -1.505) 1.505 4.451 ( -0.000 0.000 -7.026) 7.026 7.013 ( 0.000 -0.000 6.108) 6.108 8.883 ( 0.000 0.000 0.078) 0.078 8.883 ( 0.000 -0.000 0.078) 0.078 9.224 ( 0.000 0.000 0.078) 0.078 9.224 ( 0.000 -0.000 0.078) 0.078 9.424 ( 0.000 -0.000 4.109) 4.109 9.834 ( -0.000 0.000 -4.014) 4.014 10.034 ( 0.000 -0.000 1.650) 1.650 10.034 ( 0.000 -0.000 1.650) 1.650 11.882 ( -0.000 0.000 -1.282) 1.282 11.882 ( -0.000 -0.000 -1.282) 1.282 13.676 ( 0.000 -0.000 0.005) 0.005 16.959 ( 0.000 -0.000 0.108) 0.108======================= Grid point 728 (236/344) =======================q-point: ( 0.27 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.967 ( 18.285 10.557 22.473) 30.836 1.017 ( 20.950 12.096 23.071) 33.429 1.734 ( 31.118 17.966 40.444) 54.100 2.384 ( 5.931 3.424 -17.934) 19.197 2.400 ( 8.643 4.990 -16.384) 19.184 3.088 ( -1.251 -0.722 8.832) 8.949 3.283 ( 11.226 6.481 6.029) 14.296 3.962 ( -0.992 -0.573 -15.660) 15.702 4.110 ( 1.408 0.813 -1.376) 2.130 4.227 ( 2.797 1.615 -1.002) 3.381 4.518 ( 11.076 6.395 -12.107) 17.611 6.988 ( -3.660 -2.113 6.048) 7.378 7.951 ( -31.109 -17.961 31.703) 47.910 8.916 ( 2.347 1.355 0.018) 2.710 9.083 ( -4.208 -2.430 -9.934) 11.059 9.233 ( 1.119 0.646 0.220) 1.311 9.370 ( -6.285 -3.629 4.849) 8.728 9.839 ( 5.385 3.109 -8.456) 10.496 9.977 ( -4.536 -2.619 1.729) 5.516 11.091 ( 23.670 13.666 -19.760) 33.726 11.907 ( 1.923 1.110 -1.393) 2.622 11.919 ( 7.048 4.069 -8.622) 11.857 13.798 ( 10.149 5.859 0.116) 11.719 15.551 ( -69.976 -40.401 58.654) 99.846======================= Grid point 729 (237/344) =======================q-point: ( 0.33 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.462 ( 19.444 11.226 15.318) 27.180 1.571 ( 22.384 12.923 16.039) 30.418 2.524 ( 9.350 5.398 -18.085) 21.062 2.526 ( 20.861 12.044 -5.660) 24.744 2.701 ( 26.981 15.578 11.687) 33.275 3.077 ( -1.365 -0.788 9.143) 9.278 3.569 ( 12.150 7.015 6.451) 15.442 3.991 ( 4.934 2.849 -9.890) 11.413 4.160 ( 3.154 1.821 -0.931) 3.759 4.215 ( -0.222 -0.128 -3.571) 3.580 4.925 ( 23.697 13.681 -9.752) 29.049 6.861 ( -8.190 -4.729 3.809) 10.195 7.641 ( -4.999 -2.886 12.192) 13.489 8.902 ( -8.690 -5.017 -5.875) 11.627 8.987 ( 3.684 2.127 -0.694) 4.310 9.273 ( 2.029 1.171 1.160) 2.614 9.300 ( -0.864 -0.499 5.666) 5.753 9.844 ( -7.089 -4.093 2.013) 8.430 9.944 ( 5.235 3.023 -9.433) 11.204 11.128 ( -8.711 -5.029 1.970) 10.249 11.960 ( 2.853 1.647 -1.816) 3.762 11.986 ( -2.675 -1.544 -12.493) 12.869 14.083 ( 11.893 6.867 -0.211) 13.735 14.572 ( -26.262 -15.163 34.281) 45.769======================= Grid point 730 (238/344) =======================q-point: ( 0.40 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.887 ( 14.230 8.216 9.539) 19.000 2.092 ( 19.613 11.323 9.483) 24.552 2.730 ( 11.685 6.746 -15.242) 20.356 2.805 ( 11.533 6.659 -12.626) 18.351 3.071 ( -0.703 -0.406 8.668) 8.706 3.396 ( 21.200 12.240 6.303) 25.278 3.889 ( 12.682 7.322 7.394) 16.405 4.076 ( 7.013 4.049 0.541) 8.116 4.252 ( 4.846 2.798 -0.391) 5.610 4.350 ( 13.305 7.682 -5.571) 16.342 5.483 ( 24.520 14.157 -6.314) 29.009 6.650 ( -9.482 -5.474 0.603) 10.965 7.650 ( 3.039 1.755 2.240) 4.163 8.711 ( -6.893 -3.980 1.115) 8.037 9.074 ( 3.877 2.238 -2.297) 5.031 9.320 ( 1.049 0.606 3.922) 4.105 9.334 ( 2.855 1.649 3.309) 4.671 9.682 ( -6.445 -3.721 1.278) 7.551 10.041 ( 5.068 2.926 -8.896) 10.648 10.896 ( -10.780 -6.224 8.058) 14.828 11.796 ( -9.823 -5.671 -7.059) 13.360 12.026 ( 3.232 1.866 -2.153) 4.309 14.136 ( -5.370 -3.100 7.320) 9.593 14.474 ( 7.944 4.586 5.397) 10.643======================= Grid point 731 (239/344) =======================q-point: ( 0.47 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.149 ( 7.423 4.286 3.645) 9.314 2.481 ( 12.221 7.056 2.802) 14.387 2.978 ( 10.154 5.862 -5.255) 12.849 3.069 ( 13.715 7.919 -4.826) 16.556 3.096 ( 2.919 1.685 2.891) 4.441 3.629 ( 1.773 1.023 -2.595) 3.305 4.082 ( 7.415 4.281 7.833) 11.604 4.375 ( 5.620 3.244 0.068) 6.489 4.406 ( 13.766 7.948 -6.619) 17.219 4.786 ( 22.831 13.181 6.191) 27.080 5.919 ( 10.852 6.265 -3.674) 13.058 6.525 ( 2.154 1.244 0.334) 2.510 7.759 ( 5.960 3.441 -1.399) 7.023 8.590 ( -4.245 -2.451 3.975) 6.310 9.125 ( -0.158 -0.091 -4.023) 4.027 9.319 ( -1.480 -0.854 8.033) 8.213 9.448 ( 6.446 3.721 1.125) 7.527 9.601 ( -0.070 -0.041 -1.170) 1.173 10.146 ( 5.658 3.266 -6.983) 9.563 10.701 ( -7.426 -4.287 7.869) 11.638 11.553 ( -9.740 -5.624 -4.035) 11.949 12.097 ( 3.242 1.872 -2.084) 4.284 14.075 ( -0.944 -0.545 3.169) 3.352 14.663 ( 6.723 3.881 0.911) 7.816======================= Grid point 732 (240/344) =======================q-point: ( 0.53 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.270 ( 3.255 1.879 0.431) 3.783 2.673 ( 4.940 2.852 -0.857) 5.768 3.076 ( 0.709 0.409 7.578) 7.622 3.290 ( 11.036 6.371 -7.646) 14.861 3.409 ( 15.269 8.816 0.507) 17.639 3.602 ( -2.219 -1.281 -1.670) 3.059 4.286 ( 8.158 4.710 6.055) 11.198 4.501 ( 5.064 2.924 0.470) 5.866 4.625 ( 7.434 4.292 -7.836) 11.623 5.225 ( 9.708 5.605 5.272) 12.388 6.024 ( 5.376 3.104 -0.678) 6.245 6.747 ( 12.109 6.991 3.207) 14.346 7.909 ( 7.207 4.161 -2.588) 8.715 8.529 ( -1.716 -0.991 3.138) 3.711 9.024 ( -6.737 -3.890 -0.671) 7.809 9.344 ( 2.014 1.163 3.945) 4.580 9.622 ( 8.159 4.710 -1.104) 9.485 9.641 ( 2.840 1.640 -1.092) 3.457 10.272 ( 6.190 3.574 -3.710) 8.052 10.585 ( -3.953 -2.282 5.439) 7.101 11.332 ( -8.904 -5.141 -2.259) 10.527 12.165 ( 2.929 1.691 -1.560) 3.724 14.089 ( 1.376 0.795 1.543) 2.215 14.782 ( 3.728 2.152 -0.628) 4.350======================= Grid point 733 (241/344) =======================q-point: ( 0.60 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.321 ( 1.427 0.824 -0.481) 1.716 2.739 ( 1.533 0.885 -1.563) 2.361 3.099 ( -0.007 -0.004 6.682) 6.682 3.495 ( 7.683 4.436 -6.453) 10.970 3.542 ( -1.962 -1.133 -0.929) 2.449 3.741 ( 11.814 6.821 2.332) 13.840 4.471 ( 6.918 3.994 3.170) 8.594 4.602 ( 3.414 1.971 0.830) 4.029 4.742 ( 4.397 2.539 -4.387) 6.710 5.226 ( -7.132 -4.117 2.281) 8.545 6.269 ( 13.000 7.505 1.278) 15.065 6.974 ( 5.698 3.290 7.307) 9.832 8.065 ( 6.495 3.750 -3.698) 8.362 8.520 ( 0.355 0.205 1.296) 1.359 8.868 ( -6.056 -3.497 0.057) 6.993 9.399 ( 1.888 1.090 1.621) 2.717 9.703 ( 2.397 1.384 -0.508) 2.814 9.795 ( 6.828 3.942 -3.092) 8.469 10.383 ( 2.063 1.191 2.329) 3.331 10.563 ( 2.640 1.524 0.476) 3.086 11.129 ( -8.304 -4.794 -1.287) 9.674 12.223 ( 2.238 1.292 -0.804) 2.707 14.132 ( 1.810 1.045 1.356) 2.491 14.838 ( 1.488 0.859 -1.679) 2.402======================= Grid point 734 (242/344) =======================q-point: ( 0.67 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.342 ( 0.625 0.361 -0.611) 0.946 2.757 ( 0.729 0.421 -1.622) 1.828 3.102 ( -0.998 -0.576 5.810) 5.923 3.508 ( -0.749 -0.432 -0.135) 0.875 3.608 ( 3.220 1.859 -5.868) 6.946 3.935 ( 4.001 2.310 1.744) 4.938 4.608 ( 3.550 2.050 0.995) 4.219 4.657 ( 1.124 0.649 1.051) 1.671 4.838 ( 5.179 2.990 -0.783) 6.031 5.027 ( -8.658 -4.999 1.680) 10.138 6.521 ( 7.317 4.225 0.486) 8.463 7.036 ( -1.660 -0.959 10.338) 10.515 8.169 ( 2.810 1.622 -4.558) 5.594 8.543 ( 1.294 0.747 0.471) 1.566 8.763 ( -2.706 -1.562 -0.373) 3.147 9.431 ( 0.590 0.340 0.871) 1.105 9.742 ( 0.963 0.556 -0.211) 1.132 9.912 ( 3.858 2.227 -4.394) 6.257 10.371 ( -2.724 -1.573 5.005) 5.911 10.691 ( 6.230 3.597 -1.358) 7.321 10.953 ( -5.788 -3.342 -0.780) 6.729 12.261 ( 1.152 0.665 -0.167) 1.340 14.169 ( 0.914 0.528 1.583) 1.902 14.850 ( 0.079 0.045 -2.437) 2.438======================= Grid point 735 (243/344) =======================q-point: (-0.27 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.349 ( 0.130 0.075 -0.517) 0.538 2.774 ( 1.035 0.598 -1.123) 1.640 3.074 ( -2.570 -1.484 4.984) 5.800 3.510 ( 0.997 0.575 0.288) 1.186 3.619 ( -1.085 -0.626 -5.310) 5.456 3.922 ( -5.267 -3.041 0.774) 6.131 4.573 ( -6.618 -3.821 0.395) 7.652 4.657 ( -1.373 -0.793 1.030) 1.891 4.874 ( -2.465 -1.423 0.987) 3.013 5.030 ( 8.884 5.129 0.640) 10.279 6.561 ( -4.749 -2.742 0.413) 5.499 6.979 ( -4.382 -2.530 10.273) 11.451 8.159 ( -2.810 -1.623 -4.730) 5.736 8.576 ( 1.247 0.720 1.209) 1.880 8.748 ( 1.563 0.903 -0.666) 1.924 9.429 ( -0.982 -0.567 0.789) 1.381 9.744 ( -0.712 -0.411 -0.149) 0.836 9.953 ( 0.594 0.343 -4.699) 4.749 10.296 ( -4.834 -2.791 4.202) 6.987 10.705 ( -4.040 -2.333 -0.718) 4.720 10.976 ( 7.219 4.168 -0.359) 8.344 12.273 ( -0.214 -0.124 0.062) 0.255 14.176 ( -0.643 -0.371 1.788) 1.936 14.835 ( -0.860 -0.497 -2.817) 2.987======================= Grid point 736 (244/344) =======================q-point: (-0.20 0.20 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.343 ( -0.690 -0.398 -0.121) 0.806 2.793 ( 0.341 0.197 0.133) 0.416 3.001 ( -4.714 -2.721 3.440) 6.439 3.543 ( -4.255 -2.457 -4.066) 6.378 3.554 ( 2.589 1.495 0.436) 3.021 3.712 ( -12.242 -7.068 -0.248) 14.138 4.378 ( -9.385 -5.418 0.742) 10.862 4.600 ( -3.669 -2.119 0.766) 4.306 4.827 ( -2.430 -1.403 -1.203) 3.053 5.230 ( 6.307 3.641 1.396) 7.415 6.324 ( -14.016 -8.092 2.071) 16.317 6.884 ( -6.162 -3.558 6.544) 9.667 8.027 ( -7.336 -4.236 -4.345) 9.521 8.602 ( 0.562 0.325 2.845) 2.918 8.829 ( 5.353 3.090 -0.671) 6.217 9.392 ( -2.289 -1.322 1.332) 2.960 9.710 ( -2.145 -1.239 -0.300) 2.495 9.913 ( -3.657 -2.111 -2.013) 4.678 10.169 ( -5.881 -3.395 -0.568) 6.815 10.631 ( -1.671 -0.965 1.462) 2.421 11.169 ( 8.865 5.118 -0.418) 10.245 12.251 ( -1.620 -0.935 -0.207) 1.882 14.149 ( -1.922 -1.110 1.818) 2.869 14.797 ( -2.001 -1.155 -2.673) 3.533======================= Grid point 743 (245/344) =======================q-point: ( 0.27 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.000 ( 0.000 20.051 23.731) 31.068 1.081 ( 0.000 23.318 23.755) 33.287 1.847 ( 0.000 35.389 41.926) 54.865 2.293 ( -0.000 3.744 -17.963) 18.349 2.406 ( -0.000 11.902 -17.814) 21.424 3.147 ( 0.000 0.963 7.583) 7.644 3.247 ( 0.000 9.988 7.437) 12.452 3.902 ( -0.000 -3.117 -17.793) 18.064 4.104 ( -0.000 1.448 -1.454) 2.052 4.240 ( -0.000 4.840 -1.163) 4.978 4.488 ( -0.000 12.205 -12.509) 17.476 7.003 ( 0.000 -4.112 6.412) 7.617 8.002 ( 0.000 -40.125 30.367) 50.320 8.893 ( -0.000 1.503 -0.110) 1.507 9.017 ( -0.000 -7.948 -9.289) 12.226 9.251 ( -0.000 2.229 0.294) 2.248 9.418 ( 0.000 -1.177 3.731) 3.913 9.801 ( -0.000 2.581 -7.980) 8.387 10.004 ( 0.000 -4.279 1.951) 4.702 11.156 ( -0.000 44.653 -23.368) 50.398 11.809 ( 0.000 -8.624 -0.163) 8.625 11.888 ( -0.000 1.564 -1.555) 2.205 13.792 ( -0.000 10.636 0.332) 10.641 15.702 ( 0.000 -75.900 49.353) 90.534======================= Grid point 744 (246/344) =======================q-point: ( 0.33 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.397 ( 12.748 21.198 18.239) 30.734 1.477 ( 11.637 22.267 18.808) 31.384 2.350 ( 8.620 10.508 -10.867) 17.401 2.463 ( 10.705 22.884 -2.948) 25.436 2.569 ( 11.174 20.439 6.682) 24.233 3.151 ( -2.273 2.881 7.674) 8.507 3.465 ( 9.246 9.006 6.687) 14.537 3.890 ( 4.560 1.666 -14.490) 15.282 4.142 ( 2.161 2.987 -1.238) 3.889 4.229 ( -2.184 -1.003 -2.674) 3.595 4.755 ( 12.857 21.936 -10.976) 27.694 6.922 ( -4.511 -7.301 5.161) 10.014 7.691 ( -5.189 -13.985 16.199) 22.021 8.896 ( -2.117 -8.557 -6.639) 11.035 8.951 ( 3.571 2.198 -0.521) 4.225 9.282 ( 0.595 3.289 0.719) 3.419 9.382 ( -5.049 2.180 6.374) 8.418 9.794 ( 0.807 -2.932 -8.174) 8.721 9.973 ( 0.076 -0.385 0.333) 0.515 11.304 ( -11.931 7.837 -4.373) 14.929 11.727 ( 4.222 -14.000 -4.024) 15.166 12.025 ( 7.615 6.162 -6.757) 11.900 13.991 ( 8.540 11.686 0.546) 14.484 14.898 ( -25.429 -36.592 37.014) 57.928======================= Grid point 745 (247/344) =======================q-point: ( 0.40 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.852 ( 10.518 19.703 12.540) 25.614 1.957 ( 14.999 18.264 12.700) 26.830 2.577 ( 12.229 8.515 -15.077) 21.199 2.679 ( 7.065 10.161 -16.744) 20.821 3.151 ( 0.820 7.198 8.623) 11.263 3.234 ( 15.541 21.770 13.114) 29.789 3.748 ( 12.308 7.889 6.277) 15.910 4.009 ( 6.585 3.482 -3.199) 8.107 4.217 ( 3.510 3.764 -5.393) 7.454 4.237 ( 4.888 6.208 -2.416) 8.262 5.254 ( 19.848 22.024 -7.425) 30.563 6.733 ( -7.950 -9.243 1.881) 12.336 7.614 ( 1.576 -2.424 4.662) 5.485 8.755 ( -3.965 -6.105 -0.883) 7.333 9.049 ( 3.611 4.481 -1.233) 5.886 9.331 ( 0.404 1.588 4.144) 4.456 9.355 ( -1.612 4.713 3.338) 5.997 9.731 ( -2.265 -4.242 -2.835) 5.582 10.000 ( 1.662 3.081 -4.982) 6.089 11.062 ( -14.259 -5.312 6.749) 16.646 11.622 ( 3.438 -18.542 -6.399) 19.914 12.135 ( -0.497 7.829 -4.505) 9.046 14.235 ( 1.817 7.513 1.207) 7.823 14.420 ( -5.474 -10.172 16.051) 19.776======================= Grid point 746 (248/344) =======================q-point: ( 0.47 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.175 ( 3.782 15.640 5.781) 17.098 2.374 ( 11.819 12.428 5.984) 18.165 2.867 ( 10.610 12.616 -12.042) 20.414 2.899 ( 12.505 8.370 -6.509) 16.395 3.196 ( -3.036 9.287 5.990) 11.460 3.588 ( 5.130 5.089 -0.216) 7.229 3.986 ( 8.029 0.590 6.416) 10.295 4.234 ( 12.405 8.874 -2.805) 15.508 4.350 ( 4.492 6.806 -0.922) 8.207 4.561 ( 20.029 15.865 2.781) 25.702 5.777 ( 16.729 16.843 -4.304) 24.126 6.521 ( -4.625 -7.029 0.035) 8.414 7.679 ( 5.312 1.384 -0.266) 5.495 8.640 ( -4.021 -3.865 3.578) 6.626 9.142 ( 1.088 5.645 -2.906) 6.442 9.377 ( 2.002 2.412 4.564) 5.537 9.408 ( 0.329 4.685 2.907) 5.523 9.639 ( -4.073 -0.062 -0.508) 4.105 10.067 ( 4.449 2.578 -6.923) 8.623 10.801 ( -9.436 -7.535 8.315) 14.662 11.457 ( 1.009 -18.695 -5.279) 19.452 12.189 ( -2.340 10.442 -2.284) 10.942 14.149 ( -6.490 1.033 4.454) 7.939 14.544 ( 9.764 0.974 1.619) 9.945======================= Grid point 747 (249/344) =======================q-point: ( 0.53 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.340 ( -1.308 12.917 1.394) 13.057 2.619 ( 5.635 5.499 0.505) 7.890 3.150 ( 11.571 10.244 -7.049) 16.986 3.156 ( 1.457 9.765 5.398) 11.252 3.330 ( 6.867 15.309 -0.480) 16.786 3.615 ( -1.206 -0.855 -2.004) 2.491 4.166 ( 9.795 1.111 6.564) 11.843 4.476 ( 7.006 5.672 -2.519) 9.359 4.503 ( 7.031 5.669 -5.455) 10.551 5.089 ( 17.415 13.462 6.361) 22.913 6.017 ( 0.202 5.213 -1.536) 5.438 6.576 ( 13.205 3.040 1.334) 13.616 7.809 ( 7.185 2.803 -1.684) 7.894 8.555 ( -2.642 -3.002 3.831) 5.538 9.154 ( -6.138 4.896 -3.083) 8.435 9.387 ( -3.174 3.810 6.293) 8.012 9.535 ( 7.143 4.444 -0.438) 8.424 9.633 ( 0.929 3.894 -0.607) 4.049 10.176 ( 6.822 2.370 -5.517) 9.088 10.628 ( -4.672 -6.551 6.634) 10.428 11.274 ( -0.277 -17.024 -3.221) 17.328 12.255 ( -2.730 12.095 -1.456) 12.485 14.103 ( -1.705 1.584 1.955) 3.039 14.691 ( 7.043 -1.061 -0.345) 7.131======================= Grid point 748 (250/344) =======================q-point: ( 0.60 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.416 ( -4.067 12.053 0.015) 12.720 2.712 ( 1.961 1.532 -0.866) 2.635 3.227 ( -4.825 11.459 5.424) 13.565 3.402 ( 7.881 6.687 -5.903) 11.903 3.555 ( 0.668 0.752 -0.571) 1.157 3.666 ( 7.700 13.388 1.160) 15.488 4.358 ( 9.479 1.208 4.329) 10.491 4.608 ( 2.438 6.219 0.212) 6.683 4.653 ( 6.848 1.865 -6.176) 9.408 5.315 ( -2.632 2.604 3.800) 5.305 6.139 ( 9.610 7.343 1.201) 12.154 6.857 ( 12.131 1.839 4.836) 13.188 7.964 ( 7.495 2.935 -2.184) 8.341 8.508 ( -0.231 -2.445 1.294) 2.776 9.034 ( -11.089 4.924 -0.244) 12.136 9.416 ( -0.206 4.245 2.762) 5.069 9.675 ( 3.595 2.691 -1.469) 4.725 9.731 ( 5.042 6.004 -1.202) 7.932 10.319 ( 7.220 2.440 -2.262) 7.950 10.532 ( -0.650 -5.279 3.927) 6.611 11.094 ( -1.171 -15.348 -1.704) 15.487 12.324 ( -3.687 13.087 -0.842) 13.623 14.114 ( 0.964 0.645 1.461) 1.865 14.769 ( 4.701 -2.977 -1.527) 5.770======================= Grid point 749 (251/344) =======================q-point: ( 0.67 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.450 ( -5.511 11.731 -0.270) 12.964 2.735 ( 0.640 -0.084 -1.170) 1.336 3.257 ( -6.680 12.271 4.102) 14.561 3.471 ( 1.596 -3.220 -1.721) 3.985 3.625 ( 1.274 8.915 -4.128) 9.906 3.901 ( 4.647 7.437 2.739) 9.187 4.535 ( 7.579 2.422 1.870) 8.173 4.686 ( 0.263 4.468 -0.247) 4.482 4.760 ( 5.734 1.069 -2.314) 6.275 5.183 ( -11.611 0.021 2.970) 11.985 6.408 ( 10.784 5.124 1.367) 12.017 7.013 ( 4.707 -2.994 8.500) 10.167 8.098 ( 5.370 1.359 -2.776) 6.196 8.500 ( 1.822 -2.259 -1.378) 3.213 8.910 ( -9.479 7.061 0.759) 11.844 9.455 ( -0.655 3.718 1.294) 3.991 9.734 ( 1.244 1.858 -0.393) 2.270 9.864 ( 4.183 4.216 -3.607) 6.949 10.393 ( -0.467 -1.600 3.901) 4.242 10.572 ( 8.908 -0.467 -1.194) 9.000 10.918 ( -1.768 -14.049 -1.019) 14.196 12.380 ( -5.127 13.284 -0.311) 14.242 14.145 ( 1.853 -0.613 1.652) 2.557 14.794 ( 3.166 -4.297 -2.359) 5.835======================= Grid point 750 (252/344) =======================q-point: (-0.27 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.462 ( -6.225 11.223 -0.356) 12.839 2.742 ( 0.978 -0.454 -1.061) 1.512 3.257 ( -8.501 12.172 3.239) 15.196 3.467 ( 2.115 -2.614 -0.387) 3.385 3.687 ( -3.031 7.771 -4.856) 9.651 3.967 ( -2.100 0.120 2.640) 3.376 4.615 ( -1.098 -1.700 0.423) 2.067 4.706 ( -1.460 2.258 -0.460) 2.728 4.881 ( 4.194 0.568 -0.006) 4.232 5.025 ( -5.616 6.045 2.999) 8.779 6.558 ( 2.719 -0.910 0.319) 2.885 7.011 ( -1.224 -6.263 10.717) 12.473 8.145 ( 0.776 -1.871 -3.257) 3.835 8.514 ( 2.802 -2.427 -2.163) 4.292 8.865 ( -5.841 10.372 1.023) 11.947 9.469 ( -1.930 2.948 0.930) 3.644 9.755 ( -0.328 0.792 -0.185) 0.877 9.936 ( 1.509 2.121 -4.811) 5.470 10.345 ( -2.966 -3.097 4.856) 6.479 10.707 ( 0.296 -3.187 -1.521) 3.543 10.795 ( 9.184 -9.138 -0.540) 12.967 12.407 ( -6.697 12.578 -0.058) 14.250 14.166 ( 1.184 -1.473 1.892) 2.674 14.788 ( 2.280 -5.038 -2.808) 6.202======================= Grid point 751 (253/344) =======================q-point: (-0.20 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.458 ( -6.570 10.257 -0.374) 12.187 2.756 ( 1.376 -0.833 -0.449) 1.670 3.217 ( -10.813 11.678 2.589) 16.124 3.496 ( 3.460 -1.179 -0.367) 3.674 3.655 ( -6.963 5.727 -4.031) 9.875 3.847 ( -9.684 -4.254 1.865) 10.741 4.479 ( -8.493 -5.606 1.048) 10.230 4.680 ( -4.076 1.802 -0.072) 4.457 4.840 ( -2.469 -2.825 -0.684) 3.814 5.178 ( 6.224 9.442 2.028) 11.489 6.458 ( -9.218 -7.394 0.919) 11.852 6.926 ( -3.014 -7.214 9.296) 12.146 8.071 ( -4.266 -4.824 -3.361) 7.264 8.536 ( 3.177 -2.986 -0.809) 4.434 8.917 ( -2.615 13.588 0.895) 13.866 9.452 ( -3.392 2.476 1.239) 4.378 9.738 ( -1.900 -0.127 -0.326) 1.932 9.939 ( -1.299 0.382 -4.991) 5.171 10.241 ( -6.167 -4.415 3.865) 8.513 10.607 ( -0.138 -7.381 -0.333) 7.390 10.965 ( 13.231 -3.795 -0.614) 13.778 12.397 ( -8.052 11.111 -0.196) 13.723 14.163 ( -0.334 -1.380 1.906) 2.376 14.762 ( 1.454 -5.459 -2.733) 6.275======================= Grid point 759 (254/344) =======================q-point: ( 0.33 0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.541 ( 0.000 23.122 18.495) 29.609 1.675 ( 0.000 25.990 18.107) 31.675 2.315 ( -0.000 5.995 -16.906) 17.938 2.567 ( -0.000 15.092 -20.575) 25.517 2.816 ( 0.000 39.069 26.497) 47.207 3.201 ( 0.000 1.577 4.931) 5.177 3.518 ( 0.000 12.998 8.561) 15.564 3.847 ( -0.000 5.333 -13.662) 14.667 4.147 ( -0.000 3.505 -0.904) 3.619 4.233 ( -0.000 -0.793 -4.332) 4.404 4.877 ( -0.000 28.167 -9.674) 29.781 6.886 ( 0.000 -10.262 4.509) 11.209 7.623 ( 0.000 -11.420 12.230) 16.733 8.820 ( -0.000 -7.090 -4.136) 8.208 8.938 ( -0.000 2.899 -0.132) 2.902 9.314 ( -0.000 3.856 0.578) 3.899 9.482 ( 0.000 4.661 6.587) 8.069 9.780 ( -0.000 -0.534 -10.393) 10.407 9.887 ( 0.000 -8.111 1.861) 8.322 11.537 ( 0.000 -17.763 4.944) 18.439 11.567 ( -0.000 9.697 -13.656) 16.749 11.929 ( -0.000 3.127 -1.675) 3.547 14.034 ( -0.000 10.842 2.181) 11.059 14.813 ( 0.000 -32.612 25.827) 41.600======================= Grid point 760 (255/344) =======================q-point: ( 0.40 0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.900 ( 9.656 20.129 15.147) 26.978 2.026 ( 6.004 24.313 13.563) 28.480 2.430 ( 9.524 8.301 -14.108) 18.938 2.676 ( 2.410 11.818 -19.041) 22.539 3.228 ( 1.473 8.832 6.403) 11.008 3.320 ( 6.813 23.817 12.686) 27.832 3.699 ( 4.298 10.317 7.097) 13.239 3.956 ( 5.206 12.268 -4.401) 14.035 4.211 ( 1.149 4.581 -4.924) 6.823 4.230 ( 2.295 4.853 -2.143) 5.780 5.235 ( 9.495 28.447 -7.220) 30.847 6.740 ( -4.464 -11.800 2.078) 12.786 7.574 ( 0.885 -2.901 5.605) 6.372 8.743 ( -1.481 -4.577 -0.548) 4.842 9.012 ( 4.500 3.578 -0.281) 5.756 9.361 ( 0.251 3.896 1.764) 4.284 9.485 ( -6.138 4.227 6.327) 9.776 9.701 ( -0.580 -1.443 -8.587) 8.727 9.922 ( 7.208 -4.640 -0.402) 8.582 11.287 ( -12.528 -14.253 7.397) 20.367 11.446 ( -6.091 -4.585 -8.918) 11.732 12.100 ( 9.341 3.944 -3.279) 10.657 14.194 ( 7.355 5.235 3.303) 9.613 14.518 ( -10.327 -11.466 12.075) 19.594======================= Grid point 761 (256/344) =======================q-point: ( 0.47 0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.265 ( 7.734 15.190 7.841) 18.762 2.372 ( 6.525 16.913 6.007) 19.098 2.757 ( 15.800 15.555 -5.360) 22.810 2.818 ( 5.763 11.176 -13.973) 18.798 3.333 ( 1.083 8.646 3.845) 9.524 3.593 ( 2.334 8.137 1.773) 8.649 3.874 ( 6.229 3.321 5.206) 8.771 4.173 ( 4.614 9.449 -1.730) 10.657 4.336 ( 4.704 8.842 -1.740) 10.165 4.461 ( 13.260 20.549 2.465) 24.580 5.699 ( 13.936 24.049 -4.384) 28.139 6.530 ( -6.231 -10.423 0.084) 12.144 7.617 ( 3.495 1.722 1.639) 4.226 8.668 ( -2.953 -3.582 2.658) 5.350 9.147 ( 5.420 5.540 -1.071) 7.824 9.375 ( -1.093 1.370 3.180) 3.631 9.485 ( -0.435 6.542 1.159) 6.658 9.691 ( -0.832 2.019 -3.505) 4.130 9.993 ( 5.160 -2.097 -1.701) 5.824 10.931 ( -13.548 -11.337 6.976) 18.993 11.273 ( -2.588 -11.922 -6.177) 13.675 12.260 ( 4.382 6.547 -2.052) 8.141 14.290 ( -4.247 -5.256 5.628) 8.794 14.403 ( 4.447 6.009 0.793) 7.517======================= Grid point 762 (257/344) =======================q-point: ( 0.53 0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.500 ( 1.765 14.335 1.692) 14.542 2.600 ( 4.403 7.822 1.443) 9.091 3.048 ( 9.762 11.855 -6.147) 16.542 3.192 ( 12.390 19.598 -1.076) 23.211 3.455 ( -0.412 13.063 3.414) 13.508 3.629 ( -1.081 0.985 -1.469) 2.072 4.029 ( 7.895 1.469 5.707) 9.851 4.349 ( 8.207 5.448 -6.345) 11.717 4.491 ( 4.281 7.045 -0.468) 8.257 4.970 ( 16.310 20.773 5.410) 26.959 6.094 ( 3.784 15.563 -1.388) 16.076 6.393 ( 5.201 -5.162 0.090) 7.328 7.727 ( 5.525 3.761 0.297) 6.691 8.579 ( -3.398 -4.229 3.161) 6.278 9.269 ( 0.265 8.024 -2.236) 8.334 9.442 ( 5.722 3.232 -0.227) 6.576 9.537 ( -2.948 6.087 3.201) 7.482 9.686 ( -1.880 4.637 -0.213) 5.008 10.067 ( 5.961 -0.266 -3.500) 6.917 10.659 ( -7.189 -9.694 6.039) 13.495 11.095 ( -1.163 -14.570 -4.279) 15.230 12.391 ( 1.494 10.569 -1.119) 10.733 14.189 ( -5.162 1.094 1.849) 5.591 14.542 ( 7.285 -1.178 0.180) 7.381======================= Grid point 763 (258/344) =======================q-point: ( 0.60 0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.637 ( -3.033 15.442 0.171) 15.738 2.705 ( 1.627 3.443 0.040) 3.808 3.312 ( 8.305 8.370 -3.733) 12.368 3.455 ( -1.752 11.193 0.180) 11.331 3.574 ( -0.415 9.033 3.024) 9.535 3.723 ( 5.350 17.224 -0.792) 18.053 4.203 ( 9.892 0.504 4.566) 10.906 4.520 ( 8.176 2.427 -5.793) 10.310 4.618 ( 3.437 4.883 -0.511) 5.994 5.365 ( 6.446 11.907 4.220) 14.182 6.138 ( -1.677 7.221 0.694) 7.446 6.630 ( 15.685 0.888 2.339) 15.883 7.875 ( 6.442 4.422 0.299) 7.819 8.493 ( -1.744 -4.305 0.620) 4.686 9.288 ( -8.134 9.252 -1.986) 12.478 9.505 ( -3.623 5.196 4.401) 7.713 9.612 ( 6.435 3.856 -2.030) 7.772 9.742 ( 1.436 6.256 -0.179) 6.421 10.188 ( 8.496 0.755 -2.923) 9.016 10.501 ( -2.701 -8.114 4.401) 9.617 10.928 ( 0.084 -15.347 -2.477) 15.546 12.519 ( -1.081 14.320 -0.640) 14.375 14.137 ( -2.576 0.860 1.233) 2.983 14.625 ( 6.101 -4.934 -0.997) 7.909======================= Grid point 764 (259/344) =======================q-point: ( 0.67 0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.714 ( -6.386 16.435 0.107) 17.633 2.740 ( -0.371 2.016 -0.366) 2.082 3.396 ( 1.213 -4.124 -2.087) 4.779 3.523 ( -3.604 14.772 -1.117) 15.246 3.701 ( 0.511 13.563 1.610) 13.667 3.968 ( 1.403 14.631 1.269) 14.753 4.408 ( 10.658 2.808 2.723) 11.353 4.649 ( 6.262 0.277 -2.969) 6.936 4.703 ( 2.567 2.706 -1.259) 3.936 5.424 ( -9.512 7.686 3.486) 12.717 6.287 ( 8.558 6.052 1.256) 10.557 6.854 ( 10.639 -4.535 5.427) 12.775 8.023 ( 5.298 3.485 0.664) 6.376 8.442 ( 0.826 -3.608 -2.988) 4.756 9.194 ( -12.025 10.088 0.866) 15.720 9.528 ( -1.628 5.545 2.249) 6.201 9.723 ( 2.914 2.472 -1.341) 4.050 9.843 ( 3.048 5.625 -2.241) 6.779 10.351 ( 9.017 1.022 -0.894) 9.119 10.409 ( 0.508 -7.841 2.558) 8.264 10.779 ( 0.215 -14.259 -1.364) 14.326 12.629 ( -4.342 16.924 -0.349) 17.476 14.119 ( 0.039 -0.943 1.599) 1.857 14.655 ( 5.048 -7.414 -2.006) 9.191======================= Grid point 765 (260/344) =======================q-point: ( 0.73 0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.737 ( -4.807 7.632 -0.310) 9.025 2.755 ( -4.851 10.875 -0.137) 11.909 3.368 ( 1.994 -4.793 -1.479) 5.398 3.577 ( -7.322 15.490 -1.064) 17.167 3.827 ( -2.012 12.481 -0.778) 12.666 4.050 ( -3.807 6.010 3.091) 7.757 4.583 ( 4.307 1.214 0.356) 4.489 4.709 ( 1.849 -1.501 -0.505) 2.435 4.799 ( 5.632 3.449 -0.777) 6.650 5.302 ( -13.461 10.628 3.405) 17.486 6.467 ( 6.737 0.132 0.570) 6.762 6.929 ( 4.406 -9.009 8.026) 12.845 8.107 ( 1.592 0.207 0.681) 1.744 8.436 ( 2.744 -2.214 -5.140) 6.233 9.119 ( -9.247 12.333 1.904) 15.531 9.551 ( -2.359 5.094 1.278) 5.757 9.767 ( 0.401 1.384 -0.365) 1.486 9.927 ( 1.613 3.744 -4.047) 5.744 10.348 ( -0.199 -5.149 3.377) 6.161 10.514 ( 10.637 -6.619 -0.100) 12.529 10.649 ( -0.004 -8.798 -1.900) 9.001 12.697 ( -7.862 17.501 -0.214) 19.187 14.123 ( 1.685 -2.157 2.042) 3.415 14.650 ( 4.561 -8.810 -2.632) 10.264======================= Grid point 766 (261/344) =======================q-point: (-0.20 0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.724 ( -5.728 8.430 -0.708) 10.216 2.770 ( -4.911 8.967 0.255) 10.227 3.371 ( 3.337 -3.124 -1.796) 4.911 3.580 ( -9.141 14.108 -0.820) 16.830 3.861 ( -7.397 10.931 -2.336) 13.403 3.990 ( -8.121 1.490 4.706) 9.504 4.556 ( -5.226 -3.780 0.507) 6.469 4.716 ( 0.456 -0.619 -0.652) 1.008 4.854 ( -1.793 -2.678 -0.850) 3.333 5.285 ( -3.839 16.295 3.333) 17.070 6.487 ( -1.784 -5.885 -0.128) 6.151 6.883 ( 0.256 -10.923 9.238) 14.308 8.081 ( -2.624 -3.412 -0.091) 4.305 8.458 ( 2.779 -1.403 -4.304) 5.312 9.138 ( -5.156 15.391 1.644) 16.314 9.554 ( -3.425 4.919 1.341) 6.142 9.767 ( -1.241 0.397 -0.374) 1.355 9.951 ( -0.631 1.566 -5.066) 5.340 10.294 ( -2.700 -4.200 4.778) 6.911 10.475 ( 2.314 -14.179 -1.038) 14.404 10.715 ( 9.994 -2.405 -1.428) 10.378 12.702 ( -10.624 15.597 -0.257) 18.873 14.139 ( 1.715 -1.571 2.074) 3.116 14.631 ( 4.316 -9.219 -2.648) 10.518======================= Grid point 775 (262/344) =======================q-point: ( 0.40 0.40 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.034 ( 0.000 16.746 13.878) 21.749 2.254 ( 0.000 24.000 12.797) 27.199 2.395 ( -0.000 10.016 -11.435) 15.201 2.729 ( -0.000 11.267 -18.093) 21.314 3.249 ( 0.000 1.772 0.792) 1.941 3.519 ( -0.000 16.522 5.270) 17.342 3.805 ( 0.000 11.599 8.138) 14.169 4.097 ( -0.000 23.289 2.722) 23.447 4.238 ( -0.000 5.775 -0.168) 5.778 4.271 ( -0.000 11.178 -6.718) 13.042 5.436 ( -0.000 29.290 -5.825) 29.863 6.663 ( 0.000 -11.644 1.197) 11.706 7.563 ( 0.000 0.479 4.396) 4.422 8.721 ( 0.000 -2.339 0.566) 2.406 8.999 ( -0.000 2.938 0.163) 2.942 9.406 ( -0.000 4.841 0.985) 4.940 9.643 ( 0.000 7.532 8.949) 11.697 9.703 ( -0.000 -1.373 -12.095) 12.172 9.709 ( 0.000 -9.803 1.030) 9.857 11.182 ( 0.000 -17.414 2.238) 17.558 11.587 ( -0.000 -2.392 -4.161) 4.799 11.994 ( -0.000 4.055 -1.560) 4.345 14.157 ( 0.000 -1.067 4.783) 4.900 14.557 ( 0.000 -1.579 5.025) 5.267======================= Grid point 776 (263/344) =======================q-point: ( 0.47 0.40 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.258 ( 7.745 9.144 5.435) 13.158 2.478 ( 1.291 14.972 3.791) 15.498 2.660 ( 13.309 18.264 0.043) 22.599 2.838 ( 2.739 14.040 -11.431) 18.311 3.323 ( 5.952 3.269 -0.485) 6.808 3.621 ( 0.654 2.943 -1.305) 3.285 3.933 ( -0.992 11.256 8.491) 14.134 4.239 ( -1.053 9.587 -3.849) 10.385 4.352 ( 3.823 7.431 -1.439) 8.480 4.550 ( 6.052 31.245 4.424) 32.132 5.757 ( 6.676 23.820 -3.930) 25.048 6.529 ( -4.100 -7.337 0.240) 8.408 7.606 ( 1.509 3.794 2.702) 4.896 8.688 ( -2.080 -2.160 1.533) 3.368 9.079 ( 5.765 2.770 0.102) 6.397 9.443 ( -2.390 2.771 2.902) 4.670 9.546 ( -1.842 1.310 -2.138) 3.111 9.711 ( 1.049 2.811 -7.312) 7.903 9.831 ( 8.204 -1.342 5.655) 10.054 10.976 ( -5.797 -14.982 2.325) 16.232 11.363 ( -14.756 -3.937 -3.358) 15.637 12.167 ( 10.729 3.915 -1.439) 11.511 14.185 ( 4.415 -3.936 2.867) 6.573 14.536 ( -4.972 5.519 2.052) 7.707======================= Grid point 777 (264/344) =======================q-point: ( 0.53 0.40 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.509 ( 10.211 7.930 1.043) 12.971 2.625 ( 2.063 7.577 0.783) 7.892 3.021 ( 7.991 13.460 -6.067) 16.788 3.153 ( 14.127 21.963 2.455) 26.229 3.505 ( 7.906 7.259 0.117) 10.734 3.627 ( 1.008 -1.804 -1.196) 2.387 4.029 ( -1.287 8.807 6.132) 10.809 4.319 ( 1.510 8.151 -5.046) 9.704 4.493 ( 3.755 7.242 -0.745) 8.191 4.991 ( 9.278 25.852 4.209) 27.788 6.097 ( 11.675 12.190 -1.758) 16.971 6.396 ( -7.550 2.001 0.174) 7.812 7.701 ( 3.242 5.742 1.813) 6.839 8.604 ( -3.948 -4.348 1.710) 6.117 9.242 ( 8.812 3.778 -0.581) 9.605 9.438 ( -0.742 4.634 0.643) 4.737 9.603 ( 2.230 4.837 -1.170) 5.453 9.741 ( 1.039 1.862 -4.727) 5.186 9.955 ( 5.188 0.920 4.482) 6.917 10.712 ( -9.067 -11.204 3.089) 14.741 11.077 ( -10.648 -6.973 -3.708) 13.257 12.386 ( 8.765 6.663 -0.814) 11.040 14.216 ( 2.269 -3.181 0.346) 3.923 14.517 ( -3.310 4.397 1.598) 5.731======================= Grid point 778 (265/344) =======================q-point: ( 0.60 0.40 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.704 ( 2.319 3.946 -0.501) 4.604 2.763 ( 5.873 10.518 0.990) 12.087 3.264 ( 6.478 9.871 -2.960) 12.172 3.497 ( 2.523 4.805 -0.282) 5.434 3.702 ( 7.999 16.254 0.829) 18.134 3.767 ( 8.606 12.787 1.164) 15.458 4.106 ( 1.876 4.448 3.255) 5.822 4.429 ( 4.359 5.418 -3.982) 8.013 4.606 ( 2.488 4.407 -0.292) 5.069 5.376 ( 8.813 16.988 2.518) 19.303 6.282 ( -0.717 -0.184 0.622) 0.967 6.419 ( 6.178 11.071 0.632) 12.694 7.837 ( 4.659 6.627 1.822) 8.303 8.489 ( -3.430 -5.306 0.083) 6.318 9.423 ( 4.460 6.883 -0.855) 8.246 9.516 ( 4.076 5.202 -1.376) 6.750 9.662 ( -2.559 5.089 1.837) 5.985 9.764 ( 1.461 1.462 -2.685) 3.389 10.064 ( 5.249 2.488 1.305) 5.954 10.493 ( -5.176 -8.330 3.566) 10.435 10.838 ( -6.299 -9.828 -3.315) 12.135 12.602 ( 6.296 10.782 -0.394) 12.492 14.196 ( -1.959 -0.828 -0.245) 2.141 14.511 ( 0.599 -1.877 0.704) 2.092======================= Grid point 779 (266/344) =======================q-point: ( 0.67 0.40 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.759 ( 0.733 2.774 -0.084) 2.870 2.942 ( 0.123 13.856 0.438) 13.863 3.338 ( -0.060 -3.741 -1.370) 3.984 3.612 ( 4.501 9.907 -1.264) 10.954 3.916 ( -1.847 17.442 0.908) 17.563 4.098 ( 3.219 16.737 1.131) 17.081 4.244 ( 12.026 4.018 1.745) 12.799 4.552 ( 5.387 3.383 -2.735) 6.924 4.666 ( 2.235 0.143 -0.124) 2.243 5.616 ( 0.853 11.815 2.099) 12.031 6.290 ( -1.155 6.816 0.686) 6.947 6.617 ( 10.603 -3.435 2.681) 11.464 7.992 ( 4.608 6.488 2.659) 8.390 8.393 ( -1.148 -4.907 -2.924) 5.826 9.485 ( -7.477 10.417 -0.618) 12.837 9.625 ( -2.028 4.822 3.669) 6.390 9.670 ( 4.298 2.677 -1.332) 5.236 9.826 ( 4.446 1.303 -3.040) 5.541 10.188 ( 6.160 0.195 -0.054) 6.163 10.381 ( -1.347 -4.295 3.127) 5.481 10.652 ( -2.118 -11.169 -2.421) 11.623 12.811 ( 2.756 14.903 -0.221) 15.157 14.143 ( -3.004 -0.749 0.720) 3.179 14.495 ( 2.889 -7.369 -0.844) 7.960======================= Grid point 780 (267/344) =======================q-point: ( 0.73 0.40 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.789 ( -0.873 3.505 -0.243) 3.620 3.046 ( -5.101 15.453 0.470) 16.280 3.278 ( 0.745 -6.537 -0.906) 6.642 3.766 ( 0.557 10.948 -2.829) 11.321 4.027 ( -4.068 15.694 0.478) 16.220 4.196 ( -2.662 6.239 2.555) 7.248 4.510 ( 7.173 5.317 -0.030) 8.929 4.641 ( 2.626 -0.736 0.118) 2.730 4.749 ( 6.274 5.762 -0.742) 8.551 5.652 ( -10.412 13.079 2.384) 16.886 6.368 ( 4.044 1.393 0.016) 4.277 6.723 ( 8.816 -10.661 4.564) 14.568 8.110 ( 1.070 3.715 4.542) 5.964 8.351 ( 2.472 -2.917 -6.615) 7.640 9.418 ( -10.617 11.165 1.882) 15.522 9.644 ( -1.905 4.754 1.805) 5.430 9.756 ( 2.476 1.306 -0.853) 2.927 9.919 ( 4.345 2.467 -3.106) 5.883 10.219 ( 2.549 -8.467 -0.953) 8.894 10.392 ( 2.425 0.287 4.104) 4.775 10.539 ( 1.672 -8.498 -2.922) 9.140 12.978 ( -2.883 17.661 -0.263) 17.897 14.094 ( -0.875 -2.067 1.906) 2.944 14.463 ( 4.305 -10.656 -2.120) 11.687======================= Grid point 781 (268/344) =======================q-point: (-0.20 0.40 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.797 ( -2.304 3.770 -0.390) 4.435 3.079 ( -8.689 14.931 0.506) 17.283 3.252 ( 3.934 -5.811 -1.061) 7.097 3.824 ( -5.047 10.106 -3.685) 11.882 4.086 ( -5.182 9.802 -0.381) 11.094 4.176 ( -6.620 6.933 4.184) 10.459 4.573 ( 0.018 -1.736 -0.554) 1.822 4.671 ( 2.663 -2.211 0.489) 3.496 4.886 ( -1.555 5.808 -0.358) 6.024 5.599 ( -10.868 16.289 2.584) 19.751 6.416 ( 2.840 -5.055 -0.395) 5.811 6.732 ( 4.991 -13.367 6.102) 15.519 8.108 ( -2.976 -1.359 3.893) 5.085 8.385 ( 3.667 0.199 -6.589) 7.543 9.392 ( -6.637 13.439 2.102) 15.135 9.657 ( -2.158 4.458 1.091) 5.071 9.782 ( -0.025 0.302 -0.566) 0.642 9.983 ( -0.859 3.763 -3.079) 4.937 10.169 ( 5.594 -12.243 -1.287) 13.521 10.377 ( -1.963 -5.893 4.855) 7.884 10.559 ( 5.995 -1.686 -3.275) 7.036 13.044 ( -9.489 16.527 -0.347) 19.060 14.092 ( 2.180 -1.438 2.340) 3.507 14.429 ( 5.574 -11.785 -2.533) 13.280======================= Grid point 791 (269/344) =======================q-point: ( 0.47 0.47 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.249 ( -0.000 3.938 0.263) 3.947 2.635 ( -0.000 8.779 -1.681) 8.939 2.686 ( -0.000 17.961 4.895) 18.616 2.971 ( -0.000 20.447 -2.563) 20.607 3.275 ( -0.000 1.370 -3.356) 3.625 3.628 ( -0.000 -0.283 -2.155) 2.173 4.086 ( 0.000 11.724 8.970) 14.762 4.355 ( -0.000 10.374 -6.659) 12.327 4.369 ( -0.000 6.984 0.225) 6.988 4.842 ( -0.000 31.831 4.328) 32.124 5.891 ( -0.000 14.515 -2.985) 14.819 6.541 ( -0.000 3.218 0.341) 3.236 7.649 ( 0.000 5.982 2.812) 6.610 8.695 ( 0.000 -1.364 -0.037) 1.364 9.038 ( 0.000 0.039 0.938) 0.939 9.502 ( 0.000 0.306 4.719) 4.729 9.536 ( -0.000 -2.934 -3.920) 4.897 9.641 ( -0.000 0.864 -9.104) 9.145 9.861 ( 0.000 10.077 7.991) 12.861 10.893 ( 0.000 -11.799 -0.029) 11.799 11.475 ( 0.000 -6.964 -1.758) 7.183 12.073 ( -0.000 4.329 -1.248) 4.505 14.126 ( 0.000 -1.325 1.211) 1.795 14.637 ( -0.000 5.102 1.855) 5.428======================= Grid point 792 (270/344) =======================q-point: ( 0.53 0.47 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.371 ( 10.016 3.306 -0.609) 10.565 2.674 ( -0.376 4.675 -2.230) 5.194 2.982 ( 10.091 14.642 3.321) 18.090 3.217 ( 4.392 20.691 0.975) 21.175 3.372 ( 9.746 3.523 -2.959) 10.778 3.606 ( -0.502 -1.923 -1.330) 2.391 4.190 ( -2.701 10.176 6.904) 12.590 4.410 ( -1.644 9.780 -4.246) 10.788 4.495 ( 3.766 7.202 -1.300) 8.231 5.155 ( 2.761 23.088 2.427) 23.379 6.021 ( 4.763 4.709 -1.828) 6.943 6.596 ( -4.330 14.297 0.407) 14.944 7.734 ( 1.277 7.386 2.602) 7.934 8.636 ( -3.960 -3.580 -0.637) 5.376 9.103 ( 7.956 -1.103 0.532) 8.050 9.479 ( 1.466 -0.727 1.564) 2.264 9.576 ( 1.809 3.219 -3.017) 4.768 9.677 ( 3.348 1.816 -5.827) 6.962 9.989 ( 0.640 9.750 7.654) 12.412 10.740 ( -5.366 -9.170 -0.306) 10.629 11.244 ( -14.111 -6.637 -1.887) 15.708 12.243 ( 11.998 4.166 -0.810) 12.727 14.143 ( 2.225 -0.661 -0.340) 2.346 14.650 ( -4.360 4.369 1.999) 6.488======================= Grid point 793 (271/344) =======================q-point: ( 0.60 0.47 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.631 ( 13.555 4.590 0.380) 14.316 2.719 ( 2.546 2.593 -0.984) 3.764 3.260 ( 5.929 10.180 0.594) 11.795 3.483 ( 5.419 4.170 -2.117) 7.158 3.626 ( 9.482 5.204 -1.816) 10.968 3.678 ( 13.580 13.396 3.625) 19.417 4.235 ( -4.278 9.378 2.674) 10.649 4.471 ( -1.126 8.662 -2.459) 9.074 4.615 ( 2.522 5.096 -0.303) 5.694 5.407 ( 6.163 12.122 0.544) 13.609 6.154 ( 6.623 2.823 -0.663) 7.230 6.652 ( -7.499 15.738 0.446) 17.439 7.851 ( 2.757 7.992 2.381) 8.783 8.508 ( -4.819 -5.146 -0.666) 7.082 9.275 ( 12.236 -0.723 -0.503) 12.268 9.547 ( 3.412 3.914 0.644) 5.232 9.632 ( 3.322 0.775 -3.763) 5.079 9.750 ( 2.455 3.312 -1.708) 4.462 10.102 ( -0.302 9.218 5.477) 10.727 10.537 ( -7.890 -7.103 0.890) 10.654 10.928 ( -13.088 -6.724 -2.562) 14.935 12.515 ( 12.998 6.342 -0.345) 14.466 14.167 ( 1.664 -1.430 -1.451) 2.630 14.589 ( -6.662 2.093 2.162) 7.310======================= Grid point 794 (272/344) =======================q-point: ( 0.67 0.47 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.757 ( 2.287 1.861 0.207) 2.956 2.944 ( 11.826 7.129 0.161) 13.810 3.329 ( -2.305 -1.933 -0.108) 3.010 3.606 ( 6.422 7.975 -0.386) 10.247 3.923 ( 13.883 6.829 -0.080) 15.472 4.096 ( 14.983 12.528 1.323) 19.576 4.259 ( -3.988 12.022 -0.247) 12.669 4.538 ( 1.075 6.495 -0.861) 6.640 4.665 ( -0.773 1.947 -0.104) 2.097 5.632 ( 8.724 7.222 -0.122) 11.326 6.293 ( 5.888 2.281 0.384) 6.326 6.634 ( -8.932 8.673 0.245) 12.452 7.997 ( 4.032 8.023 2.170) 9.238 8.379 ( -3.689 -5.002 -1.197) 6.329 9.486 ( 12.277 -0.225 -0.666) 12.297 9.647 ( 0.957 6.611 -0.035) 6.680 9.692 ( 5.475 -1.918 -3.953) 7.020 9.790 ( -3.273 4.468 2.037) 5.901 10.179 ( -1.049 6.007 1.267) 6.228 10.377 ( -2.876 -4.179 3.461) 6.141 10.658 ( -9.420 -6.969 -3.094) 12.119 12.810 ( 11.575 9.786 -0.052) 15.157 14.159 ( -0.155 -2.209 -1.632) 2.750 14.477 ( -6.620 -2.023 1.772) 7.145======================= Grid point 795 (273/344) =======================q-point: ( 0.73 0.47 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.819 ( 1.918 3.202 0.116) 3.735 3.178 ( 5.276 9.222 0.199) 10.626 3.232 ( -3.137 -5.644 -0.254) 6.462 3.805 ( 5.549 9.074 -0.374) 10.643 4.192 ( 8.212 6.533 2.411) 10.767 4.221 ( -2.534 4.120 -2.001) 5.235 4.468 ( 5.158 8.556 -0.187) 9.992 4.636 ( -1.338 -2.173 -0.007) 2.552 4.702 ( 8.150 14.048 -0.175) 16.242 5.836 ( 4.624 8.768 0.352) 9.919 6.382 ( 1.312 1.126 0.365) 1.767 6.533 ( -3.712 -4.446 0.683) 5.832 8.149 ( 3.047 7.462 3.736) 8.884 8.279 ( -1.167 -4.799 -3.779) 6.219 9.663 ( 2.400 4.697 -0.095) 5.276 9.701 ( 1.891 2.452 -0.332) 3.114 9.738 ( -6.373 4.256 4.187) 8.733 9.769 ( 6.986 -2.616 -4.611) 8.770 10.186 ( -0.480 -1.148 0.061) 1.246 10.381 ( 1.146 1.756 5.226) 5.631 10.457 ( -3.993 -6.541 -4.725) 9.003 13.099 ( 7.790 13.378 -0.007) 15.481 14.114 ( -2.058 -2.222 -0.304) 3.044 14.340 ( -3.507 -7.432 0.242) 8.221======================= Grid point 796 (274/344) =======================q-point: ( 0.80 0.47 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.879 ( -0.760 5.523 -0.022) 5.575 3.136 ( 0.712 -7.209 -0.475) 7.259 3.304 ( -1.803 9.466 0.251) 9.639 3.951 ( 0.648 8.541 -1.144) 8.642 4.193 ( -2.173 -0.035 -0.592) 2.252 4.338 ( -0.862 8.687 1.553) 8.866 4.544 ( 0.787 -0.399 -0.676) 1.112 4.602 ( 1.763 -3.037 0.690) 3.579 4.993 ( 3.563 14.910 -0.126) 15.330 5.928 ( -6.806 12.473 1.344) 14.272 6.339 ( -1.950 -3.672 -1.395) 4.385 6.490 ( 7.299 -13.191 2.958) 15.363 8.167 ( -3.807 -1.922 4.800) 6.421 8.310 ( 4.831 3.251 -5.617) 8.091 9.635 ( -7.646 9.079 2.414) 12.112 9.714 ( -0.968 1.308 0.449) 1.688 9.772 ( 1.191 0.773 -0.994) 1.734 9.881 ( 9.999 -4.462 -1.518) 11.054 10.128 ( -5.789 0.404 -1.536) 6.003 10.340 ( 0.504 -7.125 3.572) 7.986 10.465 ( 3.222 1.761 -2.450) 4.414 13.311 ( -1.174 14.922 -0.254) 14.970 14.062 ( -0.469 -1.895 2.070) 2.845 14.229 ( 1.894 -10.920 -2.002) 11.262======================= Grid point 807 (275/344) =======================q-point: ( 0.53 0.53 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.294 ( -0.000 1.647 -1.187) 2.030 2.703 ( -0.000 1.705 -3.694) 4.068 3.051 ( 0.000 14.366 9.026) 16.966 3.275 ( -0.000 1.082 -6.606) 6.694 3.410 ( -0.000 20.996 1.847) 21.077 3.585 ( -0.000 -2.454 -1.194) 2.729 4.325 ( 0.000 8.543 6.061) 10.475 4.506 ( -0.000 6.389 0.116) 6.390 4.535 ( -0.000 10.018 -4.792) 11.105 5.305 ( -0.000 9.706 0.475) 9.717 6.046 ( -0.000 9.465 -1.751) 9.625 6.798 ( -0.000 17.071 0.273) 17.073 7.808 ( -0.000 8.122 3.018) 8.665 8.645 ( -0.000 -2.884 -3.200) 4.308 8.985 ( 0.000 -5.868 1.600) 6.082 9.428 ( 0.000 -1.606 -0.375) 1.649 9.615 ( -0.000 4.616 -0.093) 4.617 9.668 ( -0.000 4.767 -4.846) 6.798 10.109 ( 0.000 11.046 7.105) 13.134 10.706 ( 0.000 -6.628 -1.866) 6.886 11.308 ( 0.000 -8.817 -1.072) 8.882 12.152 ( -0.000 3.940 -0.847) 4.030 14.131 ( -0.000 1.480 -0.844) 1.704 14.733 ( 0.000 3.324 2.195) 3.984======================= Grid point 808 (276/344) =======================q-point: ( 0.60 0.53 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.419 ( 12.122 1.893 -0.279) 12.272 2.709 ( 0.446 0.698 -1.204) 1.461 3.260 ( 6.120 9.614 6.502) 13.121 3.354 ( 8.276 1.805 -5.965) 10.361 3.565 ( 1.543 -0.814 -1.058) 2.041 3.662 ( 6.129 17.303 1.933) 18.458 4.390 ( -2.546 7.921 2.658) 8.735 4.582 ( -0.120 7.811 -0.509) 7.829 4.621 ( 1.316 6.189 -1.579) 6.522 5.368 ( 4.046 -1.662 -0.771) 4.442 6.175 ( 0.977 13.324 -1.818) 13.483 6.917 ( -4.873 14.472 -0.530) 15.280 7.906 ( 1.109 8.045 2.926) 8.632 8.549 ( -5.242 -3.886 -2.092) 6.853 9.031 ( 10.873 -5.592 0.021) 12.226 9.462 ( 4.404 0.142 -1.039) 4.527 9.657 ( -0.020 4.640 -0.131) 4.642 9.736 ( 2.444 4.717 -1.936) 5.654 10.228 ( -0.613 10.592 5.864) 12.122 10.599 ( -5.346 -4.587 -1.878) 7.290 11.088 ( -12.509 -8.160 -1.222) 14.985 12.320 ( 13.177 3.627 -0.478) 13.676 14.148 ( 0.143 1.249 -1.442) 1.913 14.723 ( -4.778 2.082 2.419) 5.746======================= Grid point 809 (277/344) =======================q-point: ( 0.67 0.53 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.707 ( 13.595 2.691 1.174) 13.909 2.741 ( 6.251 0.324 -0.750) 6.304 3.369 ( -2.874 0.040 1.769) 3.375 3.518 ( 11.014 3.283 -0.415) 11.501 3.727 ( 13.373 5.742 -2.060) 14.699 3.967 ( 11.748 10.299 1.565) 15.701 4.429 ( -2.744 9.590 -0.034) 9.975 4.630 ( -2.732 7.528 -0.764) 8.044 4.693 ( 1.153 2.867 0.418) 3.118 5.459 ( 11.168 -4.347 -1.443) 12.071 6.305 ( 0.073 10.500 -1.265) 10.576 6.905 ( -9.935 8.945 -1.812) 13.491 8.019 ( 2.579 7.149 1.487) 7.744 8.415 ( -5.230 -3.372 0.477) 6.241 9.210 ( 14.920 -4.456 -1.373) 15.631 9.558 ( 6.213 0.305 -1.944) 6.517 9.708 ( 0.418 4.279 0.699) 4.356 9.825 ( 2.720 3.998 0.423) 4.854 10.319 ( -2.626 9.851 3.483) 10.773 10.430 ( -7.990 -3.863 -0.346) 8.882 10.781 ( -12.431 -7.029 -1.712) 14.383 12.627 ( 16.756 4.728 -0.093) 17.410 14.144 ( -0.820 -0.250 -1.964) 2.143 14.623 ( -8.690 0.380 2.516) 9.055======================= Grid point 810 (278/344) =======================q-point: ( 0.73 0.53 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.787 ( 3.656 0.956 0.451) 3.805 3.048 ( 15.936 3.368 -0.262) 16.290 3.273 ( -5.782 -2.667 0.748) 6.412 3.751 ( 9.651 5.386 1.634) 11.172 4.030 ( 14.157 4.282 -0.224) 14.792 4.210 ( 7.625 1.293 -1.460) 7.871 4.508 ( 0.516 8.304 0.343) 8.327 4.644 ( -1.800 2.455 -0.881) 3.169 4.746 ( 2.116 8.476 0.286) 8.741 5.665 ( 16.216 -2.345 -1.467) 16.451 6.368 ( -1.360 4.110 0.027) 4.329 6.748 ( -14.165 3.080 -2.871) 14.778 8.136 ( 4.065 4.022 -2.969) 6.443 8.311 ( -4.570 -0.950 4.732) 6.647 9.431 ( 14.954 -3.276 -1.846) 15.419 9.657 ( 5.040 0.123 -2.025) 5.433 9.751 ( 0.014 2.962 0.689) 3.041 9.901 ( -0.254 5.076 2.214) 5.544 10.212 ( -8.767 -2.486 0.962) 9.163 10.405 ( 0.455 4.226 0.485) 4.278 10.531 ( -9.412 -4.321 -0.839) 10.390 12.976 ( 16.720 6.284 0.192) 17.863 14.108 ( -1.442 -1.577 -2.241) 3.097 14.447 ( -11.164 -1.806 2.395) 11.560======================= Grid point 823 (279/344) =======================q-point: ( 0.60 0.60 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.317 ( -0.000 0.989 -0.186) 1.007 2.710 ( 0.000 0.218 0.286) 0.359 3.238 ( -0.000 0.225 -4.609) 4.614 3.347 ( 0.000 9.203 5.716) 10.833 3.534 ( 0.000 -2.053 -0.433) 2.098 3.779 ( -0.000 14.716 -0.348) 14.720 4.490 ( -0.000 6.701 2.031) 7.002 4.615 ( -0.000 4.307 -0.307) 4.318 4.700 ( -0.000 7.610 -1.472) 7.751 5.269 ( 0.000 -8.923 -1.162) 8.998 6.317 ( -0.000 15.131 -2.684) 15.367 7.085 ( -0.000 10.583 -2.548) 10.885 7.981 ( 0.000 7.153 3.642) 8.027 8.574 ( -0.000 -2.044 -3.383) 3.952 8.854 ( 0.000 -6.732 1.217) 6.841 9.429 ( -0.000 1.096 -0.826) 1.372 9.694 ( -0.000 3.127 0.170) 3.132 9.765 ( -0.000 5.413 -0.424) 5.429 10.346 ( 0.000 8.875 4.709) 10.047 10.610 ( -0.000 -1.490 -2.715) 3.096 11.120 ( 0.000 -9.389 -0.546) 9.405 12.219 ( -0.000 2.919 -0.458) 2.954 14.165 ( -0.000 2.157 -1.536) 2.648 14.789 ( 0.000 1.324 2.595) 2.913======================= Grid point 824 (280/344) =======================q-point: ( 0.67 0.60 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.447 ( 13.200 0.960 0.194) 13.237 2.715 ( 0.316 0.101 1.438) 1.475 3.320 ( 10.403 -0.227 -4.955) 11.525 3.431 ( -1.847 2.325 4.201) 5.145 3.585 ( 8.198 3.149 1.408) 8.894 3.931 ( 3.848 8.625 -1.297) 9.533 4.546 ( -1.285 6.913 0.445) 7.045 4.682 ( 2.842 2.530 0.219) 3.811 4.748 ( -2.184 6.848 -0.713) 7.223 5.218 ( 6.537 -10.020 -1.812) 12.100 6.435 ( -1.444 11.338 -2.364) 11.671 7.108 ( -5.599 5.155 -4.992) 9.102 8.058 ( 0.698 5.330 2.839) 6.079 8.488 ( -5.482 -1.311 0.269) 5.643 8.921 ( 11.993 -4.379 -0.700) 12.787 9.472 ( 3.780 0.846 -1.023) 4.006 9.729 ( 0.814 2.294 0.348) 2.459 9.829 ( 1.437 4.272 1.442) 4.732 10.412 ( -0.593 3.049 1.219) 3.337 10.568 ( -5.618 4.583 -0.634) 7.278 10.913 ( -11.259 -8.677 -0.407) 14.221 12.379 ( 13.995 2.285 -0.184) 14.182 14.169 ( -1.371 1.370 -1.793) 2.640 14.759 ( -5.215 0.432 2.700) 5.889======================= Grid point 825 (281/344) =======================q-point: (-0.27 -0.40 -0.80)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.735 ( 5.665 -0.525 0.387) 5.702 2.753 ( 15.668 1.418 0.546) 15.742 3.358 ( -4.929 -0.663 1.459) 5.183 3.571 ( 14.842 1.398 0.774) 14.928 3.824 ( 13.470 3.769 0.109) 13.988 4.068 ( 6.977 0.481 -2.335) 7.373 4.583 ( -1.277 4.073 0.154) 4.272 4.707 ( -1.747 0.621 0.233) 1.869 4.797 ( -0.043 7.043 -0.060) 7.044 5.322 ( 15.804 -6.221 -2.553) 17.176 6.473 ( -3.628 5.536 -1.041) 6.700 6.978 ( -10.711 0.290 -6.445) 12.503 8.113 ( 0.988 1.478 -0.910) 1.997 8.402 ( -4.341 0.886 4.851) 6.569 9.131 ( 15.514 -1.811 -1.801) 15.723 9.560 ( 5.683 0.357 -1.283) 5.836 9.764 ( 0.927 1.182 0.422) 1.560 9.903 ( 2.483 2.723 3.018) 4.764 10.366 ( -5.558 -2.282 -1.930) 6.311 10.511 ( -9.251 6.975 0.806) 11.614 10.641 ( -8.481 -5.496 0.588) 10.123 12.695 ( 19.021 1.924 0.127) 19.118 14.137 ( -2.628 0.411 -2.090) 3.383 14.632 ( -9.839 -0.490 2.668) 10.206======================= Grid point 839 (282/344) =======================q-point: (-0.33 -0.33 -0.80)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.333 ( 0.000 0.595 0.571) 0.825 2.725 ( 0.000 0.744 2.782) 2.879 3.193 ( -0.000 -1.508 -7.382) 7.535 3.505 ( 0.000 -0.641 -0.003) 0.641 3.516 ( 0.000 4.180 7.528) 8.610 3.967 ( -0.000 4.274 -2.383) 4.893 4.614 ( -0.000 3.963 0.209) 3.969 4.670 ( -0.000 1.408 -0.775) 1.607 4.833 ( -0.000 6.778 -0.259) 6.782 5.052 ( 0.000 -10.152 -1.681) 10.290 6.541 ( -0.000 7.403 -2.138) 7.705 7.168 ( -0.000 0.153 -8.428) 8.430 8.106 ( 0.000 3.074 4.365) 5.339 8.552 ( -0.000 0.784 -0.751) 1.086 8.755 ( 0.000 -3.134 0.731) 3.218 9.444 ( -0.000 0.489 -0.830) 0.963 9.739 ( -0.000 1.184 0.222) 1.205 9.861 ( 0.000 3.391 2.862) 4.437 10.422 ( -0.000 -1.605 -2.281) 2.789 10.675 ( -0.000 6.722 0.898) 6.782 10.946 ( 0.000 -6.717 0.243) 6.721 12.261 ( -0.000 1.415 -0.137) 1.422 14.192 ( -0.000 1.105 -1.780) 2.096 14.813 ( 0.000 -0.018 2.808) 2.808======================= Grid point 840 (283/344) =======================q-point: (-0.27 -0.33 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.460 ( 13.048 0.187 0.423) 13.056 2.732 ( -0.414 0.802 1.947) 2.146 3.281 ( 12.559 -1.568 -4.094) 13.302 3.462 ( -2.909 0.790 1.201) 3.244 3.655 ( 9.056 1.201 4.534) 10.199 3.986 ( 1.605 -1.827 -3.096) 3.937 4.618 ( -0.963 -1.720 -0.330) 1.998 4.703 ( 2.025 -0.066 0.334) 2.054 4.880 ( -1.660 3.823 0.241) 4.174 5.045 ( 8.624 -1.886 -2.893) 9.290 6.563 ( -2.323 1.482 -0.983) 2.925 7.081 ( -5.265 -3.653 -10.145) 11.999 8.124 ( -0.848 -0.368 3.027) 3.165 8.499 ( -4.741 1.304 2.367) 5.458 8.872 ( 12.450 0.139 -0.935) 12.486 9.475 ( 3.596 -0.201 -0.967) 3.729 9.754 ( 0.845 0.115 0.243) 0.887 9.905 ( 1.017 1.933 4.181) 4.717 10.376 ( -1.198 -3.751 -4.214) 5.767 10.697 ( -3.022 -1.051 1.474) 3.523 10.791 ( -12.535 3.142 0.671) 12.940 12.407 ( 14.193 0.467 0.058) 14.201 14.179 ( -1.814 0.294 -1.902) 2.645 14.769 ( -5.466 -0.540 2.800) 6.165======================= Grid point 855 (284/344) =======================q-point: (-0.27 -0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.345 ( 0.000 0.206 0.759) 0.787 2.762 ( 0.000 1.569 2.457) 2.915 3.113 ( -0.000 -3.395 -6.600) 7.422 3.511 ( -0.000 1.242 -0.014) 1.242 3.579 ( 0.000 -0.871 6.502) 6.560 3.932 ( 0.000 -6.453 -2.026) 6.764 4.577 ( 0.000 -7.531 -0.754) 7.569 4.664 ( -0.000 -1.628 -0.984) 1.902 4.878 ( 0.000 -3.211 -0.144) 3.214 5.036 ( -0.000 10.258 -1.058) 10.313 6.564 ( 0.000 -5.244 -0.666) 5.286 7.052 ( -0.000 -5.767 -11.377) 12.755 8.127 ( 0.000 -3.163 4.820) 5.765 8.582 ( -0.000 1.882 -0.532) 1.956 8.745 ( -0.000 1.820 0.492) 1.885 9.435 ( -0.000 -1.071 -0.928) 1.417 9.743 ( 0.000 -0.837 0.245) 0.873 9.920 ( 0.000 0.661 4.943) 4.987 10.326 ( -0.000 -6.021 -4.766) 7.679 10.700 ( 0.000 -4.233 0.972) 4.343 10.972 ( -0.000 8.367 0.741) 8.400 12.272 ( 0.000 -0.289 0.092) 0.304 14.188 ( -0.000 -0.743 -1.849) 1.993 14.816 ( 0.000 -0.966 2.838) 2.998======================= Grid point 968 (285/344) =======================q-point: ( 0.27 0.27 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 344Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.842 ( 0.000 -0.000 29.375) 29.375 0.842 ( 0.000 -0.000 29.375) 29.375 1.597 ( 0.000 -0.000 59.373) 59.373 2.221 ( -0.000 0.000 -18.789) 18.789 2.221 ( -0.000 0.000 -18.789) 18.789 3.148 ( 0.000 -0.000 7.625) 7.625 3.148 ( 0.000 -0.000 7.625) 7.625 3.923 ( -0.000 0.000 -30.245) 30.245 4.087 ( -0.000 0.000 -1.645) 1.645 4.087 ( -0.000 0.000 -1.645) 1.645 4.407 ( -0.000 0.000 -5.956) 5.956 7.058 ( 0.000 -0.000 7.042) 7.042 8.883 ( -0.000 0.000 0.043) 0.043 8.883 ( -0.000 -0.000 0.043) 0.043 9.224 ( 0.000 0.000 0.114) 0.114 9.224 ( 0.000 0.000 0.114) 0.114 9.454 ( 0.000 -0.000 5.079) 5.079 9.803 ( -0.000 0.000 -5.211) 5.211 10.045 ( 0.000 0.000 1.746) 1.746 10.045 ( 0.000 -0.000 1.746) 1.746 11.874 ( -0.000 0.000 -1.359) 1.359 11.874 ( -0.000 -0.000 -1.359) 1.359 13.676 ( 0.000 -0.000 0.009) 0.009 16.960 ( 0.000 -0.000 0.120) 0.120======================= Grid point 969 (286/344) =======================q-point: ( 0.33 0.27 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.121 ( 15.793 9.118 23.229) 29.532 1.176 ( 18.952 10.942 24.268) 32.677 2.004 ( 21.816 12.596 36.649) 44.472 2.259 ( 5.901 3.407 -19.465) 20.623 2.302 ( 11.326 6.539 -9.632) 16.242 3.144 ( -1.078 -0.622 7.693) 7.793 3.321 ( 10.961 6.328 5.151) 13.664 3.832 ( 1.133 0.654 -23.832) 23.867 4.101 ( 1.513 0.874 -1.462) 2.278 4.221 ( 3.790 2.188 -0.917) 4.472 4.438 ( 9.806 5.662 -11.358) 16.038 7.030 ( -3.982 -2.299 6.584) 8.030 8.142 ( -34.164 -19.724 25.407) 46.922 8.915 ( 2.231 1.288 -0.332) 2.597 9.016 ( -4.842 -2.795 -10.196) 11.629 9.236 ( 1.262 0.728 0.471) 1.531 9.400 ( -4.469 -2.580 4.143) 6.618 9.784 ( 4.488 2.591 -7.704) 9.285 9.990 ( -4.458 -2.574 2.025) 5.531 10.990 ( 28.071 16.207 -11.240) 34.307 11.872 ( 2.759 1.593 -5.644) 6.481 11.897 ( 1.837 1.061 -1.598) 2.656 13.798 ( 10.125 5.846 0.134) 11.692 15.868 ( -65.302 -37.702 37.471) 84.202======================= Grid point 970 (287/344) =======================q-point: ( 0.40 0.27 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.570 ( 17.632 10.180 16.931) 26.480 1.686 ( 20.204 11.665 18.480) 29.762 2.398 ( 9.780 5.646 -19.396) 22.443 2.442 ( 14.219 8.209 -16.101) 22.996 2.835 ( 29.144 16.826 25.021) 41.935 3.134 ( -1.224 -0.706 7.785) 7.912 3.605 ( 12.437 7.181 4.007) 14.910 3.913 ( 8.964 5.175 -13.813) 17.261 4.153 ( 3.314 1.913 -1.015) 3.959 4.187 ( -1.905 -1.100 -4.320) 4.848 4.861 ( 24.752 14.291 -9.095) 29.993 6.889 ( -9.251 -5.341 4.471) 11.580 7.717 ( -9.035 -5.217 10.312) 14.669 8.861 ( -6.430 -3.712 -6.298) 9.736 8.980 ( 3.399 1.963 -1.265) 4.124 9.282 ( 2.455 1.417 1.547) 3.229 9.344 ( -1.345 -0.776 7.269) 7.433 9.858 ( -7.105 -4.102 2.353) 8.535 9.879 ( 5.120 2.956 -9.910) 11.540 11.152 ( -5.799 -3.348 4.867) 8.278 11.903 ( -1.662 -0.960 -12.330) 12.479 11.947 ( 2.755 1.591 -2.010) 3.763 14.081 ( 12.000 6.928 -0.344) 13.861 14.782 ( -32.885 -18.986 28.106) 47.243======================= Grid point 971 (288/344) =======================q-point: ( 0.47 0.27 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.954 ( 12.184 7.035 10.657) 17.650 2.162 ( 17.368 10.027 11.448) 23.092 2.625 ( 13.313 7.686 -16.076) 22.243 2.720 ( 13.500 7.794 -12.644) 20.072 3.126 ( -0.864 -0.499 7.582) 7.648 3.441 ( 16.093 9.291 7.000) 19.858 3.931 ( 12.860 7.425 5.122) 15.708 4.083 ( 7.658 4.421 1.591) 8.985 4.249 ( 5.003 2.888 -0.521) 5.800 4.305 ( 16.543 9.551 -7.634) 20.572 5.442 ( 25.352 14.637 -5.784) 29.840 6.656 ( -10.191 -5.884 1.241) 11.833 7.659 ( 1.443 0.833 0.660) 1.792 8.718 ( -5.227 -3.018 0.807) 6.090 9.057 ( 3.382 1.952 -2.644) 4.716 9.347 ( 2.217 1.280 4.007) 4.755 9.365 ( 1.931 1.115 5.898) 6.305 9.691 ( -7.086 -4.091 1.480) 8.315 9.978 ( 5.482 3.165 -9.903) 11.753 10.955 ( -10.552 -6.092 9.538) 15.474 11.744 ( -8.434 -4.869 -8.211) 12.738 12.012 ( 3.219 1.859 -2.166) 4.303 14.177 ( -5.036 -2.908 4.767) 7.519 14.514 ( 4.049 2.338 6.192) 7.759======================= Grid point 972 (289/344) =======================q-point: ( 0.53 0.27 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.174 ( 5.940 3.429 3.999) 7.939 2.503 ( 10.315 5.955 3.872) 12.524 2.924 ( 14.219 8.209 -9.647) 19.043 3.039 ( 15.943 9.205 -4.232) 18.889 3.131 ( 0.071 0.041 6.286) 6.286 3.614 ( 1.240 0.716 -1.760) 2.269 4.133 ( 7.467 4.311 7.195) 11.230 4.359 ( 12.132 7.004 -7.392) 15.839 4.375 ( 5.759 3.325 -0.071) 6.650 4.824 ( 24.341 14.053 5.118) 28.569 5.896 ( 11.548 6.667 -3.069) 13.683 6.528 ( 2.483 1.434 0.691) 2.949 7.744 ( 5.572 3.217 -2.838) 7.032 8.619 ( -3.966 -2.290 4.593) 6.486 9.100 ( 0.032 0.018 -3.507) 3.507 9.372 ( -1.407 -0.813 7.733) 7.902 9.462 ( 5.499 3.175 3.101) 7.066 9.591 ( -0.447 -0.258 -1.735) 1.810 10.095 ( 6.483 3.743 -8.203) 11.106 10.756 ( -8.045 -4.645 8.221) 12.404 11.525 ( -8.930 -5.156 -4.219) 11.141 12.084 ( 3.345 1.931 -1.848) 4.281 14.096 ( -1.673 -0.966 2.991) 3.560 14.666 ( 6.133 3.541 0.206) 7.085======================= Grid point 973 (290/344) =======================q-point: ( 0.60 0.27 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.274 ( 2.708 1.564 0.739) 3.214 2.669 ( 4.325 2.497 -0.188) 4.998 3.126 ( 0.962 0.555 7.534) 7.615 3.236 ( 11.188 6.459 -8.420) 15.420 3.414 ( 15.947 9.207 0.862) 18.434 3.591 ( -1.761 -1.017 -1.518) 2.538 4.325 ( 7.401 4.273 5.423) 10.121 4.504 ( 5.194 2.999 0.365) 6.009 4.573 ( 8.127 4.692 -7.513) 12.021 5.259 ( 8.716 5.032 4.710) 11.112 6.023 ( 6.356 3.670 0.171) 7.342 6.767 ( 13.189 7.615 2.828) 15.490 7.887 ( 7.097 4.097 -3.801) 9.034 8.555 ( -2.334 -1.347 4.495) 5.241 9.017 ( -6.048 -3.492 -1.300) 7.103 9.372 ( 0.834 0.482 4.211) 4.320 9.619 ( 7.325 4.229 0.200) 8.460 9.633 ( 3.105 1.793 -1.266) 3.802 10.241 ( 7.402 4.274 -5.466) 10.145 10.623 ( -4.794 -2.768 5.733) 7.970 11.318 ( -8.507 -4.912 -1.844) 9.995 12.156 ( 3.105 1.793 -1.161) 3.769 14.100 ( 1.189 0.686 1.795) 2.259 14.775 ( 3.456 1.995 -1.467) 4.252======================= Grid point 974 (291/344) =======================q-point: ( 0.67 0.27 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.318 ( 1.278 0.738 -0.313) 1.509 2.727 ( 1.352 0.781 -1.787) 2.373 3.146 ( -0.282 -0.163 7.289) 7.296 3.448 ( 8.018 4.629 -7.556) 11.950 3.536 ( -1.719 -0.993 -0.714) 2.110 3.758 ( 11.892 6.866 2.505) 13.958 4.489 ( 6.165 3.559 2.080) 7.416 4.607 ( 3.516 2.030 0.757) 4.130 4.715 ( 5.539 3.198 -3.417) 7.251 5.242 ( -7.483 -4.320 2.472) 8.987 6.281 ( 12.951 7.477 2.271) 15.126 7.021 ( 6.909 3.989 6.584) 10.344 8.038 ( 6.312 3.644 -4.394) 8.510 8.533 ( -0.317 -0.183 2.408) 2.436 8.866 ( -6.028 -3.481 -0.496) 6.979 9.410 ( 1.497 0.864 1.687) 2.415 9.699 ( 2.530 1.461 -0.510) 2.966 9.778 ( 6.202 3.580 -2.163) 7.480 10.388 ( 4.486 2.590 -0.928) 5.263 10.572 ( 0.707 0.408 2.215) 2.361 11.122 ( -8.175 -4.720 -0.794) 9.473 12.218 ( 2.405 1.388 -0.435) 2.811 14.142 ( 1.811 1.046 1.689) 2.688 14.825 ( 1.323 0.764 -2.391) 2.837======================= Grid point 975 (292/344) =======================q-point: ( 0.73 0.27 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.338 ( 0.602 0.347 -0.651) 0.952 2.743 ( 0.795 0.459 -2.522) 2.684 3.145 ( -1.256 -0.725 6.913) 7.064 3.506 ( -0.599 -0.346 -0.220) 0.726 3.565 ( 3.459 1.997 -7.015) 8.072 3.950 ( 3.703 2.138 2.517) 4.962 4.613 ( 3.346 1.932 0.411) 3.885 4.664 ( 1.164 0.672 0.991) 1.670 4.833 ( 5.734 3.311 -0.439) 6.636 5.039 ( -8.768 -5.062 1.989) 10.318 6.528 ( 6.864 3.963 1.587) 8.083 7.105 ( -0.932 -0.538 10.109) 10.166 8.137 ( 2.728 1.575 -4.827) 5.764 8.547 ( 1.125 0.650 0.612) 1.436 8.760 ( -2.762 -1.595 -0.606) 3.246 9.438 ( 0.485 0.280 0.938) 1.093 9.740 ( 1.007 0.581 -0.241) 1.187 9.884 ( 3.467 2.002 -3.830) 5.540 10.401 ( -2.334 -1.348 3.925) 4.762 10.682 ( 6.178 3.567 -1.313) 7.254 10.949 ( -5.724 -3.305 -0.560) 6.633 12.261 ( 1.233 0.712 -0.017) 1.424 14.180 ( 0.946 0.546 1.830) 2.132 14.833 ( -0.003 -0.002 -2.860) 2.860======================= Grid point 984 (293/344) =======================q-point: ( 0.33 0.33 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.161 ( 0.000 17.638 24.230) 29.970 1.240 ( 0.000 21.474 23.756) 32.023 2.111 ( 0.000 23.781 28.394) 37.037 2.170 ( -0.000 4.017 -18.552) 18.982 2.311 ( -0.000 15.848 -2.424) 16.032 3.192 ( 0.000 0.668 5.798) 5.837 3.295 ( 0.000 10.332 6.667) 12.297 3.755 ( -0.000 -0.043 -26.441) 26.441 4.094 ( -0.000 1.573 -1.366) 2.083 4.231 ( -0.000 5.924 -1.278) 6.061 4.410 ( -0.000 10.218 -10.408) 14.585 7.047 ( 0.000 -4.440 6.425) 7.810 8.185 ( 0.000 -42.801 24.402) 49.268 8.893 ( -0.000 1.452 0.149) 1.460 8.955 ( -0.000 -7.443 -9.076) 11.737 9.252 ( -0.000 2.315 0.101) 2.317 9.440 ( 0.000 0.356 2.781) 2.804 9.751 ( -0.000 1.358 -6.670) 6.807 10.016 ( 0.000 -4.215 1.536) 4.486 11.034 ( -0.000 43.634 -13.950) 45.810 11.807 ( 0.000 -7.685 -0.451) 7.699 11.878 ( -0.000 1.484 -1.256) 1.944 13.794 ( -0.000 10.894 0.331) 10.899 15.965 ( 0.000 -70.503 30.562) 76.842======================= Grid point 985 (294/344) =======================q-point: ( 0.40 0.33 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.524 ( 11.275 19.820 19.520) 30.017 1.608 ( 10.576 20.198 20.257) 30.498 2.246 ( 7.853 6.557 -17.436) 20.216 2.362 ( 5.175 14.395 -19.809) 25.028 2.731 ( 14.909 28.264 31.528) 44.890 3.197 ( -1.644 2.385 5.863) 6.539 3.504 ( 8.451 9.759 4.888) 13.804 3.776 ( 6.588 4.890 -19.808) 21.440 4.134 ( 2.160 3.093 -1.037) 3.912 4.208 ( -2.661 -2.196 -3.298) 4.773 4.687 ( 13.391 22.833 -9.069) 27.981 6.957 ( -4.970 -8.076 5.063) 10.749 7.792 ( -8.006 -18.155 13.794) 24.165 8.852 ( -1.683 -6.662 -6.146) 9.219 8.949 ( 3.300 2.450 -0.342) 4.124 9.287 ( 0.852 3.466 0.549) 3.611 9.426 ( -4.423 2.623 6.519) 8.303 9.738 ( 1.644 -3.058 -8.445) 9.131 9.978 ( -0.953 -1.014 0.859) 1.635 11.282 ( -6.524 10.685 -2.477) 12.762 11.699 ( 1.871 -13.957 -4.110) 14.669 11.989 ( 6.187 6.260 -4.182) 9.745 13.994 ( 8.205 12.046 0.458) 14.582 15.113 ( -27.258 -42.007 26.919) 56.853======================= Grid point 986 (295/344) =======================q-point: ( 0.47 0.33 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.940 ( 8.621 18.127 13.569) 24.229 2.048 ( 13.528 16.143 14.754) 25.716 2.474 ( 12.437 10.739 -16.009) 22.941 2.566 ( 9.199 10.682 -16.896) 22.004 3.202 ( -1.188 5.106 6.478) 8.333 3.327 ( 13.209 18.461 14.329) 26.844 3.783 ( 12.273 8.196 4.131) 15.325 3.987 ( 11.457 7.817 -3.870) 14.399 4.169 ( 3.234 3.282 -7.860) 9.111 4.229 ( 3.756 6.256 -0.761) 7.336 5.207 ( 20.495 22.748 -6.150) 31.230 6.746 ( -8.670 -10.144 2.131) 13.513 7.641 ( -0.337 -3.835 3.264) 5.047 8.749 ( -2.758 -4.333 -1.022) 5.237 9.040 ( 3.063 4.568 -1.506) 5.702 9.351 ( 1.821 3.616 2.040) 4.533 9.391 ( -2.937 1.996 7.108) 7.946 9.707 ( 0.501 -4.864 -4.432) 6.599 9.970 ( -0.915 3.864 -3.761) 5.469 11.112 ( -12.960 -5.032 8.333) 16.209 11.574 ( 3.367 -18.081 -7.889) 20.012 12.107 ( 0.045 8.535 -3.614) 9.269 14.239 ( 3.815 8.307 0.130) 9.142 14.520 ( -10.364 -14.717 13.309) 22.386======================= Grid point 987 (296/344) =======================q-point: ( 0.53 0.33 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.213 ( 2.326 13.861 5.615) 15.135 2.419 ( 9.858 10.456 7.221) 16.083 2.785 ( 11.856 13.665 -12.073) 21.750 2.857 ( 14.976 11.644 -6.140) 19.939 3.235 ( -3.254 8.353 5.621) 10.582 3.589 ( 3.268 3.712 0.460) 4.967 4.025 ( 9.137 0.935 4.966) 10.441 4.211 ( 9.959 6.883 -4.043) 12.763 4.345 ( 4.753 6.756 -0.647) 8.286 4.578 ( 22.424 18.651 2.218) 29.251 5.751 ( 17.283 17.522 -3.433) 24.850 6.523 ( -4.655 -7.255 0.453) 8.632 7.674 ( 4.378 1.462 -1.319) 4.801 8.663 ( -3.277 -3.322 3.183) 5.648 9.122 ( 0.507 5.709 -2.826) 6.391 9.408 ( 3.011 0.722 4.714) 5.640 9.432 ( 0.194 4.849 3.937) 6.249 9.636 ( -3.954 -0.248 -0.287) 3.972 10.019 ( 3.690 3.741 -7.427) 9.098 10.858 ( -9.582 -8.211 8.529) 15.231 11.420 ( 1.740 -18.141 -5.588) 19.062 12.175 ( -2.108 10.756 -1.924) 11.128 14.176 ( -7.163 0.450 3.490) 7.980 14.553 ( 8.991 0.114 1.044) 9.052======================= Grid point 988 (297/344) =======================q-point: ( 0.60 0.33 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.350 ( -1.837 12.216 1.373) 12.430 2.625 ( 4.758 4.712 1.453) 6.852 3.101 ( 11.713 11.676 -7.345) 18.096 3.189 ( 4.694 9.858 4.290) 11.731 3.331 ( 5.029 15.139 0.658) 15.966 3.603 ( -1.141 -0.688 -1.358) 1.902 4.207 ( 9.581 0.666 5.532) 11.083 4.438 ( 10.222 4.518 -7.027) 13.202 4.488 ( 3.819 7.071 -0.416) 8.047 5.127 ( 17.310 13.283 4.889) 22.361 6.009 ( 0.802 5.912 -0.756) 6.014 6.585 ( 13.924 3.315 1.201) 14.363 7.794 ( 6.697 3.480 -2.668) 8.005 8.582 ( -2.722 -3.746 4.050) 6.152 9.135 ( -5.439 5.128 -2.599) 7.914 9.428 ( -3.721 3.078 5.801) 7.548 9.535 ( 6.451 3.232 0.572) 7.238 9.630 ( 0.930 4.561 -0.238) 4.661 10.135 ( 7.239 3.344 -6.561) 10.326 10.671 ( -5.123 -7.231 6.080) 10.747 11.254 ( 0.350 -16.776 -2.604) 16.981 12.246 ( -2.651 12.323 -1.069) 12.650 14.116 ( -1.927 1.296 1.988) 3.057 14.686 ( 6.690 -1.224 -1.132) 6.895======================= Grid point 989 (298/344) =======================q-point: ( 0.67 0.33 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.417 ( -4.256 11.959 0.091) 12.694 2.707 ( 1.563 1.522 -0.626) 2.270 3.264 ( -4.388 9.889 5.574) 12.170 3.360 ( 7.529 7.994 -6.374) 12.697 3.554 ( -0.123 0.887 0.330) 0.954 3.672 ( 9.146 13.660 0.359) 16.443 4.384 ( 8.784 0.905 3.244) 9.407 4.608 ( 2.894 5.637 -1.583) 6.531 4.617 ( 7.394 2.739 -3.212) 8.514 5.339 ( -3.205 2.515 3.333) 5.263 6.149 ( 10.102 7.495 1.801) 12.707 6.886 ( 13.351 2.371 3.871) 14.101 7.947 ( 6.965 3.801 -2.924) 8.457 8.520 ( -0.612 -3.961 1.969) 4.465 9.033 ( -10.630 5.327 -0.231) 11.892 9.434 ( -0.994 3.968 2.745) 4.926 9.666 ( 4.159 2.640 -1.294) 5.094 9.726 ( 4.021 5.542 -0.261) 6.852 10.297 ( 8.341 3.418 -4.110) 9.907 10.559 ( -1.376 -5.943 3.929) 7.256 11.085 ( -0.887 -15.293 -0.866) 15.343 12.320 ( -3.594 13.221 -0.454) 13.709 14.125 ( 0.967 0.599 1.733) 2.073 14.756 ( 4.467 -3.027 -2.203) 5.828======================= Grid point 990 (299/344) =======================q-point: ( 0.73 0.33 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.449 ( -5.650 11.860 -0.256) 13.140 2.725 ( 0.377 0.215 -1.660) 1.716 3.287 ( -6.079 10.441 4.741) 12.979 3.456 ( 2.333 -2.030 -2.963) 4.283 3.600 ( -0.012 9.037 -3.075) 9.545 3.919 ( 4.942 7.541 2.398) 9.330 4.545 ( 6.964 2.271 0.867) 7.376 4.684 ( 0.491 4.043 -0.295) 4.083 4.749 ( 6.629 1.379 -1.005) 6.845 5.203 ( -11.836 0.398 2.681) 12.142 6.420 ( 10.606 4.761 2.151) 11.823 7.066 ( 5.948 -2.664 7.286) 9.775 8.078 ( 4.707 2.354 -2.988) 6.052 8.492 ( 1.801 -3.838 -0.984) 4.352 8.916 ( -9.603 7.597 0.780) 12.270 9.464 ( -0.925 3.675 1.289) 4.003 9.732 ( 1.419 1.876 -0.426) 2.390 9.843 ( 3.618 3.818 -2.665) 5.897 10.412 ( 0.896 -0.474 1.472) 1.787 10.567 ( 8.086 -1.309 -0.405) 8.201 10.913 ( -1.734 -14.116 -0.347) 14.226 12.378 ( -5.048 13.308 -0.069) 14.234 14.157 ( 1.881 -0.567 1.875) 2.716 14.777 ( 3.034 -4.310 -2.760) 5.950======================= Grid point 1000 (300/344) =======================q-point: ( 0.40 0.40 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.670 ( 0.000 21.778 19.857) 29.472 1.799 ( 0.000 24.034 18.886) 30.566 2.201 ( -0.000 6.782 -17.074) 18.372 2.424 ( -0.000 14.879 -21.990) 26.551 3.002 ( 0.000 33.455 28.762) 44.119 3.227 ( 0.000 0.849 2.785) 2.912 3.571 ( 0.000 13.450 7.221) 15.266 3.743 ( -0.000 9.860 -17.717) 20.276 4.142 ( -0.000 3.709 -0.645) 3.765 4.201 ( -0.000 -1.966 -4.810) 5.196 4.819 ( -0.000 29.063 -7.406) 29.992 6.915 ( 0.000 -11.290 4.024) 11.986 7.701 ( 0.000 -15.279 10.902) 18.770 8.795 ( -0.000 -5.171 -3.170) 6.065 8.939 ( -0.000 2.860 0.416) 2.890 9.316 ( -0.000 4.007 0.074) 4.007 9.522 ( 0.000 5.513 4.714) 7.254 9.717 ( -0.000 -1.372 -7.908) 8.027 9.896 ( 0.000 -8.103 1.069) 8.173 11.465 ( -0.000 3.635 -13.550) 14.029 11.588 ( 0.000 -8.884 6.937) 11.272 11.919 ( -0.000 3.031 -1.061) 3.212 14.048 ( -0.000 11.799 1.761) 11.930 14.960 ( 0.000 -38.876 17.995) 42.839======================= Grid point 1001 (301/344) =======================q-point: ( 0.47 0.40 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.006 ( 8.321 18.205 16.599) 26.003 2.118 ( 4.600 21.756 13.685) 26.111 2.336 ( 10.559 11.048 -13.657) 20.495 2.547 ( 3.315 13.118 -19.466) 23.707 3.258 ( 1.712 3.875 2.753) 5.052 3.408 ( 5.311 20.040 12.551) 24.235 3.743 ( 3.344 10.272 5.838) 12.279 3.928 ( 7.475 19.792 -3.950) 21.522 4.169 ( -0.626 2.889 -6.635) 7.264 4.224 ( 3.700 5.740 -0.469) 6.845 5.192 ( 9.750 29.240 -5.331) 31.281 6.754 ( -4.841 -12.804 1.883) 13.818 7.610 ( -0.195 -4.528 5.051) 6.786 8.739 ( -1.073 -3.203 -0.418) 3.404 9.011 ( 4.211 3.616 0.227) 5.555 9.370 ( 0.987 4.393 0.798) 4.573 9.529 ( -7.563 2.751 6.823) 10.552 9.639 ( 0.943 -0.672 -9.476) 9.547 9.923 ( 6.770 -4.510 0.623) 8.158 11.329 ( -8.042 -17.947 3.626) 19.998 11.392 ( -9.539 -0.067 -5.569) 11.046 12.082 ( 8.956 4.471 -1.944) 10.197 14.212 ( 6.766 6.710 2.254) 9.792 14.588 ( -10.766 -16.735 8.480) 21.630======================= Grid point 1002 (302/344) =======================q-point: ( 0.53 0.40 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.311 ( 5.789 12.749 5.483) 15.037 2.416 ( 6.056 13.856 7.207) 16.751 2.718 ( 12.812 17.395 -9.182) 23.474 2.737 ( 10.712 15.393 -6.989) 20.013 3.354 ( 1.946 7.580 2.419) 8.191 3.603 ( 1.484 5.473 1.257) 5.809 3.906 ( 5.766 4.581 4.234) 8.495 4.158 ( 3.175 6.669 -2.472) 7.789 4.327 ( 5.538 9.971 -1.107) 11.459 4.476 ( 14.245 23.281 1.914) 27.360 5.674 ( 14.366 24.765 -3.074) 28.795 6.532 ( -6.399 -10.775 0.253) 12.535 7.627 ( 2.612 1.634 1.207) 3.309 8.683 ( -2.356 -3.103 1.773) 4.280 9.141 ( 4.787 5.738 -0.782) 7.513 9.395 ( -1.380 0.186 2.648) 2.992 9.491 ( 0.246 5.552 0.827) 5.619 9.669 ( 0.751 2.677 -2.921) 4.033 9.984 ( 3.405 -0.978 -0.981) 3.676 10.976 ( -12.953 -12.730 6.253) 19.207 11.232 ( -2.370 -10.826 -5.886) 12.549 12.249 ( 4.435 6.982 -1.366) 8.384 14.322 ( -5.024 -7.143 3.755) 9.506 14.407 ( 4.334 6.198 0.545) 7.583======================= Grid point 1003 (303/344) =======================q-point: ( 0.60 0.40 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.509 ( 1.364 13.514 0.817) 13.607 2.612 ( 3.791 6.683 2.035) 7.948 3.011 ( 10.692 13.216 -4.685) 17.633 3.186 ( 12.681 20.692 -0.910) 24.286 3.476 ( -0.196 12.445 2.821) 12.762 3.621 ( -1.386 0.957 -0.834) 1.879 4.062 ( 8.038 1.253 3.965) 9.050 4.309 ( 7.637 5.633 -5.068) 10.758 4.488 ( 4.306 7.075 -0.252) 8.287 5.000 ( 16.535 20.590 3.433) 26.630 6.087 ( 4.323 16.354 -0.809) 16.935 6.394 ( 5.431 -5.187 0.223) 7.513 7.727 ( 4.994 4.406 -0.411) 6.672 8.597 ( -3.293 -4.853 2.356) 6.321 9.255 ( -0.293 8.392 -1.820) 8.592 9.441 ( 5.370 2.159 0.007) 5.788 9.559 ( -1.420 5.694 3.280) 6.723 9.687 ( -1.561 4.328 0.508) 4.629 10.042 ( 4.709 1.195 -3.972) 6.275 10.696 ( -7.116 -10.643 4.806) 13.675 11.069 ( -0.639 -14.167 -3.230) 14.544 12.385 ( 1.527 10.809 -0.736) 10.941 14.201 ( -5.211 0.442 1.624) 5.476 14.541 ( 6.849 -1.098 -0.484) 6.953======================= Grid point 1004 (304/344) =======================q-point: ( 0.67 0.40 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.637 ( -2.901 14.994 -0.270) 15.275 2.707 ( 1.185 3.660 0.596) 3.893 3.288 ( 8.054 8.786 -3.264) 12.358 3.459 ( -1.128 9.175 1.090) 9.308 3.594 ( -0.648 10.078 2.912) 10.510 3.714 ( 5.554 18.028 -1.769) 18.947 4.230 ( 9.829 0.064 3.244) 10.351 4.485 ( 8.288 3.121 -4.324) 9.855 4.615 ( 3.311 4.884 -0.293) 5.907 5.389 ( 6.528 11.452 3.053) 13.530 6.143 ( -1.377 7.462 0.836) 7.634 6.643 ( 16.587 1.237 1.585) 16.708 7.874 ( 6.092 5.402 -0.736) 8.175 8.497 ( -2.173 -5.597 0.773) 6.054 9.278 ( -7.454 9.561 -1.063) 12.170 9.532 ( -3.059 4.946 3.470) 6.772 9.603 ( 5.117 3.531 -0.339) 6.226 9.742 ( 1.519 5.619 -0.058) 5.821 10.165 ( 8.412 2.011 -3.911) 9.492 10.526 ( -2.849 -8.720 2.838) 9.602 10.916 ( 0.534 -15.304 -0.928) 15.341 12.515 ( -1.057 14.439 -0.350) 14.482 14.146 ( -2.423 0.655 1.543) 2.946 14.616 ( 5.716 -4.847 -1.665) 7.677======================= Grid point 1005 (305/344) =======================q-point: ( 0.73 0.40 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.713 ( -5.560 15.264 -0.555) 16.254 2.738 ( -1.471 3.425 0.019) 3.727 3.382 ( 1.385 -3.368 -2.081) 4.195 3.518 ( -2.836 12.768 -0.438) 13.086 3.714 ( -0.884 14.233 2.021) 14.403 3.972 ( 2.186 15.002 -0.008) 15.160 4.423 ( 10.139 2.409 1.738) 10.565 4.633 ( 7.209 0.976 -1.581) 7.445 4.697 ( 2.150 2.572 -0.786) 3.443 5.445 ( -9.446 7.573 2.699) 12.404 6.296 ( 8.731 5.690 1.436) 10.520 6.885 ( 11.769 -4.322 3.885) 13.125 8.025 ( 4.925 4.799 -0.215) 6.880 8.424 ( 0.280 -5.090 -2.108) 5.517 9.201 ( -11.588 10.398 1.240) 15.618 9.543 ( -2.244 5.450 2.331) 6.338 9.714 ( 3.346 2.543 -1.202) 4.371 9.831 ( 2.454 5.007 -1.395) 5.748 10.339 ( 9.859 1.572 -2.485) 10.288 10.424 ( 0.016 -7.928 1.624) 8.093 10.775 ( 0.295 -14.428 0.208) 14.432 12.627 ( -4.309 16.933 -0.139) 17.474 14.131 ( 0.156 -0.925 1.928) 2.145 14.640 ( 4.809 -7.368 -2.456) 9.135======================= Grid point 1016 (306/344) =======================q-point: ( 0.47 0.47 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.122 ( 0.000 11.485 11.296) 16.109 2.328 ( -0.000 15.695 -7.575) 17.427 2.336 ( 0.000 21.110 11.457) 24.019 2.611 ( -0.000 14.077 -16.612) 21.774 3.248 ( -0.000 0.803 -1.089) 1.353 3.545 ( -0.000 10.365 2.142) 10.584 3.861 ( 0.000 12.494 8.435) 15.075 4.118 ( -0.000 23.355 3.357) 23.595 4.225 ( -0.000 15.094 -6.915) 16.603 4.238 ( -0.000 5.917 0.063) 5.918 5.404 ( -0.000 29.959 -3.823) 30.202 6.670 ( 0.000 -12.338 0.916) 12.372 7.594 ( 0.000 -0.616 4.592) 4.633 8.724 ( 0.000 -1.827 0.286) 1.850 9.003 ( -0.000 2.965 0.937) 3.109 9.409 ( -0.000 5.113 -0.157) 5.115 9.618 ( -0.000 0.421 -11.784) 11.792 9.710 ( 0.000 5.995 9.553) 11.278 9.714 ( 0.000 -10.007 0.374) 10.014 11.179 ( 0.000 -16.299 -3.148) 16.600 11.575 ( 0.000 -2.829 0.700) 2.915 11.986 ( -0.000 3.973 -0.763) 4.045 14.184 ( 0.000 -1.203 3.304) 3.516 14.584 ( 0.000 -3.949 2.872) 4.883======================= Grid point 1017 (307/344) =======================q-point: ( 0.53 0.47 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.280 ( 7.700 6.001 1.131) 9.827 2.501 ( 1.238 12.997 3.065) 13.410 2.659 ( 11.756 18.160 -0.793) 21.648 2.784 ( 3.894 20.208 -3.888) 20.944 3.315 ( 6.655 2.331 -2.005) 7.331 3.612 ( 0.759 2.044 -1.431) 2.609 3.989 ( -1.673 11.447 7.885) 14.000 4.211 ( -1.037 8.178 -4.213) 9.258 4.344 ( 3.698 7.642 -0.736) 8.521 4.575 ( 6.293 32.364 2.957) 33.103 5.736 ( 6.856 24.325 -2.295) 25.377 6.530 ( -4.203 -7.507 0.044) 8.604 7.625 ( 1.054 3.500 3.011) 4.736 8.694 ( -1.690 -2.275 0.343) 2.855 9.082 ( 5.483 2.780 0.932) 6.217 9.457 ( -2.041 3.222 1.154) 3.985 9.525 ( -1.330 0.451 -4.174) 4.404 9.669 ( 2.254 0.513 -5.097) 5.597 9.873 ( 6.216 1.671 6.804) 9.367 10.979 ( -4.681 -14.974 -1.540) 15.765 11.350 ( -15.520 -4.040 -0.375) 16.042 12.160 ( 10.722 4.018 -0.590) 11.465 14.199 ( 4.222 -4.998 1.340) 6.678 14.548 ( -5.071 5.382 1.527) 7.551======================= Grid point 1018 (308/344) =======================q-point: ( 0.60 0.47 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.513 ( 10.217 7.410 0.167) 12.622 2.628 ( 2.379 6.506 0.032) 6.927 2.992 ( 7.812 15.531 -2.479) 17.560 3.168 ( 13.308 22.127 1.972) 25.896 3.502 ( 8.965 6.629 -0.929) 11.188 3.620 ( 1.271 -1.469 -0.662) 2.052 4.064 ( -2.202 8.368 3.983) 9.526 4.291 ( 1.570 8.426 -2.787) 9.013 4.489 ( 3.889 7.260 -0.379) 8.244 5.011 ( 9.259 25.320 1.815) 27.021 6.088 ( 12.053 12.531 -1.008) 17.416 6.396 ( -7.491 2.170 -0.039) 7.799 7.712 ( 2.811 6.008 1.609) 6.825 8.611 ( -3.629 -4.876 0.376) 6.090 9.241 ( 8.413 3.762 0.205) 9.218 9.441 ( -1.273 4.665 0.216) 4.840 9.594 ( 3.372 4.123 -1.716) 5.596 9.713 ( 2.689 0.982 -3.530) 4.545 9.985 ( 2.868 2.744 4.465) 5.974 10.725 ( -7.981 -11.747 0.766) 14.223 11.057 ( -11.117 -6.770 -1.804) 13.141 12.382 ( 8.793 6.773 -0.324) 11.104 14.215 ( 2.300 -3.902 -0.408) 4.547 14.527 ( -3.632 4.675 1.450) 6.095======================= Grid point 1019 (309/344) =======================q-point: ( 0.67 0.47 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.702 ( 2.441 4.176 -0.165) 4.840 2.767 ( 5.785 10.167 0.367) 11.703 3.251 ( 6.317 10.427 -1.037) 12.236 3.495 ( 2.518 4.572 -0.111) 5.220 3.706 ( 8.561 15.634 0.278) 17.826 3.773 ( 8.228 13.534 0.415) 15.845 4.121 ( 1.910 3.774 1.290) 4.422 4.410 ( 3.998 6.130 -1.558) 7.483 4.605 ( 2.541 4.426 -0.111) 5.105 5.388 ( 9.100 16.368 0.905) 18.749 6.285 ( -0.338 -0.224 0.223) 0.463 6.422 ( 6.512 11.429 0.188) 13.156 7.845 ( 4.439 7.174 0.676) 8.463 8.490 ( -3.614 -6.032 0.014) 7.032 9.419 ( 4.246 7.098 -0.331) 8.278 9.510 ( 3.453 5.371 -0.468) 6.402 9.673 ( 0.070 4.038 1.070) 4.178 9.749 ( 1.207 0.944 -1.333) 2.031 10.070 ( 3.467 3.841 0.427) 5.192 10.510 ( -4.941 -8.421 1.418) 9.866 10.822 ( -6.030 -10.020 -1.320) 11.768 12.601 ( 6.297 10.864 -0.140) 12.558 14.195 ( -1.336 -1.422 -0.075) 1.953 14.514 ( -0.216 -1.392 0.239) 1.428======================= Grid point 1020 (310/344) =======================q-point: ( 0.73 0.47 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.759 ( 0.619 2.887 -0.187) 2.959 2.944 ( 0.153 13.839 0.145) 13.841 3.331 ( -0.165 -3.250 -0.738) 3.337 3.606 ( 3.999 9.732 -0.409) 10.530 3.921 ( -1.486 16.500 0.546) 16.575 4.101 ( 3.431 17.975 -0.116) 18.300 4.254 ( 12.120 2.866 1.191) 12.511 4.539 ( 5.277 4.027 -1.113) 6.731 4.665 ( 2.144 0.252 -0.016) 2.159 5.627 ( 1.358 11.398 1.213) 11.543 6.293 ( -1.126 6.566 0.184) 6.665 6.630 ( 11.397 -3.356 1.302) 11.952 8.003 ( 4.811 7.347 0.450) 8.794 8.379 ( -1.985 -5.747 -1.115) 6.182 9.484 ( -6.808 10.530 0.149) 12.540 9.644 ( 2.588 4.500 1.392) 5.374 9.670 ( -0.962 3.132 1.952) 3.814 9.806 ( 4.958 0.341 -2.799) 5.704 10.185 ( 5.782 0.999 -0.617) 5.900 10.390 ( -1.784 -3.912 -0.397) 4.318 10.645 ( -1.632 -11.736 0.493) 11.860 12.810 ( 2.724 14.938 -0.092) 15.184 14.149 ( -2.400 -1.047 1.248) 2.901 14.488 ( 2.193 -7.040 -1.394) 7.504======================= Grid point 1032 (311/344) =======================q-point: ( 0.53 0.53 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.243 ( -0.000 3.237 -1.929) 3.769 2.610 ( -0.000 6.945 -5.313) 8.745 2.729 ( -0.000 19.333 7.948) 20.903 2.969 ( -0.000 22.900 1.605) 22.956 3.248 ( -0.000 0.519 -4.583) 4.612 3.615 ( -0.000 -0.167 -1.608) 1.616 4.144 ( 0.000 11.282 8.253) 13.978 4.313 ( -0.000 10.227 -5.764) 11.739 4.370 ( -0.000 6.982 0.270) 6.987 4.863 ( -0.000 31.313 1.872) 31.369 5.876 ( -0.000 14.772 -1.474) 14.845 6.542 ( -0.000 3.272 -0.191) 3.277 7.671 ( 0.000 5.762 3.612) 6.801 8.690 ( -0.000 -2.084 -1.627) 2.644 9.047 ( 0.000 0.152 1.704) 1.711 9.503 ( -0.000 1.164 -4.888) 5.025 9.535 ( 0.000 -3.843 3.817) 5.417 9.581 ( -0.000 2.135 -8.506) 8.770 9.919 ( 0.000 9.562 8.889) 13.055 10.882 ( 0.000 -11.572 -3.076) 11.974 11.470 ( 0.000 -7.305 0.318) 7.312 12.067 ( -0.000 4.264 -0.431) 4.286 14.130 ( 0.000 -2.029 -0.030) 2.029 14.649 ( -0.000 5.247 1.690) 5.513======================= Grid point 1033 (312/344) =======================q-point: ( 0.60 0.53 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.366 ( 10.486 3.397 -0.988) 11.067 2.656 ( 0.566 4.542 -2.884) 5.409 3.011 ( 7.719 15.962 5.509) 18.567 3.221 ( 4.538 18.108 -0.273) 18.670 3.353 ( 10.649 5.375 -2.566) 12.202 3.599 ( -0.235 -1.670 -0.666) 1.813 4.229 ( -3.618 9.201 3.886) 10.623 4.388 ( -1.332 10.584 -1.517) 10.775 4.489 ( 4.043 7.007 -0.459) 8.103 5.162 ( 2.762 22.311 -0.102) 22.481 6.011 ( 4.899 4.771 -1.098) 6.926 6.596 ( -4.302 14.388 -0.345) 15.022 7.753 ( 0.987 7.378 3.133) 8.076 8.626 ( -3.334 -4.074 -2.186) 5.700 9.109 ( 7.539 -1.296 1.260) 7.753 9.481 ( 2.382 -1.648 -1.177) 3.127 9.556 ( 0.466 4.304 -2.652) 5.077 9.646 ( 3.919 2.931 -3.321) 5.914 10.040 ( 0.348 9.213 7.576) 11.933 10.731 ( -4.755 -9.124 -2.537) 10.596 11.237 ( -14.460 -6.855 -0.305) 16.006 12.240 ( 12.086 4.131 -0.177) 12.774 14.138 ( 2.084 -1.009 -1.110) 2.568 14.663 ( -4.357 4.529 2.055) 6.612======================= Grid point 1034 (313/344) =======================q-point: ( 0.67 0.53 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.634 ( 13.901 4.815 0.496) 14.720 2.712 ( 2.789 2.617 -0.970) 3.946 3.270 ( 4.604 10.988 2.214) 12.118 3.469 ( 6.815 3.592 -1.833) 7.918 3.612 ( 9.407 4.807 -2.455) 10.846 3.699 ( 13.310 13.955 2.763) 19.482 4.243 ( -4.857 8.713 -0.410) 9.984 4.466 ( -1.058 8.890 1.098) 9.020 4.614 ( 2.573 5.208 0.020) 5.809 5.404 ( 6.336 11.588 -1.336) 13.275 6.149 ( 6.979 2.784 -0.830) 7.559 6.651 ( -7.379 15.575 -0.667) 17.248 7.865 ( 2.404 8.061 1.737) 8.589 8.503 ( -4.470 -5.217 -0.812) 6.918 9.274 ( 12.078 -1.102 0.209) 12.130 9.547 ( 4.373 2.155 -0.955) 4.968 9.610 ( 2.029 3.051 -2.512) 4.442 9.743 ( 3.338 3.842 -0.489) 5.113 10.136 ( -1.330 8.769 4.726) 10.050 10.538 ( -6.903 -7.109 -0.815) 9.943 10.916 ( -13.427 -6.855 -0.987) 15.108 12.514 ( 13.053 6.346 0.001) 14.514 14.157 ( 1.644 -1.642 -1.619) 2.832 14.604 ( -6.817 2.273 2.080) 7.481======================= Grid point 1048 (314/344) =======================q-point: ( 0.60 0.60 0.27)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.287 ( -0.000 2.001 -1.125) 2.296 2.682 ( -0.000 2.800 -2.355) 3.659 3.112 ( 0.000 14.703 9.184) 17.335 3.230 ( -0.000 0.331 -7.054) 7.061 3.419 ( -0.000 20.454 0.660) 20.465 3.580 ( 0.000 -2.214 -0.232) 2.226 4.356 ( -0.000 7.571 2.564) 7.993 4.507 ( -0.000 6.292 -0.032) 6.292 4.514 ( -0.000 10.649 -0.735) 10.674 5.302 ( -0.000 9.301 -1.496) 9.421 6.035 ( -0.000 9.154 -1.549) 9.284 6.795 ( -0.000 16.867 -1.083) 16.902 7.832 ( 0.000 8.078 3.959) 8.995 8.619 ( -0.000 -3.189 -4.418) 5.448 8.996 ( 0.000 -6.010 1.733) 6.255 9.419 ( -0.000 -1.218 -2.308) 2.610 9.618 ( -0.000 4.417 0.751) 4.481 9.641 ( -0.000 6.068 -3.245) 6.881 10.156 ( 0.000 10.405 6.955) 12.516 10.688 ( -0.000 -6.561 -3.552) 7.461 11.304 ( 0.000 -8.994 -0.003) 8.994 12.148 ( -0.000 3.893 -0.163) 3.897 14.123 ( -0.000 1.310 -1.424) 1.935 14.748 ( 0.000 3.457 2.350) 4.181======================= Grid point 1049 (315/344) =======================q-point: (-0.33 -0.40 -0.73)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.417 ( 12.367 2.086 -0.163) 12.543 2.705 ( 0.596 1.463 -0.109) 1.584 3.293 ( 7.295 4.243 -0.031) 8.439 3.326 ( 6.646 7.327 0.865) 9.930 3.559 ( 1.251 -0.306 -0.928) 1.587 3.670 ( 6.727 16.159 0.741) 17.519 4.398 ( -3.211 7.612 -0.574) 8.281 4.587 ( -0.490 7.961 2.282) 8.296 4.614 ( 2.196 5.937 -0.556) 6.354 5.358 ( 3.950 -1.740 -2.216) 4.852 6.162 ( 1.230 12.971 -2.031) 13.187 6.907 ( -4.770 13.815 -2.419) 14.815 7.926 ( 0.639 7.977 3.211) 8.623 8.534 ( -4.282 -3.400 -2.253) 5.913 9.031 ( 10.317 -6.003 0.140) 11.937 9.451 ( 4.159 0.465 -2.157) 4.708 9.659 ( 0.001 4.947 0.690) 4.995 9.727 ( 2.714 5.433 -0.709) 6.114 10.266 ( -0.898 9.893 5.202) 11.214 10.582 ( -4.852 -4.565 -3.050) 7.327 11.083 ( -12.732 -8.220 -0.194) 15.157 12.318 ( 13.248 3.596 -0.014) 13.727 14.137 ( 0.056 1.169 -1.733) 2.091 14.740 ( -4.799 2.178 2.530) 5.846======================= Grid point 1064 (316/344) =======================q-point: (-0.33 -0.33 -0.73)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.316 ( -0.000 1.247 0.097) 1.251 2.716 ( 0.000 1.024 1.443) 1.769 3.195 ( -0.000 -0.424 -7.259) 7.272 3.396 ( 0.000 9.553 7.971) 12.441 3.533 ( 0.000 -1.957 0.101) 1.959 3.772 ( -0.000 14.157 -1.719) 14.261 4.497 ( -0.000 6.542 -0.119) 6.543 4.612 ( -0.000 4.189 -0.561) 4.226 4.699 ( -0.000 7.386 1.175) 7.479 5.258 ( 0.000 -8.866 -2.033) 9.096 6.298 ( -0.000 15.011 -2.783) 15.266 7.060 ( -0.000 9.388 -4.973) 10.624 8.008 ( 0.000 7.178 4.376) 8.407 8.552 ( -0.000 -1.256 -3.134) 3.377 8.862 ( 0.000 -6.866 0.944) 6.931 9.421 ( -0.000 1.336 -1.415) 1.946 9.696 ( -0.000 3.055 0.403) 3.081 9.767 ( -0.000 6.327 0.993) 6.405 10.373 ( 0.000 7.433 3.311) 8.137 10.590 ( -0.000 -0.786 -2.939) 3.042 11.119 ( 0.000 -9.366 0.144) 9.367 12.217 ( -0.000 2.895 -0.012) 2.896 14.154 ( -0.000 2.115 -1.761) 2.752 14.807 ( 0.000 1.388 2.728) 3.060======================= Grid point 1209 (317/344) =======================q-point: ( 0.33 0.33 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 344Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.030 ( 0.000 -0.000 26.697) 26.697 1.030 ( 0.000 -0.000 26.697) 26.697 1.989 ( 0.000 -0.000 58.115) 58.115 2.094 ( -0.000 0.000 -19.135) 19.135 2.094 ( -0.000 0.000 -19.135) 19.135 3.193 ( 0.000 0.000 5.932) 5.932 3.193 ( 0.000 -0.000 5.932) 5.932 3.692 ( -0.000 0.000 -38.844) 38.844 4.076 ( -0.000 0.000 -1.497) 1.497 4.076 ( -0.000 0.000 -1.497) 1.497 4.373 ( -0.000 0.000 -4.026) 4.026 7.104 ( 0.000 -0.000 6.600) 6.600 8.883 ( 0.000 0.000 0.006) 0.006 8.883 ( 0.000 -0.000 0.006) 0.006 9.225 ( 0.000 0.000 0.126) 0.126 9.225 ( 0.000 -0.000 0.126) 0.126 9.491 ( 0.000 -0.000 5.716) 5.716 9.765 ( -0.000 0.000 -6.021) 6.021 10.057 ( 0.000 0.000 1.537) 1.537 10.057 ( 0.000 -0.000 1.537) 1.537 11.865 ( -0.000 0.000 -1.199) 1.199 11.865 ( -0.000 -0.000 -1.199) 1.199 13.677 ( 0.000 -0.000 0.010) 0.010 16.961 ( 0.000 -0.000 0.107) 0.107======================= Grid point 1210 (318/344) =======================q-point: ( 0.40 0.33 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.273 ( 14.051 8.113 22.031) 27.361 1.337 ( 17.783 10.267 23.735) 31.385 2.088 ( 7.967 4.600 -10.707) 14.117 2.128 ( 5.755 3.323 -19.678) 20.770 2.403 ( 19.542 11.283 39.051) 45.102 3.190 ( -0.889 -0.513 5.939) 6.028 3.349 ( 10.374 5.989 3.234) 12.408 3.643 ( 4.697 2.712 -32.373) 32.824 4.091 ( 1.596 0.921 -1.285) 2.246 4.216 ( 4.689 2.707 -0.647) 5.453 4.373 ( 7.800 4.503 -7.796) 11.911 7.072 ( -4.235 -2.445 5.728) 7.531 8.291 ( -35.674 -20.596 19.256) 45.471 8.912 ( 2.041 1.178 -0.598) 2.431 8.948 ( -4.974 -2.872 -9.881) 11.429 9.239 ( 1.452 0.838 0.614) 1.786 9.425 ( -2.543 -1.468 3.380) 4.477 9.738 ( 3.166 1.828 -6.038) 7.059 10.004 ( -4.315 -2.491 1.972) 5.359 10.935 ( 30.270 17.476 -5.735) 35.420 11.841 ( -0.181 -0.104 -3.839) 3.845 11.886 ( 1.712 0.989 -1.528) 2.499 13.799 ( 10.103 5.833 0.085) 11.667 16.064 ( -59.448 -34.322 22.275) 72.168======================= Grid point 1211 (319/344) =======================q-point: ( 0.47 0.33 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.686 ( 16.128 9.312 17.537) 25.581 1.815 ( 18.302 10.567 20.086) 29.156 2.266 ( 10.118 5.842 -20.113) 23.260 2.327 ( 14.179 8.186 -17.866) 24.233 3.015 ( 24.318 14.040 27.963) 39.629 3.180 ( -1.035 -0.597 6.048) 6.165 3.620 ( 12.891 7.443 0.089) 14.885 3.805 ( 13.689 7.903 -17.970) 23.933 4.147 ( 3.434 1.983 -0.915) 4.069 4.162 ( -3.300 -1.905 -2.836) 4.750 4.808 ( 25.390 14.659 -6.555) 30.042 6.918 ( -10.068 -5.813 3.878) 12.255 7.775 ( -12.479 -7.205 6.814) 15.939 8.821 ( -4.556 -2.631 -5.393) 7.534 8.970 ( 3.101 1.791 -1.536) 3.897 9.293 ( 2.865 1.654 1.584) 3.668 9.395 ( -1.086 -0.627 8.126) 8.222 9.814 ( 4.638 2.678 -9.488) 10.895 9.874 ( -7.098 -4.098 2.288) 8.510 11.192 ( -3.190 -1.842 6.994) 7.905 11.823 ( -1.791 -1.034 -11.342) 11.529 11.934 ( 2.664 1.538 -1.857) 3.593 14.078 ( 11.879 6.858 -0.552) 13.728 14.942 ( -36.618 -21.142 19.605) 46.607======================= Grid point 1212 (320/344) =======================q-point: ( 0.53 0.33 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.027 ( 9.850 5.687 11.120) 15.907 2.244 ( 14.897 8.601 13.095) 21.619 2.517 ( 15.120 8.729 -16.350) 23.919 2.637 ( 15.754 9.095 -12.324) 21.972 3.172 ( -0.777 -0.449 6.243) 6.307 3.487 ( 11.167 6.447 6.534) 14.455 3.954 ( 13.078 7.551 1.573) 15.183 4.099 ( 6.687 3.861 3.043) 8.299 4.245 ( 5.126 2.960 -0.553) 5.945 4.251 ( 21.531 12.431 -8.209) 26.182 5.409 ( 25.963 14.990 -4.143) 30.265 6.665 ( -10.781 -6.224 1.285) 12.515 7.658 ( 0.084 0.048 -1.069) 1.073 8.722 ( -3.579 -2.066 0.486) 4.161 9.040 ( 3.031 1.750 -2.534) 4.321 9.372 ( 3.207 1.852 3.397) 5.026 9.412 ( 1.085 0.626 8.088) 8.185 9.701 ( -7.728 -4.461 1.419) 9.035 9.910 ( 5.730 3.308 -10.199) 12.157 11.021 ( -10.691 -6.172 9.983) 15.876 11.689 ( -6.998 -4.040 -8.301) 11.585 11.998 ( 3.240 1.870 -1.796) 4.149 14.200 ( -3.665 -2.116 2.150) 4.747 14.553 ( 0.009 0.005 5.381) 5.381======================= Grid point 1213 (321/344) =======================q-point: ( 0.60 0.33 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.201 ( 4.507 2.602 3.915) 6.512 2.533 ( 8.373 4.834 5.121) 10.941 2.857 ( 15.833 9.141 -10.366) 21.016 3.012 ( 18.002 10.394 -3.895) 21.149 3.174 ( -0.301 -0.174 6.343) 6.353 3.607 ( 0.641 0.370 -0.541) 0.917 4.175 ( 7.742 4.470 5.117) 10.300 4.310 ( 11.018 6.361 -6.570) 14.318 4.374 ( 5.890 3.401 -0.192) 6.804 4.852 ( 25.528 14.739 3.265) 29.658 5.879 ( 12.202 7.045 -1.891) 14.215 6.534 ( 2.668 1.540 0.832) 3.191 7.722 ( 5.220 3.014 -3.679) 7.062 8.649 ( -3.358 -1.939 4.239) 5.745 9.078 ( 0.137 0.079 -2.963) 2.967 9.422 ( -1.161 -0.670 7.085) 7.211 9.489 ( 4.349 2.511 5.084) 7.146 9.577 ( -0.933 -0.539 -2.426) 2.654 10.038 ( 7.173 4.141 -8.768) 12.062 10.808 ( -8.742 -5.047 7.428) 12.533 11.499 ( -7.983 -4.609 -3.640) 9.911 12.073 ( 3.470 2.003 -1.277) 4.205 14.114 ( -2.068 -1.194 2.313) 3.325 14.665 ( 5.497 3.174 -0.550) 6.371======================= Grid point 1214 (322/344) =======================q-point: ( 0.67 0.33 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.279 ( 2.182 1.260 0.967) 2.699 2.671 ( 3.454 1.994 0.908) 4.090 3.165 ( 9.717 5.610 -2.110) 11.417 3.189 ( 2.872 1.658 0.518) 3.356 3.419 ( 16.823 9.713 0.478) 19.432 3.582 ( -1.691 -0.976 -0.849) 2.129 4.354 ( 6.661 3.846 2.866) 8.208 4.506 ( 5.330 3.077 0.203) 6.158 4.530 ( 8.920 5.150 -4.978) 11.440 5.286 ( 8.157 4.709 3.347) 9.996 6.026 ( 7.265 4.195 0.983) 8.447 6.784 ( 14.054 8.114 2.122) 16.366 7.860 ( 7.025 4.056 -4.252) 9.159 8.587 ( -2.709 -1.564 4.911) 5.823 9.007 ( -5.523 -3.189 -1.644) 6.586 9.399 ( -0.243 -0.140 3.663) 3.674 9.624 ( 3.461 1.998 -1.209) 4.175 9.625 ( 6.345 3.663 1.652) 7.510 10.201 ( 8.303 4.794 -6.427) 11.543 10.659 ( -5.356 -3.092 4.945) 7.918 11.308 ( -8.106 -4.680 -1.046) 9.418 12.150 ( 3.263 1.884 -0.550) 3.807 14.112 ( 1.101 0.636 1.754) 2.167 14.763 ( 3.198 1.846 -2.083) 4.240======================= Grid point 1225 (323/344) =======================q-point: ( 0.40 0.40 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.318 ( 0.000 16.233 22.138) 27.452 1.394 ( 0.000 20.477 22.063) 30.101 2.049 ( -0.000 4.256 -17.449) 17.960 2.096 ( -0.000 10.320 -17.340) 20.179 2.502 ( 0.000 22.445 44.237) 49.605 3.224 ( 0.000 0.299 3.629) 3.642 3.334 ( 0.000 10.633 4.767) 11.652 3.550 ( -0.000 4.419 -34.672) 34.952 4.086 ( -0.000 1.704 -1.014) 1.983 4.223 ( -0.000 6.779 -1.145) 6.875 4.354 ( -0.000 7.745 -6.324) 9.999 7.086 ( 0.000 -4.752 5.045) 6.931 8.327 ( 0.000 -44.169 18.028) 47.706 8.895 ( -0.000 1.501 0.395) 1.552 8.898 ( -0.000 -6.193 -7.896) 10.035 9.252 ( -0.000 2.321 -0.115) 2.324 9.455 ( 0.000 1.567 1.642) 2.270 9.713 ( -0.000 0.249 -4.603) 4.610 10.024 ( 0.000 -4.244 0.838) 4.326 10.962 ( -0.000 41.786 -8.044) 42.553 11.804 ( 0.000 -6.735 -0.310) 6.743 11.872 ( -0.000 1.472 -0.725) 1.641 13.796 ( -0.000 11.131 0.292) 11.135 16.122 ( 0.000 -65.092 17.111) 67.303======================= Grid point 1226 (324/344) =======================q-point: ( 0.47 0.40 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.653 ( 10.111 19.174 18.793) 28.689 1.745 ( 10.119 18.505 20.466) 29.389 2.129 ( 7.529 6.746 -17.175) 19.929 2.224 ( 5.508 13.384 -20.945) 25.459 2.952 ( 11.894 23.846 33.794) 43.037 3.229 ( -0.815 1.906 3.765) 4.298 3.524 ( 7.152 10.929 -0.500) 13.071 3.630 ( 9.401 9.094 -22.286) 25.840 4.128 ( 2.149 3.258 -0.634) 3.954 4.189 ( -2.903 -3.422 -2.481) 5.128 4.637 ( 13.563 23.232 -5.580) 27.474 6.987 ( -5.227 -8.654 3.658) 10.752 7.871 ( -10.437 -20.971 9.410) 25.244 8.816 ( -1.432 -4.772 -4.473) 6.696 8.947 ( 2.781 2.665 -0.216) 3.858 9.290 ( 1.211 3.450 0.352) 3.673 9.468 ( -2.994 3.422 5.920) 7.464 9.684 ( 1.331 -3.766 -7.286) 8.309 9.983 ( -1.289 -1.458 0.737) 2.081 11.270 ( -1.156 11.855 -1.125) 11.965 11.674 ( -1.411 -13.560 -3.041) 13.968 11.968 ( 5.024 6.220 -2.282) 8.315 13.997 ( 7.874 12.344 0.308) 14.645 15.256 ( -27.663 -44.841 16.100) 55.092======================= Grid point 1227 (325/344) =======================q-point: ( 0.53 0.40 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.032 ( 6.554 16.044 13.846) 22.183 2.152 ( 12.138 14.010 16.185) 24.608 2.364 ( 12.418 13.269 -16.897) 24.815 2.456 ( 11.882 11.650 -15.783) 22.935 3.238 ( -1.229 4.242 4.376) 6.218 3.417 ( 9.009 13.346 12.132) 20.161 3.802 ( 11.821 8.220 1.465) 14.473 3.955 ( 18.338 15.450 -5.782) 24.667 4.124 ( 0.674 0.838 -4.670) 4.793 4.225 ( 3.627 6.337 -0.500) 7.319 5.174 ( 20.856 23.216 -3.718) 31.429 6.759 ( -9.160 -10.841 1.551) 14.277 7.656 ( -2.094 -4.594 1.165) 5.181 8.743 ( -1.885 -2.914 -0.812) 3.565 9.030 ( 2.449 4.723 -1.457) 5.515 9.362 ( 2.403 4.037 1.369) 4.894 9.444 ( -3.043 0.647 8.625) 9.169 9.672 ( 3.171 -4.812 -5.925) 8.266 9.950 ( -3.433 4.038 -2.389) 5.814 11.172 ( -11.895 -5.036 9.362) 15.953 11.519 ( 3.423 -17.691 -8.580) 19.958 12.087 ( 0.221 9.051 -2.386) 9.363 14.238 ( 4.253 8.711 -0.458) 9.705 14.593 ( -12.563 -17.629 8.409) 23.223======================= Grid point 1228 (326/344) =======================q-point: ( 0.60 0.40 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.248 ( 1.112 11.852 4.740) 12.813 2.468 ( 7.912 8.253 7.322) 13.576 2.710 ( 13.102 15.619 -10.003) 22.709 2.817 ( 16.677 14.181 -5.566) 22.587 3.270 ( -2.936 7.690 4.692) 9.474 3.594 ( 1.918 2.576 1.056) 3.380 4.047 ( 10.565 1.833 1.060) 10.775 4.187 ( 7.746 5.138 -2.291) 9.573 4.342 ( 4.957 6.867 -0.275) 8.474 4.589 ( 24.043 20.527 0.878) 31.626 5.733 ( 17.651 18.004 -1.833) 25.280 6.527 ( -4.635 -7.430 0.528) 8.773 7.662 ( 3.487 1.728 -2.208) 4.474 8.681 ( -2.429 -2.855 2.241) 4.367 9.105 ( 0.135 5.794 -2.385) 6.267 9.439 ( 3.306 -0.721 4.045) 5.273 9.459 ( 0.677 4.310 4.427) 6.215 9.636 ( -3.570 0.040 0.451) 3.599 9.969 ( 2.484 4.778 -7.449) 9.191 10.913 ( -9.980 -9.094 7.564) 15.476 11.385 ( 2.718 -17.419 -4.836) 18.281 12.164 ( -1.951 11.027 -1.243) 11.267 14.194 ( -7.311 0.342 2.039) 7.598 14.557 ( 8.165 -0.756 0.225) 8.203======================= Grid point 1229 (327/344) =======================q-point: ( 0.67 0.40 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.358 ( -2.179 11.464 1.225) 11.734 2.638 ( 3.965 3.769 2.427) 5.984 3.053 ( 11.268 13.160 -6.883) 18.642 3.212 ( 9.153 11.079 2.446) 14.578 3.339 ( 2.112 13.929 1.651) 14.185 3.597 ( -1.224 -0.781 -0.334) 1.490 4.235 ( 9.534 0.533 2.140) 9.785 4.397 ( 10.140 4.744 -4.321) 12.000 4.487 ( 3.906 7.036 0.070) 8.048 5.153 ( 17.495 13.322 2.683) 22.153 6.007 ( 1.345 6.421 0.176) 6.562 6.592 ( 14.397 3.446 0.891) 14.831 7.774 ( 6.233 4.093 -3.163) 8.100 8.607 ( -2.436 -4.419 3.436) 6.105 9.120 ( -5.047 5.462 -1.967) 7.693 9.462 ( -3.705 2.246 4.192) 6.029 9.542 ( 5.364 2.333 1.560) 6.054 9.632 ( 0.871 5.100 0.989) 5.268 10.089 ( 7.540 4.196 -7.189) 11.231 10.707 ( -5.447 -7.961 4.601) 10.687 11.240 ( 0.935 -16.402 -1.349) 16.484 12.241 ( -2.557 12.479 -0.489) 12.747 14.128 ( -2.002 1.195 1.689) 2.879 14.676 ( 6.358 -1.381 -1.742) 6.735======================= Grid point 1241 (328/344) =======================q-point: ( 0.47 0.47 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.800 ( 0.000 21.510 18.532) 28.393 1.924 ( 0.000 22.347 18.452) 28.981 2.091 ( -0.000 6.877 -15.287) 16.762 2.277 ( -0.000 15.202 -21.817) 26.591 3.192 ( 0.000 25.839 27.109) 37.451 3.238 ( 0.000 0.171 0.511) 0.539 3.600 ( -0.000 17.234 -9.886) 19.868 3.626 ( -0.000 13.745 -5.144) 14.676 4.139 ( -0.000 3.887 -0.246) 3.894 4.172 ( -0.000 -3.160 -3.605) 4.794 4.781 ( -0.000 29.462 -4.037) 29.737 6.937 ( 0.000 -11.985 2.386) 12.221 7.764 ( 0.000 -17.725 7.762) 19.350 8.779 ( 0.000 -3.758 -1.477) 4.038 8.943 ( -0.000 2.915 0.909) 3.054 9.315 ( -0.000 4.031 -0.446) 4.056 9.535 ( -0.000 4.739 -1.487) 4.967 9.685 ( -0.000 -0.589 -0.804) 0.996 9.900 ( 0.000 -8.109 0.062) 8.109 11.380 ( -0.000 3.128 -11.769) 12.178 11.636 ( 0.000 -6.960 7.557) 10.274 11.915 ( -0.000 2.972 -0.244) 2.982 14.058 ( -0.000 12.494 1.444) 12.578 15.051 ( 0.000 -42.498 8.909) 43.422======================= Grid point 1242 (329/344) =======================q-point: ( 0.53 0.47 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.117 ( 6.115 14.216 15.309) 21.769 2.195 ( 5.416 16.721 5.502) 18.417 2.261 ( 10.407 17.891 -4.524) 21.187 2.421 ( 4.344 15.095 -17.455) 23.482 3.267 ( 2.587 2.230 0.128) 3.418 3.473 ( 3.910 12.591 5.966) 14.471 3.778 ( 2.112 11.202 4.617) 12.299 3.908 ( 9.437 28.357 -1.356) 29.916 4.130 ( -1.138 0.841 -4.654) 4.865 4.222 ( 3.821 6.075 -0.072) 7.177 5.165 ( 9.844 29.700 -2.513) 31.389 6.764 ( -5.040 -13.472 0.935) 14.414 7.639 ( -1.305 -5.358 3.509) 6.536 8.738 ( -0.919 -2.395 -0.089) 2.566 9.015 ( 3.805 3.788 0.729) 5.418 9.372 ( 1.528 4.572 -0.045) 4.820 9.560 ( -5.741 -4.160 -3.640) 7.969 9.590 ( -0.299 5.198 1.051) 5.311 9.929 ( 6.373 -3.849 1.022) 7.514 11.301 ( 0.402 -14.283 -9.034) 16.905 11.408 ( -17.057 -3.430 7.227) 18.840 12.074 ( 8.533 4.750 -0.486) 9.778 14.225 ( 6.217 7.574 1.562) 9.922 14.628 ( -10.655 -19.795 3.265) 22.716======================= Grid point 1243 (330/344) =======================q-point: ( 0.60 0.47 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.335 ( 5.186 10.400 1.801) 11.761 2.461 ( 5.388 10.442 5.020) 12.778 2.654 ( 10.302 17.358 -6.762) 21.288 2.716 ( 14.014 21.619 -1.261) 25.795 3.365 ( 3.026 6.668 0.826) 7.370 3.609 ( 1.518 3.680 0.459) 4.007 3.927 ( 4.645 6.001 1.764) 7.791 4.145 ( 2.570 4.964 -1.261) 5.730 4.322 ( 6.036 10.574 -0.369) 12.181 4.485 ( 14.580 24.805 0.724) 28.781 5.660 ( 14.560 25.167 -1.105) 29.096 6.533 ( -6.434 -11.025 0.125) 12.766 7.632 ( 1.652 1.849 0.445) 2.519 8.691 ( -1.871 -2.906 0.622) 3.512 9.137 ( 4.022 6.076 -0.288) 7.292 9.408 ( -1.057 -0.849 1.062) 1.722 9.495 ( 1.390 4.307 0.315) 4.537 9.655 ( 1.787 3.336 -1.182) 3.965 9.980 ( 1.436 0.173 -0.317) 1.481 11.008 ( -11.191 -15.162 2.934) 19.072 11.201 ( -3.233 -8.800 -2.836) 9.795 12.243 ( 4.343 7.276 -0.478) 8.487 14.339 ( -5.139 -8.306 1.316) 9.856 14.410 ( 4.013 6.438 0.193) 7.589======================= Grid point 1244 (331/344) =======================q-point: ( 0.67 0.47 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.512 ( 1.246 12.838 0.298) 12.902 2.624 ( 3.668 5.715 1.371) 6.928 2.989 ( 10.711 14.344 -1.572) 17.971 3.179 ( 12.731 21.696 -1.333) 25.191 3.492 ( 0.390 11.758 1.946) 11.924 3.618 ( -1.681 0.719 -0.059) 1.829 4.077 ( 8.260 1.440 0.233) 8.387 4.286 ( 6.987 5.790 -1.490) 9.196 4.487 ( 4.325 7.055 0.034) 8.275 5.014 ( 16.877 20.557 0.884) 26.612 6.084 ( 4.698 16.757 0.060) 17.404 6.396 ( 5.574 -5.283 0.203) 7.683 7.721 ( 4.379 4.995 -1.098) 6.733 8.609 ( -2.940 -5.327 1.085) 6.180 9.245 ( -0.674 8.777 -1.067) 8.867 9.441 ( 4.988 1.421 0.041) 5.187 9.579 ( 0.327 5.405 2.610) 6.011 9.695 ( -1.242 3.682 1.869) 4.312 10.014 ( 3.056 2.584 -4.262) 5.846 10.720 ( -6.865 -11.742 2.286) 13.792 11.054 ( -0.256 -13.587 -0.951) 13.623 12.382 ( 1.518 10.961 -0.225) 11.068 14.210 ( -4.993 0.071 1.110) 5.115 14.535 ( 6.353 -0.966 -1.059) 6.513======================= Grid point 1257 (332/344) =======================q-point: ( 0.53 0.53 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.153 ( -0.000 5.172 -3.539) 6.267 2.325 ( -0.000 22.488 8.068) 23.891 2.388 ( -0.000 15.011 0.575) 15.022 2.528 ( -0.000 20.157 -4.823) 20.726 3.234 ( -0.000 0.020 -2.937) 2.937 3.547 ( -0.000 7.557 -1.554) 7.715 3.914 ( 0.000 13.302 7.085) 15.071 4.138 ( -0.000 11.645 1.537) 11.746 4.186 ( -0.000 28.031 -3.139) 28.206 4.239 ( -0.000 5.997 0.296) 6.004 5.387 ( -0.000 30.311 -1.145) 30.333 6.674 ( 0.000 -12.765 0.147) 12.766 7.623 ( 0.000 -1.121 3.981) 4.136 8.725 ( 0.000 -1.908 0.024) 1.908 9.011 ( 0.000 3.061 1.611) 3.459 9.404 ( -0.000 5.013 -1.311) 5.182 9.542 ( -0.000 0.159 -11.052) 11.053 9.714 ( 0.000 -9.910 -0.385) 9.918 9.775 ( 0.000 6.614 9.976) 11.970 11.143 ( -0.000 -14.507 -7.301) 16.241 11.595 ( 0.000 -4.489 4.851) 6.609 11.984 ( -0.000 3.882 0.182) 3.886 14.201 ( 0.000 -1.667 1.753) 2.419 14.593 ( 0.000 -4.625 -0.074) 4.626======================= Grid point 1258 (333/344) =======================q-point: ( 0.60 0.53 0.33)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.274 ( 8.499 5.479 -2.718) 10.471 2.506 ( 1.748 9.894 -2.784) 10.426 2.662 ( 9.229 19.761 3.539) 22.095 2.786 ( 4.703 22.973 3.427) 23.699 3.297 ( 7.387 1.656 -3.441) 8.316 3.602 ( 0.978 2.033 -1.381) 2.645 4.033 ( -2.705 11.347 4.982) 12.685 4.188 ( -0.365 7.769 -2.318) 8.116 4.341 ( 3.559 7.781 -0.165) 8.558 4.589 ( 6.191 32.279 1.011) 32.883 5.727 ( 6.882 24.494 -0.221) 25.443 6.529 ( -4.210 -7.669 -0.295) 8.754 7.645 ( 0.445 3.522 2.816) 4.531 8.692 ( -1.407 -2.743 -0.983) 3.235 9.091 ( 5.204 2.855 1.716) 6.179 9.457 ( -1.863 3.210 -1.266) 3.921 9.493 ( 0.565 1.255 -5.305) 5.480 9.645 ( 2.184 -1.667 -2.221) 3.533 9.920 ( 4.498 3.463 7.225) 9.188 10.956 ( -3.630 -14.199 -5.207) 15.554 11.358 ( -16.146 -5.020 2.775) 17.135 12.159 ( 10.651 3.985 0.356) 11.378 14.202 ( 4.052 -5.777 -0.357) 7.066 14.555 ( -4.983 5.795 0.699) 7.675======================= Grid point 1273 (334/344) =======================q-point: (-0.40 -0.40 -0.67)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.225 ( -0.000 3.854 -3.290) 5.067 2.571 ( -0.000 7.734 -6.015) 9.798 2.789 ( 0.000 19.273 9.753) 21.600 2.987 ( -0.000 22.558 3.379) 22.810 3.214 ( -0.000 -0.084 -5.626) 5.627 3.607 ( -0.000 0.169 -0.679) 0.700 4.187 ( -0.000 10.212 2.956) 10.631 4.287 ( -0.000 11.129 -0.717) 11.152 4.372 ( -0.000 6.918 0.262) 6.923 4.866 ( -0.000 30.532 -0.804) 30.542 5.872 ( -0.000 14.614 0.275) 14.617 6.539 ( -0.000 3.207 -0.647) 3.272 7.696 ( 0.000 5.780 3.922) 6.985 8.674 ( -0.000 -2.977 -3.137) 4.325 9.061 ( 0.000 0.195 2.371) 2.379 9.466 ( -0.000 -0.750 -6.172) 6.218 9.529 ( -0.000 3.571 -6.960) 7.823 9.558 ( 0.000 -1.856 3.214) 3.711 9.978 ( 0.000 8.962 8.989) 12.694 10.853 ( -0.000 -10.921 -5.666) 12.303 11.479 ( 0.000 -8.137 2.278) 8.450 12.067 ( -0.000 4.150 0.467) 4.176 14.126 ( -0.000 -2.411 -1.268) 2.724 14.659 ( -0.000 5.693 1.224) 5.823======================= Grid point 1451 (335/344) =======================q-point: ( 0.40 0.40 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 344Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.193 ( 0.000 -0.000 21.360) 21.360 1.193 ( 0.000 -0.000 21.360) 21.360 1.972 ( -0.000 0.000 -16.806) 16.806 1.972 ( -0.000 0.000 -16.806) 16.806 2.371 ( 0.000 -0.000 56.274) 56.274 3.226 ( 0.000 0.000 3.765) 3.765 3.226 ( 0.000 -0.000 3.765) 3.765 3.409 ( -0.000 0.000 -45.593) 45.593 4.067 ( -0.000 0.000 -1.055) 1.055 4.067 ( -0.000 0.000 -1.055) 1.055 4.353 ( -0.000 0.000 -2.202) 2.202 7.142 ( 0.000 -0.000 4.698) 4.698 8.883 ( 0.000 0.000 -0.013) 0.013 8.883 ( -0.000 -0.000 -0.013) 0.013 9.226 ( 0.000 0.000 0.099) 0.099 9.226 ( 0.000 -0.000 0.099) 0.099 9.529 ( 0.000 -0.000 5.591) 5.591 9.724 ( -0.000 0.000 -5.899) 5.899 10.065 ( 0.000 0.000 1.052) 1.052 10.065 ( 0.000 -0.000 1.052) 1.052 11.858 ( -0.000 0.000 -0.822) 0.822 11.858 ( -0.000 -0.000 -0.822) 0.822 13.677 ( 0.000 -0.000 0.007) 0.007 16.961 ( 0.000 -0.000 0.073) 0.073======================= Grid point 1452 (336/344) =======================q-point: ( 0.47 0.40 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.407 ( 13.246 7.648 17.343) 23.124 1.485 ( 17.828 10.293 19.667) 28.471 1.990 ( 6.447 3.722 -15.064) 16.803 2.003 ( 5.241 3.026 -16.764) 17.823 2.696 ( 15.720 9.076 45.875) 49.336 3.222 ( -0.664 -0.383 3.765) 3.843 3.347 ( 8.159 4.710 -12.442) 15.606 3.420 ( 10.258 5.923 -25.687) 28.287 4.084 ( 1.638 0.946 -0.849) 2.074 4.213 ( 5.583 3.223 -0.225) 6.450 4.334 ( 5.939 3.429 -3.987) 7.932 7.104 ( -4.395 -2.537 3.582) 6.211 8.397 ( -37.431 -21.611 12.186) 44.907 8.887 ( -4.155 -2.399 -7.984) 9.314 8.907 ( 1.818 1.050 -0.730) 2.223 9.244 ( 1.650 0.953 0.623) 2.005 9.445 ( -0.610 -0.352 2.460) 2.559 9.705 ( 1.668 0.963 -3.790) 4.251 10.016 ( -4.131 -2.385 1.568) 5.021 10.909 ( 31.776 18.346 -2.030) 36.748 11.820 ( -2.269 -1.310 -2.413) 3.562 11.877 ( 1.568 0.905 -1.185) 2.164 13.800 ( 10.052 5.804 -0.005) 11.608 16.174 ( -55.110 -31.818 11.108) 64.597======================= Grid point 1453 (337/344) =======================q-point: ( 0.53 0.40 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.800 ( 15.610 9.013 16.334) 24.325 1.951 ( 17.088 9.866 19.826) 27.972 2.133 ( 9.748 5.628 -19.235) 22.286 2.208 ( 14.708 8.492 -17.080) 24.087 3.199 ( 17.904 10.337 26.235) 33.402 3.214 ( -0.751 -0.434 4.023) 4.116 3.588 ( 17.278 9.975 -11.989) 23.276 3.696 ( 15.263 8.812 -11.570) 21.082 4.141 ( 3.488 2.014 -0.631) 4.077 4.151 ( -3.796 -2.192 -0.557) 4.419 4.775 ( 25.604 14.783 -3.163) 29.734 6.938 ( -10.543 -6.087 2.195) 12.370 7.805 ( -14.920 -8.614 2.060) 17.351 8.791 ( -3.252 -1.877 -3.410) 5.072 8.960 ( 2.844 1.642 -1.527) 3.621 9.303 ( 3.188 1.841 1.347) 3.921 9.451 ( -0.183 -0.105 8.320) 8.323 9.754 ( 3.713 2.144 -8.379) 9.412 9.888 ( -7.073 -4.084 1.800) 8.364 11.244 ( -0.861 -0.497 8.675) 8.732 11.752 ( -2.718 -1.569 -10.004) 10.485 11.923 ( 2.595 1.498 -1.367) 3.294 14.073 ( 11.632 6.716 -0.829) 13.457 15.042 ( -38.229 -22.071 10.226) 45.312======================= Grid point 1454 (338/344) =======================q-point: ( 0.60 0.40 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.100 ( 7.055 4.073 10.338) 13.163 2.333 ( 12.324 7.115 12.974) 19.257 2.410 ( 17.382 10.036 -15.324) 25.252 2.559 ( 18.189 10.502 -10.297) 23.392 3.209 ( -0.479 -0.276 4.678) 4.710 3.525 ( 7.558 4.364 4.669) 9.898 3.949 ( 12.488 7.210 -3.163) 14.763 4.124 ( 3.876 2.238 4.157) 6.108 4.201 ( 28.290 16.333 -6.155) 33.241 4.241 ( 5.194 2.999 -0.473) 6.016 5.389 ( 26.262 15.163 -1.682) 30.372 6.672 ( -11.093 -6.404 0.727) 12.829 7.645 ( -0.768 -0.444 -2.716) 2.857 8.724 ( -2.324 -1.341 0.221) 2.692 9.024 ( 2.799 1.616 -2.158) 3.886 9.391 ( 3.930 2.269 2.427) 5.147 9.472 ( 0.463 0.267 9.794) 9.808 9.709 ( -8.255 -4.766 1.037) 9.588 9.842 ( 5.819 3.360 -10.163) 12.184 11.086 ( -11.330 -6.541 9.389) 16.103 11.636 ( -5.498 -3.174 -7.276) 9.656 11.989 ( 3.290 1.900 -1.093) 3.953 14.207 ( -2.321 -1.340 0.001) 2.680 14.582 ( -2.857 -1.649 3.097) 4.525======================= Grid point 1467 (339/344) =======================q-point: ( 0.47 0.47 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.445 ( 0.000 15.837 14.361) 21.379 1.525 ( 0.000 20.866 15.822) 26.186 1.948 ( -0.000 4.286 -11.209) 12.000 1.978 ( -0.000 8.050 -15.588) 17.544 2.807 ( 0.000 17.778 45.997) 49.313 3.240 ( 0.000 -0.088 1.202) 1.206 3.285 ( -0.000 8.830 -38.011) 39.023 3.370 ( -0.000 11.337 -0.061) 11.337 4.081 ( -0.000 1.815 -0.445) 1.868 4.217 ( -0.000 7.306 -0.791) 7.349 4.325 ( -0.000 6.011 -2.528) 6.521 7.112 ( 0.000 -4.996 2.515) 5.593 8.421 ( 0.000 -45.606 9.534) 46.592 8.855 ( -0.000 -4.129 -4.209) 5.896 8.898 ( -0.000 1.639 0.597) 1.745 9.250 ( -0.000 2.248 -0.333) 2.272 9.461 ( -0.000 1.968 0.239) 1.983 9.691 ( -0.000 -0.201 -1.916) 1.926 10.027 ( 0.000 -4.362 -0.019) 4.362 10.922 ( -0.000 39.944 -4.063) 40.150 11.804 ( 0.000 -5.684 0.267) 5.690 11.869 ( -0.000 1.532 -0.057) 1.533 13.798 ( -0.000 11.338 0.215) 11.340 16.201 ( 0.000 -61.820 6.904) 62.205======================= Grid point 1468 (340/344) =======================q-point: ( 0.53 0.47 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.761 ( 10.420 19.816 11.419) 25.133 1.870 ( 10.424 17.892 14.434) 25.241 2.032 ( 5.913 6.563 -8.984) 12.600 2.093 ( 5.823 12.220 -16.496) 21.339 3.168 ( 7.522 15.967 27.771) 32.905 3.249 ( 0.824 2.831 3.444) 4.534 3.420 ( 10.991 16.391 -25.701) 32.404 3.564 ( 7.622 10.827 -0.518) 13.251 4.125 ( 2.113 3.483 -0.197) 4.078 4.177 ( -2.816 -4.314 -0.899) 5.230 4.613 ( 13.519 23.325 -1.837) 27.022 7.004 ( -5.281 -9.000 1.329) 10.519 7.914 ( -12.248 -22.237 3.370) 25.610 8.795 ( -1.536 -3.424 -1.665) 4.106 8.946 ( 2.149 2.971 -0.075) 3.668 9.291 ( 1.630 3.300 0.122) 3.682 9.500 ( -0.087 3.947 3.016) 4.968 9.646 ( -0.682 -4.445 -3.503) 5.700 9.987 ( -1.214 -1.779 0.281) 2.172 11.266 ( 3.782 11.292 -0.303) 11.912 11.660 ( -5.007 -12.517 -1.119) 13.528 11.958 ( 4.133 6.355 -0.729) 7.616 13.998 ( 7.524 12.600 0.109) 14.677 15.328 ( -27.270 -46.218 5.337) 53.928======================= Grid point 1469 (341/344) =======================q-point: ( 0.60 0.47 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 1688Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.121 ( 4.121 12.247 12.034) 17.657 2.250 ( 14.194 17.350 -13.586) 26.212 2.254 ( 10.064 11.499 8.396) 17.435 2.367 ( 14.099 13.529 -7.540) 20.944 3.260 ( -0.526 3.709 2.199) 4.344 3.477 ( 6.244 9.016 4.831) 11.984 3.801 ( 10.480 7.434 -1.986) 13.002 3.917 ( 22.626 22.782 -4.260) 32.390 4.111 ( -0.122 -1.067 0.653) 1.257 4.222 ( 3.523 6.400 -0.238) 7.310 5.159 ( 20.939 23.417 -0.665) 31.420 6.766 ( -9.325 -11.185 0.377) 14.568 7.656 ( -3.384 -4.580 -1.270) 5.835 8.738 ( -1.483 -2.103 -0.375) 2.600 9.021 ( 1.866 4.934 -1.166) 5.403 9.369 ( 2.880 3.934 0.766) 4.936 9.505 ( -2.895 -0.721 9.290) 9.758 9.629 ( 5.186 -3.866 -6.740) 9.342 9.937 ( -5.303 3.822 -1.477) 6.701 11.236 ( -11.372 -5.399 9.839) 15.978 11.461 ( 3.788 -17.374 -8.520) 19.718 12.076 ( 0.131 9.447 -0.987) 9.500 14.233 ( 4.059 8.989 -0.992) 9.913 14.630 ( -12.970 -19.091 2.617) 23.227======================= Grid point 1483 (342/344) =======================q-point: ( 0.53 0.53 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.878 ( -0.000 21.672 -1.491) 21.723 2.027 ( -0.000 21.398 6.759) 22.440 2.036 ( 0.000 6.958 4.696) 8.395 2.152 ( -0.000 15.382 -9.979) 18.335 3.233 ( -0.000 -0.411 -1.798) 1.845 3.317 ( -0.000 14.008 0.592) 14.020 3.508 ( -0.000 28.867 -0.422) 28.870 3.650 ( -0.000 14.590 4.675) 15.321 4.139 ( -0.000 4.001 0.214) 4.006 4.155 ( 0.000 -4.059 -1.648) 4.380 4.766 ( -0.000 29.576 -0.427) 29.579 6.946 ( 0.000 -12.291 0.101) 12.292 7.801 ( 0.000 -18.416 3.160) 18.685 8.777 ( 0.000 -3.213 0.878) 3.331 8.951 ( -0.000 3.058 1.298) 3.322 9.310 ( -0.000 3.924 -0.940) 4.035 9.503 ( -0.000 1.762 -7.071) 7.287 9.705 ( 0.000 2.360 5.888) 6.344 9.897 ( 0.000 -8.133 -0.963) 8.190 11.307 ( -0.000 1.342 -10.192) 10.280 11.690 ( 0.000 -4.850 8.646) 9.914 11.916 ( -0.000 2.959 0.621) 3.024 14.067 ( -0.000 13.026 1.136) 13.076 15.078 ( 0.000 -44.157 -0.618) 44.161======================= Grid point 1694 (343/344) =======================q-point: ( 0.47 0.47 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 344Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.301 ( 0.000 -0.000 9.309) 9.309 1.301 ( 0.000 -0.000 9.309) 9.309 1.884 ( -0.000 0.000 -7.786) 7.786 1.884 ( -0.000 0.000 -7.786) 7.786 2.739 ( 0.000 -0.000 53.757) 53.757 3.088 ( -0.000 0.000 -50.371) 50.371 3.243 ( 0.000 0.000 1.292) 1.292 3.243 ( 0.000 -0.000 1.292) 1.292 4.063 ( -0.000 0.000 -0.381) 0.381 4.063 ( -0.000 0.000 -0.381) 0.381 4.343 ( -0.000 0.000 -0.687) 0.687 7.164 ( 0.000 -0.000 1.701) 1.701 8.883 ( 0.000 0.000 -0.008) 0.008 8.883 ( 0.000 -0.000 -0.008) 0.008 9.226 ( 0.000 0.000 0.038) 0.038 9.226 ( 0.000 -0.000 0.038) 0.038 9.560 ( 0.000 -0.000 2.990) 2.990 9.692 ( -0.000 0.000 -3.118) 3.118 10.070 ( 0.000 0.000 0.374) 0.374 10.070 ( 0.000 -0.000 0.374) 0.374 11.854 ( -0.000 0.000 -0.293) 0.293 11.854 ( -0.000 -0.000 -0.293) 0.293 13.677 ( 0.000 -0.000 0.003) 0.003 16.962 ( 0.000 -0.000 0.026) 0.026======================= Grid point 1695 (344/344) =======================q-point: ( 0.53 0.47 0.47)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 3.36e-05 3.36e-05 0.00e+00 0.00e+00 5.98e-04 5.98e-04 0.00e+00 0.00e+00 Number of triplets: 904Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.484 ( 13.527 7.810 3.710) 16.054 1.573 ( 18.958 10.945 3.830) 22.223 1.924 ( 5.370 3.100 -1.738) 6.440 1.924 ( 4.165 2.405 -5.035) 6.963 2.999 ( 11.332 6.543 43.652) 45.571 3.110 ( 11.595 6.694 -42.393) 44.457 3.239 ( -0.391 -0.226 1.325) 1.400 3.380 ( 10.407 6.008 -1.237) 12.080 4.081 ( 1.630 0.941 -0.228) 1.896 4.213 ( 6.233 3.599 0.289) 7.203 4.319 ( 4.942 2.853 -0.701) 5.750 7.118 ( -4.428 -2.557 0.604) 5.149 8.446 ( -39.471 -22.789 2.043) 45.623 8.849 ( -2.881 -1.663 -2.662) 4.261 8.902 ( 1.600 0.924 -0.721) 1.984 9.248 ( 1.822 1.052 0.517) 2.167 9.458 ( 0.984 0.568 1.238) 1.680 9.688 ( 0.377 0.218 -1.054) 1.140 10.024 ( -3.939 -2.274 0.875) 4.632 10.906 ( 33.144 19.136 0.964) 38.283 11.808 ( -3.787 -2.186 -1.206) 4.536 11.871 ( 1.431 0.826 -0.622) 1.766 13.799 ( 9.958 5.749 -0.112) 11.499 16.217 ( -53.087 -30.650 1.952) 61.330=================== 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 3/81000 10.0 1195.708 1195.708 3100.106 0.000 0.000 0.000 3/81000 20.0 479.476 479.476 380.506 0.000 -0.000 0.000 3/81000 30.0 171.137 171.137 117.633 0.000 -0.000 0.000 3/81000 40.0 97.739 97.739 62.252 0.000 -0.000 0.000 3/81000 50.0 70.000 70.000 42.041 0.000 -0.000 0.000 3/81000 60.0 54.782 54.782 31.654 0.000 -0.000 0.000 3/81000 70.0 44.706 44.706 25.235 0.000 -0.000 0.000 3/81000 80.0 37.468 37.468 20.864 0.000 -0.000 0.000 3/81000 90.0 32.051 32.051 17.713 0.000 -0.000 0.000 3/81000 100.0 27.887 27.887 15.350 0.000 -0.000 0.000 3/81000 110.0 24.617 24.617 13.524 0.000 -0.000 0.000 3/81000 120.0 22.000 22.000 12.078 0.000 -0.000 0.000 3/81000 130.0 19.869 19.869 10.909 0.000 -0.000 0.000 3/81000 140.0 18.109 18.109 9.947 0.000 -0.000 0.000 3/81000 150.0 16.633 16.633 9.142 0.000 -0.000 0.000 3/81000 160.0 15.381 15.381 8.460 0.000 -0.000 0.000 3/81000 170.0 14.307 14.307 7.875 0.000 -0.000 0.000 3/81000 180.0 13.375 13.375 7.368 0.000 -0.000 0.000 3/81000 190.0 12.561 12.561 6.925 0.000 -0.000 0.000 3/81000 200.0 11.843 11.843 6.533 0.000 -0.000 0.000 3/81000 210.0 11.204 11.204 6.185 0.000 -0.000 0.000 3/81000 220.0 10.634 10.634 5.874 0.000 -0.000 0.000 3/81000 230.0 10.120 10.120 5.593 0.000 -0.000 0.000 3/81000 240.0 9.656 9.656 5.339 0.000 -0.000 0.000 3/81000 250.0 9.233 9.233 5.108 0.000 -0.000 0.000 3/81000 260.0 8.848 8.848 4.896 0.000 -0.000 0.000 3/81000 270.0 8.494 8.494 4.702 0.000 -0.000 0.000 3/81000 280.0 8.168 8.168 4.524 0.000 -0.000 0.000 3/81000 290.0 7.868 7.868 4.359 0.000 -0.000 0.000 3/81000 300.0 7.589 7.589 4.205 0.000 -0.000 0.000 3/81000 310.0 7.330 7.330 4.063 0.000 -0.000 0.000 3/81000 320.0 7.089 7.089 3.930 0.000 -0.000 0.000 3/81000 330.0 6.863 6.863 3.806 0.000 -0.000 0.000 3/81000 340.0 6.652 6.652 3.690 0.000 -0.000 0.000 3/81000 350.0 6.454 6.454 3.580 0.000 -0.000 0.000 3/81000 360.0 6.267 6.267 3.477 0.000 -0.000 0.000 3/81000 370.0 6.091 6.091 3.380 0.000 -0.000 0.000 3/81000 380.0 5.925 5.925 3.289 0.000 -0.000 0.000 3/81000 390.0 5.769 5.769 3.202 0.000 -0.000 0.000 3/81000 400.0 5.620 5.620 3.120 0.000 -0.000 0.000 3/81000 410.0 5.479 5.479 3.042 0.000 -0.000 0.000 3/81000 420.0 5.345 5.345 2.968 0.000 -0.000 0.000 3/81000 430.0 5.218 5.218 2.898 0.000 -0.000 0.000 3/81000 440.0 5.096 5.096 2.830 0.000 -0.000 0.000 3/81000 450.0 4.981 4.981 2.766 0.000 -0.000 0.000 3/81000 460.0 4.870 4.870 2.705 0.000 -0.000 0.000 3/81000 470.0 4.765 4.765 2.647 0.000 -0.000 0.000 3/81000 480.0 4.664 4.664 2.591 0.000 -0.000 0.000 3/81000 490.0 4.567 4.567 2.537 0.000 -0.000 0.000 3/81000 500.0 4.474 4.474 2.486 0.000 -0.000 0.000 3/81000 510.0 4.385 4.385 2.436 0.000 -0.000 0.000 3/81000 520.0 4.299 4.299 2.389 0.000 -0.000 0.000 3/81000 530.0 4.217 4.217 2.343 0.000 -0.000 0.000 3/81000 540.0 4.138 4.138 2.300 0.000 -0.000 0.000 3/81000 550.0 4.062 4.062 2.257 0.000 -0.000 0.000 3/81000 560.0 3.989 3.989 2.217 0.000 -0.000 0.000 3/81000 570.0 3.918 3.918 2.177 0.000 -0.000 0.000 3/81000 580.0 3.850 3.850 2.140 0.000 -0.000 0.000 3/81000 590.0 3.784 3.784 2.103 0.000 -0.000 0.000 3/81000 600.0 3.721 3.721 2.068 0.000 -0.000 0.000 3/81000 610.0 3.659 3.659 2.034 0.000 -0.000 0.000 3/81000 620.0 3.600 3.600 2.001 0.000 -0.000 0.000 3/81000 630.0 3.542 3.542 1.969 0.000 -0.000 0.000 3/81000 640.0 3.487 3.487 1.938 0.000 -0.000 0.000 3/81000 650.0 3.433 3.433 1.908 0.000 -0.000 0.000 3/81000 660.0 3.380 3.380 1.879 0.000 -0.000 0.000 3/81000 670.0 3.330 3.330 1.851 0.000 -0.000 0.000 3/81000 680.0 3.280 3.280 1.823 0.000 -0.000 0.000 3/81000 690.0 3.233 3.233 1.797 0.000 -0.000 0.000 3/81000 700.0 3.186 3.186 1.771 0.000 -0.000 0.000 3/81000 710.0 3.141 3.141 1.746 0.000 -0.000 0.000 3/81000 720.0 3.097 3.097 1.722 0.000 -0.000 0.000 3/81000 730.0 3.055 3.055 1.698 0.000 -0.000 0.000 3/81000 740.0 3.014 3.014 1.675 0.000 -0.000 0.000 3/81000 750.0 2.973 2.973 1.653 0.000 -0.000 0.000 3/81000 760.0 2.934 2.934 1.631 0.000 -0.000 0.000 3/81000 770.0 2.896 2.896 1.610 0.000 -0.000 0.000 3/81000 780.0 2.859 2.859 1.589 0.000 -0.000 0.000 3/81000 790.0 2.822 2.822 1.569 0.000 -0.000 0.000 3/81000 800.0 2.787 2.787 1.549 0.000 -0.000 0.000 3/81000 810.0 2.753 2.753 1.530 0.000 -0.000 0.000 3/81000 820.0 2.719 2.719 1.511 0.000 -0.000 0.000 3/81000 830.0 2.686 2.686 1.493 0.000 -0.000 0.000 3/81000 840.0 2.654 2.654 1.475 0.000 -0.000 0.000 3/81000 850.0 2.623 2.623 1.458 0.000 -0.000 0.000 3/81000 860.0 2.593 2.593 1.441 0.000 -0.000 0.000 3/81000 870.0 2.563 2.563 1.425 0.000 -0.000 0.000 3/81000 880.0 2.534 2.534 1.408 0.000 -0.000 0.000 3/81000 890.0 2.505 2.505 1.392 0.000 -0.000 0.000 3/81000 900.0 2.477 2.477 1.377 0.000 -0.000 0.000 3/81000 910.0 2.450 2.450 1.362 0.000 -0.000 0.000 3/81000 920.0 2.424 2.424 1.347 0.000 -0.000 0.000 3/81000 930.0 2.397 2.397 1.333 0.000 -0.000 0.000 3/81000 940.0 2.372 2.372 1.318 0.000 -0.000 0.000 3/81000 950.0 2.347 2.347 1.305 0.000 -0.000 0.000 3/81000 960.0 2.323 2.323 1.291 0.000 -0.000 0.000 3/81000 970.0 2.299 2.299 1.278 0.000 -0.000 0.000 3/81000 980.0 2.275 2.275 1.265 0.000 -0.000 0.000 3/81000 990.0 2.252 2.252 1.252 0.000 -0.000 0.000 3/81000 1000.0 2.230 2.230 1.239 0.000 -0.000 0.000 3/81000Thermal conductivity related properties were written into "kappa-m151515.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 00:12:08]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|