# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/504989df-9459-4815-8173-8f5e2d21521d/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 SrIn2O4 / Pnma (62) / materials id 540688](https://mdr.nims.go.jp/datasets/08cb69d2-a5a8-463e-9fab-93d9e8862b90) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-08 09:57:03]-------------------------Compiled with OpenMP support (max 128 threads).Running in phonopy.load mode.Python version 3.14.2Spglib version 2.6.1Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".Unit of length: angstromSettings: Supercell: [1 3 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: Pnma (62)Number of symmetry operations in supercell: 24------------------------------ primitive cell ------------------------------Lattice vectors: a 9.820914790000000 0.000000000000000 0.000000000000000 b 0.000000000000000 3.279854440000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.518522009999998Atomic positions (fractional): *1 Sr 0.75579111865240 0.75000000000000 0.15277538118809 87.620 2 Sr 0.24420888134760 0.25000000000000 0.84722461881191 87.620 3 Sr 0.25579111865240 0.75000000000000 0.34722461881191 87.620 4 Sr 0.74420888134760 0.25000000000000 0.65277538118809 87.620 *5 In 0.41889528758327 0.75000000000000 0.60616535342669 114.818 6 In 0.58110471241673 0.25000000000000 0.39383464657331 114.818 7 In 0.91889528758327 0.75000000000000 0.89383464657331 114.818 8 In 0.08110471241673 0.25000000000000 0.10616535342669 114.818 *9 In 0.42990119711164 0.75000000000000 0.11109461324687 114.818 10 In 0.57009880288836 0.25000000000000 0.88890538675313 114.818 11 In 0.92990119711164 0.75000000000000 0.38890538675313 114.818 12 In 0.07009880288836 0.25000000000000 0.61109461324687 114.818 *13 O 0.20680943299340 0.75000000000000 0.66826467513428 15.999 14 O 0.79319056700660 0.25000000000000 0.33173532486572 15.999 15 O 0.70680943299340 0.75000000000000 0.83173532486572 15.999 16 O 0.29319056700660 0.25000000000000 0.16826467513428 15.999 *17 O 0.12201038293046 0.75000000000000 0.97859040580511 15.999 18 O 0.87798961706954 0.25000000000000 0.02140959419489 15.999 19 O 0.62201038293046 0.75000000000000 0.52140959419489 15.999 20 O 0.37798961706954 0.25000000000000 0.47859040580511 15.999 *21 O 0.52272209424252 0.75000000000000 0.28263424205065 15.999 22 O 0.47727790575748 0.25000000000000 0.71736575794935 15.999 23 O 0.02272209424252 0.75000000000000 0.21736575794935 15.999 24 O 0.97727790575748 0.25000000000000 0.78263424205065 15.999 *25 O 0.41872130340978 0.75000000000000 0.92502499376609 15.999 26 O 0.58127869659022 0.25000000000000 0.07497500623391 15.999 27 O 0.91872130340978 0.75000000000000 0.57497500623391 15.999 28 O 0.08127869659022 0.25000000000000 0.42502499376609 15.999-------------------------------- unit cell ---------------------------------Lattice vectors: a 9.820914790000000 0.000000000000000 0.000000000000000 b 0.000000000000000 3.279854440000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.518522009999998Atomic positions (fractional): *1 Sr 0.75579111865240 0.75000000000000 0.15277538118809 87.620 > 1 2 Sr 0.24420888134760 0.25000000000000 0.84722461881191 87.620 > 2 3 Sr 0.25579111865240 0.75000000000000 0.34722461881191 87.620 > 3 4 Sr 0.74420888134760 0.25000000000000 0.65277538118809 87.620 > 4 *5 In 0.41889528758327 0.75000000000000 0.60616535342669 114.818 > 5 6 In 0.58110471241673 0.25000000000000 0.39383464657331 114.818 > 6 7 In 0.91889528758327 0.75000000000000 0.89383464657331 114.818 > 7 8 In 0.08110471241673 0.25000000000000 0.10616535342669 114.818 > 8 *9 In 0.42990119711164 0.75000000000000 0.11109461324687 114.818 > 9 10 In 0.57009880288836 0.25000000000000 0.88890538675313 114.818 > 10 11 In 0.92990119711164 0.75000000000000 0.38890538675313 114.818 > 11 12 In 0.07009880288836 0.25000000000000 0.61109461324687 114.818 > 12 *13 O 0.20680943299340 0.75000000000000 0.66826467513428 15.999 > 13 14 O 0.79319056700660 0.25000000000000 0.33173532486572 15.999 > 14 15 O 0.70680943299340 0.75000000000000 0.83173532486572 15.999 > 15 16 O 0.29319056700660 0.25000000000000 0.16826467513428 15.999 > 16 *17 O 0.12201038293046 0.75000000000000 0.97859040580511 15.999 > 17 18 O 0.87798961706954 0.25000000000000 0.02140959419489 15.999 > 18 19 O 0.62201038293046 0.75000000000000 0.52140959419489 15.999 > 19 20 O 0.37798961706954 0.25000000000000 0.47859040580511 15.999 > 20 *21 O 0.52272209424252 0.75000000000000 0.28263424205065 15.999 > 21 22 O 0.47727790575748 0.25000000000000 0.71736575794935 15.999 > 22 23 O 0.02272209424252 0.75000000000000 0.21736575794935 15.999 > 23 24 O 0.97727790575748 0.25000000000000 0.78263424205065 15.999 > 24 *25 O 0.41872130340978 0.75000000000000 0.92502499376609 15.999 > 25 26 O 0.58127869659022 0.25000000000000 0.07497500623391 15.999 > 26 27 O 0.91872130340978 0.75000000000000 0.57497500623391 15.999 > 27 28 O 0.08127869659022 0.25000000000000 0.42502499376609 15.999 > 28-------------------------------- super cell --------------------------------Lattice vectors: a 9.820914790000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.839563320000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.518522009999998Atomic positions (fractional): *1 Sr 0.75579111865240 0.25000000000000 0.15277538118809 87.620 > 1 2 Sr 0.75579111865240 0.58333333333333 0.15277538118809 87.620 > 1 3 Sr 0.75579111865240 0.91666666666667 0.15277538118809 87.620 > 1 4 Sr 0.24420888134760 0.08333333333333 0.84722461881191 87.620 > 2 5 Sr 0.24420888134760 0.41666666666667 0.84722461881191 87.620 > 2 6 Sr 0.24420888134760 0.75000000000000 0.84722461881191 87.620 > 2 7 Sr 0.25579111865240 0.25000000000000 0.34722461881191 87.620 > 3 8 Sr 0.25579111865240 0.58333333333333 0.34722461881191 87.620 > 3 9 Sr 0.25579111865240 0.91666666666667 0.34722461881191 87.620 > 3 10 Sr 0.74420888134760 0.08333333333333 0.65277538118809 87.620 > 4 11 Sr 0.74420888134760 0.41666666666667 0.65277538118809 87.620 > 4 12 Sr 0.74420888134760 0.75000000000000 0.65277538118809 87.620 > 4 *13 In 0.41889528758327 0.25000000000000 0.60616535342669 114.818 > 5 14 In 0.41889528758327 0.58333333333333 0.60616535342669 114.818 > 5 15 In 0.41889528758327 0.91666666666667 0.60616535342669 114.818 > 5 16 In 0.58110471241673 0.08333333333333 0.39383464657331 114.818 > 6 17 In 0.58110471241673 0.41666666666667 0.39383464657331 114.818 > 6 18 In 0.58110471241673 0.75000000000000 0.39383464657331 114.818 > 6 19 In 0.91889528758327 0.25000000000000 0.89383464657331 114.818 > 7 20 In 0.91889528758327 0.58333333333333 0.89383464657331 114.818 > 7 21 In 0.91889528758327 0.91666666666667 0.89383464657331 114.818 > 7 22 In 0.08110471241673 0.08333333333333 0.10616535342669 114.818 > 8 23 In 0.08110471241673 0.41666666666667 0.10616535342669 114.818 > 8 24 In 0.08110471241673 0.75000000000000 0.10616535342669 114.818 > 8 *25 In 0.42990119711164 0.25000000000000 0.11109461324687 114.818 > 9 26 In 0.42990119711164 0.58333333333333 0.11109461324687 114.818 > 9 27 In 0.42990119711164 0.91666666666667 0.11109461324687 114.818 > 9 28 In 0.57009880288836 0.08333333333333 0.88890538675313 114.818 > 10 29 In 0.57009880288836 0.41666666666667 0.88890538675313 114.818 > 10 30 In 0.57009880288836 0.75000000000000 0.88890538675313 114.818 > 10 31 In 0.92990119711164 0.25000000000000 0.38890538675313 114.818 > 11 32 In 0.92990119711164 0.58333333333333 0.38890538675313 114.818 > 11 33 In 0.92990119711164 0.91666666666667 0.38890538675313 114.818 > 11 34 In 0.07009880288836 0.08333333333333 0.61109461324687 114.818 > 12 35 In 0.07009880288836 0.41666666666667 0.61109461324687 114.818 > 12 36 In 0.07009880288836 0.75000000000000 0.61109461324687 114.818 > 12 *37 O 0.20680943299340 0.25000000000000 0.66826467513428 15.999 > 13 38 O 0.20680943299340 0.58333333333333 0.66826467513428 15.999 > 13 39 O 0.20680943299340 0.91666666666667 0.66826467513428 15.999 > 13 40 O 0.79319056700660 0.08333333333333 0.33173532486572 15.999 > 14 41 O 0.79319056700660 0.41666666666667 0.33173532486572 15.999 > 14 42 O 0.79319056700660 0.75000000000000 0.33173532486572 15.999 > 14 43 O 0.70680943299340 0.25000000000000 0.83173532486572 15.999 > 15 44 O 0.70680943299340 0.58333333333333 0.83173532486572 15.999 > 15 45 O 0.70680943299340 0.91666666666667 0.83173532486572 15.999 > 15 46 O 0.29319056700660 0.08333333333333 0.16826467513428 15.999 > 16 47 O 0.29319056700660 0.41666666666667 0.16826467513428 15.999 > 16 48 O 0.29319056700660 0.75000000000000 0.16826467513428 15.999 > 16 *49 O 0.12201038293046 0.25000000000000 0.97859040580511 15.999 > 17 50 O 0.12201038293046 0.58333333333333 0.97859040580511 15.999 > 17 51 O 0.12201038293046 0.91666666666667 0.97859040580511 15.999 > 17 52 O 0.87798961706954 0.08333333333333 0.02140959419489 15.999 > 18 53 O 0.87798961706954 0.41666666666667 0.02140959419489 15.999 > 18 54 O 0.87798961706954 0.75000000000000 0.02140959419489 15.999 > 18 55 O 0.62201038293046 0.25000000000000 0.52140959419489 15.999 > 19 56 O 0.62201038293046 0.58333333333333 0.52140959419489 15.999 > 19 57 O 0.62201038293046 0.91666666666667 0.52140959419489 15.999 > 19 58 O 0.37798961706954 0.08333333333333 0.47859040580511 15.999 > 20 59 O 0.37798961706954 0.41666666666667 0.47859040580511 15.999 > 20 60 O 0.37798961706954 0.75000000000000 0.47859040580511 15.999 > 20 *61 O 0.52272209424252 0.25000000000000 0.28263424205065 15.999 > 21 62 O 0.52272209424252 0.58333333333333 0.28263424205065 15.999 > 21 63 O 0.52272209424252 0.91666666666667 0.28263424205065 15.999 > 21 64 O 0.47727790575748 0.08333333333333 0.71736575794935 15.999 > 22 65 O 0.47727790575748 0.41666666666667 0.71736575794935 15.999 > 22 66 O 0.47727790575748 0.75000000000000 0.71736575794935 15.999 > 22 67 O 0.02272209424252 0.25000000000000 0.21736575794935 15.999 > 23 68 O 0.02272209424252 0.58333333333333 0.21736575794935 15.999 > 23 69 O 0.02272209424252 0.91666666666667 0.21736575794935 15.999 > 23 70 O 0.97727790575748 0.08333333333333 0.78263424205065 15.999 > 24 71 O 0.97727790575748 0.41666666666667 0.78263424205065 15.999 > 24 72 O 0.97727790575748 0.75000000000000 0.78263424205065 15.999 > 24 *73 O 0.41872130340978 0.25000000000000 0.92502499376609 15.999 > 25 74 O 0.41872130340978 0.58333333333333 0.92502499376609 15.999 > 25 75 O 0.41872130340978 0.91666666666667 0.92502499376609 15.999 > 25 76 O 0.58127869659022 0.08333333333333 0.07497500623391 15.999 > 26 77 O 0.58127869659022 0.41666666666667 0.07497500623391 15.999 > 26 78 O 0.58127869659022 0.75000000000000 0.07497500623391 15.999 > 26 79 O 0.91872130340978 0.25000000000000 0.57497500623391 15.999 > 27 80 O 0.91872130340978 0.58333333333333 0.57497500623391 15.999 > 27 81 O 0.91872130340978 0.91666666666667 0.57497500623391 15.999 > 27 82 O 0.08127869659022 0.08333333333333 0.42502499376609 15.999 > 28 83 O 0.08127869659022 0.41666666666667 0.42502499376609 15.999 > 28 84 O 0.08127869659022 0.75000000000000 0.42502499376609 15.999 > 28----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 4.6421557 0.0000000 0.0000000 0.0000000 4.8221343 0.0000000 0.0000000 0.0000000 4.6145081-------------------------- Born effective charges -------------------------- 1 Sr 2.6573947 0.0000000 0.0140229 0.0000000 2.4271147 0.0000000 -0.0727142 0.0000000 2.4848118 2 Sr 2.6573947 0.0000000 0.0140229 0.0000000 2.4271147 0.0000000 -0.0727142 0.0000000 2.4848118 3 Sr 2.6573947 0.0000000 -0.0140229 0.0000000 2.4271147 0.0000000 0.0727142 0.0000000 2.4848118 4 Sr 2.6573947 0.0000000 -0.0140229 0.0000000 2.4271147 0.0000000 0.0727142 0.0000000 2.4848118 5 In 3.1063650 0.0000000 -0.2636044 0.0000000 3.4689045 0.0000000 -0.1483835 0.0000000 3.0918676 6 In 3.1063650 0.0000000 -0.2636044 0.0000000 3.4689045 0.0000000 -0.1483835 0.0000000 3.0918676 7 In 3.1063650 0.0000000 0.2636044 0.0000000 3.4689045 0.0000000 0.1483835 0.0000000 3.0918676 8 In 3.1063650 0.0000000 0.2636044 0.0000000 3.4689045 0.0000000 0.1483835 0.0000000 3.0918676 9 In 3.0168552 0.0000000 -0.0974670 0.0000000 3.4314451 0.0000000 -0.0032390 0.0000000 3.3155907 10 In 3.0168552 0.0000000 -0.0974670 0.0000000 3.4314451 0.0000000 -0.0032390 0.0000000 3.3155907 11 In 3.0168552 0.0000000 0.0974670 0.0000000 3.4314451 0.0000000 0.0032390 0.0000000 3.3155907 12 In 3.0168552 0.0000000 0.0974670 0.0000000 3.4314451 0.0000000 0.0032390 0.0000000 3.3155907 13 O -2.5513079 0.0000000 -0.1150715 0.0000000 -2.4324616 0.0000000 -0.0545005 0.0000000 -1.9563914 14 O -2.5513079 0.0000000 -0.1150715 0.0000000 -2.4324616 0.0000000 -0.0545005 0.0000000 -1.9563914 15 O -2.5513079 0.0000000 0.1150715 0.0000000 -2.4324616 0.0000000 0.0545005 0.0000000 -1.9563914 16 O -2.5513079 0.0000000 0.1150715 0.0000000 -2.4324616 0.0000000 0.0545005 0.0000000 -1.9563914 17 O -2.0580961 0.0000000 0.0784541 0.0000000 -2.3961733 0.0000000 0.0448941 0.0000000 -2.2857991 18 O -2.0580961 0.0000000 0.0784541 0.0000000 -2.3961733 0.0000000 0.0448941 0.0000000 -2.2857991 19 O -2.0580961 0.0000000 -0.0784541 0.0000000 -2.3961733 0.0000000 -0.0448941 0.0000000 -2.2857991 20 O -2.0580961 0.0000000 -0.0784541 0.0000000 -2.3961733 0.0000000 -0.0448941 0.0000000 -2.2857991 21 O -2.0308401 0.0000000 -0.2821394 0.0000000 -2.1348370 0.0000000 -0.2839549 0.0000000 -2.5515187 22 O -2.0308401 0.0000000 -0.2821394 0.0000000 -2.1348370 0.0000000 -0.2839549 0.0000000 -2.5515187 23 O -2.0308401 0.0000000 0.2821394 0.0000000 -2.1348370 0.0000000 0.2839549 0.0000000 -2.5515187 24 O -2.0308401 0.0000000 0.2821394 0.0000000 -2.1348370 0.0000000 0.2839549 0.0000000 -2.5515187 25 O -2.1403709 0.0000000 -0.1180300 0.0000000 -2.3639923 0.0000000 -0.0207500 0.0000000 -2.0985609 26 O -2.1403709 0.0000000 -0.1180300 0.0000000 -2.3639923 0.0000000 -0.0207500 0.0000000 -2.0985609 27 O -2.1403709 0.0000000 0.1180300 0.0000000 -2.3639923 0.0000000 0.0207500 0.0000000 -2.0985609 28 O -2.1403709 0.0000000 0.1180300 0.0000000 -2.3639923 0.0000000 0.0207500 0.0000000 -2.0985609----------------------------------------------------------------------------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: 252/252Permutation basis: 10794/10794Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 1456Number of blocks in projector: 1456Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 392Use standard eigh solver.--- Eigsh_solver_block: 2 / 6 ---Block_size: 224Use standard eigh solver.--- Eigsh_solver_block: 3 / 6 ---Block_size: 224Use standard eigh solver.--- Eigsh_solver_block: 4 / 6 ---Block_size: 224Use standard eigh solver.--- Eigsh_solver_block: 5 / 6 ---Block_size: 196Use standard eigh solver.--- Eigsh_solver_block: 6 / 6 ---Block_size: 196Use standard eigh solver.Tree of FC basis block matrices:- (1456, 1421), data: False|-- (196, 196), data: True|-- (196, 196), data: True|-- (224, 217), data: True|-- (224, 217), data: True|-- (224, 217), data: True|-- (392, 378), data: True-----Solver_atoms: 1 -- 84 / 84Time (Solver_compr_matrix_reshape): 0.002Solver_block: 100 / 480 - Time: 1.493Solver_block: 200 / 480 - Time: 1.547Solver_block: 300 / 480 - Time: 1.475Solver_block: 400 / 480 - Time: 1.590Solver_block: 480 / 480 - Time: 1.185Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 7.383--------------------------------- Symfc end --------------------------------Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 252/252Permutation basis: 10794/10794Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 1456Number of blocks in projector: 1456Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 392Use standard eigh solver.--- Eigsh_solver_block: 2 / 6 ---Block_size: 224Use standard eigh solver.--- Eigsh_solver_block: 3 / 6 ---Block_size: 224Use standard eigh solver.--- Eigsh_solver_block: 4 / 6 ---Block_size: 224Use standard eigh solver.--- Eigsh_solver_block: 5 / 6 ---Block_size: 196Use standard eigh solver.--- Eigsh_solver_block: 6 / 6 ---Block_size: 196Use standard eigh solver.Tree of FC basis block matrices:- (1456, 1421), data: False|-- (196, 196), data: True|-- (196, 196), data: True|-- (224, 217), data: True|-- (224, 217), data: True|-- (224, 217), data: True|-- (392, 378), 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 09:57:35]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 09:57:36]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: force constantsHDF5 data compression filter: gzipCrystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz".Supercell (dim): [1 3 1]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: Pnma (62)------------------------------ primitive cell ------------------------------Lattice vectors: a 9.820914790000000 0.000000000000000 0.000000000000000 b 0.000000000000000 3.279854440000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.518522009999998Atomic positions (fractional): 1 Sr 0.75579111865240 0.75000000000000 0.15277538118809 87.620 2 Sr 0.24420888134760 0.25000000000000 0.84722461881191 87.620 3 Sr 0.25579111865240 0.75000000000000 0.34722461881191 87.620 4 Sr 0.74420888134760 0.25000000000000 0.65277538118809 87.620 5 In 0.41889528758327 0.75000000000000 0.60616535342669 114.818 6 In 0.58110471241673 0.25000000000000 0.39383464657331 114.818 7 In 0.91889528758327 0.75000000000000 0.89383464657331 114.818 8 In 0.08110471241673 0.25000000000000 0.10616535342669 114.818 9 In 0.42990119711164 0.75000000000000 0.11109461324687 114.818 10 In 0.57009880288836 0.25000000000000 0.88890538675313 114.818 11 In 0.92990119711164 0.75000000000000 0.38890538675313 114.818 12 In 0.07009880288836 0.25000000000000 0.61109461324687 114.818 13 O 0.20680943299340 0.75000000000000 0.66826467513428 15.999 14 O 0.79319056700660 0.25000000000000 0.33173532486572 15.999 15 O 0.70680943299340 0.75000000000000 0.83173532486572 15.999 16 O 0.29319056700660 0.25000000000000 0.16826467513428 15.999 17 O 0.12201038293046 0.75000000000000 0.97859040580511 15.999 18 O 0.87798961706954 0.25000000000000 0.02140959419489 15.999 19 O 0.62201038293046 0.75000000000000 0.52140959419489 15.999 20 O 0.37798961706954 0.25000000000000 0.47859040580511 15.999 21 O 0.52272209424252 0.75000000000000 0.28263424205065 15.999 22 O 0.47727790575748 0.25000000000000 0.71736575794935 15.999 23 O 0.02272209424252 0.75000000000000 0.21736575794935 15.999 24 O 0.97727790575748 0.25000000000000 0.78263424205065 15.999 25 O 0.41872130340978 0.75000000000000 0.92502499376609 15.999 26 O 0.58127869659022 0.25000000000000 0.07497500623391 15.999 27 O 0.91872130340978 0.75000000000000 0.57497500623391 15.999 28 O 0.08127869659022 0.25000000000000 0.42502499376609 15.999-------------------------------- supercell ---------------------------------Lattice vectors: a 9.820914790000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.839563320000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.518522009999998Atomic positions (fractional): 1 Sr 0.75579111865240 0.25000000000000 0.15277538118809 87.620 > 1 2 Sr 0.75579111865240 0.58333333333333 0.15277538118809 87.620 > 1 3 Sr 0.75579111865240 0.91666666666667 0.15277538118809 87.620 > 1 4 Sr 0.24420888134760 0.08333333333333 0.84722461881191 87.620 > 4 5 Sr 0.24420888134760 0.41666666666667 0.84722461881191 87.620 > 4 6 Sr 0.24420888134760 0.75000000000000 0.84722461881191 87.620 > 4 7 Sr 0.25579111865240 0.25000000000000 0.34722461881191 87.620 > 7 8 Sr 0.25579111865240 0.58333333333333 0.34722461881191 87.620 > 7 9 Sr 0.25579111865240 0.91666666666667 0.34722461881191 87.620 > 7 10 Sr 0.74420888134760 0.08333333333333 0.65277538118809 87.620 > 10 11 Sr 0.74420888134760 0.41666666666667 0.65277538118809 87.620 > 10 12 Sr 0.74420888134760 0.75000000000000 0.65277538118809 87.620 > 10 13 In 0.41889528758327 0.25000000000000 0.60616535342669 114.818 > 13 14 In 0.41889528758327 0.58333333333333 0.60616535342669 114.818 > 13 15 In 0.41889528758327 0.91666666666667 0.60616535342669 114.818 > 13 16 In 0.58110471241673 0.08333333333333 0.39383464657331 114.818 > 16 17 In 0.58110471241673 0.41666666666667 0.39383464657331 114.818 > 16 18 In 0.58110471241673 0.75000000000000 0.39383464657331 114.818 > 16 19 In 0.91889528758327 0.25000000000000 0.89383464657331 114.818 > 19 20 In 0.91889528758327 0.58333333333333 0.89383464657331 114.818 > 19 21 In 0.91889528758327 0.91666666666667 0.89383464657331 114.818 > 19 22 In 0.08110471241673 0.08333333333333 0.10616535342669 114.818 > 22 23 In 0.08110471241673 0.41666666666667 0.10616535342669 114.818 > 22 24 In 0.08110471241673 0.75000000000000 0.10616535342669 114.818 > 22 25 In 0.42990119711164 0.25000000000000 0.11109461324687 114.818 > 25 26 In 0.42990119711164 0.58333333333333 0.11109461324687 114.818 > 25 27 In 0.42990119711164 0.91666666666667 0.11109461324687 114.818 > 25 28 In 0.57009880288836 0.08333333333333 0.88890538675313 114.818 > 28 29 In 0.57009880288836 0.41666666666667 0.88890538675313 114.818 > 28 30 In 0.57009880288836 0.75000000000000 0.88890538675313 114.818 > 28 31 In 0.92990119711164 0.25000000000000 0.38890538675313 114.818 > 31 32 In 0.92990119711164 0.58333333333333 0.38890538675313 114.818 > 31 33 In 0.92990119711164 0.91666666666667 0.38890538675313 114.818 > 31 34 In 0.07009880288836 0.08333333333333 0.61109461324687 114.818 > 34 35 In 0.07009880288836 0.41666666666667 0.61109461324687 114.818 > 34 36 In 0.07009880288836 0.75000000000000 0.61109461324687 114.818 > 34 37 O 0.20680943299340 0.25000000000000 0.66826467513428 15.999 > 37 38 O 0.20680943299340 0.58333333333333 0.66826467513428 15.999 > 37 39 O 0.20680943299340 0.91666666666667 0.66826467513428 15.999 > 37 40 O 0.79319056700660 0.08333333333333 0.33173532486572 15.999 > 40 41 O 0.79319056700660 0.41666666666667 0.33173532486572 15.999 > 40 42 O 0.79319056700660 0.75000000000000 0.33173532486572 15.999 > 40 43 O 0.70680943299340 0.25000000000000 0.83173532486572 15.999 > 43 44 O 0.70680943299340 0.58333333333333 0.83173532486572 15.999 > 43 45 O 0.70680943299340 0.91666666666667 0.83173532486572 15.999 > 43 46 O 0.29319056700660 0.08333333333333 0.16826467513428 15.999 > 46 47 O 0.29319056700660 0.41666666666667 0.16826467513428 15.999 > 46 48 O 0.29319056700660 0.75000000000000 0.16826467513428 15.999 > 46 49 O 0.12201038293046 0.25000000000000 0.97859040580511 15.999 > 49 50 O 0.12201038293046 0.58333333333333 0.97859040580511 15.999 > 49 51 O 0.12201038293046 0.91666666666667 0.97859040580511 15.999 > 49 52 O 0.87798961706954 0.08333333333333 0.02140959419489 15.999 > 52 53 O 0.87798961706954 0.41666666666667 0.02140959419489 15.999 > 52 54 O 0.87798961706954 0.75000000000000 0.02140959419489 15.999 > 52 55 O 0.62201038293046 0.25000000000000 0.52140959419489 15.999 > 55 56 O 0.62201038293046 0.58333333333333 0.52140959419489 15.999 > 55 57 O 0.62201038293046 0.91666666666667 0.52140959419489 15.999 > 55 58 O 0.37798961706954 0.08333333333333 0.47859040580511 15.999 > 58 59 O 0.37798961706954 0.41666666666667 0.47859040580511 15.999 > 58 60 O 0.37798961706954 0.75000000000000 0.47859040580511 15.999 > 58 61 O 0.52272209424252 0.25000000000000 0.28263424205065 15.999 > 61 62 O 0.52272209424252 0.58333333333333 0.28263424205065 15.999 > 61 63 O 0.52272209424252 0.91666666666667 0.28263424205065 15.999 > 61 64 O 0.47727790575748 0.08333333333333 0.71736575794935 15.999 > 64 65 O 0.47727790575748 0.41666666666667 0.71736575794935 15.999 > 64 66 O 0.47727790575748 0.75000000000000 0.71736575794935 15.999 > 64 67 O 0.02272209424252 0.25000000000000 0.21736575794935 15.999 > 67 68 O 0.02272209424252 0.58333333333333 0.21736575794935 15.999 > 67 69 O 0.02272209424252 0.91666666666667 0.21736575794935 15.999 > 67 70 O 0.97727790575748 0.08333333333333 0.78263424205065 15.999 > 70 71 O 0.97727790575748 0.41666666666667 0.78263424205065 15.999 > 70 72 O 0.97727790575748 0.75000000000000 0.78263424205065 15.999 > 70 73 O 0.41872130340978 0.25000000000000 0.92502499376609 15.999 > 73 74 O 0.41872130340978 0.58333333333333 0.92502499376609 15.999 > 73 75 O 0.41872130340978 0.91666666666667 0.92502499376609 15.999 > 73 76 O 0.58127869659022 0.08333333333333 0.07497500623391 15.999 > 76 77 O 0.58127869659022 0.41666666666667 0.07497500623391 15.999 > 76 78 O 0.58127869659022 0.75000000000000 0.07497500623391 15.999 > 76 79 O 0.91872130340978 0.25000000000000 0.57497500623391 15.999 > 79 80 O 0.91872130340978 0.58333333333333 0.57497500623391 15.999 > 79 81 O 0.91872130340978 0.91666666666667 0.57497500623391 15.999 > 79 82 O 0.08127869659022 0.08333333333333 0.42502499376609 15.999 > 82 83 O 0.08127869659022 0.41666666666667 0.42502499376609 15.999 > 82 84 O 0.08127869659022 0.75000000000000 0.42502499376609 15.999 > 82----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 4.6421557 0.0000000 0.0000000 0.0000000 4.8221343 0.0000000 0.0000000 0.0000000 4.6145081-------------------------- Born effective charges -------------------------- 1 Sr 2.6573947 0.0000000 0.0140229 0.0000000 2.4271147 0.0000000 -0.0727142 0.0000000 2.4848118 2 Sr 2.6573947 0.0000000 0.0140229 0.0000000 2.4271147 0.0000000 -0.0727142 0.0000000 2.4848118 3 Sr 2.6573947 0.0000000 -0.0140229 0.0000000 2.4271147 0.0000000 0.0727142 0.0000000 2.4848118 4 Sr 2.6573947 0.0000000 -0.0140229 0.0000000 2.4271147 0.0000000 0.0727142 0.0000000 2.4848118 5 In 3.1063650 0.0000000 -0.2636044 0.0000000 3.4689045 0.0000000 -0.1483835 0.0000000 3.0918676 6 In 3.1063650 0.0000000 -0.2636044 0.0000000 3.4689045 0.0000000 -0.1483835 0.0000000 3.0918676 7 In 3.1063650 0.0000000 0.2636044 0.0000000 3.4689045 0.0000000 0.1483835 0.0000000 3.0918676 8 In 3.1063650 0.0000000 0.2636044 0.0000000 3.4689045 0.0000000 0.1483835 0.0000000 3.0918676 9 In 3.0168552 0.0000000 -0.0974670 0.0000000 3.4314451 0.0000000 -0.0032390 0.0000000 3.3155907 10 In 3.0168552 0.0000000 -0.0974670 0.0000000 3.4314451 0.0000000 -0.0032390 0.0000000 3.3155907 11 In 3.0168552 0.0000000 0.0974670 0.0000000 3.4314451 0.0000000 0.0032390 0.0000000 3.3155907 12 In 3.0168552 0.0000000 0.0974670 0.0000000 3.4314451 0.0000000 0.0032390 0.0000000 3.3155907 13 O -2.5513079 0.0000000 -0.1150715 0.0000000 -2.4324616 0.0000000 -0.0545005 0.0000000 -1.9563914 14 O -2.5513079 0.0000000 -0.1150715 0.0000000 -2.4324616 0.0000000 -0.0545005 0.0000000 -1.9563914 15 O -2.5513079 0.0000000 0.1150715 0.0000000 -2.4324616 0.0000000 0.0545005 0.0000000 -1.9563914 16 O -2.5513079 0.0000000 0.1150715 0.0000000 -2.4324616 0.0000000 0.0545005 0.0000000 -1.9563914 17 O -2.0580961 0.0000000 0.0784541 0.0000000 -2.3961733 0.0000000 0.0448941 0.0000000 -2.2857991 18 O -2.0580961 0.0000000 0.0784541 0.0000000 -2.3961733 0.0000000 0.0448941 0.0000000 -2.2857991 19 O -2.0580961 0.0000000 -0.0784541 0.0000000 -2.3961733 0.0000000 -0.0448941 0.0000000 -2.2857991 20 O -2.0580961 0.0000000 -0.0784541 0.0000000 -2.3961733 0.0000000 -0.0448941 0.0000000 -2.2857991 21 O -2.0308401 0.0000000 -0.2821394 0.0000000 -2.1348370 0.0000000 -0.2839549 0.0000000 -2.5515187 22 O -2.0308401 0.0000000 -0.2821394 0.0000000 -2.1348370 0.0000000 -0.2839549 0.0000000 -2.5515187 23 O -2.0308401 0.0000000 0.2821394 0.0000000 -2.1348370 0.0000000 0.2839549 0.0000000 -2.5515187 24 O -2.0308401 0.0000000 0.2821394 0.0000000 -2.1348370 0.0000000 0.2839549 0.0000000 -2.5515187 25 O -2.1403709 0.0000000 -0.1180300 0.0000000 -2.3639923 0.0000000 -0.0207500 0.0000000 -2.0985609 26 O -2.1403709 0.0000000 -0.1180300 0.0000000 -2.3639923 0.0000000 -0.0207500 0.0000000 -2.0985609 27 O -2.1403709 0.0000000 0.1180300 0.0000000 -2.3639923 0.0000000 0.0207500 0.0000000 -2.0985609 28 O -2.1403709 0.0000000 0.1180300 0.0000000 -2.3639923 0.0000000 0.0207500 0.0000000 -2.0985609----------------------------------------------------------------------------Sets of supercell forces were read from "FORCES_FC3.xz".Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz".----------------------------- Force constants ------------------------------Computing fc3[ 1, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 13, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 25, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 37, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 49, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 61, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100]Computing fc3[ 73, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 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: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz)fc3 was written into "fc3.hdf5".Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) 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 09:57:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 09:57:54]-------------------------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: conductivity-RTAHDF5 data compression filter: gzipCrystal structure was read from "phono3py.yaml".Supercell (dim): [1 3 1]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: Pnma (62)------------------------------ primitive cell ------------------------------Lattice vectors: a 9.820914790000000 0.000000000000000 0.000000000000000 b 0.000000000000000 3.279854440000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.518522009999998Atomic positions (fractional): 1 Sr 0.75579111865240 0.75000000000000 0.15277538118809 87.620 2 Sr 0.24420888134760 0.25000000000000 0.84722461881191 87.620 3 Sr 0.25579111865240 0.75000000000000 0.34722461881191 87.620 4 Sr 0.74420888134760 0.25000000000000 0.65277538118809 87.620 5 In 0.41889528758327 0.75000000000000 0.60616535342669 114.818 6 In 0.58110471241673 0.25000000000000 0.39383464657331 114.818 7 In 0.91889528758327 0.75000000000000 0.89383464657331 114.818 8 In 0.08110471241673 0.25000000000000 0.10616535342669 114.818 9 In 0.42990119711164 0.75000000000000 0.11109461324687 114.818 10 In 0.57009880288836 0.25000000000000 0.88890538675313 114.818 11 In 0.92990119711164 0.75000000000000 0.38890538675313 114.818 12 In 0.07009880288836 0.25000000000000 0.61109461324687 114.818 13 O 0.20680943299340 0.75000000000000 0.66826467513428 15.999 14 O 0.79319056700660 0.25000000000000 0.33173532486572 15.999 15 O 0.70680943299340 0.75000000000000 0.83173532486572 15.999 16 O 0.29319056700660 0.25000000000000 0.16826467513428 15.999 17 O 0.12201038293046 0.75000000000000 0.97859040580511 15.999 18 O 0.87798961706954 0.25000000000000 0.02140959419489 15.999 19 O 0.62201038293046 0.75000000000000 0.52140959419489 15.999 20 O 0.37798961706954 0.25000000000000 0.47859040580511 15.999 21 O 0.52272209424252 0.75000000000000 0.28263424205065 15.999 22 O 0.47727790575748 0.25000000000000 0.71736575794935 15.999 23 O 0.02272209424252 0.75000000000000 0.21736575794935 15.999 24 O 0.97727790575748 0.25000000000000 0.78263424205065 15.999 25 O 0.41872130340978 0.75000000000000 0.92502499376609 15.999 26 O 0.58127869659022 0.25000000000000 0.07497500623391 15.999 27 O 0.91872130340978 0.75000000000000 0.57497500623391 15.999 28 O 0.08127869659022 0.25000000000000 0.42502499376609 15.999-------------------------------- supercell ---------------------------------Lattice vectors: a 9.820914790000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.839563320000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.518522009999998Atomic positions (fractional): 1 Sr 0.75579111865240 0.25000000000000 0.15277538118809 87.620 > 1 2 Sr 0.75579111865240 0.58333333333333 0.15277538118809 87.620 > 1 3 Sr 0.75579111865240 0.91666666666667 0.15277538118809 87.620 > 1 4 Sr 0.24420888134760 0.08333333333333 0.84722461881191 87.620 > 4 5 Sr 0.24420888134760 0.41666666666667 0.84722461881191 87.620 > 4 6 Sr 0.24420888134760 0.75000000000000 0.84722461881191 87.620 > 4 7 Sr 0.25579111865240 0.25000000000000 0.34722461881191 87.620 > 7 8 Sr 0.25579111865240 0.58333333333333 0.34722461881191 87.620 > 7 9 Sr 0.25579111865240 0.91666666666667 0.34722461881191 87.620 > 7 10 Sr 0.74420888134760 0.08333333333333 0.65277538118809 87.620 > 10 11 Sr 0.74420888134760 0.41666666666667 0.65277538118809 87.620 > 10 12 Sr 0.74420888134760 0.75000000000000 0.65277538118809 87.620 > 10 13 In 0.41889528758327 0.25000000000000 0.60616535342669 114.818 > 13 14 In 0.41889528758327 0.58333333333333 0.60616535342669 114.818 > 13 15 In 0.41889528758327 0.91666666666667 0.60616535342669 114.818 > 13 16 In 0.58110471241673 0.08333333333333 0.39383464657331 114.818 > 16 17 In 0.58110471241673 0.41666666666667 0.39383464657331 114.818 > 16 18 In 0.58110471241673 0.75000000000000 0.39383464657331 114.818 > 16 19 In 0.91889528758327 0.25000000000000 0.89383464657331 114.818 > 19 20 In 0.91889528758327 0.58333333333333 0.89383464657331 114.818 > 19 21 In 0.91889528758327 0.91666666666667 0.89383464657331 114.818 > 19 22 In 0.08110471241673 0.08333333333333 0.10616535342669 114.818 > 22 23 In 0.08110471241673 0.41666666666667 0.10616535342669 114.818 > 22 24 In 0.08110471241673 0.75000000000000 0.10616535342669 114.818 > 22 25 In 0.42990119711164 0.25000000000000 0.11109461324687 114.818 > 25 26 In 0.42990119711164 0.58333333333333 0.11109461324687 114.818 > 25 27 In 0.42990119711164 0.91666666666667 0.11109461324687 114.818 > 25 28 In 0.57009880288836 0.08333333333333 0.88890538675313 114.818 > 28 29 In 0.57009880288836 0.41666666666667 0.88890538675313 114.818 > 28 30 In 0.57009880288836 0.75000000000000 0.88890538675313 114.818 > 28 31 In 0.92990119711164 0.25000000000000 0.38890538675313 114.818 > 31 32 In 0.92990119711164 0.58333333333333 0.38890538675313 114.818 > 31 33 In 0.92990119711164 0.91666666666667 0.38890538675313 114.818 > 31 34 In 0.07009880288836 0.08333333333333 0.61109461324687 114.818 > 34 35 In 0.07009880288836 0.41666666666667 0.61109461324687 114.818 > 34 36 In 0.07009880288836 0.75000000000000 0.61109461324687 114.818 > 34 37 O 0.20680943299340 0.25000000000000 0.66826467513428 15.999 > 37 38 O 0.20680943299340 0.58333333333333 0.66826467513428 15.999 > 37 39 O 0.20680943299340 0.91666666666667 0.66826467513428 15.999 > 37 40 O 0.79319056700660 0.08333333333333 0.33173532486572 15.999 > 40 41 O 0.79319056700660 0.41666666666667 0.33173532486572 15.999 > 40 42 O 0.79319056700660 0.75000000000000 0.33173532486572 15.999 > 40 43 O 0.70680943299340 0.25000000000000 0.83173532486572 15.999 > 43 44 O 0.70680943299340 0.58333333333333 0.83173532486572 15.999 > 43 45 O 0.70680943299340 0.91666666666667 0.83173532486572 15.999 > 43 46 O 0.29319056700660 0.08333333333333 0.16826467513428 15.999 > 46 47 O 0.29319056700660 0.41666666666667 0.16826467513428 15.999 > 46 48 O 0.29319056700660 0.75000000000000 0.16826467513428 15.999 > 46 49 O 0.12201038293046 0.25000000000000 0.97859040580511 15.999 > 49 50 O 0.12201038293046 0.58333333333333 0.97859040580511 15.999 > 49 51 O 0.12201038293046 0.91666666666667 0.97859040580511 15.999 > 49 52 O 0.87798961706954 0.08333333333333 0.02140959419489 15.999 > 52 53 O 0.87798961706954 0.41666666666667 0.02140959419489 15.999 > 52 54 O 0.87798961706954 0.75000000000000 0.02140959419489 15.999 > 52 55 O 0.62201038293046 0.25000000000000 0.52140959419489 15.999 > 55 56 O 0.62201038293046 0.58333333333333 0.52140959419489 15.999 > 55 57 O 0.62201038293046 0.91666666666667 0.52140959419489 15.999 > 55 58 O 0.37798961706954 0.08333333333333 0.47859040580511 15.999 > 58 59 O 0.37798961706954 0.41666666666667 0.47859040580511 15.999 > 58 60 O 0.37798961706954 0.75000000000000 0.47859040580511 15.999 > 58 61 O 0.52272209424252 0.25000000000000 0.28263424205065 15.999 > 61 62 O 0.52272209424252 0.58333333333333 0.28263424205065 15.999 > 61 63 O 0.52272209424252 0.91666666666667 0.28263424205065 15.999 > 61 64 O 0.47727790575748 0.08333333333333 0.71736575794935 15.999 > 64 65 O 0.47727790575748 0.41666666666667 0.71736575794935 15.999 > 64 66 O 0.47727790575748 0.75000000000000 0.71736575794935 15.999 > 64 67 O 0.02272209424252 0.25000000000000 0.21736575794935 15.999 > 67 68 O 0.02272209424252 0.58333333333333 0.21736575794935 15.999 > 67 69 O 0.02272209424252 0.91666666666667 0.21736575794935 15.999 > 67 70 O 0.97727790575748 0.08333333333333 0.78263424205065 15.999 > 70 71 O 0.97727790575748 0.41666666666667 0.78263424205065 15.999 > 70 72 O 0.97727790575748 0.75000000000000 0.78263424205065 15.999 > 70 73 O 0.41872130340978 0.25000000000000 0.92502499376609 15.999 > 73 74 O 0.41872130340978 0.58333333333333 0.92502499376609 15.999 > 73 75 O 0.41872130340978 0.91666666666667 0.92502499376609 15.999 > 73 76 O 0.58127869659022 0.08333333333333 0.07497500623391 15.999 > 76 77 O 0.58127869659022 0.41666666666667 0.07497500623391 15.999 > 76 78 O 0.58127869659022 0.75000000000000 0.07497500623391 15.999 > 76 79 O 0.91872130340978 0.25000000000000 0.57497500623391 15.999 > 79 80 O 0.91872130340978 0.58333333333333 0.57497500623391 15.999 > 79 81 O 0.91872130340978 0.91666666666667 0.57497500623391 15.999 > 79 82 O 0.08127869659022 0.08333333333333 0.42502499376609 15.999 > 82 83 O 0.08127869659022 0.41666666666667 0.42502499376609 15.999 > 82 84 O 0.08127869659022 0.75000000000000 0.42502499376609 15.999 > 82----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 4.6421557 0.0000000 0.0000000 0.0000000 4.8221343 0.0000000 0.0000000 0.0000000 4.6145081-------------------------- Born effective charges -------------------------- 1 Sr 2.6573947 0.0000000 0.0140229 0.0000000 2.4271147 0.0000000 -0.0727142 0.0000000 2.4848118 2 Sr 2.6573947 0.0000000 0.0140229 0.0000000 2.4271147 0.0000000 -0.0727142 0.0000000 2.4848118 3 Sr 2.6573947 0.0000000 -0.0140229 0.0000000 2.4271147 0.0000000 0.0727142 0.0000000 2.4848118 4 Sr 2.6573947 0.0000000 -0.0140229 0.0000000 2.4271147 0.0000000 0.0727142 0.0000000 2.4848118 5 In 3.1063650 0.0000000 -0.2636044 0.0000000 3.4689045 0.0000000 -0.1483835 0.0000000 3.0918676 6 In 3.1063650 0.0000000 -0.2636044 0.0000000 3.4689045 0.0000000 -0.1483835 0.0000000 3.0918676 7 In 3.1063650 0.0000000 0.2636044 0.0000000 3.4689045 0.0000000 0.1483835 0.0000000 3.0918676 8 In 3.1063650 0.0000000 0.2636044 0.0000000 3.4689045 0.0000000 0.1483835 0.0000000 3.0918676 9 In 3.0168552 0.0000000 -0.0974670 0.0000000 3.4314451 0.0000000 -0.0032390 0.0000000 3.3155907 10 In 3.0168552 0.0000000 -0.0974670 0.0000000 3.4314451 0.0000000 -0.0032390 0.0000000 3.3155907 11 In 3.0168552 0.0000000 0.0974670 0.0000000 3.4314451 0.0000000 0.0032390 0.0000000 3.3155907 12 In 3.0168552 0.0000000 0.0974670 0.0000000 3.4314451 0.0000000 0.0032390 0.0000000 3.3155907 13 O -2.5513079 0.0000000 -0.1150715 0.0000000 -2.4324616 0.0000000 -0.0545005 0.0000000 -1.9563914 14 O -2.5513079 0.0000000 -0.1150715 0.0000000 -2.4324616 0.0000000 -0.0545005 0.0000000 -1.9563914 15 O -2.5513079 0.0000000 0.1150715 0.0000000 -2.4324616 0.0000000 0.0545005 0.0000000 -1.9563914 16 O -2.5513079 0.0000000 0.1150715 0.0000000 -2.4324616 0.0000000 0.0545005 0.0000000 -1.9563914 17 O -2.0580961 0.0000000 0.0784541 0.0000000 -2.3961733 0.0000000 0.0448941 0.0000000 -2.2857991 18 O -2.0580961 0.0000000 0.0784541 0.0000000 -2.3961733 0.0000000 0.0448941 0.0000000 -2.2857991 19 O -2.0580961 0.0000000 -0.0784541 0.0000000 -2.3961733 0.0000000 -0.0448941 0.0000000 -2.2857991 20 O -2.0580961 0.0000000 -0.0784541 0.0000000 -2.3961733 0.0000000 -0.0448941 0.0000000 -2.2857991 21 O -2.0308401 0.0000000 -0.2821394 0.0000000 -2.1348370 0.0000000 -0.2839549 0.0000000 -2.5515187 22 O -2.0308401 0.0000000 -0.2821394 0.0000000 -2.1348370 0.0000000 -0.2839549 0.0000000 -2.5515187 23 O -2.0308401 0.0000000 0.2821394 0.0000000 -2.1348370 0.0000000 0.2839549 0.0000000 -2.5515187 24 O -2.0308401 0.0000000 0.2821394 0.0000000 -2.1348370 0.0000000 0.2839549 0.0000000 -2.5515187 25 O -2.1403709 0.0000000 -0.1180300 0.0000000 -2.3639923 0.0000000 -0.0207500 0.0000000 -2.0985609 26 O -2.1403709 0.0000000 -0.1180300 0.0000000 -2.3639923 0.0000000 -0.0207500 0.0000000 -2.0985609 27 O -2.1403709 0.0000000 0.1180300 0.0000000 -2.3639923 0.0000000 0.0207500 0.0000000 -2.0985609 28 O -2.1403709 0.0000000 0.1180300 0.0000000 -2.3639923 0.0000000 0.0207500 0.0000000 -2.0985609----------------------------------------------------------------------------fc3 was read from "fc3.hdf5".fc2 was read from "fc2.hdf5".----------------------------- Force constants ------------------------------Max drift of fc3: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz)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 ... [ 5 15 4 ]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: 0.58, Number of G-points: 293, Lambda: 0.13Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/72) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating 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 2.084 ( 0.000 0.000 0.000) 0.000 2.337 ( 0.000 0.000 0.000) 0.000 2.376 ( 0.000 0.000 0.000) 0.000 2.435 ( 0.000 0.000 0.000) 0.000 2.529 ( 0.000 0.000 0.000) 0.000 2.610 ( 0.000 0.000 0.000) 0.000 2.767 ( 0.000 0.000 0.000) 0.000 2.921 ( 0.000 0.000 0.000) 0.000 3.033 ( 0.000 0.000 0.000) 0.000 3.068 ( 0.000 0.000 0.000) 0.000 3.070 ( 0.000 0.000 0.000) 0.000 3.130 ( 0.000 0.000 0.000) 0.000 3.225 ( 0.000 0.000 0.000) 0.000 3.383 ( 0.000 0.000 0.000) 0.000 3.444 ( 0.000 0.000 0.000) 0.000 3.466 ( 0.000 0.000 0.000) 0.000 3.502 ( 0.000 0.000 0.000) 0.000 3.581 ( 0.000 0.000 0.000) 0.000 3.742 ( 0.000 0.000 0.000) 0.000 4.115 ( 0.000 0.000 0.000) 0.000 4.531 ( 0.000 0.000 0.000) 0.000 4.587 ( 0.000 0.000 0.000) 0.000 4.688 ( 0.000 0.000 0.000) 0.000 5.220 ( 0.000 0.000 0.000) 0.000 5.276 ( 0.000 0.000 0.000) 0.000 5.435 ( 0.000 0.000 0.000) 0.000 5.617 ( 0.000 0.000 0.000) 0.000 5.846 ( 0.000 0.000 0.000) 0.000 5.907 ( 0.000 0.000 0.000) 0.000 6.185 ( 0.000 0.000 0.000) 0.000 6.301 ( 0.000 0.000 0.000) 0.000 6.366 ( 0.000 0.000 0.000) 0.000 6.744 ( 0.000 0.000 0.000) 0.000 6.806 ( 0.000 0.000 0.000) 0.000 6.833 ( 0.000 0.000 0.000) 0.000 7.144 ( 0.000 0.000 0.000) 0.000 7.397 ( 0.000 0.000 0.000) 0.000 8.782 ( 0.000 0.000 0.000) 0.000 8.784 ( 0.000 0.000 0.000) 0.000 8.878 ( 0.000 0.000 0.000) 0.000 9.063 ( 0.000 0.000 0.000) 0.000 9.174 ( 0.000 0.000 0.000) 0.000 9.270 ( 0.000 0.000 0.000) 0.000 9.313 ( 0.000 0.000 0.000) 0.000 9.490 ( 0.000 0.000 0.000) 0.000 9.503 ( 0.000 0.000 0.000) 0.000 9.741 ( 0.000 0.000 0.000) 0.000 9.746 ( 0.000 0.000 0.000) 0.000 9.750 ( 0.000 0.000 0.000) 0.000 9.969 ( 0.000 0.000 0.000) 0.000 10.099 ( 0.000 0.000 0.000) 0.000 10.147 ( 0.000 0.000 0.000) 0.000 10.343 ( 0.000 0.000 0.000) 0.000 10.343 ( 0.000 0.000 0.000) 0.000 10.972 ( 0.000 0.000 0.000) 0.000 11.000 ( 0.000 0.000 0.000) 0.000 11.210 ( 0.000 0.000 0.000) 0.000 11.275 ( 0.000 0.000 0.000) 0.000 11.682 ( 0.000 0.000 0.000) 0.000 11.845 ( 0.000 0.000 0.000) 0.000 11.946 ( 0.000 0.000 0.000) 0.000 12.173 ( 0.000 0.000 0.000) 0.000 12.268 ( 0.000 0.000 0.000) 0.000 12.503 ( 0.000 0.000 0.000) 0.000 12.522 ( 0.000 0.000 0.000) 0.000 12.578 ( 0.000 0.000 0.000) 0.000 12.731 ( 0.000 0.000 0.000) 0.000 12.790 ( 0.000 0.000 0.000) 0.000 13.658 ( 0.000 0.000 0.000) 0.000 13.843 ( 0.000 0.000 0.000) 0.000 13.947 ( 0.000 0.000 0.000) 0.000 14.381 ( 0.000 0.000 0.000) 0.000 15.347 ( 0.000 0.000 0.000) 0.000 15.398 ( 0.000 0.000 0.000) 0.000 15.526 ( 0.000 0.000 0.000) 0.000 15.866 ( 0.000 0.000 0.000) 0.000 15.946 ( 0.000 0.000 0.000) 0.000 16.901 ( 0.000 0.000 0.000) 0.000 16.935 ( 0.000 0.000 0.000) 0.000 17.357 ( 0.000 0.000 0.000) 0.000 17.574 ( 0.000 0.000 0.000) 0.000======================= Grid point 1 (2/72) =======================q-point: ( 0.20 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.595 ( 28.871 0.000 0.000) 28.871 0.599 ( 29.289 0.000 0.000) 29.289 1.122 ( 54.401 0.000 0.000) 54.401 2.049 ( -8.201 0.000 0.000) 8.201 2.227 ( -16.424 0.000 0.000) 16.424 2.290 ( -5.852 0.000 0.000) 5.852 2.447 ( 6.738 0.000 0.000) 6.738 2.542 ( 5.338 0.000 0.000) 5.338 2.637 ( 1.124 0.000 0.000) 1.124 2.688 ( -5.155 0.000 0.000) 5.155 2.972 ( -4.683 0.000 0.000) 4.683 2.999 ( -4.685 0.000 0.000) 4.685 3.036 ( 5.851 0.000 0.000) 5.851 3.094 ( 1.548 0.000 0.000) 1.548 3.167 ( 3.738 0.000 0.000) 3.738 3.223 ( -3.530 0.000 0.000) 3.530 3.388 ( 0.220 0.000 0.000) 0.220 3.457 ( -3.034 0.000 0.000) 3.034 3.489 ( 1.848 0.000 0.000) 1.848 3.571 ( -0.857 0.000 0.000) 0.857 3.617 ( 8.053 0.000 0.000) 8.053 3.807 ( 7.597 0.000 0.000) 7.597 4.124 ( 4.749 0.000 0.000) 4.749 4.167 ( -31.178 0.000 0.000) 31.178 4.646 ( 9.774 0.000 0.000) 9.774 4.843 ( 9.888 0.000 0.000) 9.888 5.123 ( -8.059 0.000 0.000) 8.059 5.138 ( -22.423 0.000 0.000) 22.423 5.594 ( -6.885 0.000 0.000) 6.885 5.728 ( -16.562 0.000 0.000) 16.562 5.836 ( 14.141 0.000 0.000) 14.141 6.001 ( 8.385 0.000 0.000) 8.385 6.137 ( -2.814 0.000 0.000) 2.814 6.235 ( 3.167 0.000 0.000) 3.167 6.592 ( 9.384 0.000 0.000) 9.384 6.738 ( -0.516 0.000 0.000) 0.516 6.815 ( 0.145 0.000 0.000) 0.145 7.234 ( 7.079 0.000 0.000) 7.079 7.259 ( -10.237 0.000 0.000) 10.237 7.472 ( 0.466 0.000 0.000) 0.466 8.799 ( 1.530 0.000 0.000) 1.530 8.799 ( 1.379 0.000 0.000) 1.379 9.023 ( 9.824 0.000 0.000) 9.824 9.074 ( 1.033 0.000 0.000) 1.033 9.178 ( 0.910 0.000 0.000) 0.910 9.235 ( -2.855 0.000 0.000) 2.855 9.260 ( -3.859 0.000 0.000) 3.859 9.517 ( 2.336 0.000 0.000) 2.336 9.568 ( 5.004 0.000 0.000) 5.004 9.675 ( -6.321 0.000 0.000) 6.321 9.722 ( -1.943 0.000 0.000) 1.943 9.931 ( -3.471 0.000 0.000) 3.471 10.088 ( -0.873 0.000 0.000) 0.873 10.176 ( 2.566 0.000 0.000) 2.566 10.271 ( -6.057 0.000 0.000) 6.057 10.334 ( -1.019 0.000 0.000) 1.019 10.999 ( 2.542 0.000 0.000) 2.542 11.110 ( 8.271 0.000 0.000) 8.271 11.198 ( -0.803 0.000 0.000) 0.803 11.243 ( -2.981 0.000 0.000) 2.981 11.522 ( 10.085 0.000 0.000) 10.085 11.708 ( -5.623 0.000 0.000) 5.623 12.077 ( 4.690 0.000 0.000) 4.690 12.120 ( -7.920 0.000 0.000) 7.920 12.186 ( 1.222 0.000 0.000) 1.222 12.262 ( -0.559 0.000 0.000) 0.559 12.511 ( 0.728 0.000 0.000) 0.728 12.572 ( -0.635 0.000 0.000) 0.635 12.702 ( 13.199 0.000 0.000) 13.199 12.745 ( 2.586 0.000 0.000) 2.586 13.566 ( -8.152 0.000 0.000) 8.152 13.594 ( -14.731 0.000 0.000) 14.731 14.097 ( 8.932 0.000 0.000) 8.932 14.399 ( 0.638 0.000 0.000) 0.638 15.268 ( -4.561 0.000 0.000) 4.561 15.358 ( -3.556 0.000 0.000) 3.556 15.619 ( 6.312 0.000 0.000) 6.312 15.872 ( 0.584 0.000 0.000) 0.584 15.872 ( 0.572 0.000 0.000) 0.572 15.930 ( -2.778 0.000 0.000) 2.778 16.903 ( -0.185 0.000 0.000) 0.185 16.928 ( -0.620 0.000 0.000) 0.620 17.381 ( 2.140 0.000 0.000) 2.140 17.553 ( -1.967 0.000 0.000) 1.967======================= Grid point 2 (3/72) =======================q-point: ( 0.40 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.168 ( 27.106 0.000 0.000) 27.106 1.190 ( 28.724 0.000 0.000) 28.724 1.686 ( -23.307 0.000 0.000) 23.307 1.759 ( -26.553 0.000 0.000) 26.553 2.197 ( 50.120 0.000 0.000) 50.120 2.336 ( 6.812 0.000 0.000) 6.812 2.502 ( -8.840 0.000 0.000) 8.840 2.617 ( 8.399 0.000 0.000) 8.399 2.692 ( 4.448 0.000 0.000) 4.448 2.744 ( 5.677 0.000 0.000) 5.677 2.873 ( -6.651 0.000 0.000) 6.651 2.930 ( 2.305 0.000 0.000) 2.305 3.026 ( -18.498 0.000 0.000) 18.498 3.104 ( 1.241 0.000 0.000) 1.241 3.113 ( 0.245 0.000 0.000) 0.245 3.188 ( -27.725 0.000 0.000) 27.725 3.283 ( 6.030 0.000 0.000) 6.030 3.371 ( -2.396 0.000 0.000) 2.396 3.525 ( 1.502 0.000 0.000) 1.502 3.550 ( -1.093 0.000 0.000) 1.093 3.645 ( -2.125 0.000 0.000) 2.125 3.662 ( -7.938 0.000 0.000) 7.938 4.097 ( 19.073 0.000 0.000) 19.073 4.343 ( 8.855 0.000 0.000) 8.855 4.684 ( -15.902 0.000 0.000) 15.902 4.812 ( -13.890 0.000 0.000) 13.890 4.913 ( 16.339 0.000 0.000) 16.339 5.156 ( 12.168 0.000 0.000) 12.168 5.307 ( -21.402 0.000 0.000) 21.402 5.408 ( -11.153 0.000 0.000) 11.153 6.091 ( 7.169 0.000 0.000) 7.169 6.111 ( 2.410 0.000 0.000) 2.410 6.149 ( 4.041 0.000 0.000) 4.041 6.253 ( -2.465 0.000 0.000) 2.465 6.698 ( 2.151 0.000 0.000) 2.151 6.725 ( -0.821 0.000 0.000) 0.821 6.888 ( 6.316 0.000 0.000) 6.316 7.047 ( -9.436 0.000 0.000) 9.436 7.373 ( 5.801 0.000 0.000) 5.801 7.456 ( -2.269 0.000 0.000) 2.269 8.829 ( 1.136 0.000 0.000) 1.136 8.830 ( 1.089 0.000 0.000) 1.089 9.102 ( 1.503 0.000 0.000) 1.503 9.125 ( -0.243 0.000 0.000) 0.243 9.183 ( -1.519 0.000 0.000) 1.519 9.191 ( -2.329 0.000 0.000) 2.329 9.313 ( 11.296 0.000 0.000) 11.296 9.522 ( -8.767 0.000 0.000) 8.767 9.574 ( 3.069 0.000 0.000) 3.069 9.629 ( -1.370 0.000 0.000) 1.370 9.724 ( 4.410 0.000 0.000) 4.410 9.837 ( -5.538 0.000 0.000) 5.538 10.082 ( 0.992 0.000 0.000) 0.992 10.146 ( -5.199 0.000 0.000) 5.199 10.238 ( 3.274 0.000 0.000) 3.274 10.298 ( -2.447 0.000 0.000) 2.447 11.071 ( 4.308 0.000 0.000) 4.308 11.164 ( -4.545 0.000 0.000) 4.545 11.195 ( 0.770 0.000 0.000) 0.770 11.212 ( 0.603 0.000 0.000) 0.603 11.714 ( 5.712 0.000 0.000) 5.712 11.744 ( 8.504 0.000 0.000) 8.504 11.973 ( -4.679 0.000 0.000) 4.679 12.050 ( -6.634 0.000 0.000) 6.634 12.216 ( 1.548 0.000 0.000) 1.548 12.244 ( -1.154 0.000 0.000) 1.154 12.531 ( 1.133 0.000 0.000) 1.133 12.554 ( -1.075 0.000 0.000) 1.075 12.879 ( 9.668 0.000 0.000) 9.668 12.951 ( 7.963 0.000 0.000) 7.963 13.316 ( -9.439 0.000 0.000) 9.439 13.368 ( -9.963 0.000 0.000) 9.963 14.255 ( 6.777 0.000 0.000) 6.777 14.368 ( -3.874 0.000 0.000) 3.874 15.224 ( 0.520 0.000 0.000) 0.520 15.275 ( -3.918 0.000 0.000) 3.918 15.741 ( 5.545 0.000 0.000) 5.545 15.842 ( -4.214 0.000 0.000) 4.214 15.885 ( 0.564 0.000 0.000) 0.564 15.892 ( -0.187 0.000 0.000) 0.187 16.904 ( 0.260 0.000 0.000) 0.260 16.914 ( -0.667 0.000 0.000) 0.667 17.436 ( 3.080 0.000 0.000) 3.080 17.500 ( -3.034 0.000 0.000) 3.034======================= Grid point 5 (4/72) =======================q-point: ( 0.00 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.569 ( 0.000 28.234 0.000) 28.234 0.617 ( 0.000 30.269 0.000) 30.269 1.249 ( 0.000 60.500 0.000) 60.500 2.306 ( 0.000 19.925 0.000) 19.925 2.368 ( 0.000 3.212 0.000) 3.212 2.407 ( 0.000 3.179 0.000) 3.179 2.573 ( 0.000 4.307 0.000) 4.307 2.640 ( 0.000 18.366 0.000) 18.366 2.724 ( 0.000 8.842 0.000) 8.842 2.950 ( 0.000 16.846 0.000) 16.846 3.011 ( 0.000 7.283 0.000) 7.283 3.054 ( 0.000 4.822 0.000) 4.822 3.222 ( 0.000 0.071 0.000) 0.071 3.237 ( 0.000 14.942 0.000) 14.942 3.239 ( 0.000 14.398 0.000) 14.398 3.283 ( 0.000 14.031 0.000) 14.031 3.434 ( 0.000 4.855 0.000) 4.855 3.437 ( 0.000 0.608 0.000) 0.608 3.565 ( 0.000 13.861 0.000) 13.861 3.745 ( 0.000 0.507 0.000) 0.507 3.775 ( 0.000 18.395 0.000) 18.395 3.778 ( 0.000 19.794 0.000) 19.794 4.102 ( 0.000 -1.219 0.000) 1.219 4.600 ( 0.000 1.735 0.000) 1.735 4.601 ( 0.000 7.233 0.000) 7.233 4.735 ( 0.000 4.759 0.000) 4.759 5.191 ( 0.000 -2.734 0.000) 2.734 5.245 ( 0.000 -2.918 0.000) 2.918 5.432 ( 0.000 -0.285 0.000) 0.285 5.614 ( 0.000 -0.047 0.000) 0.047 5.807 ( 0.000 -3.508 0.000) 3.508 5.862 ( 0.000 -4.164 0.000) 4.164 6.143 ( 0.000 -4.059 0.000) 4.059 6.263 ( 0.000 -3.487 0.000) 3.487 6.356 ( 0.000 -0.979 0.000) 0.979 6.712 ( 0.000 -3.110 0.000) 3.110 6.775 ( 0.000 -5.413 0.000) 5.413 6.797 ( 0.000 -0.712 0.000) 0.712 7.042 ( 0.000 -8.942 0.000) 8.942 7.327 ( 0.000 -6.420 0.000) 6.420 8.827 ( 0.000 -4.373 0.000) 4.373 8.933 ( 0.000 12.607 0.000) 12.607 8.959 ( 0.000 15.218 0.000) 15.218 9.015 ( 0.000 -3.100 0.000) 3.100 9.118 ( 0.000 -4.544 0.000) 4.544 9.291 ( 0.000 2.756 0.000) 2.756 9.622 ( 0.000 2.035 0.000) 2.035 9.670 ( 0.000 -2.656 0.000) 2.656 9.697 ( 0.000 14.326 0.000) 14.326 9.715 ( 0.000 6.599 0.000) 6.599 9.850 ( 0.000 14.249 0.000) 14.249 9.940 ( 0.000 1.092 0.000) 1.092 10.266 ( 0.000 10.522 0.000) 10.522 10.334 ( 0.000 -0.747 0.000) 0.747 10.341 ( 0.000 16.443 0.000) 16.443 10.452 ( 0.000 9.644 0.000) 9.644 10.984 ( 0.000 -1.542 0.000) 1.542 10.987 ( 0.000 1.241 0.000) 1.241 11.163 ( 0.000 -3.390 0.000) 3.390 11.215 ( 0.000 -4.916 0.000) 4.916 11.705 ( 0.000 -9.330 0.000) 9.330 11.719 ( 0.000 3.700 0.000) 3.700 11.909 ( 0.000 5.211 0.000) 5.211 12.025 ( 0.000 8.446 0.000) 8.446 12.439 ( 0.000 -4.889 0.000) 4.889 12.480 ( 0.000 17.391 0.000) 17.391 12.527 ( 0.000 0.923 0.000) 0.923 12.605 ( 0.000 2.316 0.000) 2.316 12.801 ( 0.000 5.734 0.000) 5.734 12.857 ( 0.000 6.582 0.000) 6.582 13.678 ( 0.000 1.631 0.000) 1.631 13.825 ( 0.000 -1.676 0.000) 1.676 13.916 ( 0.000 -2.698 0.000) 2.698 14.340 ( 0.000 -3.896 0.000) 3.896 15.300 ( 0.000 -4.300 0.000) 4.300 15.359 ( 0.000 -3.671 0.000) 3.671 15.516 ( 0.000 -0.823 0.000) 0.823 15.815 ( 0.000 -4.714 0.000) 4.714 15.873 ( 0.000 -6.742 0.000) 6.742 16.035 ( 0.000 -1.987 0.000) 1.987 16.863 ( 0.000 -3.628 0.000) 3.628 16.885 ( 0.000 -4.769 0.000) 4.769 17.301 ( 0.000 -5.461 0.000) 5.461 17.495 ( 0.000 -7.449 0.000) 7.449======================= Grid point 6 (5/72) =======================q-point: ( 0.20 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.852 ( 19.849 21.215 0.000) 29.053 0.955 ( 25.834 20.184 0.000) 32.785 1.596 ( 32.237 44.196 0.000) 54.703 2.269 ( -15.128 4.754 0.000) 15.858 2.274 ( -7.912 20.041 0.000) 21.547 2.473 ( 1.766 7.760 0.000) 7.959 2.489 ( -0.934 12.444 0.000) 12.479 2.562 ( 5.005 2.369 0.000) 5.538 2.775 ( 4.838 9.877 0.000) 10.999 2.867 ( -6.812 16.829 0.000) 18.156 2.984 ( -4.549 3.904 0.000) 5.995 3.120 ( 3.193 4.749 0.000) 5.723 3.167 ( -4.378 15.179 0.000) 15.798 3.255 ( 1.455 4.572 0.000) 4.798 3.260 ( 1.259 14.677 0.000) 14.730 3.297 ( 0.934 13.001 0.000) 13.035 3.436 ( 0.951 5.219 0.000) 5.305 3.540 ( -0.001 12.718 0.000) 12.718 3.631 ( 8.298 2.620 0.000) 8.702 3.761 ( -0.081 16.634 0.000) 16.634 3.763 ( -0.617 17.846 0.000) 17.857 3.818 ( 6.837 4.192 0.000) 8.020 4.117 ( 4.582 -0.241 0.000) 4.588 4.208 ( -29.558 4.677 0.000) 29.926 4.696 ( 8.738 5.513 0.000) 10.332 4.872 ( 8.617 3.058 0.000) 9.144 5.070 ( -18.694 -5.234 0.000) 19.413 5.098 ( -7.693 -2.348 0.000) 8.043 5.514 ( -1.040 -4.423 0.000) 4.544 5.702 ( -15.517 -2.404 0.000) 15.702 5.810 ( 13.256 -2.280 0.000) 13.450 5.899 ( 9.496 -6.937 0.000) 11.760 6.109 ( -3.306 -2.475 0.000) 4.130 6.184 ( 2.808 -4.437 0.000) 5.251 6.560 ( 8.779 -2.915 0.000) 9.251 6.693 ( -0.726 -3.764 0.000) 3.833 6.759 ( 0.445 -5.374 0.000) 5.393 7.009 ( 9.327 -13.569 0.000) 16.465 7.128 ( 6.494 -9.089 0.000) 11.171 7.259 ( -3.935 -6.213 0.000) 7.355 8.845 ( 1.641 -0.933 0.000) 1.888 8.937 ( 0.166 10.571 0.000) 10.572 9.026 ( 1.013 -3.109 0.000) 3.270 9.061 ( 5.498 7.447 0.000) 9.257 9.137 ( 5.137 -0.719 0.000) 5.187 9.288 ( 0.149 5.596 0.000) 5.598 9.595 ( -8.069 12.964 0.000) 15.270 9.648 ( -2.048 -2.953 0.000) 3.594 9.688 ( 4.760 8.575 0.000) 9.807 9.699 ( 0.295 15.444 0.000) 15.447 9.832 ( -2.001 9.467 0.000) 9.677 9.938 ( -0.541 3.682 0.000) 3.722 10.173 ( -6.916 8.942 0.000) 11.304 10.230 ( -8.062 0.454 0.000) 8.075 10.379 ( 2.750 14.326 0.000) 14.588 10.479 ( 1.684 10.470 0.000) 10.604 10.942 ( -1.386 -0.588 0.000) 1.506 11.047 ( 2.836 -5.142 0.000) 5.873 11.150 ( -0.835 -3.394 0.000) 3.496 11.213 ( 0.791 -2.792 0.000) 2.902 11.655 ( -2.067 -3.687 0.000) 4.227 11.704 ( 2.668 7.981 0.000) 8.415 11.974 ( 4.467 1.053 0.000) 4.589 12.152 ( 4.527 5.969 0.000) 7.492 12.358 ( -10.794 4.441 0.000) 11.672 12.383 ( -4.438 2.170 0.000) 4.940 12.508 ( 1.775 7.127 0.000) 7.345 12.626 ( -0.265 3.927 0.000) 3.936 12.845 ( 4.924 9.738 0.000) 10.912 12.862 ( 5.772 9.059 0.000) 10.742 13.602 ( -6.957 3.273 0.000) 7.688 13.622 ( -12.457 2.439 0.000) 12.693 14.051 ( 7.534 -4.413 0.000) 8.732 14.343 ( -0.364 -5.257 0.000) 5.269 15.248 ( -3.165 -1.970 0.000) 3.727 15.335 ( -2.584 -2.811 0.000) 3.818 15.582 ( 4.854 -3.214 0.000) 5.822 15.823 ( 0.673 -4.598 0.000) 4.647 15.841 ( -3.057 -7.540 0.000) 8.136 15.924 ( -4.868 1.902 0.000) 5.226 16.861 ( -0.183 -3.870 0.000) 3.874 16.879 ( -0.527 -4.669 0.000) 4.699 17.322 ( 1.936 -5.671 0.000) 5.992 17.477 ( -1.742 -7.222 0.000) 7.429======================= Grid point 7 (6/72) =======================q-point: ( 0.40 0.07 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.321 ( 24.929 12.334 0.000) 27.813 1.461 ( 24.025 21.656 0.000) 32.345 1.833 ( -24.477 7.327 0.000) 25.550 1.930 ( -21.531 20.376 0.000) 29.644 2.396 ( 41.457 21.053 0.000) 46.496 2.528 ( 6.493 16.806 0.000) 18.016 2.653 ( 8.802 3.726 0.000) 9.558 2.672 ( -4.201 10.537 0.000) 11.343 2.746 ( 1.882 10.222 0.000) 10.394 2.891 ( -0.537 9.240 0.000) 9.256 2.943 ( 8.420 5.377 0.000) 9.990 2.997 ( -8.519 7.302 0.000) 11.220 3.057 ( -13.442 6.379 0.000) 14.879 3.238 ( -12.774 11.350 0.000) 17.088 3.271 ( -0.077 14.342 0.000) 14.342 3.276 ( -5.328 13.652 0.000) 14.655 3.444 ( 2.087 12.257 0.000) 12.434 3.512 ( -2.659 12.606 0.000) 12.884 3.641 ( -3.305 5.161 0.000) 6.128 3.641 ( -9.043 6.647 0.000) 11.223 3.780 ( 0.564 16.887 0.000) 16.897 3.785 ( -0.937 16.417 0.000) 16.444 4.094 ( 17.889 0.151 0.000) 17.889 4.324 ( 8.418 -1.625 0.000) 8.573 4.662 ( -14.453 -1.954 0.000) 14.585 4.797 ( -14.288 -1.457 0.000) 14.362 4.941 ( 15.221 3.240 0.000) 15.562 5.153 ( 11.499 0.067 0.000) 11.500 5.309 ( -20.136 0.461 0.000) 20.141 5.381 ( -9.850 -1.962 0.000) 10.044 6.042 ( 6.506 -4.708 0.000) 8.030 6.048 ( 3.837 -6.058 0.000) 7.171 6.113 ( 3.212 -3.258 0.000) 4.575 6.199 ( -2.196 -4.727 0.000) 5.213 6.653 ( 1.803 -3.933 0.000) 4.326 6.678 ( -0.857 -4.103 0.000) 4.192 6.840 ( 6.408 -4.573 0.000) 7.872 6.982 ( -7.043 -5.993 0.000) 9.247 7.244 ( 4.018 -10.237 0.000) 10.998 7.271 ( 1.527 -11.779 0.000) 11.877 8.888 ( 2.327 1.754 0.000) 2.914 8.927 ( -1.304 5.485 0.000) 5.638 9.052 ( 1.413 -2.837 0.000) 3.169 9.077 ( -0.875 -2.148 0.000) 2.319 9.321 ( 3.479 12.167 0.000) 12.655 9.361 ( 11.954 6.429 0.000) 13.573 9.434 ( -6.651 18.034 0.000) 19.221 9.568 ( -6.841 5.146 0.000) 8.560 9.717 ( 1.768 10.102 0.000) 10.256 9.765 ( -1.849 10.701 0.000) 10.860 9.821 ( 5.177 5.355 0.000) 7.448 9.915 ( -2.213 7.643 0.000) 7.957 10.045 ( -3.766 2.252 0.000) 4.388 10.078 ( -5.804 0.297 0.000) 5.812 10.442 ( 3.073 13.672 0.000) 14.013 10.488 ( -1.077 12.818 0.000) 12.863 10.964 ( 2.896 -6.041 0.000) 6.700 11.030 ( -3.048 -8.165 0.000) 8.715 11.155 ( 1.825 -3.298 0.000) 3.770 11.212 ( -2.460 -2.300 0.000) 3.367 11.711 ( 6.964 0.192 0.000) 6.966 11.788 ( 2.379 2.571 0.000) 3.503 12.038 ( 1.012 2.484 0.000) 2.682 12.080 ( -6.153 9.742 0.000) 11.522 12.274 ( -0.337 2.281 0.000) 2.306 12.293 ( -3.135 3.369 0.000) 4.602 12.547 ( 2.123 3.707 0.000) 4.272 12.594 ( -2.257 3.836 0.000) 4.451 13.009 ( 7.243 9.498 0.000) 11.945 13.019 ( 8.040 5.322 0.000) 9.642 13.398 ( -7.556 7.772 0.000) 10.840 13.430 ( -8.500 6.179 0.000) 10.509 14.193 ( 6.261 -6.015 0.000) 8.682 14.300 ( -3.959 -6.489 0.000) 7.602 15.220 ( 0.711 -0.525 0.000) 0.884 15.268 ( -3.400 -1.119 0.000) 3.579 15.680 ( 4.551 -5.757 0.000) 7.339 15.766 ( -3.983 -7.528 0.000) 8.517 15.841 ( 1.100 -3.820 0.000) 3.976 15.868 ( -1.639 -1.508 0.000) 2.227 16.860 ( 0.144 -4.105 0.000) 4.107 16.867 ( -0.519 -4.408 0.000) 4.438 17.372 ( 2.794 -6.138 0.000) 6.744 17.430 ( -2.726 -6.701 0.000) 7.234======================= Grid point 10 (7/72) =======================q-point: ( 0.00 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.146 ( 0.000 28.407 0.000) 28.407 1.227 ( 0.000 29.660 0.000) 29.660 2.343 ( 0.000 27.989 0.000) 27.989 2.509 ( 0.000 6.807 0.000) 6.807 2.569 ( 0.000 35.230 0.000) 35.230 2.699 ( 0.000 7.781 0.000) 7.781 2.782 ( 0.000 23.838 0.000) 23.838 2.864 ( 0.000 4.755 0.000) 4.755 3.051 ( 0.000 16.527 0.000) 16.527 3.145 ( 0.000 5.414 0.000) 5.414 3.251 ( 0.000 5.593 0.000) 5.593 3.257 ( 0.000 13.446 0.000) 13.446 3.353 ( 0.000 15.745 0.000) 15.745 3.485 ( 0.000 9.576 0.000) 9.576 3.519 ( 0.000 12.173 0.000) 12.173 3.613 ( 0.000 21.067 0.000) 21.067 3.654 ( 0.000 19.874 0.000) 19.874 3.770 ( 0.000 25.642 0.000) 25.642 3.790 ( 0.000 6.160 0.000) 6.160 3.944 ( 0.000 21.871 0.000) 21.871 4.069 ( 0.000 -1.806 0.000) 1.806 4.243 ( 0.000 23.724 0.000) 23.724 4.281 ( 0.000 30.069 0.000) 30.069 4.703 ( 0.000 10.300 0.000) 10.300 4.844 ( 0.000 16.935 0.000) 16.935 4.893 ( 0.000 11.012 0.000) 11.012 5.115 ( 0.000 -4.536 0.000) 4.536 5.165 ( 0.000 -4.563 0.000) 4.563 5.422 ( 0.000 -0.950 0.000) 0.950 5.633 ( 0.000 2.565 0.000) 2.565 5.728 ( 0.000 -3.396 0.000) 3.396 5.754 ( 0.000 -6.029 0.000) 6.029 6.026 ( 0.000 -7.142 0.000) 7.142 6.176 ( 0.000 -4.477 0.000) 4.477 6.329 ( 0.000 -1.746 0.000) 1.746 6.623 ( 0.000 -5.399 0.000) 5.399 6.632 ( 0.000 -7.838 0.000) 7.838 6.785 ( 0.000 -0.354 0.000) 0.354 6.834 ( 0.000 -10.413 0.000) 10.413 7.160 ( 0.000 -9.389 0.000) 9.389 8.724 ( 0.000 -5.401 0.000) 5.401 8.965 ( 0.000 -1.934 0.000) 1.934 9.008 ( 0.000 -5.821 0.000) 5.821 9.071 ( 0.000 -2.125 0.000) 2.125 9.354 ( 0.000 21.524 0.000) 21.524 9.509 ( 0.000 -6.992 0.000) 6.992 9.511 ( 0.000 19.547 0.000) 19.547 9.564 ( 0.000 -4.992 0.000) 4.992 10.026 ( 0.000 6.462 0.000) 6.462 10.047 ( 0.000 18.526 0.000) 18.526 10.088 ( 0.000 19.529 0.000) 19.529 10.165 ( 0.000 12.218 0.000) 12.218 10.340 ( 0.000 4.054 0.000) 4.054 10.359 ( 0.000 -3.427 0.000) 3.427 10.679 ( 0.000 10.830 0.000) 10.830 10.722 ( 0.000 18.716 0.000) 18.716 11.002 ( 0.000 5.706 0.000) 5.706 11.027 ( 0.000 3.707 0.000) 3.707 11.127 ( 0.000 -2.036 0.000) 2.036 11.132 ( 0.000 1.764 0.000) 1.764 11.729 ( 0.000 11.590 0.000) 11.590 11.827 ( 0.000 6.506 0.000) 6.506 12.007 ( 0.000 3.473 0.000) 3.473 12.187 ( 0.000 5.917 0.000) 5.917 12.343 ( 0.000 -3.998 0.000) 3.998 12.595 ( 0.000 6.636 0.000) 6.636 12.664 ( 0.000 3.599 0.000) 3.599 12.777 ( 0.000 11.658 0.000) 11.658 12.945 ( 0.000 8.507 0.000) 8.507 13.042 ( 0.000 10.888 0.000) 10.888 13.691 ( 0.000 -1.543 0.000) 1.543 13.782 ( 0.000 -2.305 0.000) 2.305 13.863 ( 0.000 -1.746 0.000) 1.746 14.238 ( 0.000 -5.566 0.000) 5.566 15.198 ( 0.000 -5.002 0.000) 5.002 15.257 ( 0.000 -6.035 0.000) 6.035 15.501 ( 0.000 -0.507 0.000) 0.507 15.691 ( 0.000 -6.966 0.000) 6.966 15.699 ( 0.000 -9.561 0.000) 9.561 15.975 ( 0.000 -3.923 0.000) 3.923 16.752 ( 0.000 -7.955 0.000) 7.955 16.756 ( 0.000 -6.774 0.000) 6.774 17.143 ( 0.000 -9.855 0.000) 9.855 17.288 ( 0.000 -12.421 0.000) 12.421======================= Grid point 11 (8/72) =======================q-point: ( 0.20 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.349 ( 11.349 26.250 0.000) 28.598 1.375 ( 19.978 22.003 0.000) 29.720 2.390 ( -7.928 11.185 0.000) 13.710 2.579 ( 6.699 6.607 0.000) 9.409 2.621 ( 7.705 25.705 0.000) 26.835 2.675 ( 8.052 30.876 0.000) 31.909 2.733 ( -12.464 21.180 0.000) 24.576 2.858 ( -3.242 17.280 0.000) 17.582 2.896 ( 3.707 3.367 0.000) 5.007 3.195 ( -3.125 13.978 0.000) 14.323 3.196 ( -0.194 3.862 0.000) 3.867 3.293 ( -5.727 21.945 0.000) 22.680 3.365 ( 4.561 6.775 0.000) 8.167 3.519 ( 2.345 14.844 0.000) 15.028 3.598 ( 2.816 11.911 0.000) 12.239 3.630 ( -1.913 19.658 0.000) 19.751 3.698 ( 8.930 13.651 0.000) 16.313 3.744 ( -0.725 20.736 0.000) 20.749 3.867 ( 6.187 9.381 0.000) 11.238 3.930 ( -1.385 20.980 0.000) 21.026 4.081 ( 3.431 1.741 0.000) 3.847 4.239 ( -1.796 22.079 0.000) 22.152 4.287 ( 0.365 27.367 0.000) 27.370 4.420 ( -20.535 18.986 0.000) 27.967 4.892 ( 2.876 12.306 0.000) 12.638 4.973 ( 0.258 5.079 0.000) 5.086 4.973 ( -13.621 -1.980 0.000) 13.764 5.045 ( -1.591 -0.429 0.000) 1.648 5.472 ( -0.559 0.235 0.000) 0.606 5.643 ( -11.512 -3.019 0.000) 11.901 5.757 ( 5.012 -7.014 0.000) 8.621 5.765 ( 9.580 -1.388 0.000) 9.680 6.047 ( -4.374 -3.311 0.000) 5.486 6.068 ( 2.695 -6.738 0.000) 7.257 6.495 ( 8.323 -2.929 0.000) 8.823 6.605 ( -1.146 -4.896 0.000) 5.028 6.609 ( 0.265 -8.856 0.000) 8.860 6.851 ( 3.884 -4.303 0.000) 5.797 6.924 ( 6.461 -9.995 0.000) 11.902 7.114 ( -3.547 -8.092 0.000) 8.835 8.752 ( 2.435 -6.248 0.000) 6.706 8.944 ( -2.027 -4.120 0.000) 4.592 9.036 ( 2.111 -4.322 0.000) 4.810 9.070 ( -0.014 0.104 0.000) 0.105 9.426 ( 6.955 19.990 0.000) 21.166 9.539 ( 2.906 15.069 0.000) 15.346 9.566 ( 5.222 -6.808 0.000) 8.580 9.574 ( 1.367 -0.506 0.000) 1.458 10.013 ( -1.138 12.428 0.000) 12.480 10.017 ( -4.150 16.744 0.000) 17.250 10.093 ( -4.976 13.029 0.000) 13.946 10.121 ( 1.327 13.014 0.000) 13.082 10.293 ( -3.774 6.290 0.000) 7.335 10.308 ( -4.660 0.576 0.000) 4.695 10.673 ( -2.832 14.671 0.000) 14.942 10.687 ( 0.292 7.589 0.000) 7.595 10.972 ( -3.493 3.554 0.000) 4.983 10.979 ( -3.135 0.500 0.000) 3.174 11.149 ( 1.118 5.693 0.000) 5.802 11.195 ( 5.707 3.432 0.000) 6.659 11.698 ( -1.391 8.688 0.000) 8.799 11.832 ( 0.965 5.784 0.000) 5.864 12.056 ( 3.925 5.151 0.000) 6.476 12.270 ( 5.493 4.295 0.000) 6.973 12.354 ( 0.739 -1.240 0.000) 1.443 12.503 ( -8.351 9.531 0.000) 12.672 12.694 ( 1.583 3.689 0.000) 4.014 12.702 ( -4.187 8.825 0.000) 9.768 13.040 ( 1.308 9.561 0.000) 9.650 13.055 ( 7.488 9.330 0.000) 11.963 13.670 ( -2.202 2.225 0.000) 3.130 13.697 ( -5.283 5.134 0.000) 7.367 13.930 ( 4.308 -6.824 0.000) 8.070 14.205 ( -3.148 -7.533 0.000) 8.165 15.189 ( -0.545 -3.715 0.000) 3.755 15.247 ( -1.058 -5.500 0.000) 5.601 15.513 ( 1.005 -2.961 0.000) 3.127 15.654 ( -3.803 -9.902 0.000) 10.607 15.705 ( 1.529 -6.240 0.000) 6.424 15.922 ( -4.196 -1.998 0.000) 4.647 16.749 ( -0.249 -7.779 0.000) 7.783 16.752 ( -0.357 -6.759 0.000) 6.768 17.159 ( 1.483 -10.112 0.000) 10.221 17.275 ( -1.221 -12.113 0.000) 12.174======================= Grid point 12 (9/72) =======================q-point: ( 0.40 0.13 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.655 ( 17.947 19.549 0.000) 26.538 1.852 ( 24.776 16.631 0.000) 29.840 2.049 ( -19.684 13.510 0.000) 23.874 2.341 ( -22.416 17.176 0.000) 28.240 2.764 ( 10.118 6.827 0.000) 12.205 2.799 ( 7.326 6.557 0.000) 9.832 2.878 ( 0.847 13.468 0.000) 13.495 2.937 ( -3.302 3.407 0.000) 4.744 3.028 ( 15.978 32.881 0.000) 36.557 3.134 ( -4.031 11.089 0.000) 11.799 3.167 ( 1.056 23.497 0.000) 23.520 3.243 ( 9.293 19.080 0.000) 21.222 3.310 ( -7.637 13.431 0.000) 15.451 3.576 ( -5.594 15.162 0.000) 16.161 3.610 ( -0.420 15.816 0.000) 15.822 3.616 ( -0.730 21.766 0.000) 21.778 3.751 ( 1.252 17.942 0.000) 17.986 3.780 ( -0.441 14.643 0.000) 14.650 3.879 ( -11.025 18.474 0.000) 21.514 3.880 ( -3.462 18.575 0.000) 18.895 4.109 ( 10.308 6.831 0.000) 12.366 4.246 ( 5.306 21.923 0.000) 22.556 4.284 ( 0.469 26.556 0.000) 26.560 4.299 ( 1.833 3.941 0.000) 4.347 4.625 ( -10.655 -0.452 0.000) 10.664 4.758 ( -14.225 -2.101 0.000) 14.379 5.073 ( 10.988 10.568 0.000) 15.245 5.188 ( 9.140 4.264 0.000) 10.086 5.348 ( -15.162 4.170 0.000) 15.726 5.369 ( -7.827 1.875 0.000) 8.048 5.885 ( 5.132 -9.221 0.000) 10.553 5.916 ( 3.240 -6.888 0.000) 7.613 6.032 ( 2.234 -4.435 0.000) 4.966 6.087 ( -1.364 -5.937 0.000) 6.092 6.564 ( 1.013 -4.437 0.000) 4.552 6.584 ( -0.953 -4.867 0.000) 4.959 6.715 ( 7.343 -7.091 0.000) 10.208 6.845 ( -4.638 -6.464 0.000) 7.956 7.035 ( 3.805 -9.592 0.000) 10.319 7.073 ( -0.556 -8.290 0.000) 8.308 8.814 ( 3.470 -6.922 0.000) 7.743 8.886 ( -3.443 -6.363 0.000) 7.234 9.068 ( 0.795 -0.705 0.000) 1.062 9.072 ( 0.122 1.279 0.000) 1.285 9.578 ( 5.292 9.595 0.000) 10.957 9.610 ( 1.267 5.834 0.000) 5.970 9.640 ( 6.935 9.234 0.000) 11.548 9.709 ( 7.271 4.798 0.000) 8.711 9.865 ( -6.589 8.163 0.000) 10.491 9.956 ( -6.035 12.989 0.000) 14.323 10.044 ( -0.508 15.675 0.000) 15.683 10.080 ( -4.218 6.950 0.000) 8.130 10.222 ( -2.140 11.812 0.000) 12.005 10.225 ( -2.166 10.087 0.000) 10.317 10.654 ( 0.750 6.193 0.000) 6.239 10.678 ( -1.095 3.107 0.000) 3.294 10.918 ( -1.782 -0.760 0.000) 1.938 10.918 ( -1.593 2.525 0.000) 2.985 11.192 ( 3.283 10.088 0.000) 10.608 11.253 ( -1.213 9.403 0.000) 9.481 11.748 ( 6.284 3.933 0.000) 7.413 11.844 ( -1.253 3.491 0.000) 3.709 12.142 ( 4.736 6.415 0.000) 7.973 12.292 ( -10.362 9.258 0.000) 13.895 12.342 ( 1.569 4.754 0.000) 5.006 12.359 ( -0.348 4.261 0.000) 4.275 12.660 ( 0.276 6.269 0.000) 6.276 12.691 ( -1.725 5.983 0.000) 6.227 13.132 ( 6.135 5.513 0.000) 8.248 13.177 ( 2.960 6.541 0.000) 7.180 13.606 ( -3.028 11.926 0.000) 12.305 13.607 ( -2.974 10.196 0.000) 10.621 14.023 ( 4.791 -10.113 0.000) 11.190 14.121 ( -4.694 -10.402 0.000) 11.412 15.190 ( 0.812 -2.727 0.000) 2.845 15.217 ( -1.627 -3.877 0.000) 4.205 15.536 ( 1.345 -7.356 0.000) 7.478 15.579 ( -3.035 -9.741 0.000) 10.203 15.755 ( 3.275 -4.121 0.000) 5.263 15.833 ( -4.240 -1.998 0.000) 4.687 16.745 ( -0.103 -7.360 0.000) 7.361 16.746 ( -0.209 -6.947 0.000) 6.951 17.197 ( 2.155 -10.698 0.000) 10.913 17.241 ( -2.025 -11.420 0.000) 11.598======================= Grid point 15 (10/72) =======================q-point: ( 0.00 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.713 ( 0.000 27.029 0.000) 27.029 1.814 ( 0.000 27.898 0.000) 27.898 2.572 ( 0.000 8.929 0.000) 8.929 2.674 ( 0.000 9.081 0.000) 9.081 2.867 ( 0.000 7.987 0.000) 7.987 2.966 ( 0.000 6.311 0.000) 6.311 3.124 ( 0.000 5.085 0.000) 5.085 3.217 ( 0.000 8.800 0.000) 8.800 3.253 ( 0.000 5.767 0.000) 5.767 3.388 ( 0.000 7.349 0.000) 7.349 3.496 ( 0.000 11.903 0.000) 11.903 3.528 ( 0.000 12.843 0.000) 12.843 3.645 ( 0.000 42.926 0.000) 42.926 3.734 ( 0.000 8.193 0.000) 8.193 3.891 ( 0.000 18.544 0.000) 18.544 3.904 ( 0.000 11.219 0.000) 11.219 4.037 ( 0.000 19.259 0.000) 19.259 4.049 ( 0.000 3.200 0.000) 3.200 4.179 ( 0.000 24.410 0.000) 24.410 4.316 ( 0.000 25.201 0.000) 25.201 4.402 ( 0.000 22.206 0.000) 22.206 4.646 ( 0.000 15.644 0.000) 15.644 4.942 ( 0.000 32.891 0.000) 32.891 5.022 ( 0.000 0.597 0.000) 0.597 5.061 ( 0.000 -3.314 0.000) 3.314 5.078 ( 0.000 20.622 0.000) 20.622 5.168 ( 0.000 15.089 0.000) 15.089 5.286 ( 0.000 23.823 0.000) 23.823 5.365 ( 0.000 -5.230 0.000) 5.230 5.629 ( 0.000 -5.626 0.000) 5.626 5.719 ( 0.000 3.216 0.000) 3.216 5.754 ( 0.000 9.582 0.000) 9.582 5.872 ( 0.000 -7.095 0.000) 7.095 6.121 ( 0.000 0.534 0.000) 0.534 6.261 ( 0.000 -5.446 0.000) 5.446 6.508 ( 0.000 -5.278 0.000) 5.278 6.512 ( 0.000 -2.406 0.000) 2.406 6.650 ( 0.000 -7.191 0.000) 7.191 6.786 ( 0.000 0.488 0.000) 0.488 6.967 ( 0.000 -9.062 0.000) 9.062 8.614 ( 0.000 -5.408 0.000) 5.408 8.883 ( 0.000 -6.420 0.000) 6.420 8.925 ( 0.000 -2.395 0.000) 2.395 8.931 ( 0.000 -10.189 0.000) 10.189 9.388 ( 0.000 -4.476 0.000) 4.476 9.482 ( 0.000 -2.720 0.000) 2.720 9.740 ( 0.000 13.469 0.000) 13.469 9.911 ( 0.000 16.524 0.000) 16.524 10.163 ( 0.000 4.017 0.000) 4.017 10.225 ( 0.000 -4.002 0.000) 4.002 10.253 ( 0.000 2.493 0.000) 2.493 10.368 ( 0.000 12.069 0.000) 12.069 10.407 ( 0.000 10.193 0.000) 10.193 10.546 ( 0.000 11.017 0.000) 11.017 10.793 ( 0.000 -0.108 0.000) 0.108 10.972 ( 0.000 5.431 0.000) 5.431 11.209 ( 0.000 13.712 0.000) 13.712 11.214 ( 0.000 14.325 0.000) 14.325 11.242 ( 0.000 13.137 0.000) 13.137 11.267 ( 0.000 10.727 0.000) 10.727 11.963 ( 0.000 6.672 0.000) 6.672 12.033 ( 0.000 -1.027 0.000) 1.027 12.089 ( 0.000 20.888 0.000) 20.888 12.276 ( 0.000 4.581 0.000) 4.581 12.302 ( 0.000 0.608 0.000) 0.608 12.762 ( 0.000 6.139 0.000) 6.139 12.780 ( 0.000 10.260 0.000) 10.260 12.969 ( 0.000 7.899 0.000) 7.899 13.153 ( 0.000 11.906 0.000) 11.906 13.272 ( 0.000 11.361 0.000) 11.361 13.576 ( 0.000 -10.006 0.000) 10.006 13.742 ( 0.000 -1.375 0.000) 1.375 13.881 ( 0.000 4.172 0.000) 4.172 14.136 ( 0.000 -3.979 0.000) 3.979 15.112 ( 0.000 -3.813 0.000) 3.813 15.130 ( 0.000 -6.016 0.000) 6.016 15.502 ( 0.000 0.759 0.000) 0.759 15.513 ( 0.000 -8.262 0.000) 8.262 15.563 ( 0.000 -4.624 0.000) 4.624 15.876 ( 0.000 -5.739 0.000) 5.739 16.576 ( 0.000 -8.998 0.000) 8.998 16.594 ( 0.000 -9.067 0.000) 9.067 16.912 ( 0.000 -12.527 0.000) 12.527 17.012 ( 0.000 -14.230 0.000) 14.230======================= Grid point 16 (11/72) =======================q-point: ( 0.20 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.840 ( 12.130 23.174 0.000) 26.157 1.886 ( 6.839 26.093 0.000) 26.974 2.601 ( -4.479 10.545 0.000) 11.457 2.733 ( 5.484 8.114 0.000) 9.793 2.795 ( 0.403 8.599 0.000) 8.609 2.974 ( 2.629 5.004 0.000) 5.652 3.014 ( -14.438 7.359 0.000) 16.206 3.147 ( -1.429 10.161 0.000) 10.261 3.308 ( 2.890 7.404 0.000) 7.948 3.438 ( -1.148 11.239 0.000) 11.298 3.511 ( 2.497 6.393 0.000) 6.864 3.540 ( 3.726 8.578 0.000) 9.352 3.711 ( 4.570 38.733 0.000) 39.002 3.722 ( 1.626 6.724 0.000) 6.918 3.885 ( 1.181 23.024 0.000) 23.055 4.016 ( 7.363 15.723 0.000) 17.362 4.081 ( 6.533 1.415 0.000) 6.684 4.095 ( 2.331 17.765 0.000) 17.917 4.102 ( -6.501 20.276 0.000) 21.293 4.303 ( -1.053 23.192 0.000) 23.216 4.372 ( -2.870 21.605 0.000) 21.795 4.646 ( -2.455 19.817 0.000) 19.969 4.858 ( -13.951 3.480 0.000) 14.378 4.918 ( -7.428 14.246 0.000) 16.066 4.937 ( -1.466 26.031 0.000) 26.072 4.973 ( -8.475 12.367 0.000) 14.992 5.230 ( 4.653 13.126 0.000) 13.926 5.309 ( 2.307 22.417 0.000) 22.535 5.491 ( 7.188 -1.353 0.000) 7.315 5.595 ( -3.764 -1.610 0.000) 4.094 5.659 ( -3.406 1.211 0.000) 3.615 5.797 ( 3.547 5.590 0.000) 6.620 5.928 ( 3.543 -6.326 0.000) 7.250 6.004 ( -6.279 0.682 0.000) 6.316 6.386 ( 6.467 -9.359 0.000) 11.376 6.497 ( -0.570 -4.436 0.000) 4.473 6.497 ( 1.180 -0.264 0.000) 1.209 6.745 ( 6.592 -7.248 0.000) 9.797 6.798 ( 0.075 -1.279 0.000) 1.281 6.945 ( -1.720 -8.003 0.000) 8.186 8.621 ( 0.971 -6.424 0.000) 6.497 8.833 ( -4.678 -7.220 0.000) 8.603 8.939 ( 4.661 -5.159 0.000) 6.952 9.014 ( 3.500 -4.541 0.000) 5.733 9.424 ( 3.621 -5.800 0.000) 6.838 9.494 ( 2.028 -2.651 0.000) 3.338 9.787 ( 4.028 11.799 0.000) 12.467 9.896 ( -2.231 11.953 0.000) 12.159 10.174 ( -1.059 -4.238 0.000) 4.368 10.226 ( -3.080 8.376 0.000) 8.924 10.228 ( 2.506 8.676 0.000) 9.031 10.354 ( -2.017 5.672 0.000) 6.020 10.388 ( -1.636 7.160 0.000) 7.345 10.446 ( -6.419 10.987 0.000) 12.725 10.759 ( -3.045 0.203 0.000) 3.052 10.911 ( -4.174 7.695 0.000) 8.755 11.145 ( -3.306 14.014 0.000) 14.399 11.146 ( -5.918 15.392 0.000) 16.491 11.363 ( 9.798 12.229 0.000) 15.670 11.379 ( 6.681 14.246 0.000) 15.735 11.910 ( -5.660 7.159 0.000) 9.127 11.952 ( -0.364 6.146 0.000) 6.156 12.199 ( 5.127 11.531 0.000) 12.620 12.355 ( 5.867 4.909 0.000) 7.650 12.361 ( 5.336 1.889 0.000) 5.661 12.650 ( -8.179 5.766 0.000) 10.008 12.854 ( 3.408 11.100 0.000) 11.611 12.860 ( -6.651 6.780 0.000) 9.498 13.228 ( -2.784 8.739 0.000) 9.172 13.240 ( 4.545 8.887 0.000) 9.981 13.641 ( 5.978 -5.193 0.000) 7.919 13.749 ( 0.740 -4.096 0.000) 4.162 13.885 ( 0.273 7.039 0.000) 7.044 14.079 ( -5.419 -3.917 0.000) 6.687 15.110 ( -0.122 -3.991 0.000) 3.993 15.127 ( -0.324 -5.851 0.000) 5.860 15.468 ( -2.644 -1.520 0.000) 3.050 15.469 ( -3.539 -7.800 0.000) 8.565 15.603 ( 3.293 -3.075 0.000) 4.506 15.853 ( -2.277 -4.512 0.000) 5.054 16.576 ( 0.048 -8.874 0.000) 8.874 16.591 ( -0.231 -8.882 0.000) 8.885 16.924 ( 1.098 -12.671 0.000) 12.718 17.005 ( -0.696 -13.982 0.000) 14.000======================= Grid point 17 (12/72) =======================q-point: ( 0.40 0.20 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.081 ( 11.905 21.551 0.000) 24.621 2.177 ( 19.703 15.915 0.000) 25.328 2.358 ( -13.937 16.261 0.000) 21.416 2.614 ( -20.866 10.665 0.000) 23.433 2.903 ( 7.547 6.380 0.000) 9.883 2.932 ( 6.918 5.860 0.000) 9.067 3.031 ( 1.327 6.601 0.000) 6.733 3.089 ( -4.246 9.814 0.000) 10.693 3.341 ( 0.071 6.539 0.000) 6.539 3.359 ( -3.493 8.972 0.000) 9.628 3.559 ( 1.494 10.956 0.000) 11.058 3.584 ( -0.506 13.004 0.000) 13.014 3.802 ( 4.727 16.862 0.000) 17.512 3.852 ( 7.907 8.127 0.000) 11.339 3.958 ( -3.858 11.569 0.000) 12.196 4.019 ( 10.452 34.698 0.000) 36.238 4.084 ( -3.768 11.275 0.000) 11.888 4.140 ( 2.626 21.151 0.000) 21.313 4.265 ( 4.689 2.196 0.000) 5.178 4.290 ( 0.059 15.719 0.000) 15.719 4.318 ( 1.717 21.824 0.000) 21.891 4.456 ( -12.972 28.278 0.000) 31.112 4.609 ( -5.716 6.798 0.000) 8.882 4.738 ( -12.610 4.148 0.000) 13.275 4.872 ( 1.095 27.611 0.000) 27.633 4.907 ( -1.750 28.811 0.000) 28.864 5.342 ( 5.715 9.839 0.000) 11.379 5.372 ( 3.314 16.094 0.000) 16.431 5.496 ( -4.543 11.086 0.000) 11.981 5.499 ( -4.690 9.613 0.000) 10.696 5.708 ( 6.280 -6.075 0.000) 8.738 5.815 ( -3.297 -0.412 0.000) 3.323 5.949 ( 1.242 -2.656 0.000) 2.932 5.971 ( 0.312 -4.911 0.000) 4.921 6.450 ( 1.516 -7.600 0.000) 7.749 6.476 ( -1.148 -5.707 0.000) 5.821 6.612 ( 7.372 -1.497 0.000) 7.523 6.745 ( -5.186 -2.956 0.000) 5.969 6.862 ( 4.357 -7.375 0.000) 8.566 6.917 ( -1.358 -6.961 0.000) 7.092 8.662 ( 3.068 -7.551 0.000) 8.151 8.740 ( -4.382 -7.778 0.000) 8.927 9.028 ( 3.214 -3.137 0.000) 4.491 9.056 ( 0.421 -2.686 0.000) 2.719 9.534 ( 6.600 -6.483 0.000) 9.252 9.578 ( 4.571 -2.404 0.000) 5.165 9.803 ( -4.962 -1.357 0.000) 5.144 9.826 ( -2.791 2.342 0.000) 3.644 10.147 ( -1.426 17.410 0.000) 17.468 10.160 ( -0.483 9.810 0.000) 9.822 10.279 ( 1.884 7.119 0.000) 7.364 10.308 ( -1.147 -3.230 0.000) 3.428 10.361 ( -0.558 6.149 0.000) 6.175 10.375 ( -1.930 14.937 0.000) 15.062 10.715 ( 0.393 2.994 0.000) 3.020 10.803 ( -6.711 8.410 0.000) 10.760 11.053 ( -1.070 13.418 0.000) 13.460 11.084 ( -2.825 13.326 0.000) 13.622 11.502 ( 4.966 17.102 0.000) 17.809 11.534 ( 3.882 15.695 0.000) 16.168 11.866 ( 2.367 6.345 0.000) 6.772 11.938 ( -2.059 5.629 0.000) 5.993 12.287 ( 4.469 8.903 0.000) 9.961 12.419 ( -5.569 5.061 0.000) 7.525 12.470 ( 3.475 6.073 0.000) 6.997 12.482 ( -1.479 8.268 0.000) 8.400 12.782 ( 0.350 5.346 0.000) 5.357 12.853 ( -3.884 9.354 0.000) 10.129 13.231 ( 3.071 3.695 0.000) 4.804 13.282 ( -0.596 3.660 0.000) 3.708 13.779 ( 6.406 4.064 0.000) 7.586 13.797 ( 4.605 -5.924 0.000) 7.503 13.871 ( -2.324 8.565 0.000) 8.875 13.934 ( -7.998 -4.596 0.000) 9.224 15.111 ( 0.273 -4.640 0.000) 4.648 15.119 ( -0.423 -5.372 0.000) 5.389 15.409 ( -1.571 -6.339 0.000) 6.531 15.416 ( -1.969 -4.022 0.000) 4.478 15.687 ( 4.779 -2.423 0.000) 5.358 15.784 ( -4.370 -2.844 0.000) 5.214 16.579 ( 0.235 -8.668 0.000) 8.671 16.585 ( -0.342 -8.645 0.000) 8.652 16.953 ( 1.595 -13.005 0.000) 13.103 16.984 ( -1.365 -13.468 0.000) 13.537======================= Grid point 20 (13/72) =======================q-point: ( 0.00 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.231 ( 0.000 23.640 0.000) 23.640 2.349 ( 0.000 24.333 0.000) 24.333 2.767 ( 0.000 10.008 0.000) 10.008 2.860 ( 0.000 8.751 0.000) 8.751 3.009 ( 0.000 6.292 0.000) 6.292 3.131 ( 0.000 9.516 0.000) 9.516 3.153 ( 0.000 0.391 0.000) 0.391 3.349 ( 0.000 3.357 0.000) 3.357 3.394 ( 0.000 8.255 0.000) 8.255 3.427 ( 0.000 0.768 0.000) 0.768 3.675 ( 0.000 6.317 0.000) 6.317 3.790 ( 0.000 13.359 0.000) 13.359 3.854 ( 0.000 4.126 0.000) 4.126 3.964 ( 0.000 -1.168 0.000) 1.168 4.123 ( 0.000 8.310 0.000) 8.310 4.220 ( 0.000 11.593 0.000) 11.593 4.340 ( 0.000 9.416 0.000) 9.416 4.607 ( 0.000 33.993 0.000) 33.993 4.619 ( 0.000 16.550 0.000) 16.550 4.638 ( 0.000 4.255 0.000) 4.255 4.855 ( 0.000 3.843 0.000) 3.843 4.869 ( 0.000 27.256 0.000) 27.256 4.979 ( 0.000 -2.715 0.000) 2.715 5.165 ( 0.000 18.082 0.000) 18.082 5.220 ( 0.000 -8.072 0.000) 8.072 5.447 ( 0.000 9.323 0.000) 9.323 5.529 ( 0.000 19.677 0.000) 19.677 5.574 ( 0.000 3.518 0.000) 3.518 5.604 ( 0.000 12.195 0.000) 12.195 5.628 ( 0.000 19.325 0.000) 19.325 5.808 ( 0.000 2.804 0.000) 2.804 5.917 ( 0.000 0.123 0.000) 0.123 5.933 ( 0.000 20.638 0.000) 20.638 6.245 ( 0.000 10.982 0.000) 10.982 6.257 ( 0.000 12.770 0.000) 12.770 6.466 ( 0.000 3.250 0.000) 3.250 6.538 ( 0.000 4.165 0.000) 4.165 6.560 ( 0.000 -0.791 0.000) 0.791 6.803 ( 0.000 1.115 0.000) 1.115 6.812 ( 0.000 -5.864 0.000) 5.864 8.506 ( 0.000 -5.122 0.000) 5.122 8.692 ( 0.000 -12.524 0.000) 12.524 8.748 ( 0.000 -6.779 0.000) 6.779 8.853 ( 0.000 -4.919 0.000) 4.919 9.336 ( 0.000 -0.554 0.000) 0.554 9.467 ( 0.000 1.406 0.000) 1.406 9.851 ( 0.000 -0.227 0.000) 0.227 10.082 ( 0.000 -3.366 0.000) 3.366 10.126 ( 0.000 4.326 0.000) 4.326 10.310 ( 0.000 0.371 0.000) 0.371 10.358 ( 0.000 9.288 0.000) 9.288 10.506 ( 0.000 1.243 0.000) 1.243 10.543 ( 0.000 5.896 0.000) 5.896 10.734 ( 0.000 -4.606 0.000) 4.606 10.785 ( 0.000 13.588 0.000) 13.588 11.026 ( 0.000 -0.479 0.000) 0.479 11.470 ( 0.000 6.937 0.000) 6.937 11.471 ( 0.000 7.864 0.000) 7.864 11.515 ( 0.000 11.793 0.000) 11.793 11.534 ( 0.000 17.280 0.000) 17.280 11.986 ( 0.000 -2.022 0.000) 2.022 12.137 ( 0.000 11.977 0.000) 11.977 12.373 ( 0.000 5.446 0.000) 5.446 12.436 ( 0.000 11.832 0.000) 11.832 12.466 ( 0.000 14.014 0.000) 14.014 12.906 ( 0.000 7.572 0.000) 7.572 12.972 ( 0.000 8.246 0.000) 8.246 13.087 ( 0.000 -1.214 0.000) 1.214 13.356 ( 0.000 -4.776 0.000) 4.776 13.424 ( 0.000 14.572 0.000) 14.572 13.502 ( 0.000 11.354 0.000) 11.354 13.730 ( 0.000 0.123 0.000) 0.123 14.031 ( 0.000 10.066 0.000) 10.066 14.090 ( 0.000 -0.412 0.000) 0.412 15.014 ( 0.000 -6.168 0.000) 6.168 15.031 ( 0.000 -3.387 0.000) 3.387 15.375 ( 0.000 -5.204 0.000) 5.204 15.529 ( 0.000 1.138 0.000) 1.138 15.531 ( 0.000 2.028 0.000) 2.028 15.743 ( 0.000 -7.348 0.000) 7.348 16.397 ( 0.000 -10.062 0.000) 10.062 16.399 ( 0.000 -8.154 0.000) 8.154 16.647 ( 0.000 -13.270 0.000) 13.270 16.727 ( 0.000 -13.457 0.000) 13.457======================= Grid point 21 (14/72) =======================q-point: ( 0.20 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.297 ( 6.608 21.372 0.000) 22.370 2.391 ( 3.998 23.126 0.000) 23.469 2.811 ( 0.408 9.914 0.000) 9.922 2.892 ( 3.041 7.284 0.000) 7.894 2.965 ( -1.877 7.504 0.000) 7.735 3.100 ( -7.852 2.237 0.000) 8.164 3.116 ( 1.920 9.103 0.000) 9.303 3.322 ( 0.294 7.656 0.000) 7.662 3.441 ( 1.347 5.633 0.000) 5.792 3.547 ( 8.749 0.773 0.000) 8.783 3.625 ( -0.521 5.474 0.000) 5.499 3.688 ( -7.277 9.620 0.000) 12.062 3.831 ( 0.983 4.054 0.000) 4.171 4.063 ( 3.495 1.062 0.000) 3.652 4.142 ( -1.397 9.784 0.000) 9.884 4.282 ( 10.261 8.763 0.000) 13.493 4.354 ( -2.446 6.172 0.000) 6.639 4.417 ( -13.299 8.619 0.000) 15.848 4.592 ( -4.528 4.167 0.000) 6.154 4.624 ( 1.621 30.151 0.000) 30.195 4.823 ( -4.855 14.971 0.000) 15.739 4.910 ( -1.335 18.933 0.000) 18.980 4.979 ( 4.119 13.403 0.000) 14.022 5.132 ( -1.124 18.544 0.000) 18.578 5.308 ( 5.475 -6.693 0.000) 8.647 5.444 ( -3.041 18.133 0.000) 18.386 5.466 ( -1.347 6.883 0.000) 7.013 5.572 ( -2.477 19.733 0.000) 19.888 5.597 ( 0.576 7.162 0.000) 7.185 5.641 ( 1.114 6.666 0.000) 6.759 5.870 ( 4.564 3.712 0.000) 5.883 5.927 ( -0.165 23.168 0.000) 23.168 5.936 ( 1.654 2.436 0.000) 2.945 6.168 ( -5.158 16.321 0.000) 17.117 6.279 ( 1.463 4.157 0.000) 4.407 6.451 ( -1.541 2.886 0.000) 3.272 6.567 ( 3.223 6.042 0.000) 6.848 6.641 ( 5.535 -2.640 0.000) 6.132 6.781 ( -1.968 -1.632 0.000) 2.557 6.817 ( 0.102 -3.034 0.000) 3.036 8.497 ( -0.129 -5.601 0.000) 5.603 8.651 ( -3.309 -10.185 0.000) 10.709 8.825 ( 6.154 -6.130 0.000) 8.686 8.902 ( 3.788 -6.475 0.000) 7.502 9.342 ( 1.227 -2.114 0.000) 2.444 9.473 ( 1.406 0.804 0.000) 1.619 9.892 ( 2.553 0.898 0.000) 2.707 9.953 ( -11.921 -2.546 0.000) 12.189 10.155 ( 3.548 0.479 0.000) 3.580 10.250 ( -6.031 -5.767 0.000) 8.344 10.412 ( 3.729 8.589 0.000) 9.363 10.488 ( -1.244 3.619 0.000) 3.827 10.500 ( -3.112 9.095 0.000) 9.613 10.713 ( -3.296 7.087 0.000) 7.816 10.726 ( -1.251 3.974 0.000) 4.166 11.016 ( -1.137 2.266 0.000) 2.536 11.434 ( -2.024 11.020 0.000) 11.204 11.462 ( -4.918 13.187 0.000) 14.075 11.609 ( 9.233 6.376 0.000) 11.221 11.664 ( 10.059 16.322 0.000) 19.172 11.954 ( -1.823 0.580 0.000) 1.913 12.117 ( -1.071 11.567 0.000) 11.616 12.407 ( 5.147 2.612 0.000) 5.772 12.493 ( 1.491 12.616 0.000) 12.704 12.509 ( 5.431 10.912 0.000) 12.189 12.795 ( -7.747 8.123 0.000) 11.225 12.967 ( -7.796 1.985 0.000) 8.044 13.055 ( 4.548 7.602 0.000) 8.859 13.340 ( -1.122 -0.510 0.000) 1.233 13.383 ( -10.240 6.095 0.000) 11.916 13.607 ( 12.674 7.460 0.000) 14.707 13.694 ( -1.787 0.905 0.000) 2.003 14.048 ( -3.855 0.455 0.000) 3.881 14.081 ( 2.886 10.715 0.000) 11.097 15.014 ( 0.025 -5.630 0.000) 5.630 15.028 ( -0.315 -3.528 0.000) 3.542 15.348 ( -1.975 -4.122 0.000) 4.571 15.465 ( -3.848 1.570 0.000) 4.156 15.584 ( 2.941 0.715 0.000) 3.026 15.744 ( -0.261 -6.141 0.000) 6.147 16.400 ( 0.237 -9.720 0.000) 9.723 16.400 ( 0.111 -8.192 0.000) 8.193 16.657 ( 0.999 -13.233 0.000) 13.271 16.724 ( -0.376 -13.351 0.000) 13.356======================= Grid point 22 (15/72) =======================q-point: ( 0.40 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.498 ( 12.526 15.432 0.000) 19.876 2.506 ( 7.037 19.677 0.000) 20.898 2.685 ( -8.431 15.310 0.000) 17.478 2.806 ( -14.354 8.573 0.000) 16.719 3.019 ( 3.722 5.116 0.000) 6.326 3.034 ( 3.607 4.524 0.000) 5.786 3.190 ( 4.494 8.128 0.000) 9.288 3.282 ( -4.126 7.791 0.000) 8.816 3.468 ( 1.802 7.968 0.000) 8.169 3.541 ( -6.022 9.660 0.000) 11.384 3.706 ( 5.033 4.002 0.000) 6.430 3.714 ( 5.611 1.771 0.000) 5.884 3.931 ( 9.558 1.930 0.000) 9.751 4.006 ( -0.996 4.996 0.000) 5.094 4.135 ( -11.937 4.186 0.000) 12.650 4.180 ( -12.304 0.657 0.000) 12.322 4.293 ( 8.960 2.478 0.000) 9.296 4.466 ( -6.970 1.969 0.000) 7.243 4.488 ( 7.742 12.840 0.000) 14.993 4.622 ( -4.162 17.723 0.000) 18.205 4.787 ( 3.841 17.802 0.000) 18.211 4.913 ( -6.868 19.086 0.000) 20.284 4.972 ( 6.617 32.965 0.000) 33.623 5.119 ( -4.991 26.422 0.000) 26.889 5.385 ( 0.324 20.084 0.000) 20.087 5.386 ( 1.828 2.339 0.000) 2.969 5.476 ( 1.092 0.967 0.000) 1.458 5.518 ( -2.760 14.727 0.000) 14.984 5.614 ( 1.500 4.770 0.000) 5.001 5.647 ( -1.012 1.538 0.000) 1.841 5.935 ( 2.447 12.612 0.000) 12.847 5.964 ( 0.392 5.520 0.000) 5.534 5.969 ( 3.537 16.278 0.000) 16.658 6.057 ( -5.343 19.255 0.000) 19.983 6.334 ( 3.536 0.718 0.000) 3.609 6.404 ( -3.019 1.561 0.000) 3.399 6.646 ( 4.114 4.104 0.000) 5.811 6.725 ( -3.473 0.538 0.000) 3.515 6.744 ( 4.179 -3.877 0.000) 5.700 6.803 ( -1.666 -3.733 0.000) 4.088 8.518 ( 2.161 -6.406 0.000) 6.760 8.578 ( -3.528 -7.864 0.000) 8.619 8.939 ( 3.919 -5.649 0.000) 6.876 8.964 ( 1.430 -6.338 0.000) 6.497 9.422 ( 7.152 -3.973 0.000) 8.181 9.543 ( 2.809 -0.778 0.000) 2.915 9.706 ( -7.627 -5.305 0.000) 9.290 9.825 ( -10.073 -1.519 0.000) 10.187 10.190 ( 2.546 -6.004 0.000) 6.522 10.227 ( 1.843 -1.321 0.000) 2.268 10.394 ( -1.760 4.879 0.000) 5.186 10.434 ( -3.794 8.438 0.000) 9.252 10.557 ( 5.298 10.030 0.000) 11.343 10.645 ( -3.371 11.513 0.000) 11.996 10.775 ( 6.495 3.591 0.000) 7.422 10.943 ( -7.194 5.207 0.000) 8.881 11.350 ( -2.801 12.727 0.000) 13.032 11.374 ( -3.386 12.301 0.000) 12.759 11.780 ( 6.710 8.329 0.000) 10.696 11.849 ( 2.478 13.616 0.000) 13.840 11.971 ( 6.375 6.329 0.000) 8.983 12.094 ( -2.568 11.305 0.000) 11.593 12.511 ( 1.035 10.391 0.000) 10.443 12.569 ( -2.563 9.501 0.000) 9.841 12.578 ( 8.609 4.296 0.000) 9.621 12.653 ( -2.648 8.264 0.000) 8.678 12.867 ( 0.490 3.050 0.000) 3.089 13.032 ( -10.496 7.602 0.000) 12.959 13.239 ( 1.022 -3.251 0.000) 3.408 13.299 ( -2.944 -1.430 0.000) 3.273 13.714 ( 3.999 1.542 0.000) 4.286 13.790 ( 1.007 3.062 0.000) 3.223 13.996 ( 2.351 6.077 0.000) 6.516 14.087 ( -2.941 10.105 0.000) 10.524 15.016 ( 0.130 -4.658 0.000) 4.660 15.020 ( -0.327 -3.947 0.000) 3.961 15.330 ( 0.809 -1.497 0.000) 1.702 15.382 ( -3.860 0.705 0.000) 3.924 15.653 ( 3.632 -1.111 0.000) 3.799 15.718 ( -2.393 -3.604 0.000) 4.326 16.403 ( 0.112 -8.435 0.000) 8.436 16.403 ( 0.074 -9.004 0.000) 9.004 16.683 ( 1.418 -13.163 0.000) 13.239 16.709 ( -1.045 -13.187 0.000) 13.228======================= Grid point 25 (16/72) =======================q-point: ( 0.00 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.662 ( 0.000 18.549 0.000) 18.549 2.785 ( 0.000 17.954 0.000) 17.954 2.965 ( 0.000 9.119 0.000) 9.119 3.021 ( 0.000 7.266 0.000) 7.266 3.126 ( 0.000 5.093 0.000) 5.093 3.159 ( 0.000 0.326 0.000) 0.326 3.345 ( 0.000 11.500 0.000) 11.500 3.385 ( 0.000 0.748 0.000) 0.748 3.439 ( 0.000 0.406 0.000) 0.406 3.587 ( 0.000 10.618 0.000) 10.618 3.771 ( 0.000 3.510 0.000) 3.510 3.915 ( 0.000 2.019 0.000) 2.019 3.945 ( 0.000 -0.466 0.000) 0.466 4.075 ( 0.000 14.420 0.000) 14.420 4.222 ( 0.000 1.994 0.000) 1.994 4.333 ( 0.000 0.924 0.000) 0.924 4.415 ( 0.000 -0.971 0.000) 0.971 4.619 ( 0.000 -3.156 0.000) 3.156 4.776 ( 0.000 -0.840 0.000) 0.840 4.852 ( 0.000 -2.811 0.000) 2.811 4.928 ( 0.000 -4.238 0.000) 4.238 4.933 ( 0.000 -2.569 0.000) 2.569 5.151 ( 0.000 9.241 0.000) 9.241 5.513 ( 0.000 -3.397 0.000) 3.397 5.514 ( 0.000 22.033 0.000) 22.033 5.579 ( 0.000 19.764 0.000) 19.764 5.581 ( 0.000 -0.117 0.000) 0.117 5.718 ( 0.000 7.996 0.000) 7.996 5.820 ( 0.000 6.161 0.000) 6.161 5.880 ( 0.000 15.047 0.000) 15.047 5.954 ( 0.000 9.246 0.000) 9.246 6.189 ( 0.000 24.154 0.000) 24.154 6.403 ( 0.000 21.536 0.000) 21.536 6.467 ( 0.000 5.145 0.000) 5.145 6.562 ( 0.000 12.433 0.000) 12.433 6.650 ( 0.000 11.808 0.000) 11.808 6.690 ( 0.000 13.135 0.000) 13.135 6.720 ( 0.000 16.595 0.000) 16.595 6.741 ( 0.000 -0.194 0.000) 0.194 6.830 ( 0.000 1.611 0.000) 1.611 8.410 ( 0.000 -4.166 0.000) 4.166 8.456 ( 0.000 -10.004 0.000) 10.004 8.606 ( 0.000 -7.186 0.000) 7.186 8.727 ( 0.000 -7.239 0.000) 7.239 9.363 ( 0.000 3.104 0.000) 3.104 9.535 ( 0.000 5.081 0.000) 5.081 9.830 ( 0.000 -0.566 0.000) 0.566 10.043 ( 0.000 -0.436 0.000) 0.436 10.141 ( 0.000 -2.199 0.000) 2.199 10.236 ( 0.000 -6.757 0.000) 6.757 10.502 ( 0.000 -1.634 0.000) 1.634 10.556 ( 0.000 10.080 0.000) 10.080 10.589 ( 0.000 -4.653 0.000) 4.653 10.675 ( 0.000 2.912 0.000) 2.912 10.969 ( 0.000 -3.536 0.000) 3.536 11.056 ( 0.000 11.335 0.000) 11.335 11.524 ( 0.000 -0.911 0.000) 0.911 11.527 ( 0.000 -0.449 0.000) 0.449 11.637 ( 0.000 -0.370 0.000) 0.370 11.855 ( 0.000 12.949 0.000) 12.949 12.038 ( 0.000 7.498 0.000) 7.498 12.441 ( 0.000 16.372 0.000) 16.372 12.477 ( 0.000 4.190 0.000) 4.190 12.617 ( 0.000 -0.039 0.000) 0.039 12.727 ( 0.000 15.181 0.000) 15.181 12.824 ( 0.000 -15.587 0.000) 15.587 13.058 ( 0.000 7.274 0.000) 7.274 13.112 ( 0.000 5.556 0.000) 5.556 13.534 ( 0.000 14.880 0.000) 14.880 13.722 ( 0.000 9.617 0.000) 9.617 13.734 ( 0.000 15.587 0.000) 15.587 13.741 ( 0.000 0.853 0.000) 0.853 14.111 ( 0.000 1.927 0.000) 1.927 14.264 ( 0.000 12.281 0.000) 12.281 14.870 ( 0.000 -7.699 0.000) 7.699 14.997 ( 0.000 -0.134 0.000) 0.134 15.300 ( 0.000 -2.389 0.000) 2.389 15.581 ( 0.000 2.667 0.000) 2.667 15.581 ( 0.000 -8.427 0.000) 8.427 15.582 ( 0.000 3.351 0.000) 3.351 16.198 ( 0.000 -9.142 0.000) 9.142 16.254 ( 0.000 -5.977 0.000) 5.977 16.385 ( 0.000 -12.126 0.000) 12.126 16.477 ( 0.000 -10.942 0.000) 10.942======================= Grid point 26 (17/72) =======================q-point: ( 0.20 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.694 ( 3.203 17.459 0.000) 17.750 2.807 ( 2.049 17.307 0.000) 17.427 2.997 ( 1.950 8.261 0.000) 8.488 3.024 ( 0.544 5.737 0.000) 5.763 3.096 ( -2.020 5.532 0.000) 5.890 3.133 ( -3.431 1.300 0.000) 3.669 3.320 ( 0.037 9.940 0.000) 9.940 3.412 ( 1.338 1.346 0.000) 1.898 3.546 ( 7.415 -0.148 0.000) 7.416 3.603 ( 2.429 10.304 0.000) 10.587 3.742 ( -1.781 5.884 0.000) 6.147 3.879 ( -4.875 8.079 0.000) 9.436 3.891 ( 0.660 2.211 0.000) 2.307 4.088 ( -1.576 1.877 0.000) 2.451 4.275 ( -0.505 4.168 0.000) 4.198 4.340 ( 4.161 -2.297 0.000) 4.753 4.386 ( -5.783 -0.414 0.000) 5.798 4.469 ( -9.226 -1.425 0.000) 9.335 4.633 ( -3.167 2.134 0.000) 3.819 4.915 ( -1.135 0.888 0.000) 1.441 4.960 ( 2.887 1.669 0.000) 3.335 5.114 ( 13.087 -3.727 0.000) 13.607 5.198 ( 4.163 3.252 0.000) 5.283 5.498 ( -7.236 16.363 0.000) 17.891 5.503 ( -1.565 1.856 0.000) 2.427 5.517 ( 0.373 17.654 0.000) 17.658 5.610 ( 2.175 0.733 0.000) 2.295 5.668 ( -2.377 3.511 0.000) 4.240 5.815 ( -0.279 9.540 0.000) 9.544 5.905 ( 0.257 17.205 0.000) 17.207 5.995 ( 3.764 9.852 0.000) 10.546 6.186 ( -0.547 21.205 0.000) 21.212 6.409 ( 0.726 21.697 0.000) 21.709 6.477 ( 1.483 8.945 0.000) 9.067 6.568 ( -1.464 18.222 0.000) 18.280 6.640 ( -1.234 12.961 0.000) 13.019 6.651 ( 0.115 6.471 0.000) 6.472 6.739 ( -0.150 -0.308 0.000) 0.343 6.768 ( 2.129 13.291 0.000) 13.461 6.823 ( -0.651 2.055 0.000) 2.156 8.399 ( -0.266 -3.911 0.000) 3.920 8.451 ( -0.480 -8.629 0.000) 8.642 8.687 ( 6.338 -7.388 0.000) 9.734 8.755 ( 2.564 -7.804 0.000) 8.215 9.340 ( -1.013 1.897 0.000) 2.151 9.524 ( -0.317 3.930 0.000) 3.943 9.900 ( 5.016 0.839 0.000) 5.086 9.914 ( -13.801 -0.820 0.000) 13.826 10.103 ( -10.514 -7.959 0.000) 13.187 10.135 ( 3.447 -2.045 0.000) 4.008 10.479 ( -2.744 -1.512 0.000) 3.133 10.567 ( -2.542 -4.036 0.000) 4.770 10.628 ( 5.490 9.312 0.000) 10.810 10.702 ( 3.018 3.761 0.000) 4.822 10.986 ( -4.884 10.514 0.000) 11.593 11.017 ( 3.210 -0.806 0.000) 3.310 11.537 ( 0.769 0.398 0.000) 0.866 11.602 ( -4.135 0.577 0.000) 4.175 11.663 ( 10.444 0.283 0.000) 10.448 11.966 ( 9.794 11.819 0.000) 15.350 12.049 ( 1.081 9.227 0.000) 9.290 12.415 ( -1.786 16.034 0.000) 16.133 12.425 ( -0.202 -1.546 0.000) 1.559 12.640 ( 0.989 1.462 0.000) 1.765 12.770 ( 2.684 13.095 0.000) 13.367 12.850 ( 1.549 -9.621 0.000) 9.745 12.954 ( -7.862 7.246 0.000) 10.692 13.159 ( 2.509 3.326 0.000) 4.166 13.467 ( -4.865 12.885 0.000) 13.773 13.485 ( -16.215 4.703 0.000) 16.883 13.781 ( 0.050 5.786 0.000) 5.787 13.853 ( 8.595 13.920 0.000) 16.360 14.080 ( -2.261 2.247 0.000) 3.188 14.302 ( 1.863 10.925 0.000) 11.083 14.885 ( 1.418 -6.821 0.000) 6.967 14.987 ( -1.023 -0.749 0.000) 1.268 15.297 ( 0.508 -0.964 0.000) 1.089 15.524 ( -3.749 3.692 0.000) 5.262 15.610 ( 2.190 -6.773 0.000) 7.118 15.613 ( 1.320 1.824 0.000) 2.252 16.209 ( 0.954 -8.744 0.000) 8.796 16.252 ( -0.161 -6.186 0.000) 6.188 16.399 ( 1.215 -11.938 0.000) 11.999 16.474 ( -0.348 -11.000 0.000) 11.006======================= Grid point 27 (18/72) =======================q-point: ( 0.40 0.33 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.792 ( 6.232 13.227 0.000) 14.622 2.859 ( 2.385 14.550 0.000) 14.744 2.962 ( -3.902 11.650 0.000) 12.286 2.966 ( -6.342 7.292 0.000) 9.664 3.113 ( 2.429 4.058 0.000) 4.730 3.122 ( 2.432 4.069 0.000) 4.741 3.334 ( 0.897 5.528 0.000) 5.600 3.380 ( -3.403 2.449 0.000) 4.192 3.673 ( 2.203 9.594 0.000) 9.844 3.676 ( 3.291 0.078 0.000) 3.292 3.775 ( 4.182 5.038 0.000) 6.548 3.806 ( -0.762 11.748 0.000) 11.773 3.960 ( 6.727 1.305 0.000) 6.852 4.035 ( -0.705 -1.285 0.000) 1.466 4.151 ( -11.064 -1.346 0.000) 11.146 4.170 ( -11.515 -0.615 0.000) 11.532 4.367 ( 5.400 4.567 0.000) 7.073 4.470 ( -3.040 -0.766 0.000) 3.135 4.658 ( 7.039 4.625 0.000) 8.422 4.816 ( -7.108 2.905 0.000) 7.679 5.103 ( 9.264 9.337 0.000) 13.153 5.287 ( 3.888 -2.568 0.000) 4.660 5.288 ( -2.859 12.615 0.000) 12.935 5.329 ( -3.396 -7.124 0.000) 7.893 5.475 ( 0.538 9.542 0.000) 9.557 5.515 ( -1.221 9.403 0.000) 9.482 5.645 ( 0.990 0.284 0.000) 1.030 5.651 ( 0.064 -0.678 0.000) 0.681 5.821 ( 1.319 17.663 0.000) 17.712 5.871 ( -2.910 20.243 0.000) 20.451 6.083 ( 4.332 11.297 0.000) 12.099 6.156 ( -2.582 15.196 0.000) 15.414 6.440 ( 2.358 21.931 0.000) 22.057 6.501 ( -3.203 20.514 0.000) 20.762 6.533 ( 2.944 14.003 0.000) 14.309 6.597 ( -2.812 13.935 0.000) 14.216 6.692 ( 2.501 0.824 0.000) 2.634 6.730 ( -1.052 -0.075 0.000) 1.055 6.796 ( 0.762 9.269 0.000) 9.300 6.808 ( -0.664 4.729 0.000) 4.776 8.410 ( 1.158 -3.965 0.000) 4.130 8.435 ( -1.089 -5.784 0.000) 5.886 8.799 ( 3.381 -7.984 0.000) 8.670 8.809 ( 1.906 -8.424 0.000) 8.637 9.384 ( 6.359 0.263 0.000) 6.364 9.552 ( -0.245 1.626 0.000) 1.644 9.631 ( -7.845 -1.928 0.000) 8.079 9.782 ( -12.619 -2.421 0.000) 12.849 10.101 ( 7.257 -2.711 0.000) 7.747 10.198 ( 0.020 -1.481 0.000) 1.481 10.418 ( -0.775 -2.045 0.000) 2.187 10.483 ( -5.116 -2.388 0.000) 5.646 10.749 ( 5.473 8.653 0.000) 10.239 10.792 ( 3.614 4.615 0.000) 5.861 10.915 ( -0.150 7.794 0.000) 7.796 11.014 ( -4.803 2.024 0.000) 5.212 11.511 ( -2.143 3.657 0.000) 4.239 11.526 ( -1.828 3.474 0.000) 3.925 11.872 ( 9.118 1.966 0.000) 9.328 12.013 ( -4.359 5.650 0.000) 7.136 12.222 ( 12.616 13.964 0.000) 18.819 12.382 ( -2.539 15.150 0.000) 15.361 12.573 ( 12.787 -2.397 0.000) 13.010 12.647 ( 0.760 0.290 0.000) 0.814 12.728 ( -7.871 4.982 0.000) 9.316 12.802 ( -6.154 5.023 0.000) 7.943 12.898 ( 4.462 -0.088 0.000) 4.463 13.096 ( -14.411 -1.237 0.000) 14.464 13.260 ( 2.578 8.601 0.000) 8.979 13.359 ( -5.541 9.366 0.000) 10.882 13.810 ( 3.631 5.688 0.000) 6.748 13.908 ( -4.282 6.316 0.000) 7.631 14.137 ( 8.233 8.103 0.000) 11.551 14.280 ( -4.472 9.201 0.000) 10.231 14.920 ( 1.872 -4.772 0.000) 5.127 14.958 ( -1.732 -2.533 0.000) 3.069 15.341 ( 3.699 2.232 0.000) 4.321 15.433 ( -4.893 3.832 0.000) 6.215 15.638 ( 0.977 -0.445 0.000) 1.074 15.643 ( 0.677 -3.591 0.000) 3.655 16.230 ( 0.987 -7.789 0.000) 7.851 16.245 ( -0.531 -6.820 0.000) 6.840 16.430 ( 1.661 -11.541 0.000) 11.660 16.459 ( -1.137 -11.193 0.000) 11.251======================= Grid point 30 (19/72) =======================q-point: ( 0.00 0.40 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.982 ( 0.000 12.912 0.000) 12.912 3.047 ( 0.000 7.461 0.000) 7.461 3.120 ( 0.000 5.783 0.000) 5.783 3.165 ( 0.000 0.173 0.000) 0.173 3.174 ( 0.000 7.986 0.000) 7.986 3.214 ( 0.000 3.635 0.000) 3.635 3.389 ( 0.000 -0.268 0.000) 0.268 3.438 ( 0.000 -0.781 0.000) 0.781 3.590 ( 0.000 12.192 0.000) 12.192 3.809 ( 0.000 10.072 0.000) 10.072 3.828 ( 0.000 2.258 0.000) 2.258 3.946 ( 0.000 1.871 0.000) 1.871 3.947 ( 0.000 0.575 0.000) 0.575 4.232 ( 0.000 -0.388 0.000) 0.388 4.301 ( 0.000 -3.234 0.000) 3.234 4.323 ( 0.000 2.354 0.000) 2.354 4.383 ( 0.000 5.459 0.000) 5.459 4.540 ( 0.000 -4.725 0.000) 4.725 4.664 ( 0.000 -8.337 0.000) 8.337 4.755 ( 0.000 -8.963 0.000) 8.963 4.820 ( 0.000 1.301 0.000) 1.301 4.882 ( 0.000 -1.089 0.000) 1.089 5.306 ( 0.000 0.423 0.000) 0.423 5.335 ( 0.000 -11.089 0.000) 11.089 5.562 ( 0.000 -1.283 0.000) 1.283 5.608 ( 0.000 1.916 0.000) 1.916 5.921 ( 0.000 13.328 0.000) 13.328 5.932 ( 0.000 10.517 0.000) 10.517 6.126 ( 0.000 8.965 0.000) 8.965 6.166 ( 0.000 9.025 0.000) 9.025 6.263 ( 0.000 23.904 0.000) 23.904 6.573 ( 0.000 5.971 0.000) 5.971 6.578 ( 0.000 13.527 0.000) 13.527 6.712 ( 0.000 4.493 0.000) 4.493 6.723 ( 0.000 1.257 0.000) 1.257 6.735 ( 0.000 9.032 0.000) 9.032 6.892 ( 0.000 6.207 0.000) 6.207 6.928 ( 0.000 10.858 0.000) 10.858 7.003 ( 0.000 14.003 0.000) 14.003 7.049 ( 0.000 13.536 0.000) 13.536 8.311 ( 0.000 -3.808 0.000) 3.808 8.343 ( 0.000 -2.345 0.000) 2.345 8.463 ( 0.000 -6.541 0.000) 6.541 8.568 ( 0.000 -8.111 0.000) 8.111 9.456 ( 0.000 5.879 0.000) 5.879 9.660 ( 0.000 6.823 0.000) 6.823 9.839 ( 0.000 0.439 0.000) 0.439 10.039 ( 0.000 -2.562 0.000) 2.562 10.083 ( 0.000 -0.437 0.000) 0.437 10.085 ( 0.000 -6.227 0.000) 6.227 10.419 ( 0.000 -6.572 0.000) 6.572 10.441 ( 0.000 -8.680 0.000) 8.680 10.760 ( 0.000 9.696 0.000) 9.696 10.784 ( 0.000 6.866 0.000) 6.866 10.948 ( 0.000 1.932 0.000) 1.932 11.188 ( 0.000 0.798 0.000) 0.798 11.494 ( 0.000 -1.210 0.000) 1.210 11.502 ( 0.000 -0.876 0.000) 0.876 11.586 ( 0.000 -2.578 0.000) 2.578 11.997 ( 0.000 -1.354 0.000) 1.354 12.203 ( 0.000 6.961 0.000) 6.961 12.410 ( 0.000 -11.318 0.000) 11.318 12.545 ( 0.000 2.974 0.000) 2.974 12.704 ( 0.000 -1.230 0.000) 1.230 12.751 ( 0.000 13.458 0.000) 13.458 12.992 ( 0.000 9.447 0.000) 9.447 13.196 ( 0.000 6.110 0.000) 6.110 13.208 ( 0.000 4.363 0.000) 4.363 13.765 ( 0.000 1.596 0.000) 1.596 13.826 ( 0.000 12.824 0.000) 12.824 13.864 ( 0.000 3.876 0.000) 3.876 14.042 ( 0.000 14.413 0.000) 14.413 14.146 ( 0.000 1.053 0.000) 1.053 14.517 ( 0.000 12.363 0.000) 12.363 14.708 ( 0.000 -8.260 0.000) 8.260 15.003 ( 0.000 -0.291 0.000) 0.291 15.272 ( 0.000 -0.466 0.000) 0.466 15.412 ( 0.000 -7.586 0.000) 7.586 15.634 ( 0.000 2.406 0.000) 2.406 15.645 ( 0.000 2.489 0.000) 2.489 16.041 ( 0.000 -5.843 0.000) 5.843 16.161 ( 0.000 -3.043 0.000) 3.043 16.165 ( 0.000 -9.285 0.000) 9.285 16.289 ( 0.000 -7.494 0.000) 7.494======================= Grid point 31 (20/72) =======================q-point: ( 0.20 0.40 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.000 ( 1.417 12.525 0.000) 12.605 3.062 ( 1.674 6.858 0.000) 7.059 3.128 ( -3.031 3.221 0.000) 4.423 3.139 ( 1.778 5.491 0.000) 5.772 3.177 ( 0.366 5.127 0.000) 5.140 3.192 ( -1.476 3.977 0.000) 4.242 3.413 ( 0.822 -0.878 0.000) 1.203 3.439 ( -0.974 0.090 0.000) 0.978 3.603 ( 2.135 7.054 0.000) 7.370 3.802 ( 3.675 7.560 0.000) 8.406 3.862 ( -4.632 5.455 0.000) 7.156 3.942 ( 4.748 4.065 0.000) 6.250 3.970 ( 1.115 0.087 0.000) 1.118 4.149 ( -7.042 4.638 0.000) 8.432 4.253 ( -2.087 -5.104 0.000) 5.514 4.301 ( -2.939 -0.784 0.000) 3.042 4.418 ( -4.103 -2.268 0.000) 4.688 4.449 ( 0.749 6.032 0.000) 6.079 4.690 ( 1.718 2.379 0.000) 2.934 4.837 ( 7.384 -8.334 0.000) 11.135 4.881 ( -0.171 -2.192 0.000) 2.198 4.950 ( 8.202 -8.528 0.000) 11.832 5.299 ( -0.406 -0.943 0.000) 1.026 5.363 ( 2.432 -11.199 0.000) 11.460 5.573 ( 1.226 0.044 0.000) 1.227 5.614 ( 0.409 1.804 0.000) 1.850 5.790 ( -9.281 11.882 0.000) 15.077 5.848 ( -7.035 9.868 0.000) 12.119 6.187 ( 3.750 9.968 0.000) 10.650 6.226 ( 4.277 10.012 0.000) 10.888 6.259 ( -0.306 22.175 0.000) 22.177 6.523 ( -4.376 10.722 0.000) 11.581 6.612 ( 3.464 6.082 0.000) 7.000 6.730 ( 1.612 4.623 0.000) 4.896 6.745 ( 0.776 6.098 0.000) 6.147 6.756 ( 2.072 6.378 0.000) 6.706 6.870 ( -1.463 8.742 0.000) 8.864 6.947 ( 1.457 9.959 0.000) 10.065 6.968 ( -2.893 15.226 0.000) 15.499 7.048 ( -0.540 12.227 0.000) 12.238 8.328 ( 1.509 -3.053 0.000) 3.406 8.343 ( 0.604 -1.472 0.000) 1.591 8.533 ( 5.478 -7.357 0.000) 9.172 8.592 ( 2.128 -8.068 0.000) 8.345 9.415 ( -2.414 5.375 0.000) 5.892 9.621 ( -2.691 5.378 0.000) 6.014 9.902 ( 1.651 -5.906 0.000) 6.132 9.905 ( -13.910 -0.955 0.000) 13.942 9.977 ( -5.526 1.128 0.000) 5.640 10.096 ( 4.399 -0.840 0.000) 4.478 10.395 ( -2.877 -6.285 0.000) 6.912 10.431 ( -1.243 -8.129 0.000) 8.223 10.810 ( 4.294 8.225 0.000) 9.278 10.811 ( 2.547 6.250 0.000) 6.749 11.033 ( 5.189 2.413 0.000) 5.722 11.109 ( -5.299 1.569 0.000) 5.526 11.536 ( 3.075 0.487 0.000) 3.113 11.570 ( -1.377 -1.527 0.000) 2.056 11.632 ( 10.250 -2.843 0.000) 10.637 12.106 ( 9.833 -2.682 0.000) 10.192 12.203 ( -2.793 4.341 0.000) 5.162 12.343 ( 1.629 -1.986 0.000) 2.569 12.609 ( 2.697 -0.489 0.000) 2.741 12.715 ( -2.974 12.849 0.000) 13.189 12.752 ( 4.728 -1.606 0.000) 4.993 12.979 ( -2.945 6.392 0.000) 7.038 13.084 ( -8.789 5.720 0.000) 10.486 13.225 ( -1.109 3.257 0.000) 3.441 13.590 ( -12.003 5.815 0.000) 13.337 13.746 ( -6.243 13.011 0.000) 14.431 13.866 ( -0.600 1.760 0.000) 1.860 14.093 ( -2.949 3.880 0.000) 4.874 14.154 ( 6.960 9.887 0.000) 12.091 14.523 ( -0.429 10.726 0.000) 10.734 14.742 ( 3.060 -7.358 0.000) 7.968 14.971 ( -2.857 -1.644 0.000) 3.296 15.302 ( 3.547 1.259 0.000) 3.764 15.481 ( 5.209 -5.557 0.000) 7.617 15.598 ( -2.913 3.321 0.000) 4.418 15.649 ( -0.159 1.550 0.000) 1.558 16.059 ( 1.620 -5.573 0.000) 5.804 16.154 ( -0.657 -3.308 0.000) 3.373 16.183 ( 1.610 -9.060 0.000) 9.202 16.283 ( -0.591 -7.680 0.000) 7.703======================= Grid point 32 (21/72) =======================q-point: ( 0.40 0.40 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.028 ( 1.361 9.805 0.000) 9.899 3.065 ( -2.422 5.866 0.000) 6.347 3.115 ( 2.586 6.463 0.000) 6.961 3.152 ( -1.167 7.013 0.000) 7.109 3.190 ( 1.134 4.216 0.000) 4.365 3.195 ( 1.481 3.090 0.000) 3.426 3.394 ( -2.185 0.074 0.000) 2.186 3.397 ( -1.760 -0.597 0.000) 1.859 3.678 ( 4.422 1.616 0.000) 4.707 3.764 ( -4.246 2.350 0.000) 4.853 3.951 ( 8.415 3.788 0.000) 9.229 3.964 ( -0.118 -3.986 0.000) 3.988 4.002 ( 0.770 5.994 0.000) 6.043 4.089 ( -0.504 13.401 0.000) 13.410 4.143 ( -4.065 2.853 0.000) 4.967 4.182 ( -8.032 2.121 0.000) 8.308 4.435 ( 2.108 -2.436 0.000) 3.222 4.452 ( 0.145 2.669 0.000) 2.673 4.741 ( 3.385 4.573 0.000) 5.689 4.822 ( -3.975 0.648 0.000) 4.027 5.023 ( 7.087 -10.979 0.000) 13.067 5.067 ( 2.531 -13.004 0.000) 13.248 5.313 ( 2.617 -3.361 0.000) 4.259 5.390 ( -1.887 -9.762 0.000) 9.942 5.612 ( -0.470 2.291 0.000) 2.339 5.617 ( 2.977 4.046 0.000) 5.023 5.626 ( -4.389 10.478 0.000) 11.360 5.709 ( -5.920 6.963 0.000) 9.139 6.236 ( 1.289 13.447 0.000) 13.509 6.252 ( -0.466 18.086 0.000) 18.092 6.323 ( 4.979 9.593 0.000) 10.808 6.425 ( -5.018 9.355 0.000) 10.616 6.689 ( 3.567 5.222 0.000) 6.324 6.743 ( -1.403 4.148 0.000) 4.378 6.767 ( 1.735 5.130 0.000) 5.416 6.786 ( 0.363 6.544 0.000) 6.554 6.857 ( 0.801 14.009 0.000) 14.032 6.903 ( -3.140 16.034 0.000) 16.339 6.983 ( 1.979 10.282 0.000) 10.471 7.023 ( -1.800 10.978 0.000) 11.125 8.360 ( 1.184 -1.349 0.000) 1.795 8.363 ( 0.814 -0.559 0.000) 0.987 8.630 ( 2.903 -8.194 0.000) 8.693 8.638 ( 1.693 -8.187 0.000) 8.360 9.427 ( 4.749 3.728 0.000) 6.037 9.600 ( -0.692 2.610 0.000) 2.700 9.619 ( -10.212 0.497 0.000) 10.224 9.726 ( -9.630 -3.324 0.000) 10.187 10.076 ( 6.873 0.357 0.000) 6.882 10.165 ( 0.084 -1.610 0.000) 1.612 10.337 ( -0.656 -5.320 0.000) 5.360 10.384 ( -3.275 -6.551 0.000) 7.324 10.889 ( 4.818 5.064 0.000) 6.989 10.903 ( 3.879 6.452 0.000) 7.528 11.021 ( -2.955 2.774 0.000) 4.053 11.048 ( -3.788 1.633 0.000) 4.125 11.560 ( 0.914 2.634 0.000) 2.788 11.577 ( 0.310 2.439 0.000) 2.458 11.853 ( 10.685 -3.994 0.000) 11.407 12.053 ( -8.798 -4.071 0.000) 9.694 12.405 ( 17.535 2.755 0.000) 17.750 12.544 ( 14.969 2.133 0.000) 15.120 12.641 ( 1.184 1.744 0.000) 2.108 12.654 ( -2.964 10.625 0.000) 11.031 12.788 ( -15.401 1.623 0.000) 15.486 12.857 ( -13.530 2.482 0.000) 13.755 12.886 ( 8.303 -1.090 0.000) 8.374 13.089 ( -11.172 -0.401 0.000) 11.179 13.486 ( 3.013 12.043 0.000) 12.414 13.605 ( -7.123 12.672 0.000) 14.537 13.888 ( 3.363 1.254 0.000) 3.590 13.990 ( -5.879 1.357 0.000) 6.033 14.326 ( 8.419 10.081 0.000) 13.134 14.469 ( -5.075 9.297 0.000) 10.592 14.818 ( 4.083 -5.494 0.000) 6.845 14.900 ( -3.897 -3.579 0.000) 5.291 15.405 ( 5.853 3.731 0.000) 6.940 15.518 ( -4.889 4.138 0.000) 6.405 15.579 ( 3.866 -2.623 0.000) 4.672 15.633 ( -1.560 -0.103 0.000) 1.564 16.098 ( 1.982 -4.862 0.000) 5.250 16.134 ( -1.404 -3.998 0.000) 4.237 16.223 ( 2.139 -8.588 0.000) 8.851 16.262 ( -1.528 -8.100 0.000) 8.243======================= Grid point 35 (22/72) =======================q-point: ( 0.00 0.47 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.135 ( 0.000 2.368 0.000) 2.368 3.163 ( 0.000 -0.550 0.000) 0.550 3.171 ( 0.000 4.819 0.000) 4.819 3.194 ( 0.000 1.520 0.000) 1.520 3.293 ( 0.000 4.958 0.000) 4.958 3.309 ( 0.000 4.738 0.000) 4.738 3.371 ( 0.000 -1.711 0.000) 1.711 3.394 ( 0.000 -3.841 0.000) 3.841 3.816 ( 0.000 9.373 0.000) 9.373 3.867 ( 0.000 1.659 0.000) 1.659 3.892 ( 0.000 -0.394 0.000) 0.394 3.941 ( 0.000 -2.465 0.000) 2.465 4.082 ( 0.000 9.400 0.000) 9.400 4.210 ( 0.000 -2.575 0.000) 2.575 4.241 ( 0.000 -1.546 0.000) 1.546 4.262 ( 0.000 -3.156 0.000) 3.156 4.453 ( 0.000 -2.536 0.000) 2.536 4.494 ( 0.000 -6.833 0.000) 6.833 4.528 ( 0.000 4.250 0.000) 4.250 4.608 ( 0.000 -5.144 0.000) 5.144 4.918 ( 0.000 7.744 0.000) 7.744 4.953 ( 0.000 8.368 0.000) 8.368 5.110 ( 0.000 -10.667 0.000) 10.667 5.164 ( 0.000 -10.754 0.000) 10.754 5.606 ( 0.000 2.791 0.000) 2.791 5.633 ( 0.000 0.163 0.000) 0.163 6.090 ( 0.000 4.471 0.000) 4.471 6.100 ( 0.000 3.903 0.000) 3.903 6.256 ( 0.000 4.148 0.000) 4.148 6.282 ( 0.000 2.116 0.000) 2.116 6.632 ( 0.000 11.708 0.000) 11.708 6.692 ( 0.000 5.013 0.000) 5.013 6.727 ( 0.000 1.471 0.000) 1.471 6.753 ( 0.000 -0.620 0.000) 0.620 6.759 ( 0.000 2.025 0.000) 2.025 6.797 ( 0.000 -0.544 0.000) 0.544 7.044 ( 0.000 5.643 0.000) 5.643 7.074 ( 0.000 2.982 0.000) 2.982 7.211 ( 0.000 5.963 0.000) 5.963 7.232 ( 0.000 4.061 0.000) 4.061 8.304 ( 0.000 2.893 0.000) 2.893 8.319 ( 0.000 0.163 0.000) 0.163 8.357 ( 0.000 -3.638 0.000) 3.638 8.410 ( 0.000 -7.009 0.000) 7.009 9.597 ( 0.000 7.820 0.000) 7.820 9.762 ( 0.000 -7.652 0.000) 7.652 9.801 ( 0.000 6.871 0.000) 6.871 9.934 ( 0.000 -6.166 0.000) 6.166 10.086 ( 0.000 5.998 0.000) 5.998 10.141 ( 0.000 4.796 0.000) 4.796 10.253 ( 0.000 -9.376 0.000) 9.376 10.268 ( 0.000 -7.402 0.000) 7.402 10.932 ( 0.000 6.504 0.000) 6.504 10.943 ( 0.000 8.440 0.000) 8.440 10.995 ( 0.000 0.619 0.000) 0.619 11.109 ( 0.000 -7.156 0.000) 7.156 11.487 ( 0.000 0.378 0.000) 0.378 11.496 ( 0.000 -0.260 0.000) 0.260 11.597 ( 0.000 5.084 0.000) 5.084 11.800 ( 0.000 -13.340 0.000) 13.340 12.295 ( 0.000 2.268 0.000) 2.268 12.318 ( 0.000 -0.794 0.000) 0.794 12.610 ( 0.000 3.389 0.000) 3.389 12.671 ( 0.000 -2.305 0.000) 2.305 12.974 ( 0.000 8.222 0.000) 8.222 13.073 ( 0.000 -1.103 0.000) 1.103 13.290 ( 0.000 2.695 0.000) 2.695 13.291 ( 0.000 2.743 0.000) 2.743 13.814 ( 0.000 3.283 0.000) 3.283 13.878 ( 0.000 -2.064 0.000) 2.064 14.035 ( 0.000 7.556 0.000) 7.556 14.135 ( 0.000 -2.487 0.000) 2.487 14.311 ( 0.000 11.936 0.000) 11.936 14.528 ( 0.000 -9.587 0.000) 9.587 14.757 ( 0.000 10.931 0.000) 10.931 14.941 ( 0.000 -6.437 0.000) 6.437 15.274 ( 0.000 0.528 0.000) 0.528 15.302 ( 0.000 -2.910 0.000) 2.910 15.672 ( 0.000 1.173 0.000) 1.173 15.677 ( 0.000 0.671 0.000) 0.671 15.973 ( 0.000 -0.617 0.000) 0.617 16.018 ( 0.000 -4.919 0.000) 4.919 16.132 ( 0.000 0.274 0.000) 0.274 16.174 ( 0.000 -3.819 0.000) 3.819======================= Grid point 36 (23/72) =======================q-point: ( 0.20 0.47 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.135 ( 0.528 1.718 0.000) 1.797 3.150 ( -0.836 0.079 0.000) 0.840 3.187 ( 1.235 4.919 0.000) 5.072 3.212 ( 1.508 1.480 0.000) 2.113 3.274 ( -1.570 5.046 0.000) 5.285 3.303 ( -0.347 5.202 0.000) 5.214 3.379 ( 0.056 -2.512 0.000) 2.512 3.384 ( -1.270 -4.598 0.000) 4.770 3.764 ( -2.952 7.756 0.000) 8.299 3.900 ( 3.294 2.706 0.000) 4.263 3.903 ( -3.432 -5.647 0.000) 6.608 3.918 ( -1.953 0.776 0.000) 2.102 4.066 ( 2.077 5.457 0.000) 5.839 4.155 ( -3.370 -4.350 0.000) 5.502 4.254 ( 2.587 4.225 0.000) 4.954 4.292 ( 0.502 -0.276 0.000) 0.573 4.437 ( 1.236 5.275 0.000) 5.418 4.541 ( -0.401 3.612 0.000) 3.634 4.609 ( 6.472 -9.547 0.000) 11.534 4.663 ( 5.429 -8.171 0.000) 9.810 4.937 ( 1.416 7.029 0.000) 7.171 4.941 ( -0.952 8.261 0.000) 8.316 5.131 ( 1.787 -11.044 0.000) 11.187 5.149 ( -1.137 -10.641 0.000) 10.701 5.625 ( 1.900 2.665 0.000) 3.273 5.646 ( 1.259 0.580 0.000) 1.386 5.963 ( -8.995 4.932 0.000) 10.259 5.984 ( -8.641 2.978 0.000) 9.140 6.327 ( 4.404 4.138 0.000) 6.042 6.351 ( 4.455 2.187 0.000) 4.963 6.577 ( -4.168 8.410 0.000) 9.386 6.634 ( -5.426 1.373 0.000) 5.597 6.730 ( 3.165 4.711 0.000) 5.676 6.780 ( 2.379 0.013 0.000) 2.379 6.812 ( 2.181 3.180 0.000) 3.856 6.845 ( 2.575 1.062 0.000) 2.785 7.050 ( 0.770 6.255 0.000) 6.303 7.087 ( 1.300 2.751 0.000) 3.042 7.190 ( -1.930 6.311 0.000) 6.599 7.216 ( -1.491 3.739 0.000) 4.025 8.331 ( 2.374 3.085 0.000) 3.893 8.342 ( 2.213 1.434 0.000) 2.637 8.406 ( 4.024 -4.866 0.000) 6.314 8.437 ( 2.341 -6.851 0.000) 7.240 9.552 ( -3.214 7.872 0.000) 8.502 9.727 ( -3.815 -9.149 0.000) 9.913 9.735 ( -5.358 5.667 0.000) 7.799 9.845 ( -8.897 -4.781 0.000) 10.100 10.086 ( 0.802 7.397 0.000) 7.441 10.134 ( 0.781 4.435 0.000) 4.503 10.254 ( -1.530 -6.904 0.000) 7.071 10.255 ( -0.124 -8.856 0.000) 8.857 10.948 ( 0.865 6.936 0.000) 6.989 10.960 ( 2.708 6.549 0.000) 7.087 11.055 ( 3.253 -1.864 0.000) 3.749 11.072 ( -2.392 -4.590 0.000) 5.176 11.552 ( 4.556 0.828 0.000) 4.630 11.577 ( 7.421 -2.009 0.000) 7.688 11.621 ( 2.285 7.717 0.000) 8.049 11.863 ( 4.147 -14.632 0.000) 15.208 12.295 ( 1.577 3.778 0.000) 4.094 12.344 ( 4.394 -0.895 0.000) 4.485 12.651 ( 3.519 3.466 0.000) 4.939 12.715 ( 4.345 -2.474 0.000) 5.000 12.924 ( -4.668 7.615 0.000) 8.932 13.020 ( -5.716 -1.697 0.000) 5.962 13.196 ( -8.736 4.756 0.000) 9.946 13.256 ( -5.806 -0.819 0.000) 5.864 13.723 ( -5.408 6.890 0.000) 8.759 13.841 ( -2.166 -4.024 0.000) 4.570 13.966 ( -5.786 8.323 0.000) 10.137 14.082 ( -4.804 -3.194 0.000) 5.769 14.385 ( 6.187 10.720 0.000) 12.377 14.581 ( 4.602 -8.616 0.000) 9.768 14.731 ( -2.577 9.461 0.000) 9.806 14.894 ( -3.877 -6.148 0.000) 7.268 15.340 ( 6.099 2.288 0.000) 6.514 15.394 ( 6.982 -3.170 0.000) 7.668 15.651 ( -1.934 1.798 0.000) 2.641 15.668 ( -1.115 0.135 0.000) 1.123 15.995 ( 1.952 -0.543 0.000) 2.026 16.039 ( 1.926 -4.813 0.000) 5.184 16.122 ( -1.028 0.195 0.000) 1.046 16.164 ( -0.940 -3.983 0.000) 4.093======================= Grid point 37 (24/72) =======================q-point: ( 0.40 0.47 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 114Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.148 ( 1.044 2.649 0.000) 2.848 3.173 ( 3.038 0.293 0.000) 3.053 3.185 ( -1.840 5.272 0.000) 5.584 3.229 ( -1.176 0.543 0.000) 1.295 3.265 ( 1.360 3.990 0.000) 4.215 3.291 ( -0.955 4.567 0.000) 4.666 3.348 ( -1.017 -3.867 0.000) 3.999 3.363 ( -1.449 -2.614 0.000) 2.989 3.750 ( 1.748 4.949 0.000) 5.249 3.823 ( -5.033 3.680 0.000) 6.235 3.860 ( 0.204 -5.611 0.000) 5.615 3.908 ( -3.188 -4.175 0.000) 5.253 4.134 ( 5.797 5.533 0.000) 8.014 4.220 ( 6.395 -1.098 0.000) 6.488 4.247 ( -3.917 4.229 0.000) 5.764 4.300 ( -0.700 2.518 0.000) 2.614 4.469 ( 1.617 9.316 0.000) 9.456 4.508 ( -2.228 7.700 0.000) 8.016 4.718 ( 3.925 -11.604 0.000) 12.250 4.752 ( 1.403 -13.055 0.000) 13.131 4.935 ( 0.882 8.236 0.000) 8.283 4.953 ( -0.128 6.740 0.000) 6.741 5.141 ( 0.781 -10.722 0.000) 10.751 5.158 ( 0.170 -11.595 0.000) 11.596 5.683 ( 3.469 2.753 0.000) 4.429 5.691 ( 3.994 1.978 0.000) 4.457 5.788 ( -7.299 4.719 0.000) 8.692 5.811 ( -7.566 2.273 0.000) 7.901 6.409 ( 3.855 4.513 0.000) 5.935 6.439 ( 4.237 1.810 0.000) 4.608 6.490 ( -4.131 5.820 0.000) 7.137 6.529 ( -4.762 1.449 0.000) 4.978 6.795 ( 2.722 4.392 0.000) 5.167 6.829 ( -0.516 4.191 0.000) 4.223 6.834 ( 2.477 0.858 0.000) 2.622 6.867 ( -0.473 1.176 0.000) 1.268 7.083 ( 2.415 6.965 0.000) 7.372 7.126 ( 2.338 2.777 0.000) 3.630 7.139 ( -2.872 6.847 0.000) 7.425 7.175 ( -2.391 3.206 0.000) 3.999 8.382 ( 1.977 3.364 0.000) 3.902 8.388 ( 1.489 2.950 0.000) 3.304 8.481 ( 2.436 -6.140 0.000) 6.606 8.486 ( 1.761 -6.560 0.000) 6.793 9.524 ( 1.720 5.539 0.000) 5.800 9.633 ( -4.586 1.159 0.000) 4.730 9.638 ( -3.311 -5.306 0.000) 6.255 9.643 ( -7.757 0.661 0.000) 7.785 10.123 ( 2.339 4.322 0.000) 4.914 10.155 ( 0.018 1.357 0.000) 1.357 10.225 ( -0.348 -5.075 0.000) 5.087 10.242 ( -1.117 -6.917 0.000) 7.007 10.988 ( 2.957 4.195 0.000) 5.133 11.011 ( 1.562 4.153 0.000) 4.437 11.041 ( -0.634 -0.761 0.000) 0.990 11.064 ( -2.191 -0.751 0.000) 2.317 11.638 ( 3.078 3.783 0.000) 4.877 11.661 ( 0.812 7.876 0.000) 7.918 11.739 ( 7.760 -6.044 0.000) 9.836 11.868 ( -4.056 -11.455 0.000) 12.152 12.465 ( 15.114 3.593 0.000) 15.535 12.531 ( 13.430 -2.606 0.000) 13.680 12.749 ( 6.371 5.995 0.000) 8.748 12.788 ( -9.414 2.966 0.000) 9.870 12.810 ( -15.296 0.326 0.000) 15.300 12.844 ( 8.168 -3.300 0.000) 8.809 12.946 ( -13.375 5.772 0.000) 14.567 13.049 ( -11.953 -3.728 0.000) 12.521 13.709 ( 3.873 9.362 0.000) 10.132 13.830 ( -6.991 8.976 0.000) 11.377 13.853 ( 3.593 -4.577 0.000) 5.819 13.962 ( -6.330 -3.984 0.000) 7.480 14.525 ( 6.922 9.118 0.000) 11.448 14.651 ( -5.209 8.418 0.000) 9.899 14.691 ( 5.689 -7.139 0.000) 9.129 14.801 ( -5.069 -6.197 0.000) 8.006 15.478 ( 6.575 3.209 0.000) 7.316 15.532 ( 5.965 -2.225 0.000) 6.367 15.590 ( -4.221 2.727 0.000) 5.025 15.626 ( -3.209 -0.882 0.000) 3.328 16.043 ( 2.550 -0.332 0.000) 2.571 16.087 ( 2.542 -4.585 0.000) 5.242 16.091 ( -1.995 -0.039 0.000) 1.996 16.135 ( -1.957 -4.305 0.000) 4.729======================= Grid point 75 (25/72) =======================q-point: ( 0.00 0.00 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 48Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.659 ( 0.000 0.000 29.952) 29.952 0.674 ( 0.000 0.000 30.397) 30.397 1.240 ( 0.000 0.000 54.354) 54.354 1.836 ( 0.000 0.000 -20.472) 20.472 1.890 ( 0.000 0.000 -21.666) 21.666 2.408 ( 0.000 0.000 3.048) 3.048 2.653 ( 0.000 0.000 10.739) 10.739 2.690 ( 0.000 0.000 -6.269) 6.269 2.772 ( 0.000 0.000 16.889) 16.889 2.827 ( 0.000 0.000 11.657) 11.657 2.901 ( 0.000 0.000 -5.803) 5.803 2.939 ( 0.000 0.000 1.500) 1.500 3.038 ( 0.000 0.000 -2.195) 2.195 3.070 ( 0.000 0.000 -0.330) 0.330 3.158 ( 0.000 0.000 2.097) 2.097 3.173 ( 0.000 0.000 -12.870) 12.870 3.268 ( 0.000 0.000 -6.151) 6.151 3.330 ( 0.000 0.000 -4.208) 4.208 3.452 ( 0.000 0.000 -13.686) 13.686 3.496 ( 0.000 0.000 2.061) 2.061 3.570 ( 0.000 0.000 -0.951) 0.951 3.725 ( 0.000 0.000 -38.192) 38.192 3.931 ( 0.000 0.000 14.069) 14.069 4.196 ( 0.000 0.000 11.554) 11.554 4.885 ( 0.000 0.000 4.073) 4.073 4.951 ( 0.000 0.000 -8.404) 8.404 5.131 ( 0.000 0.000 -5.069) 5.069 5.316 ( 0.000 0.000 9.947) 9.947 5.546 ( 0.000 0.000 0.605) 0.605 5.726 ( 0.000 0.000 8.652) 8.652 5.848 ( 0.000 0.000 -7.605) 7.605 5.970 ( 0.000 0.000 7.028) 7.028 6.233 ( 0.000 0.000 5.259) 5.259 6.332 ( 0.000 0.000 1.436) 1.436 6.402 ( 0.000 0.000 1.918) 1.918 6.600 ( 0.000 0.000 -10.976) 10.976 6.739 ( 0.000 0.000 1.475) 1.475 6.988 ( 0.000 0.000 8.193) 8.193 7.089 ( 0.000 0.000 -5.703) 5.703 7.333 ( 0.000 0.000 -5.695) 5.695 8.781 ( 0.000 0.000 -0.009) 0.009 8.783 ( 0.000 0.000 -0.064) 0.064 8.925 ( 0.000 0.000 4.091) 4.091 9.137 ( 0.000 0.000 -3.393) 3.393 9.265 ( 0.000 0.000 -0.289) 0.289 9.291 ( 0.000 0.000 -1.511) 1.511 9.504 ( 0.000 0.000 1.036) 1.036 9.513 ( 0.000 0.000 0.722) 0.722 9.739 ( 0.000 0.000 -0.071) 0.071 9.743 ( 0.000 0.000 -0.035) 0.035 9.747 ( 0.000 0.000 0.387) 0.387 9.881 ( 0.000 0.000 -5.764) 5.764 10.180 ( 0.000 0.000 6.492) 6.492 10.235 ( 0.000 0.000 7.340) 7.340 10.358 ( 0.000 0.000 0.511) 0.511 10.430 ( 0.000 0.000 4.436) 4.436 10.935 ( 0.000 0.000 -1.585) 1.585 10.997 ( 0.000 0.000 -0.150) 0.150 11.066 ( 0.000 0.000 -3.221) 3.221 11.185 ( 0.000 0.000 -7.550) 7.550 11.245 ( 0.000 0.000 3.437) 3.437 11.572 ( 0.000 0.000 -8.673) 8.673 11.964 ( 0.000 0.000 1.016) 1.016 11.980 ( 0.000 0.000 0.024) 0.024 12.222 ( 0.000 0.000 3.911) 3.911 12.303 ( 0.000 0.000 2.295) 2.295 12.486 ( 0.000 0.000 -1.079) 1.079 12.553 ( 0.000 0.000 -2.217) 2.217 12.565 ( 0.000 0.000 3.700) 3.700 12.753 ( 0.000 0.000 -3.194) 3.194 13.681 ( 0.000 0.000 2.095) 2.095 13.811 ( 0.000 0.000 -2.695) 2.695 14.003 ( 0.000 0.000 4.587) 4.587 14.187 ( 0.000 0.000 -2.132) 2.132 15.348 ( 0.000 0.000 0.106) 0.106 15.373 ( 0.000 0.000 -1.127) 1.127 15.488 ( 0.000 0.000 4.441) 4.441 15.761 ( 0.000 0.000 -6.948) 6.948 15.951 ( 0.000 0.000 0.806) 0.806 15.976 ( 0.000 0.000 0.743) 0.743 16.988 ( 0.000 0.000 7.141) 7.141 17.305 ( 0.000 0.000 -4.726) 4.726 17.578 ( 0.000 0.000 0.386) 0.386 17.610 ( 0.000 0.000 -0.786) 0.786======================= Grid point 76 (26/72) =======================q-point: ( 0.20 0.00 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 80Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.893 ( 18.613 0.000 22.337) 29.076 0.926 ( 20.557 0.000 22.156) 30.224 1.625 ( 33.082 0.000 35.741) 48.702 1.897 ( 5.349 0.000 -17.704) 18.494 1.987 ( 9.574 0.000 -16.119) 18.748 2.220 ( -15.439 0.000 3.205) 15.769 2.396 ( -20.399 0.000 7.170) 21.622 2.573 ( -9.892 0.000 -8.242) 12.875 2.809 ( -9.533 0.000 -9.215) 13.259 2.824 ( 1.359 0.000 10.076) 10.167 2.896 ( 10.429 0.000 16.737) 19.721 3.025 ( 0.976 0.000 1.143) 1.503 3.052 ( 0.852 0.000 0.878) 1.223 3.078 ( 2.343 0.000 -1.307) 2.682 3.186 ( 3.914 0.000 2.080) 4.432 3.215 ( 4.361 0.000 -5.776) 7.237 3.355 ( 1.925 0.000 -3.118) 3.664 3.406 ( 8.396 0.000 -2.468) 8.751 3.500 ( 0.354 0.000 1.110) 1.165 3.561 ( -0.905 0.000 -0.959) 1.319 3.566 ( 11.047 0.000 -14.374) 18.129 3.783 ( 1.709 0.000 -23.232) 23.294 3.904 ( -1.756 0.000 6.606) 6.835 4.153 ( -0.685 0.000 2.131) 2.238 4.540 ( -23.737 0.000 14.984) 28.070 4.826 ( -12.287 0.000 -12.726) 17.690 5.039 ( -4.781 0.000 -15.686) 16.399 5.217 ( -21.012 0.000 -9.024) 22.868 5.540 ( 0.491 0.000 16.843) 16.850 5.868 ( 11.099 0.000 1.720) 11.231 5.932 ( 7.274 0.000 3.975) 8.289 6.027 ( 5.797 0.000 7.703) 9.641 6.149 ( -5.296 0.000 0.751) 5.349 6.276 ( 0.055 0.000 6.452) 6.452 6.565 ( 6.739 0.000 -2.445) 7.169 6.648 ( 5.285 0.000 -5.549) 7.663 6.859 ( -2.051 0.000 1.715) 2.674 7.098 ( 14.421 0.000 -11.849) 18.664 7.155 ( 0.381 0.000 -4.514) 4.530 7.280 ( -1.719 0.000 -3.423) 3.830 8.798 ( 1.518 0.000 -0.023) 1.518 8.799 ( 1.414 0.000 -0.029) 1.415 9.023 ( 8.301 0.000 1.833) 8.501 9.125 ( -0.470 0.000 -1.415) 1.491 9.233 ( -2.653 0.000 -0.079) 2.654 9.251 ( -3.204 0.000 -0.726) 3.285 9.463 ( -12.510 0.000 13.123) 18.130 9.528 ( 2.160 0.000 0.893) 2.337 9.559 ( 3.850 0.000 -0.544) 3.888 9.667 ( -6.859 0.000 -0.916) 6.920 9.724 ( -2.059 0.000 0.386) 2.095 9.851 ( -2.795 0.000 -5.360) 6.045 10.162 ( -1.402 0.000 5.888) 6.053 10.266 ( 2.748 0.000 7.372) 7.868 10.298 ( -5.201 0.000 1.451) 5.400 10.426 ( -0.659 0.000 5.296) 5.337 10.952 ( 1.682 0.000 -2.712) 3.191 11.101 ( 7.866 0.000 -0.502) 7.882 11.156 ( -2.709 0.000 -7.271) 7.760 11.169 ( 1.170 0.000 -2.643) 2.891 11.421 ( 14.013 0.000 -4.064) 14.591 11.675 ( 3.275 0.000 -13.467) 13.860 11.826 ( -0.189 0.000 3.311) 3.316 12.074 ( -1.548 0.000 -5.781) 5.985 12.234 ( 1.097 0.000 3.779) 3.935 12.299 ( -0.390 0.000 2.549) 2.579 12.493 ( 0.583 0.000 -1.300) 1.424 12.547 ( -0.601 0.000 -2.173) 2.255 12.681 ( 10.893 0.000 3.351) 11.396 12.821 ( 6.212 0.000 -0.503) 6.232 13.574 ( -9.294 0.000 1.631) 9.436 13.638 ( -13.125 0.000 0.806) 13.150 14.121 ( 8.083 0.000 2.354) 8.419 14.293 ( 5.943 0.000 -5.123) 7.846 15.249 ( -4.430 0.000 1.128) 4.572 15.356 ( -2.952 0.000 -1.303) 3.227 15.605 ( 7.215 0.000 0.930) 7.275 15.769 ( 1.043 0.000 -5.497) 5.595 15.910 ( -2.822 0.000 0.839) 2.945 15.944 ( -2.923 0.000 0.341) 2.943 16.992 ( 0.571 0.000 7.626) 7.648 17.306 ( -10.551 0.000 8.207) 13.368 17.336 ( -3.604 0.000 1.716) 3.992 17.542 ( -3.291 0.000 -1.095) 3.468======================= Grid point 77 (27/72) =======================q-point: ( 0.40 0.00 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 80Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.331 ( 22.954 0.000 13.791) 26.778 1.389 ( 24.194 0.000 15.749) 28.868 1.785 ( -20.360 0.000 8.338) 22.001 1.888 ( -23.707 0.000 10.802) 26.052 2.110 ( 9.264 0.000 -16.042) 18.525 2.202 ( 16.643 0.000 -16.939) 23.747 2.340 ( -12.113 0.000 -12.170) 17.171 2.502 ( 35.020 0.000 16.615) 38.762 2.537 ( -11.365 0.000 -11.660) 16.283 2.879 ( 3.655 0.000 8.149) 8.931 2.962 ( -4.200 0.000 5.457) 6.886 3.088 ( 1.147 0.000 -1.682) 2.036 3.101 ( -0.008 0.000 -1.206) 1.206 3.149 ( 11.424 0.000 16.303) 19.907 3.280 ( -27.680 0.000 11.446) 29.953 3.301 ( 5.617 0.000 1.714) 5.873 3.303 ( 0.576 0.000 10.150) 10.167 3.374 ( -1.039 0.000 -0.098) 1.044 3.511 ( 0.900 0.000 -0.921) 1.287 3.536 ( -1.367 0.000 -1.189) 1.812 3.668 ( -0.078 0.000 -0.015) 0.079 3.715 ( -4.431 0.000 0.926) 4.527 4.009 ( 14.088 0.000 -8.951) 16.691 4.281 ( 13.130 0.000 -11.506) 17.458 4.307 ( -4.208 0.000 -14.568) 15.164 4.541 ( -9.797 0.000 -11.844) 15.371 4.763 ( -15.730 0.000 -11.901) 19.725 4.827 ( -16.608 0.000 -17.678) 24.256 5.621 ( 8.287 0.000 19.093) 20.814 5.822 ( -10.124 0.000 12.986) 16.467 6.093 ( 4.955 0.000 -0.190) 4.959 6.122 ( 3.658 0.000 1.439) 3.931 6.207 ( 4.878 0.000 3.560) 6.039 6.271 ( -0.879 0.000 4.654) 4.736 6.654 ( 3.512 0.000 -0.935) 3.635 6.717 ( -1.641 0.000 2.302) 2.827 6.874 ( 6.164 0.000 -2.781) 6.762 7.033 ( -8.393 0.000 -2.348) 8.715 7.295 ( 4.766 0.000 -9.615) 10.731 7.320 ( 1.805 0.000 -6.211) 6.468 8.829 ( 1.133 0.000 0.007) 1.133 8.830 ( 1.108 0.000 -0.023) 1.108 9.140 ( 2.009 0.000 1.889) 2.758 9.166 ( 2.057 0.000 2.186) 3.002 9.184 ( -1.480 0.000 0.089) 1.483 9.190 ( -2.127 0.000 -0.101) 2.130 9.361 ( 3.287 0.000 4.353) 5.455 9.508 ( -8.321 0.000 -1.343) 8.429 9.581 ( 2.899 0.000 0.714) 2.986 9.626 ( 0.297 0.000 -0.491) 0.573 9.696 ( 1.582 0.000 -1.470) 2.159 9.775 ( -4.414 0.000 -4.215) 6.103 10.144 ( 0.325 0.000 4.703) 4.714 10.192 ( -4.294 0.000 3.184) 5.346 10.333 ( 3.503 0.000 7.346) 8.139 10.396 ( -2.369 0.000 6.722) 7.128 11.005 ( 3.471 0.000 -4.864) 5.976 11.084 ( -4.028 0.000 -6.433) 7.590 11.185 ( 1.004 0.000 -0.638) 1.190 11.198 ( 0.864 0.000 -1.036) 1.349 11.670 ( 9.764 0.000 -2.828) 10.166 11.763 ( 8.101 0.000 -1.666) 8.271 11.825 ( -3.118 0.000 -6.499) 7.208 11.964 ( -8.297 0.000 -5.990) 10.233 12.260 ( 1.391 0.000 3.471) 3.740 12.285 ( -0.971 0.000 3.048) 3.199 12.509 ( 0.989 0.000 -1.719) 1.983 12.530 ( -0.993 0.000 -2.023) 2.254 12.924 ( 11.807 0.000 3.607) 12.346 12.998 ( 8.338 0.000 1.851) 8.541 13.337 ( -10.776 0.000 1.647) 10.901 13.380 ( -11.182 0.000 0.525) 11.194 14.267 ( 5.895 0.000 1.063) 5.990 14.344 ( -1.102 0.000 -1.881) 2.180 15.214 ( 1.009 0.000 0.017) 1.009 15.274 ( -4.282 0.000 -0.856) 4.366 15.731 ( 5.118 0.000 -0.426) 5.136 15.793 ( 0.124 0.000 -3.195) 3.197 15.861 ( -1.561 0.000 -1.093) 1.905 15.879 ( -2.661 0.000 -0.860) 2.796 17.019 ( 2.283 0.000 9.164) 9.444 17.099 ( -6.189 0.000 12.407) 13.865 17.383 ( 3.405 0.000 -4.770) 5.861 17.462 ( -4.178 0.000 -3.577) 5.500======================= Grid point 80 (28/72) =======================q-point: ( 0.00 0.07 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.863 ( 0.000 17.868 22.121) 28.436 0.903 ( 0.000 18.902 22.948) 29.730 1.747 ( 0.000 42.148 34.037) 54.175 1.954 ( 0.000 6.672 -17.514) 18.742 2.025 ( 0.000 15.953 -21.592) 26.847 2.585 ( 0.000 13.905 2.944) 14.213 2.700 ( 0.000 6.461 9.692) 11.648 2.763 ( 0.000 0.581 14.353) 14.365 2.884 ( 0.000 16.975 -4.469) 17.553 2.897 ( 0.000 3.739 -1.625) 4.076 2.991 ( 0.000 3.344 -2.782) 4.350 3.003 ( 0.000 13.760 8.012) 15.923 3.203 ( 0.000 14.496 -2.709) 14.747 3.210 ( 0.000 10.345 -3.155) 10.816 3.268 ( 0.000 12.929 -4.802) 13.792 3.273 ( 0.000 3.593 -2.003) 4.113 3.320 ( 0.000 11.871 1.584) 11.976 3.398 ( 0.000 4.193 -7.598) 8.678 3.542 ( 0.000 12.667 -6.688) 14.324 3.705 ( 0.000 17.105 -1.254) 17.151 3.744 ( 0.000 15.571 -8.660) 17.817 3.825 ( 0.000 8.893 -18.458) 20.488 3.961 ( 0.000 5.564 2.500) 6.100 4.208 ( 0.000 2.388 11.974) 12.209 4.872 ( 0.000 -1.062 1.009) 1.465 4.953 ( 0.000 0.297 -9.711) 9.716 5.040 ( 0.000 -5.372 2.924) 6.117 5.316 ( 0.000 0.240 10.763) 10.766 5.530 ( 0.000 -0.649 2.515) 2.597 5.710 ( 0.000 -1.356 7.700) 7.819 5.807 ( 0.000 -3.846 -7.046) 8.028 5.892 ( 0.000 -5.640 6.965) 8.962 6.189 ( 0.000 -4.239 5.132) 6.656 6.287 ( 0.000 -3.928 1.387) 4.166 6.380 ( 0.000 -1.979 1.260) 2.346 6.573 ( 0.000 -2.489 -10.444) 10.736 6.707 ( 0.000 -2.963 0.742) 3.054 6.943 ( 0.000 -4.058 7.591) 8.608 7.000 ( 0.000 -7.841 -4.670) 9.126 7.264 ( 0.000 -6.222 -5.482) 8.292 8.858 ( 0.000 -2.695 2.375) 3.593 8.918 ( 0.000 9.179 -1.154) 9.252 8.944 ( 0.000 10.614 1.255) 10.688 9.070 ( 0.000 -1.435 -1.637) 2.176 9.161 ( 0.000 -5.800 4.980) 7.645 9.282 ( 0.000 2.033 -0.952) 2.245 9.621 ( 0.000 1.694 -0.050) 1.695 9.640 ( 0.000 4.125 -1.542) 4.404 9.699 ( 0.000 5.484 0.595) 5.516 9.717 ( 0.000 6.582 0.114) 6.583 9.915 ( 0.000 15.039 2.845) 15.305 9.941 ( 0.000 5.037 -0.125) 5.039 10.256 ( 0.000 7.016 1.008) 7.088 10.314 ( 0.000 2.417 -0.209) 2.426 10.418 ( 0.000 11.436 5.354) 12.628 10.566 ( 0.000 11.558 6.727) 13.373 10.887 ( 0.000 -3.808 -5.216) 6.458 11.001 ( 0.000 0.888 0.259) 0.925 11.090 ( 0.000 -3.557 -6.928) 7.788 11.130 ( 0.000 -1.207 -5.187) 5.325 11.645 ( 0.000 7.184 -2.624) 7.648 11.742 ( 0.000 23.193 -10.405) 25.420 11.832 ( 0.000 -5.942 6.712) 8.965 12.045 ( 0.000 6.821 -1.384) 6.960 12.373 ( 0.000 2.831 -4.613) 5.413 12.432 ( 0.000 12.178 -3.626) 12.706 12.443 ( 0.000 -2.409 0.978) 2.600 12.591 ( 0.000 4.947 -1.681) 5.225 12.697 ( 0.000 11.112 0.505) 11.123 12.820 ( 0.000 5.909 -3.114) 6.679 13.697 ( 0.000 1.239 1.730) 2.128 13.806 ( 0.000 -0.893 -2.094) 2.276 13.973 ( 0.000 -2.645 4.730) 5.419 14.216 ( 0.000 0.581 -5.981) 6.009 15.302 ( 0.000 -4.260 0.199) 4.265 15.336 ( 0.000 -3.472 -1.680) 3.857 15.475 ( 0.000 -1.469 1.769) 2.300 15.705 ( 0.000 -5.273 -6.680) 8.510 15.924 ( 0.000 -4.677 1.772) 5.002 15.957 ( 0.000 0.100 -1.492) 1.496 16.945 ( 0.000 -4.119 6.753) 7.910 17.248 ( 0.000 -5.822 -3.984) 7.054 17.297 ( 0.000 -19.431 13.516) 23.670 17.488 ( 0.000 -8.411 -0.775) 8.447======================= Grid point 81 (29/72) =======================q-point: ( 0.20 0.07 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.056 ( 16.406 15.361 17.483) 28.475 1.160 ( 20.801 16.588 16.966) 31.555 1.957 ( 15.851 24.612 6.083) 29.900 2.077 ( 15.136 15.249 6.505) 22.449 2.086 ( 5.128 15.862 -18.400) 24.829 2.414 ( -14.569 14.680 3.077) 20.910 2.440 ( -18.248 7.500 6.715) 20.840 2.759 ( -8.802 16.372 -7.825) 20.168 2.798 ( -7.532 0.441 -7.996) 10.994 2.900 ( 8.316 1.673 15.300) 17.494 2.980 ( 0.624 13.002 7.651) 15.099 3.140 ( 5.476 5.561 0.693) 7.835 3.185 ( -0.164 14.051 1.121) 14.097 3.239 ( 1.392 15.029 -1.802) 15.201 3.303 ( 4.198 10.003 -1.392) 10.937 3.318 ( 1.973 12.747 1.915) 13.041 3.417 ( 7.303 3.581 -0.074) 8.134 3.501 ( 4.598 10.364 -3.964) 12.011 3.594 ( 8.230 6.671 -9.601) 14.297 3.688 ( -0.832 14.995 -2.797) 15.277 3.763 ( 0.761 17.628 -2.161) 17.776 3.857 ( 0.521 5.333 -3.907) 6.631 3.958 ( -0.085 8.829 -9.357) 12.865 4.180 ( 0.316 3.347 0.208) 3.368 4.547 ( -23.675 1.118 14.943) 28.019 4.807 ( -11.932 -1.762 -12.533) 17.394 4.985 ( -5.628 -4.349 -13.917) 15.630 5.202 ( -18.115 -0.279 -9.261) 20.347 5.516 ( 1.905 -1.706 18.003) 18.184 5.831 ( 8.197 -3.274 2.838) 9.272 5.894 ( 7.953 -3.437 4.476) 9.752 5.983 ( 5.686 -3.959 7.387) 10.128 6.111 ( -5.427 -3.477 0.647) 6.477 6.223 ( 0.280 -4.714 4.779) 6.719 6.535 ( 6.775 -2.643 -1.972) 7.535 6.619 ( 5.187 -2.715 -5.019) 7.711 6.792 ( -0.141 -6.089 1.474) 6.266 6.966 ( 9.083 -7.992 -2.750) 12.407 7.071 ( 1.561 -7.458 -3.492) 8.382 7.214 ( -2.831 -5.843 -3.874) 7.561 8.862 ( 1.038 0.930 1.551) 2.086 8.934 ( 0.468 10.315 -0.811) 10.357 9.003 ( 3.938 -1.148 0.260) 4.110 9.068 ( 0.093 -0.552 -1.115) 1.248 9.194 ( 4.594 0.230 3.735) 5.926 9.286 ( 0.814 5.015 -0.492) 5.105 9.605 ( -4.601 6.581 0.823) 8.072 9.648 ( -2.413 -1.790 -0.384) 3.029 9.679 ( 2.532 10.260 -0.321) 10.572 9.692 ( -0.011 13.087 -0.399) 13.094 9.875 ( -3.361 12.653 2.448) 13.319 9.934 ( -1.096 7.869 -0.794) 7.985 10.188 ( -5.741 5.219 2.638) 8.195 10.257 ( -5.784 -0.140 1.434) 5.961 10.435 ( 2.551 12.057 4.692) 13.187 10.561 ( 0.569 11.399 5.335) 12.599 10.848 ( -1.433 -5.333 -5.063) 7.492 11.026 ( -1.764 -4.306 -4.433) 6.427 11.122 ( 4.354 -1.739 -1.127) 4.822 11.175 ( 2.907 -1.063 -2.553) 4.012 11.636 ( 1.435 7.965 -1.342) 8.204 11.732 ( -0.023 4.574 -1.040) 4.691 11.894 ( 4.417 8.610 -3.819) 10.403 12.083 ( 0.051 5.728 -4.756) 7.445 12.322 ( -2.528 1.944 0.229) 3.197 12.390 ( -2.700 6.029 1.781) 6.842 12.473 ( 1.612 2.045 -2.585) 3.669 12.590 ( -0.864 4.903 -2.881) 5.752 12.801 ( 9.425 9.118 0.966) 13.149 12.891 ( 6.596 6.379 -1.116) 9.243 13.614 ( -7.487 3.408 1.267) 8.323 13.652 ( -11.306 1.472 1.066) 11.451 14.076 ( 6.855 -4.251 2.455) 8.431 14.265 ( 2.919 -3.227 -5.137) 6.733 15.231 ( -3.640 -1.911 0.066) 4.112 15.317 ( -2.525 -3.687 -1.742) 4.796 15.562 ( 5.882 -3.888 0.466) 7.067 15.719 ( 1.153 -5.216 -5.582) 7.726 15.888 ( -3.293 -3.965 1.348) 5.328 15.915 ( -2.954 -0.511 -0.262) 3.009 16.948 ( 0.406 -4.244 7.216) 8.381 17.164 ( -8.592 -11.634 14.590) 20.543 17.270 ( 1.683 -5.646 -4.442) 7.378 17.458 ( -2.748 -7.934 -1.910) 8.611======================= Grid point 82 (30/72) =======================q-point: ( 0.40 0.07 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.463 ( 22.283 10.402 12.422) 27.551 1.603 ( 21.655 18.297 11.806) 30.710 1.925 ( -21.369 6.954 7.834) 23.798 2.030 ( -19.265 17.772 8.057) 27.420 2.247 ( 12.634 6.919 -18.389) 23.359 2.318 ( 8.573 15.741 -14.629) 23.136 2.535 ( -11.504 15.086 -12.420) 22.676 2.568 ( -12.620 5.893 -14.213) 19.900 2.672 ( 33.581 17.585 19.516) 42.635 3.025 ( 3.071 12.476 7.254) 14.755 3.068 ( 0.979 6.472 8.575) 10.787 3.171 ( 4.772 6.802 9.930) 12.948 3.232 ( 0.862 11.257 2.008) 11.467 3.263 ( 2.460 14.712 1.023) 14.951 3.321 ( -9.303 3.964 11.426) 15.258 3.369 ( -6.315 11.493 7.356) 15.036 3.458 ( 0.028 12.344 2.008) 12.506 3.514 ( -1.357 12.526 -0.055) 12.599 3.649 ( -2.284 6.428 -0.887) 6.879 3.666 ( -2.013 10.847 1.101) 11.087 3.781 ( 0.615 15.980 -0.732) 16.009 3.810 ( -2.596 11.884 1.891) 12.311 4.033 ( 12.173 2.918 -6.312) 14.019 4.287 ( 1.084 0.048 -2.371) 2.607 4.327 ( 6.507 3.395 -24.155) 25.246 4.542 ( -8.080 0.235 -11.023) 13.669 4.725 ( -13.937 -3.136 -11.393) 18.272 4.831 ( -17.262 0.912 -19.044) 25.719 5.606 ( 7.677 -1.335 18.453) 20.030 5.790 ( -9.149 -2.927 12.696) 15.920 6.038 ( 4.596 -5.103 0.494) 6.886 6.072 ( 2.908 -4.631 1.691) 5.724 6.158 ( 4.964 -4.334 3.328) 7.383 6.224 ( -0.807 -4.340 3.842) 5.852 6.625 ( 3.426 -2.676 -0.233) 4.353 6.686 ( -1.821 -2.805 2.800) 4.362 6.823 ( 6.583 -4.886 -2.804) 8.664 6.977 ( -7.469 -5.315 -1.584) 9.302 7.155 ( 6.080 -10.362 -7.137) 13.974 7.211 ( 0.073 -8.733 -4.597) 9.869 8.898 ( 2.065 3.120 0.892) 3.846 8.931 ( -0.923 6.676 0.033) 6.740 9.045 ( 1.100 -5.248 -0.139) 5.364 9.065 ( -0.693 -3.276 -0.773) 3.436 9.338 ( 4.623 11.217 1.104) 12.182 9.364 ( 10.383 6.959 -0.085) 12.499 9.466 ( -7.368 14.443 2.368) 16.385 9.552 ( -7.171 5.619 -1.338) 9.208 9.720 ( 2.657 10.116 0.297) 10.464 9.766 ( 2.709 11.470 -1.174) 11.844 9.804 ( -1.298 7.369 0.418) 7.494 9.884 ( -4.074 9.660 -2.487) 10.775 10.095 ( -1.704 -0.040 4.358) 4.679 10.134 ( -4.905 -0.561 3.459) 6.028 10.506 ( 3.759 11.769 5.259) 13.428 10.563 ( -1.329 12.018 5.779) 13.402 10.866 ( 3.102 -8.389 -6.672) 11.158 10.951 ( -4.601 -7.556 -6.531) 10.997 11.178 ( 1.935 -1.520 1.243) 2.757 11.213 ( -0.579 -0.801 -0.287) 1.029 11.718 ( 6.726 2.908 0.574) 7.350 11.798 ( 2.698 2.040 0.899) 3.500 11.930 ( 0.306 9.844 -7.843) 12.590 12.011 ( -5.514 5.965 -5.135) 9.610 12.307 ( 0.673 2.709 3.158) 4.215 12.338 ( -2.115 4.039 4.145) 6.162 12.510 ( 2.073 2.094 -3.129) 4.297 12.555 ( -2.208 3.408 -3.204) 5.172 13.021 ( 10.020 6.670 1.704) 12.157 13.055 ( 7.527 5.647 1.191) 9.484 13.418 ( -8.947 7.044 1.394) 11.472 13.436 ( -8.991 5.680 0.450) 10.644 14.205 ( 5.387 -5.931 1.139) 8.093 14.281 ( -1.666 -6.078 -1.600) 6.503 15.200 ( 0.769 -1.383 -0.956) 1.849 15.249 ( -3.497 -2.442 -1.763) 4.615 15.669 ( 4.380 -5.784 -0.313) 7.262 15.730 ( -1.065 -6.309 -2.613) 6.911 15.834 ( -0.794 -2.351 -0.106) 2.484 15.858 ( -2.415 -1.540 -0.753) 2.961 16.968 ( 1.763 -4.795 8.630) 10.029 17.029 ( -4.508 -6.380 11.429) 13.844 17.320 ( 3.037 -6.075 -4.733) 8.278 17.389 ( -3.628 -6.922 -3.815) 8.696======================= Grid point 85 (31/72) =======================q-point: ( 0.00 0.13 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.301 ( 0.000 23.880 13.019) 27.198 1.354 ( 0.000 24.277 11.918) 27.044 2.131 ( 0.000 11.505 -16.296) 19.948 2.353 ( 0.000 14.394 -23.939) 27.934 2.708 ( 0.000 40.052 22.777) 46.076 2.757 ( 0.000 6.122 4.932) 7.862 2.810 ( 0.000 10.725 11.289) 15.572 2.946 ( 0.000 9.305 0.699) 9.331 3.066 ( 0.000 6.233 -5.365) 8.224 3.125 ( 0.000 21.216 1.211) 21.251 3.280 ( 0.000 14.428 -7.042) 16.055 3.301 ( 0.000 3.848 3.096) 4.939 3.363 ( 0.000 15.835 8.447) 17.947 3.420 ( 0.000 12.201 -6.678) 13.909 3.498 ( 0.000 13.623 1.491) 13.705 3.578 ( 0.000 20.878 -2.169) 20.991 3.686 ( 0.000 21.631 1.736) 21.701 3.741 ( 0.000 25.737 -2.239) 25.834 3.890 ( 0.000 17.919 -6.118) 18.935 3.935 ( 0.000 5.283 11.831) 12.957 4.074 ( 0.000 17.024 5.457) 17.878 4.171 ( 0.000 25.737 -20.365) 32.819 4.330 ( 0.000 27.126 -10.798) 29.196 4.367 ( 0.000 14.758 7.073) 16.365 4.857 ( 0.000 -0.089 -10.706) 10.706 4.964 ( 0.000 0.755 -11.013) 11.039 4.973 ( 0.000 0.079 13.101) 13.101 5.345 ( 0.000 3.400 11.232) 11.735 5.530 ( 0.000 0.554 3.754) 3.795 5.689 ( 0.000 -0.873 1.273) 1.543 5.706 ( 0.000 -4.692 -2.486) 5.310 5.768 ( 0.000 -5.943 4.250) 7.306 6.068 ( 0.000 -7.455 4.628) 8.775 6.185 ( 0.000 -5.621 0.373) 5.634 6.331 ( 0.000 -2.602 0.078) 2.603 6.507 ( 0.000 -3.699 -8.490) 9.261 6.628 ( 0.000 -4.565 1.104) 4.697 6.815 ( 0.000 -9.398 -2.759) 9.795 6.851 ( 0.000 -4.224 5.058) 6.590 7.105 ( 0.000 -8.865 -4.768) 10.066 8.766 ( 0.000 -5.065 3.594) 6.211 8.927 ( 0.000 -3.042 -2.286) 3.805 8.997 ( 0.000 -6.093 -0.960) 6.168 9.051 ( 0.000 -3.760 -1.835) 4.184 9.384 ( 0.000 20.347 2.328) 20.480 9.484 ( 0.000 13.397 -1.528) 13.484 9.532 ( 0.000 -0.033 0.931) 0.931 9.560 ( 0.000 -4.597 -0.343) 4.609 10.012 ( 0.000 11.464 -1.002) 11.508 10.015 ( 0.000 15.682 -2.350) 15.857 10.071 ( 0.000 11.609 2.713) 11.921 10.269 ( 0.000 15.600 -1.458) 15.668 10.338 ( 0.000 4.921 5.021) 7.031 10.389 ( 0.000 2.434 2.228) 3.300 10.723 ( 0.000 3.949 3.482) 5.265 10.728 ( 0.000 14.571 0.799) 14.593 10.962 ( 0.000 12.451 -1.842) 12.587 11.058 ( 0.000 5.707 0.720) 5.752 11.077 ( 0.000 4.298 -4.555) 6.263 11.091 ( 0.000 -1.459 -2.457) 2.858 11.757 ( 0.000 1.824 4.169) 4.550 11.890 ( 0.000 13.143 4.913) 14.031 11.993 ( 0.000 4.582 -2.116) 5.047 12.233 ( 0.000 7.849 0.792) 7.888 12.410 ( 0.000 0.623 5.132) 5.170 12.436 ( 0.000 6.063 -7.979) 10.021 12.586 ( 0.000 5.597 -6.290) 8.419 12.789 ( 0.000 11.455 -0.713) 11.477 12.929 ( 0.000 11.138 -0.601) 11.155 12.963 ( 0.000 7.696 -5.553) 9.490 13.705 ( 0.000 -1.245 1.181) 1.716 13.770 ( 0.000 -2.455 -1.174) 2.721 13.919 ( 0.000 -1.961 4.796) 5.181 14.178 ( 0.000 -3.729 -5.018) 6.251 15.196 ( 0.000 -5.540 -0.094) 5.541 15.243 ( 0.000 -5.374 -1.725) 5.644 15.432 ( 0.000 -2.444 -2.229) 3.308 15.561 ( 0.000 -8.459 -5.804) 10.259 15.813 ( 0.000 -5.559 4.476) 7.137 15.941 ( 0.000 -1.684 -2.087) 2.682 16.825 ( 0.000 -7.512 5.772) 9.474 16.953 ( 0.000 -14.235 12.586) 19.001 17.096 ( 0.000 -9.608 -4.168) 10.473 17.262 ( 0.000 -13.128 -2.540) 13.372======================= Grid point 86 (32/72) =======================q-point: ( 0.20 0.13 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.453 ( 11.644 22.316 10.037) 27.099 1.521 ( 17.151 19.157 12.187) 28.455 2.205 ( 6.468 11.268 -15.479) 20.209 2.386 ( -0.762 12.288 -16.683) 20.734 2.594 ( -7.405 11.255 -0.749) 13.493 2.781 ( -10.744 12.921 1.514) 16.872 2.834 ( -3.367 12.537 0.837) 13.008 2.882 ( 10.835 35.250 19.396) 41.668 2.969 ( 1.468 10.940 6.994) 13.068 3.175 ( -7.805 18.079 -5.771) 20.520 3.235 ( 3.575 10.703 -0.640) 11.302 3.330 ( 1.327 14.838 8.176) 16.993 3.405 ( 6.027 4.329 0.190) 7.423 3.501 ( 6.036 12.236 -1.375) 13.713 3.612 ( 3.265 19.496 0.674) 19.779 3.645 ( 2.680 13.619 1.104) 13.924 3.692 ( 6.149 17.595 -0.970) 18.663 3.737 ( 0.483 24.077 -0.083) 24.082 3.902 ( 1.175 17.824 -5.297) 18.632 3.937 ( 0.099 8.469 7.606) 11.384 4.051 ( -1.477 16.715 5.384) 17.623 4.228 ( 3.444 25.892 -10.241) 28.056 4.324 ( -1.633 22.051 -2.779) 22.285 4.364 ( 2.952 18.761 -12.816) 22.911 4.630 ( -21.865 9.285 13.107) 27.131 4.766 ( -10.486 -1.619 -11.614) 15.731 4.905 ( -8.332 -2.933 -10.607) 13.804 5.236 ( -14.724 4.191 -10.542) 18.587 5.495 ( 2.815 0.304 16.437) 16.679 5.740 ( 3.941 -5.786 3.707) 7.922 5.820 ( 8.588 -2.808 3.969) 9.868 5.887 ( 4.318 -5.044 7.271) 9.847 6.020 ( -3.752 -5.119 -0.624) 6.377 6.102 ( -0.920 -6.747 2.203) 7.157 6.473 ( 7.256 -3.256 -1.652) 8.123 6.543 ( 4.411 -4.790 -4.091) 7.690 6.649 ( -0.487 -7.042 2.534) 7.500 6.832 ( 4.790 -5.786 -2.366) 7.875 6.901 ( 1.508 -7.917 -0.449) 8.072 7.068 ( -2.774 -8.068 -4.077) 9.456 8.791 ( 2.202 -5.530 3.410) 6.860 8.928 ( -0.399 -4.507 -0.902) 4.614 9.010 ( 1.114 -4.118 -2.049) 4.732 9.047 ( -0.253 -2.091 -1.987) 2.896 9.446 ( 5.798 18.524 1.515) 19.469 9.526 ( 3.819 15.297 -1.424) 15.831 9.570 ( 2.190 -3.907 0.550) 4.512 9.579 ( 3.762 -2.182 0.267) 4.357 9.993 ( -0.984 13.667 -0.277) 13.706 10.018 ( -1.387 17.327 -0.401) 17.387 10.096 ( 1.448 9.689 1.145) 9.864 10.206 ( -6.488 15.407 2.915) 16.969 10.276 ( -4.087 4.021 0.588) 5.764 10.331 ( -5.568 3.345 1.338) 6.632 10.665 ( -3.517 9.553 0.383) 10.187 10.721 ( -1.489 2.370 1.219) 3.053 10.907 ( -2.334 12.050 -1.230) 12.336 11.027 ( -2.800 6.186 -0.280) 6.796 11.128 ( 3.307 4.009 -0.829) 5.262 11.172 ( 5.715 3.106 -1.674) 6.717 11.740 ( -0.781 3.710 3.766) 5.344 11.839 ( -1.392 6.833 0.819) 7.021 12.071 ( 3.942 8.168 0.447) 9.081 12.278 ( 2.473 8.164 -2.866) 8.999 12.380 ( -4.332 6.566 -5.239) 9.451 12.416 ( 0.300 0.904 5.895) 5.972 12.597 ( 0.640 7.311 -5.092) 8.933 12.747 ( -3.157 9.341 -0.769) 9.890 12.982 ( 5.231 8.165 -1.826) 9.868 13.054 ( 7.680 9.082 -1.807) 12.031 13.671 ( -3.785 1.096 0.503) 3.972 13.707 ( -4.721 3.713 0.058) 6.007 13.962 ( 3.396 -6.177 3.077) 7.691 14.160 ( -1.712 -6.394 -3.829) 7.647 15.170 ( -1.653 -3.973 -1.050) 4.429 15.223 ( -1.802 -5.003 -2.266) 5.780 15.469 ( 2.899 -4.594 -1.283) 5.582 15.568 ( 0.462 -8.893 -4.422) 9.943 15.790 ( -1.708 -4.821 4.039) 6.517 15.902 ( -3.383 -1.225 -1.498) 3.897 16.826 ( 0.128 -7.604 6.155) 9.783 16.918 ( -2.812 -12.000 11.490) 16.850 17.111 ( 1.347 -9.843 -4.334) 10.839 17.243 ( -1.753 -12.588 -3.101) 13.082======================= Grid point 87 (33/72) =======================q-point: ( 0.40 0.13 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.748 ( 16.821 17.066 8.490) 25.421 1.953 ( 22.689 15.250 8.551) 28.645 2.110 ( -16.921 11.572 5.429) 21.206 2.380 ( -5.713 12.453 -7.458) 15.599 2.452 ( -4.687 14.184 -3.037) 15.244 2.638 ( -7.988 10.288 -12.477) 18.037 2.712 ( 7.906 13.894 -15.019) 21.934 2.947 ( -11.672 19.054 -11.892) 25.312 3.154 ( 9.939 4.231 13.588) 17.359 3.213 ( 13.643 28.414 12.086) 33.757 3.282 ( 1.764 12.352 7.240) 14.426 3.394 ( 5.213 15.085 9.449) 18.548 3.436 ( -2.916 10.866 7.505) 13.524 3.576 ( -2.485 15.143 -0.077) 15.346 3.638 ( 1.756 19.980 2.879) 20.263 3.707 ( 3.488 19.573 4.728) 20.436 3.749 ( 3.237 15.375 0.307) 15.715 3.810 ( -0.735 15.859 2.273) 16.038 3.872 ( -5.717 17.406 1.066) 18.352 3.932 ( -3.206 17.482 1.756) 17.860 4.100 ( 7.880 11.184 0.360) 13.686 4.242 ( -1.513 24.894 -1.963) 25.017 4.264 ( -3.236 20.353 1.078) 20.637 4.310 ( -3.709 7.370 0.807) 8.291 4.484 ( 0.002 11.025 -16.756) 20.058 4.581 ( -0.708 6.096 -13.375) 14.716 4.676 ( -7.002 0.485 -11.461) 13.440 4.906 ( -16.586 7.859 -20.220) 27.307 5.585 ( 6.079 -0.085 15.538) 16.685 5.724 ( -6.590 -2.804 10.661) 12.843 5.904 ( 3.544 -7.642 2.405) 8.761 5.951 ( 0.724 -6.689 2.370) 7.134 6.054 ( 4.482 -5.367 2.143) 7.313 6.111 ( -0.206 -6.336 2.291) 6.740 6.557 ( 2.787 -3.865 0.257) 4.772 6.609 ( -2.360 -5.031 2.865) 6.252 6.695 ( 8.107 -6.541 -2.070) 10.621 6.844 ( -5.867 -6.798 -0.651) 9.003 6.961 ( 5.296 -8.325 -5.434) 11.264 7.030 ( -1.626 -8.480 -3.987) 9.511 8.845 ( 2.906 -6.177 2.880) 7.409 8.900 ( -2.260 -6.390 1.501) 6.942 9.031 ( 0.864 -0.288 -2.997) 3.132 9.043 ( -0.264 -0.750 -2.474) 2.599 9.567 ( 4.068 8.891 -0.755) 9.807 9.588 ( 1.392 6.854 -1.596) 7.174 9.666 ( 7.261 8.446 1.718) 11.270 9.706 ( 7.132 5.638 -0.324) 9.098 9.922 ( -5.489 10.722 3.711) 12.604 9.971 ( -4.957 13.295 0.851) 14.214 10.053 ( -2.403 14.167 1.477) 14.445 10.085 ( -4.603 9.112 0.394) 10.216 10.220 ( -1.291 8.925 -0.197) 9.020 10.227 ( -2.457 8.800 0.003) 9.137 10.631 ( 0.334 1.068 -1.233) 1.665 10.668 ( -2.894 -1.785 -1.706) 3.804 10.911 ( 2.082 11.659 1.944) 12.002 10.967 ( -3.023 9.390 1.907) 10.047 11.188 ( 3.105 5.500 -0.234) 6.320 11.238 ( -0.466 6.115 -1.467) 6.306 11.777 ( 4.601 2.774 2.407) 5.887 11.841 ( -0.249 2.399 -0.164) 2.418 12.123 ( 1.908 9.388 -1.861) 9.759 12.207 ( -6.587 10.971 -6.102) 14.177 12.374 ( 2.082 4.491 2.978) 5.777 12.409 ( -1.150 3.690 4.345) 5.815 12.617 ( 1.863 7.533 -3.306) 8.434 12.675 ( -3.553 7.770 -2.367) 8.866 13.138 ( 8.086 5.360 1.190) 9.774 13.195 ( 3.872 6.700 0.665) 7.767 13.577 ( -3.336 8.196 -1.265) 8.939 13.604 ( -4.939 9.596 -1.103) 10.848 14.038 ( 3.832 -9.916 1.380) 10.720 14.110 ( -3.097 -10.139 -1.043) 10.653 15.155 ( 0.386 -3.081 -2.310) 3.870 15.181 ( -1.975 -3.904 -2.808) 5.199 15.525 ( 2.375 -7.490 -0.150) 7.859 15.563 ( -1.182 -9.133 -1.208) 9.288 15.777 ( 1.005 -2.914 1.533) 3.443 15.827 ( -3.489 -1.537 -0.591) 3.858 16.835 ( 0.865 -8.056 7.268) 10.885 16.864 ( -2.111 -9.311 9.169) 13.237 17.148 ( 2.241 -10.472 -4.478) 11.608 17.198 ( -2.497 -11.461 -4.056) 12.411======================= Grid point 90 (34/72) =======================q-point: ( 0.00 0.20 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.798 ( 0.000 24.315 7.138) 25.341 1.857 ( 0.000 24.562 4.275) 24.932 2.401 ( 0.000 14.688 -9.407) 17.442 2.614 ( 0.000 12.185 -20.048) 23.461 2.866 ( 0.000 4.815 10.252) 11.326 2.877 ( 0.000 5.583 1.927) 5.907 3.102 ( 0.000 6.231 -2.120) 6.582 3.116 ( 0.000 5.404 -6.456) 8.419 3.364 ( 0.000 5.337 -0.300) 5.346 3.391 ( 0.000 3.420 -8.258) 8.938 3.533 ( 0.000 10.962 6.247) 12.617 3.656 ( 0.000 15.532 11.750) 19.476 3.666 ( 0.000 11.717 6.568) 13.432 3.773 ( 0.000 35.219 5.242) 35.607 3.888 ( 0.000 26.426 1.981) 26.501 3.991 ( 0.000 18.170 -2.117) 18.293 4.072 ( 0.000 10.315 11.130) 15.175 4.157 ( 0.000 10.241 2.157) 10.466 4.195 ( 0.000 23.977 1.291) 24.012 4.281 ( 0.000 25.275 -2.184) 25.369 4.434 ( 0.000 15.866 5.025) 16.643 4.664 ( 0.000 10.961 -3.549) 11.522 4.758 ( 0.000 30.155 -19.409) 35.861 4.892 ( 0.000 5.749 -4.021) 7.016 4.895 ( 0.000 17.190 -10.226) 20.001 5.006 ( 0.000 12.527 -3.501) 13.007 5.155 ( 0.000 18.133 7.513) 19.628 5.487 ( 0.000 10.873 6.211) 12.522 5.502 ( 0.000 -4.816 7.650) 9.040 5.591 ( 0.000 -4.155 -4.474) 6.106 5.722 ( 0.000 3.363 0.550) 3.408 5.757 ( 0.000 5.885 0.290) 5.892 5.904 ( 0.000 -7.322 3.904) 8.298 6.089 ( 0.000 -2.506 -2.859) 3.802 6.274 ( 0.000 -2.736 1.148) 2.967 6.437 ( 0.000 -2.746 -5.334) 5.999 6.546 ( 0.000 -2.460 2.721) 3.668 6.649 ( 0.000 -6.293 -0.747) 6.338 6.792 ( 0.000 -1.459 1.008) 1.773 6.927 ( 0.000 -8.090 -3.382) 8.768 8.660 ( 0.000 -5.355 3.965) 6.663 8.849 ( 0.000 -5.323 -2.928) 6.076 8.887 ( 0.000 -4.217 -2.492) 4.898 8.899 ( 0.000 -9.605 -2.440) 9.910 9.411 ( 0.000 -4.120 1.773) 4.485 9.473 ( 0.000 -2.914 -0.770) 3.014 9.764 ( 0.000 13.245 2.148) 13.418 9.891 ( 0.000 16.064 -2.018) 16.190 10.133 ( 0.000 4.873 -1.526) 5.106 10.203 ( 0.000 4.683 -3.035) 5.581 10.288 ( 0.000 -1.307 7.095) 7.214 10.412 ( 0.000 8.504 2.361) 8.826 10.423 ( 0.000 5.952 -0.432) 5.968 10.612 ( 0.000 12.060 4.410) 12.841 10.862 ( 0.000 6.764 4.201) 7.963 10.988 ( 0.000 13.137 -3.697) 13.647 11.096 ( 0.000 2.683 -3.316) 4.266 11.197 ( 0.000 12.065 -1.003) 12.106 11.259 ( 0.000 11.739 3.398) 12.221 11.286 ( 0.000 13.317 0.086) 13.317 11.840 ( 0.000 5.991 -5.611) 8.208 11.997 ( 0.000 -3.473 -4.709) 5.851 12.201 ( 0.000 16.009 6.654) 17.336 12.318 ( 0.000 1.831 2.888) 3.419 12.459 ( 0.000 6.869 14.006) 15.600 12.686 ( 0.000 14.843 -7.180) 16.488 12.739 ( 0.000 9.976 -4.027) 10.758 12.981 ( 0.000 7.219 1.662) 7.408 13.127 ( 0.000 8.421 -10.299) 13.303 13.158 ( 0.000 11.625 -0.275) 11.628 13.627 ( 0.000 -6.299 2.999) 6.976 13.718 ( 0.000 -2.353 -1.873) 3.007 13.923 ( 0.000 2.912 3.438) 4.505 14.098 ( 0.000 -3.376 -3.228) 4.671 15.100 ( 0.000 -3.709 -0.740) 3.782 15.131 ( 0.000 -5.306 -0.371) 5.319 15.384 ( 0.000 -8.330 -5.033) 9.732 15.389 ( 0.000 -1.500 -6.567) 6.736 15.718 ( 0.000 -3.458 7.279) 8.059 15.890 ( 0.000 -3.249 -0.271) 3.260 16.647 ( 0.000 -9.841 4.541) 10.838 16.690 ( 0.000 -11.960 8.522) 14.686 16.872 ( 0.000 -12.138 -3.556) 12.648 16.978 ( 0.000 -14.298 -3.198) 14.651======================= Grid point 91 (35/72) =======================q-point: ( 0.20 0.20 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.917 ( 10.649 21.933 6.212) 25.160 1.938 ( 8.357 22.180 5.382) 24.305 2.463 ( 4.762 13.581 -8.892) 16.917 2.620 ( -2.822 11.763 -12.896) 17.681 2.805 ( -0.536 9.026 -4.482) 10.092 2.892 ( -1.285 4.813 -0.131) 4.983 3.006 ( -5.370 6.239 2.759) 8.682 3.151 ( -1.887 9.848 2.246) 10.275 3.335 ( 2.517 2.559 1.881) 4.053 3.426 ( -3.390 8.933 -6.019) 11.292 3.541 ( 3.743 5.873 -0.555) 6.987 3.645 ( 0.451 12.046 11.720) 16.813 3.714 ( 1.703 9.516 -1.034) 9.722 3.791 ( 2.430 24.049 4.361) 24.562 3.900 ( 3.965 29.367 5.549) 30.149 4.055 ( 4.077 18.370 0.935) 18.840 4.117 ( 1.963 17.342 4.116) 17.931 4.137 ( -0.613 16.156 5.226) 16.991 4.182 ( 0.363 14.008 3.357) 14.409 4.282 ( 0.008 23.367 -0.787) 23.380 4.415 ( -2.295 15.560 3.611) 16.138 4.663 ( -0.552 15.169 -4.747) 15.904 4.778 ( -9.412 8.448 -0.269) 12.650 4.806 ( 3.385 26.513 -15.438) 30.866 4.842 ( -6.410 7.826 -9.166) 13.651 4.949 ( -2.975 21.703 -5.014) 22.473 5.016 ( -10.095 24.993 4.084) 27.262 5.390 ( -9.331 10.534 -9.104) 16.760 5.554 ( 3.169 5.409 9.479) 11.364 5.604 ( 5.085 -6.084 4.307) 9.023 5.798 ( 1.299 -3.315 6.617) 7.515 5.822 ( 3.236 3.823 2.036) 5.407 5.915 ( 4.053 -5.247 -1.058) 6.714 5.990 ( -5.872 -1.824 -1.433) 6.314 6.383 ( 6.783 -6.353 -0.418) 9.303 6.445 ( 0.853 -3.340 -2.684) 4.369 6.551 ( 0.821 -1.715 3.266) 3.779 6.709 ( 5.030 -5.662 -2.887) 8.105 6.796 ( -0.414 -2.561 0.230) 2.605 6.906 ( -1.663 -7.320 -3.268) 8.187 8.671 ( 1.161 -6.072 4.338) 7.552 8.818 ( -2.865 -6.642 -0.699) 7.267 8.909 ( 3.857 -5.402 -2.744) 7.182 8.960 ( 3.026 -5.390 -4.222) 7.486 9.442 ( 3.216 -5.267 1.371) 6.322 9.488 ( 2.271 -3.095 -0.519) 3.874 9.802 ( 3.102 11.767 1.366) 12.245 9.885 ( -1.336 12.437 -1.174) 12.563 10.178 ( 3.254 5.941 -1.210) 6.881 10.219 ( 0.768 4.071 -0.526) 4.176 10.264 ( -0.675 -0.054 4.917) 4.963 10.361 ( -5.192 9.454 1.830) 10.940 10.380 ( -4.496 3.442 -0.886) 5.731 10.500 ( -7.243 11.860 2.960) 14.209 10.802 ( -4.660 7.978 2.455) 9.560 10.938 ( -4.937 14.061 -2.806) 15.165 11.076 ( -0.287 6.321 1.351) 6.470 11.209 ( -1.825 10.779 3.733) 11.552 11.333 ( 6.134 12.776 -3.554) 14.611 11.362 ( 7.362 14.287 -0.093) 16.072 11.830 ( -1.046 5.258 -4.603) 7.066 11.931 ( -3.537 0.986 -2.454) 4.417 12.263 ( 4.360 10.594 3.055) 11.856 12.378 ( 4.524 3.711 2.304) 6.289 12.482 ( 1.937 6.924 9.872) 12.213 12.581 ( -6.526 11.410 -3.927) 13.719 12.791 ( 0.453 10.789 -4.159) 11.571 12.928 ( -3.335 8.394 2.139) 9.282 13.143 ( 2.594 8.103 -4.529) 9.639 13.249 ( 5.827 10.013 -1.127) 11.640 13.633 ( 1.783 -4.850 0.052) 5.168 13.728 ( 0.800 -3.650 -1.983) 4.231 13.913 ( -1.086 3.865 2.386) 4.670 14.047 ( -4.968 -3.781 -2.694) 6.800 15.090 ( -0.652 -3.369 -1.166) 3.624 15.123 ( -0.809 -4.816 -0.849) 4.956 15.384 ( -0.011 -7.335 -3.731) 8.229 15.398 ( 0.487 -3.515 -4.562) 5.780 15.709 ( -0.377 -2.888 6.202) 6.851 15.861 ( -2.671 -2.705 -0.367) 3.819 16.647 ( 0.048 -9.789 4.858) 10.928 16.681 ( -0.754 -11.213 7.942) 13.762 16.883 ( 0.984 -12.265 -3.697) 12.848 16.969 ( -0.921 -13.932 -3.416) 14.374======================= Grid point 92 (36/72) =======================q-point: ( 0.40 0.20 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.127 ( 11.426 19.531 4.601) 23.090 2.248 ( 18.536 14.303 5.527) 24.057 2.379 ( -11.463 14.323 2.266) 18.485 2.610 ( -5.240 10.864 -7.293) 14.095 2.712 ( -5.634 11.554 -2.415) 13.079 2.834 ( -8.192 9.630 -5.049) 13.614 2.965 ( 12.519 9.803 -11.854) 19.833 3.240 ( -7.562 7.434 1.031) 10.655 3.256 ( 3.144 8.860 -1.169) 9.474 3.376 ( -1.403 3.871 5.550) 6.911 3.595 ( 1.149 5.775 3.939) 7.084 3.627 ( -2.002 9.313 5.552) 11.025 3.836 ( 8.675 9.321 -1.648) 12.840 3.862 ( 4.265 14.282 0.658) 14.919 3.974 ( 0.466 15.828 0.753) 15.853 4.076 ( -4.975 10.696 -1.083) 11.846 4.157 ( 6.054 25.705 6.704) 27.246 4.171 ( 2.039 17.915 5.318) 18.799 4.235 ( 2.876 15.842 -0.183) 16.102 4.280 ( 0.211 19.314 0.539) 19.323 4.383 ( 1.948 14.723 3.756) 15.319 4.544 ( -12.345 19.333 5.950) 23.697 4.600 ( -3.217 16.049 0.631) 16.381 4.675 ( -8.189 11.862 -3.790) 14.904 4.854 ( -1.201 26.924 -1.758) 27.008 4.860 ( -1.763 24.919 -3.883) 25.281 4.994 ( 7.299 24.188 -17.436) 30.698 5.183 ( -10.312 18.485 -14.218) 25.499 5.630 ( 4.115 3.926 8.243) 10.015 5.699 ( 0.310 0.323 4.816) 4.836 5.754 ( 0.983 -5.310 4.527) 7.046 5.840 ( -4.179 -2.122 1.473) 4.913 5.960 ( 3.307 -2.986 1.322) 4.648 5.991 ( 1.227 -4.556 1.491) 4.949 6.462 ( 1.069 -6.929 0.638) 7.040 6.468 ( 0.787 -6.210 -0.327) 6.268 6.618 ( 5.786 -0.823 1.004) 5.930 6.736 ( -4.779 -3.313 -0.948) 5.892 6.816 ( 4.140 -5.843 -3.294) 7.882 6.875 ( -1.699 -6.476 -3.453) 7.533 8.707 ( 2.303 -6.986 4.051) 8.397 8.760 ( -2.788 -7.235 2.127) 8.040 8.983 ( 2.511 -3.781 -4.019) 6.063 9.000 ( 0.701 -3.593 -4.647) 5.916 9.545 ( 6.249 -5.380 0.902) 8.295 9.578 ( 4.917 -2.532 -0.176) 5.533 9.811 ( -4.277 -0.545 0.653) 4.361 9.828 ( -2.736 2.349 0.104) 3.608 10.202 ( -0.560 14.150 3.463) 14.578 10.214 ( -3.291 11.874 3.752) 12.880 10.246 ( 1.859 4.388 -1.543) 5.009 10.299 ( -2.466 5.366 -1.252) 6.037 10.320 ( 3.152 4.716 -0.001) 5.673 10.398 ( -3.962 9.377 0.092) 10.180 10.732 ( -0.828 9.517 0.561) 9.569 10.800 ( -6.866 13.163 -2.049) 14.987 11.100 ( 2.362 8.372 6.008) 10.572 11.157 ( -2.918 10.020 6.288) 12.184 11.443 ( 4.584 15.471 -5.248) 16.967 11.487 ( 1.960 15.769 -4.432) 16.497 11.829 ( 2.586 2.655 -2.373) 4.401 11.891 ( -1.784 2.795 -3.349) 4.712 12.338 ( 3.084 12.024 3.063) 12.785 12.426 ( -5.113 10.887 -0.494) 12.037 12.486 ( 2.489 5.905 2.150) 6.759 12.512 ( 0.323 6.760 3.001) 7.403 12.777 ( 0.735 6.998 -0.647) 7.066 12.847 ( -4.836 8.772 -1.005) 10.067 13.243 ( 5.768 4.774 1.860) 7.715 13.313 ( -0.295 4.531 2.090) 4.998 13.720 ( 5.856 4.682 -4.558) 8.774 13.763 ( 2.623 0.547 -3.699) 4.567 13.869 ( -2.952 -0.124 0.576) 3.010 13.914 ( -6.953 -6.981 -1.153) 9.920 15.086 ( 0.386 -3.217 -1.623) 3.624 15.102 ( -1.059 -3.806 -1.544) 4.241 15.386 ( 0.347 -6.795 -1.094) 6.891 15.397 ( -0.532 -5.473 -1.194) 5.627 15.726 ( 2.276 -1.968 2.735) 4.066 15.792 ( -3.748 -1.921 0.165) 4.215 16.651 ( 0.423 -9.758 5.638) 11.278 16.664 ( -0.822 -10.154 6.749) 12.220 16.910 ( 1.581 -12.608 -3.877) 13.286 16.943 ( -1.547 -13.199 -3.779) 13.816======================= Grid point 95 (37/72) =======================q-point: ( 0.00 0.27 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.269 ( 0.000 21.626 2.958) 21.827 2.333 ( 0.000 21.824 -0.867) 21.841 2.709 ( 0.000 15.027 -2.765) 15.280 2.872 ( 0.000 13.322 -12.939) 18.572 2.972 ( 0.000 5.390 6.672) 8.577 2.981 ( 0.000 4.667 -0.706) 4.720 3.186 ( 0.000 2.307 0.212) 2.317 3.227 ( 0.000 5.398 -7.666) 9.376 3.479 ( 0.000 5.531 -3.714) 6.662 3.516 ( 0.000 8.055 1.424) 8.180 3.637 ( 0.000 3.980 5.793) 7.028 3.771 ( 0.000 2.899 4.476) 5.333 3.956 ( 0.000 11.523 10.122) 15.337 4.113 ( 0.000 5.235 -1.434) 5.428 4.221 ( 0.000 4.560 4.279) 6.253 4.256 ( 0.000 6.310 4.852) 7.960 4.264 ( 0.000 7.851 -1.239) 7.948 4.542 ( 0.000 2.698 -3.088) 4.100 4.655 ( 0.000 18.390 2.519) 18.562 4.693 ( 0.000 19.179 2.019) 19.285 4.793 ( 0.000 29.471 3.417) 29.669 4.888 ( 0.000 13.531 -7.815) 15.626 4.911 ( 0.000 -2.601 -5.957) 6.500 5.108 ( 0.000 10.766 6.231) 12.439 5.314 ( 0.000 21.015 -10.818) 23.635 5.399 ( 0.000 -0.030 8.053) 8.053 5.461 ( 0.000 13.384 -6.929) 15.071 5.561 ( 0.000 17.934 2.993) 18.182 5.604 ( 0.000 4.202 -2.751) 5.022 5.704 ( 0.000 10.118 4.011) 10.884 5.790 ( 0.000 6.028 -4.633) 7.603 5.822 ( 0.000 3.788 0.761) 3.863 6.002 ( 0.000 14.525 2.480) 14.735 6.179 ( 0.000 12.705 -5.733) 13.938 6.305 ( 0.000 9.135 3.342) 9.727 6.426 ( 0.000 2.283 -3.052) 3.812 6.554 ( 0.000 3.166 1.681) 3.584 6.594 ( 0.000 2.198 1.664) 2.756 6.788 ( 0.000 0.906 -1.026) 1.369 6.796 ( 0.000 -4.428 -1.166) 4.579 8.549 ( 0.000 -5.537 3.639) 6.626 8.690 ( 0.000 -10.494 0.231) 10.497 8.723 ( 0.000 -6.730 -2.475) 7.170 8.801 ( 0.000 -4.937 -3.960) 6.329 9.362 ( 0.000 -0.511 2.087) 2.149 9.450 ( 0.000 0.897 -1.394) 1.657 9.885 ( 0.000 0.879 3.185) 3.304 10.100 ( 0.000 5.293 -3.013) 6.091 10.162 ( 0.000 -2.577 3.164) 4.080 10.269 ( 0.000 0.091 -3.199) 3.200 10.302 ( 0.000 4.834 3.679) 6.075 10.500 ( 0.000 2.547 0.366) 2.573 10.563 ( 0.000 5.233 -0.480) 5.255 10.816 ( 0.000 8.697 -2.207) 8.973 10.924 ( 0.000 -0.574 14.347) 14.358 11.107 ( 0.000 0.487 6.371) 6.390 11.290 ( 0.000 11.910 -7.773) 14.222 11.409 ( 0.000 6.207 -4.911) 7.914 11.539 ( 0.000 15.984 0.041) 15.984 11.557 ( 0.000 11.693 0.952) 11.731 11.895 ( 0.000 -4.372 -7.192) 8.416 11.992 ( 0.000 9.352 -10.815) 14.297 12.343 ( 0.000 1.309 1.500) 1.991 12.487 ( 0.000 10.998 1.267) 11.071 12.684 ( 0.000 13.604 15.880) 20.910 12.959 ( 0.000 8.319 -1.508) 8.454 12.985 ( 0.000 13.969 0.149) 13.970 13.087 ( 0.000 3.115 4.616) 5.569 13.287 ( 0.000 7.139 -5.208) 8.837 13.400 ( 0.000 11.816 -2.461) 12.070 13.536 ( 0.000 1.887 2.528) 3.154 13.688 ( 0.000 -0.119 -3.572) 3.574 14.039 ( 0.000 8.075 0.356) 8.082 14.063 ( 0.000 0.168 -1.782) 1.790 15.023 ( 0.000 -4.856 0.740) 4.913 15.039 ( 0.000 -3.574 0.484) 3.606 15.253 ( 0.000 -3.737 -5.321) 6.502 15.372 ( 0.000 -0.331 -9.499) 9.505 15.676 ( 0.000 -0.843 7.829) 7.874 15.815 ( 0.000 -3.920 2.399) 4.596 16.434 ( 0.000 -10.781 3.278) 11.269 16.465 ( 0.000 -10.075 5.326) 11.396 16.616 ( 0.000 -12.787 -2.671) 13.063 16.696 ( 0.000 -13.130 -2.843) 13.434======================= Grid point 96 (38/72) =======================q-point: ( 0.20 0.27 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.335 ( 6.701 19.449 3.031) 20.793 2.389 ( 5.009 20.927 0.235) 21.519 2.735 ( 1.297 12.810 -3.371) 13.310 2.876 ( -1.139 13.075 -9.287) 16.078 2.950 ( 0.129 5.503 -1.649) 5.746 3.013 ( 2.345 6.664 0.608) 7.090 3.112 ( -4.745 4.389 0.521) 6.485 3.332 ( 5.657 6.022 -2.850) 8.740 3.390 ( -2.760 5.509 2.834) 6.782 3.584 ( -0.898 6.285 -2.789) 6.934 3.637 ( 1.978 5.109 -0.731) 5.527 3.764 ( -1.352 3.551 8.393) 9.213 3.877 ( -1.427 5.341 5.348) 7.692 4.037 ( -6.091 7.320 -6.119) 11.319 4.219 ( 1.357 3.075 10.045) 10.592 4.289 ( -0.331 5.102 -4.297) 6.679 4.358 ( 3.651 7.454 1.399) 8.417 4.479 ( -3.256 8.979 4.428) 10.528 4.554 ( -4.792 7.983 1.563) 9.441 4.745 ( 0.792 23.798 5.983) 24.552 4.788 ( -3.008 15.897 -2.244) 16.334 4.887 ( 1.217 19.281 0.825) 19.337 4.959 ( 6.831 8.876 -8.438) 14.023 5.077 ( -3.360 15.059 4.257) 16.005 5.303 ( -0.141 14.471 -6.421) 15.832 5.398 ( -2.256 16.715 -7.858) 18.608 5.465 ( 0.007 4.456 3.003) 5.374 5.525 ( -1.724 16.433 3.441) 16.878 5.613 ( 0.454 8.010 -2.256) 8.334 5.720 ( 0.862 4.478 5.560) 7.191 5.800 ( 1.766 8.807 -5.625) 10.598 5.881 ( 3.884 3.904 0.130) 5.508 5.992 ( -0.169 13.816 1.899) 13.947 6.123 ( -4.437 14.857 -4.436) 16.127 6.321 ( 1.514 4.294 3.245) 5.591 6.429 ( -0.104 2.993 -1.975) 3.587 6.584 ( 2.632 4.417 1.378) 5.324 6.641 ( 3.928 -0.061 -0.040) 3.929 6.770 ( -1.666 -1.006 -0.705) 2.070 6.796 ( -0.178 -2.264 -1.528) 2.738 8.548 ( 0.351 -5.875 4.366) 7.328 8.657 ( -2.239 -8.815 0.905) 9.140 8.791 ( 5.164 -6.287 -3.118) 8.713 8.843 ( 3.363 -6.151 -4.558) 8.362 9.367 ( 1.233 -1.846 2.040) 3.015 9.457 ( 1.481 0.264 -1.412) 2.063 9.921 ( 1.595 2.115 2.647) 3.745 9.985 ( -11.521 -0.722 1.878) 11.696 10.190 ( 0.973 -2.727 -0.363) 2.918 10.218 ( -1.497 -2.838 -1.454) 3.523 10.336 ( 3.326 5.333 0.698) 6.324 10.476 ( -2.367 4.824 0.690) 5.418 10.546 ( -0.507 8.199 0.484) 8.229 10.725 ( -6.527 10.020 -1.298) 12.028 10.897 ( -2.298 0.690 12.227) 12.460 11.122 ( 0.215 3.249 8.113) 8.742 11.266 ( -1.699 11.162 -8.403) 14.075 11.474 ( 1.133 13.301 -1.439) 13.427 11.542 ( 1.977 4.858 -5.586) 7.662 11.659 ( 9.070 14.750 -0.876) 17.338 11.877 ( -0.886 -0.095 -5.417) 5.490 12.013 ( 1.729 10.046 -7.516) 12.665 12.380 ( 5.185 1.048 0.304) 5.298 12.511 ( 1.787 8.040 -0.305) 8.242 12.699 ( 1.658 13.367 12.894) 18.646 12.834 ( -7.636 11.777 3.681) 14.511 12.963 ( -5.299 5.390 -0.631) 7.585 13.111 ( 1.212 9.713 2.356) 10.068 13.301 ( 0.004 6.178 -2.134) 6.537 13.398 ( -4.709 1.038 1.522) 5.057 13.584 ( 9.671 6.029 -2.143) 11.596 13.664 ( -1.046 0.716 -2.952) 3.212 14.014 ( -4.206 1.392 -1.604) 4.712 14.062 ( 0.370 8.177 -2.025) 8.432 15.022 ( -0.099 -4.359 0.592) 4.400 15.035 ( -0.370 -3.552 0.380) 3.591 15.257 ( 0.685 -3.439 -3.875) 5.226 15.371 ( -0.479 -0.053 -7.465) 7.480 15.673 ( 0.129 -0.796 6.478) 6.528 15.797 ( -1.741 -3.454 1.860) 4.292 16.438 ( 0.378 -10.440 3.464) 11.006 16.465 ( -0.062 -9.923 5.161) 11.185 16.625 ( 0.898 -12.752 -2.816) 13.090 16.692 ( -0.467 -12.980 -2.922) 13.313======================= Grid point 97 (39/72) =======================q-point: ( 0.40 0.27 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.515 ( 7.027 18.071 1.346) 19.436 2.538 ( 12.408 13.993 2.813) 18.912 2.670 ( -6.523 13.790 -0.282) 15.258 2.812 ( -10.432 8.862 -2.262) 13.873 2.942 ( 1.842 10.653 -3.606) 11.397 3.013 ( -3.639 7.768 0.795) 8.614 3.127 ( 10.227 6.497 -7.382) 14.188 3.351 ( -6.735 3.781 1.069) 7.797 3.429 ( 2.868 7.947 -2.408) 8.786 3.489 ( -2.498 8.137 -0.650) 8.537 3.682 ( 2.241 3.963 3.036) 5.472 3.742 ( -2.463 3.450 2.582) 4.963 3.928 ( 6.310 2.450 0.349) 6.778 4.039 ( 7.208 4.659 -3.928) 9.439 4.143 ( -10.762 0.917 -2.069) 10.997 4.209 ( -6.870 4.176 -1.251) 8.136 4.347 ( 2.837 5.473 8.130) 10.203 4.446 ( -5.418 4.654 4.128) 8.249 4.566 ( 6.407 13.170 4.371) 15.284 4.685 ( -5.230 15.699 1.311) 16.599 4.800 ( 4.210 17.899 2.493) 18.555 4.901 ( -3.665 18.817 2.444) 19.326 5.047 ( 3.548 26.415 4.338) 27.003 5.086 ( 3.124 17.524 -3.807) 18.203 5.277 ( -1.111 11.242 -6.816) 13.194 5.348 ( -7.194 18.282 -3.017) 19.876 5.419 ( 4.091 16.113 -5.067) 17.379 5.508 ( -3.260 10.418 -1.075) 10.969 5.650 ( 3.220 5.627 2.573) 6.975 5.708 ( -2.039 2.453 4.963) 5.900 5.865 ( 4.185 11.090 -5.416) 13.032 5.927 ( -0.458 6.035 -3.022) 6.764 6.007 ( 1.187 11.059 1.996) 11.300 6.039 ( -2.844 14.042 -0.281) 14.330 6.364 ( 2.542 1.606 2.006) 3.615 6.411 ( -1.744 2.076 0.018) 2.712 6.649 ( 3.433 3.455 0.407) 4.888 6.707 ( -0.486 -0.091 -1.606) 1.680 6.737 ( 1.027 -1.233 -0.164) 1.613 6.780 ( -1.576 -2.440 -1.743) 3.388 8.569 ( 1.640 -6.418 4.470) 7.991 8.610 ( -2.264 -7.340 2.985) 8.241 8.885 ( 3.098 -5.833 -4.761) 8.142 8.901 ( 1.451 -6.105 -5.142) 8.113 9.450 ( 7.246 -3.374 2.268) 8.308 9.537 ( 4.938 -1.071 -0.799) 5.116 9.730 ( -9.825 -4.853 2.080) 11.154 9.817 ( -11.039 -2.295 -0.888) 11.310 10.195 ( 4.593 -3.386 1.298) 5.852 10.273 ( -0.315 -0.691 3.578) 3.657 10.413 ( 3.036 5.071 -3.913) 7.088 10.434 ( -0.102 5.921 3.158) 6.711 10.556 ( 0.799 11.014 1.400) 11.131 10.608 ( -4.639 10.602 -0.372) 11.579 10.883 ( 2.988 4.252 5.880) 7.847 11.028 ( -8.840 7.488 3.316) 12.051 11.286 ( 3.911 8.884 -0.218) 9.709 11.388 ( -5.589 10.018 1.423) 11.560 11.670 ( 6.476 6.560 -9.046) 12.915 11.759 ( -1.418 8.865 -8.562) 12.406 11.938 ( 7.168 10.558 -0.914) 12.794 12.033 ( -0.969 11.933 -4.047) 12.638 12.546 ( 7.632 1.995 0.028) 7.889 12.577 ( 6.240 9.614 0.892) 11.496 12.671 ( -6.728 9.087 3.914) 11.965 12.703 ( -3.483 12.286 7.103) 14.613 12.883 ( 0.370 4.047 1.799) 4.444 13.015 ( -9.869 7.304 -1.474) 12.366 13.290 ( 1.357 -1.130 4.221) 4.575 13.335 ( -2.329 -1.962 2.764) 4.113 13.708 ( 5.695 2.291 -0.582) 6.166 13.795 ( 5.340 5.667 -0.698) 7.818 13.910 ( -2.039 4.652 -5.396) 7.410 14.018 ( -5.191 8.878 -5.578) 11.700 15.022 ( 0.129 -3.765 0.374) 3.786 15.027 ( -0.369 -3.633 0.276) 3.662 15.288 ( 2.318 -1.898 -1.928) 3.562 15.341 ( -2.423 -0.327 -3.273) 4.085 15.696 ( 2.121 -1.153 3.182) 3.994 15.749 ( -2.767 -2.273 1.468) 3.870 16.449 ( 0.597 -9.899 3.982) 10.686 16.460 ( -0.447 -9.708 4.653) 10.775 16.649 ( 1.375 -12.685 -3.019) 13.112 16.676 ( -1.109 -12.743 -3.043) 13.148======================= Grid point 100 (40/72) =======================q-point: ( 0.00 0.33 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.665 ( 0.000 17.260 0.220) 17.262 2.729 ( 0.000 16.906 -3.494) 17.263 2.987 ( 0.000 11.483 1.373) 11.564 3.067 ( 0.000 3.808 -1.663) 4.155 3.076 ( 0.000 4.845 3.725) 6.111 3.142 ( 0.000 12.439 -7.062) 14.304 3.215 ( 0.000 0.899 1.142) 1.454 3.326 ( 0.000 4.162 -7.272) 8.379 3.617 ( 0.000 3.425 10.427) 10.975 3.622 ( 0.000 8.551 -0.448) 8.563 3.777 ( 0.000 7.884 -1.224) 7.978 3.821 ( 0.000 2.465 3.464) 4.251 4.131 ( 0.000 -1.176 1.460) 1.874 4.143 ( 0.000 8.112 6.666) 10.500 4.269 ( 0.000 0.553 -0.368) 0.664 4.315 ( 0.000 -0.561 2.184) 2.255 4.319 ( 0.000 -1.243 -1.225) 1.745 4.568 ( 0.000 1.495 -2.435) 2.857 4.773 ( 0.000 -4.605 -7.003) 8.381 4.817 ( 0.000 -3.292 -1.374) 3.567 4.889 ( 0.000 0.910 -0.388) 0.990 4.977 ( 0.000 -3.675 1.345) 3.913 5.225 ( 0.000 7.618 7.039) 10.372 5.392 ( 0.000 11.187 -4.659) 12.119 5.459 ( 0.000 -3.944 -4.131) 5.711 5.566 ( 0.000 0.024 -2.518) 2.518 5.629 ( 0.000 21.753 1.574) 21.810 5.717 ( 0.000 11.943 -1.324) 12.016 5.907 ( 0.000 9.405 6.532) 11.451 5.935 ( 0.000 17.893 3.367) 18.207 5.937 ( 0.000 12.685 -0.046) 12.686 6.154 ( 0.000 21.797 -3.278) 22.042 6.380 ( 0.000 18.858 -0.415) 18.863 6.466 ( 0.000 7.212 0.428) 7.224 6.542 ( 0.000 13.888 -6.347) 15.269 6.596 ( 0.000 15.208 -1.474) 15.279 6.666 ( 0.000 7.945 1.222) 8.038 6.738 ( 0.000 2.495 -0.336) 2.517 6.792 ( 0.000 11.716 3.047) 12.105 6.834 ( 0.000 4.355 0.094) 4.356 8.439 ( 0.000 -5.215 2.511) 5.788 8.492 ( 0.000 -8.447 3.208) 9.035 8.581 ( 0.000 -7.085 -2.348) 7.464 8.680 ( 0.000 -6.820 -3.886) 7.850 9.392 ( 0.000 3.306 2.396) 4.083 9.509 ( 0.000 4.642 -2.142) 5.113 9.891 ( 0.000 0.850 5.301) 5.369 10.119 ( 0.000 -1.201 3.614) 3.808 10.136 ( 0.000 -1.301 -0.355) 1.348 10.198 ( 0.000 -6.192 -2.714) 6.760 10.400 ( 0.000 4.491 -1.867) 4.863 10.534 ( 0.000 0.479 2.410) 2.457 10.656 ( 0.000 4.673 -1.364) 4.868 10.869 ( 0.000 -3.884 15.646) 16.121 10.896 ( 0.000 -1.262 -7.253) 7.362 11.164 ( 0.000 6.023 5.524) 8.172 11.452 ( 0.000 -0.697 -5.928) 5.969 11.453 ( 0.000 3.976 -0.727) 4.042 11.588 ( 0.000 -7.288 -6.655) 9.870 11.833 ( 0.000 11.071 -2.738) 11.405 11.986 ( 0.000 11.545 -1.863) 11.695 12.188 ( 0.000 7.994 -14.004) 16.125 12.375 ( 0.000 1.648 -2.975) 3.401 12.615 ( 0.000 0.388 -7.736) 7.745 12.950 ( 0.000 -2.410 13.951) 14.158 12.961 ( 0.000 12.925 14.220) 19.217 13.172 ( 0.000 5.200 6.600) 8.403 13.225 ( 0.000 8.888 8.222) 12.108 13.511 ( 0.000 13.831 -2.353) 14.030 13.603 ( 0.000 7.082 -9.043) 11.486 13.712 ( 0.000 11.781 -0.801) 11.809 13.760 ( 0.000 8.668 -1.634) 8.820 14.100 ( 0.000 3.085 0.367) 3.107 14.228 ( 0.000 10.069 -3.019) 10.511 14.889 ( 0.000 -7.800 1.607) 7.964 14.986 ( 0.000 -1.879 -1.309) 2.290 15.233 ( 0.000 0.986 -3.138) 3.289 15.365 ( 0.000 -0.620 -9.000) 9.021 15.675 ( 0.000 0.522 5.787) 5.810 15.741 ( 0.000 -3.047 4.414) 5.363 16.222 ( 0.000 -9.723 2.156) 9.959 16.285 ( 0.000 -7.619 2.334) 7.968 16.366 ( 0.000 -11.378 -1.339) 11.456 16.454 ( 0.000 -10.539 -2.093) 10.745======================= Grid point 101 (41/72) =======================q-point: ( 0.20 0.33 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.699 ( 3.437 16.198 0.396) 16.563 2.765 ( 3.260 15.788 -2.822) 16.366 2.974 ( -1.499 10.268 -0.519) 10.390 3.046 ( -0.348 4.422 -0.756) 4.499 3.095 ( -0.186 5.874 1.856) 6.163 3.163 ( 1.891 9.340 -5.979) 11.250 3.185 ( -2.295 2.814 1.356) 3.876 3.389 ( 3.923 1.508 -4.644) 6.263 3.565 ( -0.224 9.460 3.638) 10.137 3.683 ( 1.495 4.217 0.522) 4.504 3.757 ( 0.294 6.333 2.390) 6.775 3.866 ( -0.250 6.298 1.652) 6.516 3.954 ( -4.753 3.417 4.440) 7.347 4.132 ( -6.406 2.384 -6.622) 9.517 4.237 ( 0.676 -0.291 9.655) 9.683 4.323 ( -1.478 0.225 -4.120) 4.383 4.395 ( 0.541 -1.787 0.895) 2.070 4.584 ( 3.170 2.769 4.587) 6.226 4.633 ( -7.984 -0.479 5.447) 9.677 4.864 ( 4.350 -0.615 -5.020) 6.671 4.941 ( 4.237 -7.056 -7.283) 10.990 5.054 ( 2.995 4.647 -1.024) 5.623 5.209 ( -1.344 4.419 1.404) 4.827 5.409 ( 2.507 7.559 -1.308) 8.071 5.482 ( -0.349 5.191 -1.997) 5.573 5.520 ( -3.887 0.245 -4.462) 5.923 5.647 ( 1.791 14.549 2.095) 14.808 5.691 ( -0.059 8.621 2.933) 9.107 5.893 ( -1.775 12.589 4.092) 13.356 5.949 ( 0.587 17.572 4.013) 18.034 5.974 ( 3.263 13.030 -1.041) 13.472 6.160 ( 0.114 19.173 -2.597) 19.348 6.376 ( 0.152 19.741 -0.946) 19.765 6.483 ( 0.828 12.127 -0.431) 12.163 6.511 ( -1.849 13.871 -4.498) 14.699 6.596 ( -0.376 12.969 -2.730) 13.259 6.679 ( 1.325 6.393 2.043) 6.841 6.741 ( 0.244 2.360 -0.208) 2.382 6.796 ( 0.280 10.383 1.956) 10.570 6.828 ( -0.575 5.178 0.265) 5.216 8.439 ( 0.323 -4.730 3.353) 5.807 8.482 ( -0.457 -7.799 2.711) 8.270 8.654 ( 5.526 -7.093 -2.857) 9.435 8.707 ( 2.486 -7.175 -3.921) 8.547 9.371 ( -0.767 2.209 2.650) 3.534 9.499 ( -0.149 3.651 -2.128) 4.229 9.944 ( -9.222 -1.399 3.002) 9.799 9.959 ( -2.142 1.565 3.634) 4.499 10.073 ( -7.857 -6.992 -1.749) 10.662 10.192 ( 4.725 -0.946 3.505) 5.959 10.425 ( 2.555 2.781 -3.406) 5.086 10.528 ( -2.246 0.163 2.665) 3.489 10.683 ( 2.364 5.707 -0.975) 6.254 10.842 ( -3.007 -0.244 6.349) 7.029 10.886 ( -0.168 0.785 -0.244) 0.839 11.180 ( 0.671 3.308 8.047) 8.726 11.419 ( -0.703 3.478 -4.451) 5.692 11.513 ( -0.919 -4.401 -9.995) 10.960 11.636 ( 7.097 1.479 -1.794) 7.468 11.919 ( 4.005 9.347 -8.768) 13.427 11.993 ( 3.986 10.241 0.634) 11.007 12.231 ( 4.232 8.885 -8.856) 13.240 12.391 ( 2.940 0.996 -1.442) 3.423 12.620 ( 1.805 2.307 -7.534) 8.084 12.913 ( -3.434 1.058 12.952) 13.441 12.991 ( 0.693 9.216 11.720) 14.925 13.048 ( -8.475 5.720 5.882) 11.796 13.273 ( 1.465 4.170 7.574) 8.769 13.426 ( -12.957 5.382 -3.500) 14.460 13.465 ( -5.103 11.979 -2.504) 13.259 13.764 ( 2.642 9.074 -1.270) 9.536 13.833 ( 8.138 12.899 -3.268) 15.598 14.064 ( -3.531 3.340 0.627) 4.900 14.247 ( 0.403 9.522 -4.626) 10.594 14.898 ( 0.834 -7.339 1.039) 7.459 14.975 ( -1.041 -2.604 -1.323) 3.101 15.250 ( 1.928 1.911 -1.966) 3.352 15.384 ( 1.030 1.034 -7.636) 7.774 15.668 ( -0.354 0.100 5.172) 5.186 15.730 ( -0.996 -2.776 3.761) 4.779 16.234 ( 1.050 -9.340 2.226) 9.659 16.286 ( -0.019 -7.616 2.636) 8.059 16.377 ( 1.047 -11.333 -1.673) 11.503 16.451 ( -0.394 -10.582 -2.127) 10.800======================= Grid point 102 (42/72) =======================q-point: ( 0.40 0.33 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.806 ( 6.789 12.164 0.874) 13.957 2.842 ( 3.735 13.713 -1.245) 14.267 2.924 ( -3.097 10.931 -1.532) 11.464 2.971 ( -7.224 6.785 -0.421) 9.920 3.113 ( 2.065 5.777 0.790) 6.186 3.152 ( -1.306 5.886 1.399) 6.190 3.235 ( 6.322 4.248 -5.320) 9.290 3.385 ( -5.670 0.000 -3.381) 6.601 3.611 ( 2.980 9.000 -0.130) 9.482 3.656 ( -2.000 6.605 -2.549) 7.357 3.792 ( 2.167 7.487 3.580) 8.577 3.832 ( -0.893 7.384 2.376) 7.808 3.976 ( 4.374 2.690 1.014) 5.235 4.094 ( 2.543 1.234 -2.977) 4.105 4.159 ( -7.749 1.099 0.574) 7.847 4.232 ( -5.648 -0.490 0.686) 5.710 4.395 ( 2.248 0.369 5.732) 6.168 4.482 ( -5.641 -0.595 7.475) 9.383 4.732 ( 8.129 3.479 5.700) 10.520 4.871 ( -4.444 2.711 2.363) 5.717 5.081 ( 6.776 1.151 -4.885) 8.433 5.098 ( 3.192 -1.060 -10.524) 11.048 5.178 ( -0.334 4.015 -5.563) 6.869 5.323 ( -9.993 2.816 -3.094) 10.834 5.488 ( 3.541 7.285 0.694) 8.129 5.524 ( 0.149 5.644 -0.842) 5.708 5.691 ( 1.804 6.035 3.709) 7.310 5.705 ( 0.442 3.261 3.531) 4.827 5.876 ( 0.629 18.208 3.894) 18.630 5.918 ( -2.706 19.349 4.257) 19.996 6.061 ( 4.547 13.105 -2.177) 14.041 6.138 ( -2.543 14.897 -2.097) 15.257 6.396 ( 1.738 21.259 -2.032) 21.426 6.443 ( -2.753 21.188 -3.618) 21.670 6.535 ( 2.249 9.799 -0.688) 10.077 6.576 ( -1.611 11.325 -2.203) 11.649 6.714 ( 1.777 3.803 1.520) 4.465 6.740 ( -0.588 2.558 0.499) 2.672 6.801 ( 0.318 7.989 0.568) 8.016 6.813 ( -0.801 7.028 0.385) 7.084 8.455 ( 1.034 -4.632 3.724) 6.033 8.472 ( -0.635 -5.861 3.186) 6.701 8.750 ( 2.945 -7.183 -4.014) 8.740 8.760 ( 1.782 -7.483 -4.059) 8.697 9.419 ( 6.363 0.374 2.909) 7.006 9.541 ( 3.707 1.401 -1.386) 4.198 9.655 ( -11.534 -2.267 2.214) 11.962 9.763 ( -12.779 -2.669 -1.724) 13.168 10.153 ( 7.752 -0.771 4.683) 9.089 10.259 ( -0.652 -0.632 5.006) 5.088 10.472 ( -0.558 -1.478 3.749) 4.069 10.474 ( 0.589 0.304 -2.227) 2.323 10.725 ( 1.332 6.744 -1.046) 6.954 10.767 ( -3.323 5.261 -0.307) 6.230 10.935 ( 6.120 1.362 1.596) 6.470 11.108 ( -8.370 0.864 3.568) 9.139 11.418 ( 1.856 4.191 -3.043) 5.502 11.473 ( -2.452 0.431 -4.142) 4.833 11.800 ( 7.132 4.799 -5.620) 10.270 11.902 ( -3.032 5.704 -9.397) 11.403 12.182 ( 9.719 10.628 -1.851) 14.520 12.288 ( -0.288 11.060 -5.956) 12.565 12.558 ( 12.183 0.142 1.026) 12.227 12.726 ( 8.707 5.244 -3.401) 10.718 12.783 ( -9.309 2.868 5.326) 11.101 12.886 ( -5.123 4.004 7.495) 9.922 12.962 ( -3.275 2.894 7.303) 8.510 13.069 ( -16.264 -2.042 -1.007) 16.422 13.332 ( 2.786 8.540 4.843) 10.205 13.396 ( -3.105 10.274 2.045) 10.927 13.834 ( 5.034 7.548 1.927) 9.275 13.951 ( -5.155 6.857 3.648) 9.323 14.044 ( 8.907 9.190 -7.280) 14.723 14.201 ( -5.260 9.216 -6.423) 12.404 14.921 ( 1.282 -5.995 -0.067) 6.131 14.949 ( -1.423 -4.209 -0.943) 4.542 15.311 ( 3.675 3.524 -1.268) 5.247 15.376 ( -2.106 3.378 -3.731) 5.456 15.674 ( 1.068 -1.037 3.239) 3.565 15.704 ( -1.536 -2.042 2.686) 3.707 16.259 ( 1.241 -8.531 2.509) 8.978 16.279 ( -0.677 -7.873 2.810) 8.386 16.405 ( 1.595 -11.070 -2.082) 11.376 16.435 ( -1.169 -10.750 -2.173) 11.029======================= Grid point 105 (43/72) =======================q-point: ( 0.00 0.40 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.967 ( 0.000 12.259 -0.849) 12.288 3.010 ( 0.000 10.520 -2.532) 10.820 3.129 ( 0.000 3.105 0.293) 3.119 3.138 ( 0.000 3.324 -1.656) 3.714 3.197 ( 0.000 6.644 1.818) 6.888 3.226 ( 0.000 0.150 0.811) 0.824 3.331 ( 0.000 5.314 -2.699) 5.960 3.382 ( 0.000 0.936 -4.216) 4.319 3.728 ( 0.000 8.067 9.247) 12.271 3.813 ( 0.000 9.161 -0.938) 9.209 3.879 ( 0.000 3.487 3.964) 5.279 3.889 ( 0.000 3.067 3.255) 4.472 4.113 ( 0.000 0.040 2.402) 2.402 4.240 ( 0.000 -2.571 -7.182) 7.629 4.263 ( 0.000 -3.815 0.341) 3.831 4.268 ( 0.000 -1.377 3.340) 3.613 4.327 ( 0.000 7.513 -1.420) 7.646 4.563 ( 0.000 -4.203 0.267) 4.211 4.683 ( 0.000 -1.962 -4.625) 5.024 4.708 ( 0.000 -7.275 1.501) 7.428 4.837 ( 0.000 -5.697 0.036) 5.697 4.849 ( 0.000 -1.523 -2.146) 2.632 5.263 ( 0.000 -5.279 -3.100) 6.122 5.292 ( 0.000 -10.372 -3.174) 10.846 5.525 ( 0.000 6.391 0.126) 6.392 5.612 ( 0.000 2.995 -0.282) 3.008 5.951 ( 0.000 10.406 0.361) 10.412 5.975 ( 0.000 11.427 -0.318) 11.432 6.143 ( 0.000 11.325 5.782) 12.715 6.198 ( 0.000 10.784 3.851) 11.451 6.342 ( 0.000 18.471 4.004) 18.900 6.488 ( 0.000 10.464 -5.946) 12.035 6.583 ( 0.000 6.962 1.130) 7.053 6.687 ( 0.000 11.055 -2.338) 11.300 6.736 ( 0.000 2.382 0.808) 2.515 6.771 ( 0.000 3.733 0.485) 3.764 6.872 ( 0.000 11.980 -2.989) 12.347 6.887 ( 0.000 11.091 -0.099) 11.092 7.006 ( 0.000 11.040 0.653) 11.060 7.067 ( 0.000 11.680 0.358) 11.685 8.340 ( 0.000 -3.887 2.373) 4.554 8.371 ( 0.000 -3.511 2.566) 4.349 8.445 ( 0.000 -5.948 -1.634) 6.169 8.533 ( 0.000 -7.433 -3.106) 8.055 9.489 ( 0.000 6.026 2.769) 6.631 9.625 ( 0.000 6.375 -2.583) 6.878 9.923 ( 0.000 0.223 6.454) 6.457 10.049 ( 0.000 -5.680 -1.017) 5.770 10.068 ( 0.000 -3.788 -0.679) 3.849 10.138 ( 0.000 2.216 5.128) 5.586 10.444 ( 0.000 -1.789 0.335) 1.820 10.491 ( 0.000 -5.097 5.216) 7.293 10.772 ( 0.000 6.928 -1.645) 7.121 10.820 ( 0.000 0.579 7.527) 7.549 10.883 ( 0.000 1.661 -5.262) 5.518 11.259 ( 0.000 0.446 0.534) 0.696 11.417 ( 0.000 -5.870 -7.371) 9.423 11.426 ( 0.000 -1.313 -5.647) 5.798 11.488 ( 0.000 -0.230 -2.020) 2.033 11.910 ( 0.000 -4.919 -7.972) 9.367 12.203 ( 0.000 8.517 0.856) 8.560 12.280 ( 0.000 2.169 -6.708) 7.050 12.404 ( 0.000 1.311 -7.083) 7.203 12.549 ( 0.000 -3.307 -9.014) 9.601 13.032 ( 0.000 8.247 17.662) 19.492 13.185 ( 0.000 8.509 11.183) 14.052 13.277 ( 0.000 4.855 5.285) 7.177 13.341 ( 0.000 3.130 9.785) 10.274 13.726 ( 0.000 5.819 -4.349) 7.265 13.760 ( 0.000 9.471 -4.635) 10.544 13.936 ( 0.000 9.449 3.405) 10.044 13.984 ( 0.000 11.089 -4.725) 12.054 14.169 ( 0.000 3.462 3.345) 4.814 14.426 ( 0.000 8.377 -6.589) 10.658 14.730 ( 0.000 -7.006 1.572) 7.180 14.945 ( 0.000 -2.783 -5.327) 6.010 15.265 ( 0.000 1.719 -0.023) 1.719 15.342 ( 0.000 -1.523 -3.867) 4.156 15.688 ( 0.000 0.613 3.041) 3.102 15.701 ( 0.000 -0.902 3.552) 3.665 16.055 ( 0.000 -6.302 1.277) 6.430 16.137 ( 0.000 -7.669 -1.693) 7.854 16.187 ( 0.000 -5.050 1.651) 5.313 16.273 ( 0.000 -7.127 -1.373) 7.258======================= Grid point 106 (44/72) =======================q-point: ( 0.20 0.40 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.986 ( 1.561 11.809 -0.881) 11.945 3.024 ( 1.576 9.580 -2.581) 10.046 3.118 ( -0.965 3.699 -1.638) 4.159 3.141 ( -0.087 4.630 -0.902) 4.718 3.171 ( -1.610 3.111 3.281) 4.799 3.231 ( 0.490 1.939 1.227) 2.347 3.314 ( -1.185 4.274 -4.468) 6.296 3.398 ( 0.028 -0.869 -3.945) 4.040 3.730 ( 0.993 6.507 7.360) 9.874 3.809 ( -0.949 8.263 -0.575) 8.337 3.882 ( 2.343 5.346 5.447) 7.984 3.974 ( 4.218 4.515 2.261) 6.580 4.053 ( -2.439 5.928 -0.605) 6.438 4.122 ( -4.576 -2.388 1.896) 5.499 4.252 ( -1.748 1.224 -0.547) 2.203 4.306 ( 0.591 -3.411 1.606) 3.816 4.383 ( -0.733 2.934 -2.520) 3.936 4.532 ( -4.156 -5.107 6.237) 9.069 4.668 ( 2.966 -0.183 -1.163) 3.191 4.740 ( 6.106 -5.289 -6.354) 10.278 4.861 ( 1.397 -1.394 -2.677) 3.326 4.941 ( 4.263 -9.703 -3.451) 11.146 5.232 ( -2.666 -4.549 -2.675) 5.912 5.315 ( 1.647 -10.253 -3.613) 10.995 5.559 ( 3.268 5.515 0.566) 6.436 5.607 ( -0.314 4.439 -0.651) 4.498 5.861 ( -6.339 9.797 3.480) 12.177 5.911 ( -5.364 8.706 3.134) 10.695 6.196 ( 3.433 12.060 2.969) 12.886 6.240 ( 3.306 11.310 1.925) 11.940 6.327 ( -1.310 16.911 3.473) 17.313 6.464 ( -2.311 9.750 -4.440) 10.959 6.616 ( 2.878 7.174 0.476) 7.744 6.697 ( 0.939 9.808 -2.073) 10.069 6.750 ( 0.941 4.781 -0.416) 4.890 6.772 ( -0.135 4.233 -0.224) 4.241 6.858 ( -0.457 11.665 -0.588) 11.689 6.901 ( 0.589 12.494 -1.533) 12.602 6.994 ( -0.793 10.747 1.319) 10.857 7.057 ( -0.995 11.093 0.097) 11.138 8.357 ( 1.520 -3.356 2.408) 4.401 8.370 ( 0.626 -2.561 2.267) 3.477 8.512 ( 5.117 -6.549 -1.742) 8.492 8.558 ( 2.341 -7.288 -2.845) 8.166 9.451 ( -2.302 5.405 2.993) 6.593 9.593 ( -2.253 5.319 -2.359) 6.240 9.902 ( -11.481 -3.168 0.227) 11.912 9.921 ( -8.557 -7.329 -0.410) 11.274 10.029 ( 3.621 4.880 5.892) 8.464 10.183 ( 4.075 0.557 6.745) 7.900 10.422 ( -0.430 -3.198 -0.327) 3.243 10.472 ( -3.047 -5.539 4.512) 7.767 10.800 ( 2.565 6.092 -1.186) 6.716 10.838 ( 1.454 1.779 4.663) 5.198 10.924 ( 1.925 2.934 -6.668) 7.535 11.198 ( -4.084 -2.931 1.265) 5.183 11.432 ( 3.554 0.207 -7.085) 7.929 11.470 ( -0.373 0.328 -5.659) 5.681 11.600 ( 10.277 -3.756 -1.923) 11.110 11.962 ( 2.476 -6.135 -11.911) 13.624 12.183 ( 1.356 7.656 0.965) 7.834 12.343 ( 6.697 3.165 0.454) 7.421 12.431 ( 2.173 2.380 -8.218) 8.828 12.612 ( 6.126 -1.724 -9.056) 11.068 12.970 ( -5.435 6.507 15.124) 17.338 13.147 ( -7.562 4.486 6.507) 10.939 13.181 ( -5.959 6.578 9.900) 13.297 13.304 ( -6.101 0.721 4.175) 7.428 13.598 ( -7.625 9.651 1.302) 12.368 13.723 ( -2.868 11.258 -2.448) 11.872 13.923 ( -0.487 6.016 3.826) 7.147 14.068 ( 4.870 7.251 -6.118) 10.665 14.148 ( -0.435 6.765 4.443) 8.105 14.437 ( -0.025 8.625 -6.809) 10.989 14.743 ( 1.357 -7.442 0.293) 7.571 14.915 ( -2.598 -3.689 -4.945) 6.694 15.305 ( 4.005 3.099 0.663) 5.107 15.401 ( 4.313 0.365 -4.132) 5.983 15.670 ( -1.436 0.087 3.668) 3.941 15.695 ( -0.729 -0.728 2.863) 3.043 16.073 ( 1.643 -6.078 1.283) 6.425 16.150 ( 0.896 -6.588 -1.111) 6.741 16.186 ( 0.104 -6.183 1.110) 6.283 16.268 ( -0.617 -7.307 -1.390) 7.463======================= Grid point 107 (45/72) =======================q-point: ( 0.40 0.40 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.023 ( 2.162 9.042 -0.364) 9.304 3.063 ( 0.557 7.640 -1.739) 7.855 3.090 ( -1.255 5.348 -0.497) 5.516 3.107 ( -1.270 7.130 -1.791) 7.460 3.190 ( 2.408 2.182 0.900) 3.372 3.237 ( -1.019 2.393 1.156) 2.847 3.299 ( 1.051 1.867 -4.573) 5.050 3.360 ( -3.452 -2.269 -4.301) 5.963 3.748 ( 0.491 4.159 4.386) 6.064 3.768 ( -1.847 6.466 3.259) 7.473 3.985 ( 6.018 10.148 1.108) 11.850 4.033 ( 3.270 4.736 1.357) 5.913 4.043 ( -0.498 6.294 0.444) 6.329 4.102 ( 2.469 1.892 3.540) 4.712 4.186 ( -4.955 2.706 1.223) 5.776 4.211 ( -7.393 -1.250 4.125) 8.558 4.398 ( 2.915 -0.248 -0.135) 2.928 4.460 ( -3.044 -0.982 2.326) 3.955 4.767 ( 5.343 1.204 2.651) 6.085 4.843 ( -0.553 -2.940 -1.384) 3.296 4.913 ( 5.070 -8.887 -6.491) 12.117 4.973 ( -0.709 -11.128 -8.953) 14.299 5.202 ( 1.584 -3.717 -5.571) 6.882 5.294 ( -4.633 -7.709 -6.094) 10.864 5.628 ( 2.836 6.782 1.997) 7.618 5.642 ( 3.762 6.285 2.077) 7.613 5.752 ( -3.422 5.101 6.017) 8.598 5.793 ( -5.595 5.091 5.027) 9.083 6.253 ( 2.251 13.983 2.187) 14.331 6.294 ( -1.793 15.043 2.586) 15.368 6.319 ( 4.111 10.133 -0.217) 10.937 6.401 ( -3.729 9.305 -2.031) 10.228 6.680 ( 2.936 6.615 -0.812) 7.283 6.714 ( 0.072 7.337 -1.975) 7.599 6.758 ( -0.223 7.732 -1.090) 7.812 6.762 ( -0.556 6.939 -1.593) 7.141 6.867 ( 1.209 12.094 0.737) 12.177 6.895 ( -1.198 13.170 -0.522) 13.235 6.995 ( 1.090 10.073 0.993) 10.181 7.028 ( -1.762 10.356 0.124) 10.506 8.388 ( 1.140 -2.086 2.314) 3.318 8.391 ( 0.839 -1.458 2.247) 2.807 8.603 ( 2.776 -7.048 -2.193) 7.886 8.609 ( 1.852 -7.149 -2.364) 7.754 9.459 ( 4.286 3.345 2.708) 6.075 9.582 ( 2.110 2.217 -1.780) 3.541 9.636 ( -11.967 0.140 1.519) 12.063 9.710 ( -9.711 -2.760 -1.358) 10.186 10.157 ( 6.664 1.136 6.816) 9.600 10.244 ( -0.152 -0.789 6.689) 6.737 10.401 ( -1.169 -4.748 4.794) 6.848 10.419 ( -1.319 -5.023 1.819) 5.502 10.854 ( 1.666 6.034 -2.338) 6.682 10.868 ( 0.884 4.832 -2.531) 5.526 10.955 ( 3.583 1.248 -3.568) 5.209 11.085 ( -7.243 -2.322 -1.262) 7.710 11.479 ( 1.504 2.590 -3.722) 4.778 11.492 ( 0.968 1.889 -5.233) 5.647 11.799 ( 8.432 -4.446 -4.670) 10.615 11.930 ( -4.533 -4.391 -9.665) 11.543 12.334 ( 10.608 5.484 -2.218) 12.146 12.456 ( -0.331 6.098 -7.582) 9.736 12.575 ( 14.629 0.911 2.692) 14.903 12.780 ( 6.833 -0.171 -5.418) 8.722 12.862 ( -1.680 4.132 8.101) 9.248 12.927 ( -10.741 2.907 6.742) 13.010 12.983 ( -11.964 1.112 9.204) 15.136 13.070 ( -13.781 1.435 -2.166) 14.024 13.568 ( 3.275 12.529 6.090) 14.310 13.653 ( -4.122 12.781 3.250) 13.817 13.949 ( 3.195 2.965 4.736) 6.437 14.035 ( -4.565 1.697 3.137) 5.793 14.260 ( 7.644 10.832 -4.502) 14.001 14.391 ( -4.618 9.331 -6.276) 12.157 14.787 ( 2.911 -6.961 -2.157) 7.848 14.853 ( -3.301 -5.298 -3.905) 7.363 15.403 ( 4.703 4.995 0.200) 6.864 15.458 ( 0.178 4.247 -2.656) 5.012 15.649 ( -0.003 -1.440 3.447) 3.736 15.671 ( -1.506 -1.273 2.338) 3.059 16.113 ( 2.036 -5.481 1.342) 5.999 16.148 ( -1.165 -4.859 1.137) 5.124 16.209 ( 1.891 -8.084 -1.118) 8.377 16.246 ( -1.540 -7.712 -1.404) 7.988======================= Grid point 110 (46/72) =======================q-point: ( 0.00 0.47 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.130 ( 0.000 3.224 -0.980) 3.369 3.144 ( 0.000 2.076 0.715) 2.195 3.175 ( 0.000 2.519 -1.670) 3.022 3.212 ( 0.000 0.128 2.104) 2.108 3.240 ( 0.000 5.370 -3.405) 6.359 3.308 ( 0.000 3.767 0.157) 3.770 3.356 ( 0.000 -3.123 -2.884) 4.251 3.370 ( 0.000 -0.792 -0.646) 1.022 3.898 ( 0.000 4.696 6.450) 7.978 3.905 ( 0.000 1.368 2.962) 3.263 3.933 ( 0.000 3.968 5.043) 6.417 3.985 ( 0.000 3.122 2.515) 4.008 4.156 ( 0.000 3.233 5.047) 5.994 4.174 ( 0.000 -2.659 -4.931) 5.603 4.185 ( 0.000 -1.737 -3.969) 4.332 4.244 ( 0.000 -1.788 0.998) 2.048 4.446 ( 0.000 3.185 -4.616) 5.608 4.468 ( 0.000 -2.862 -0.302) 2.877 4.549 ( 0.000 -5.866 1.708) 6.109 4.582 ( 0.000 -6.175 -1.998) 6.490 4.883 ( 0.000 7.825 -2.384) 8.180 4.912 ( 0.000 7.344 -2.867) 7.884 5.076 ( 0.000 -10.441 -2.361) 10.705 5.097 ( 0.000 -9.657 -4.141) 10.507 5.628 ( 0.000 3.183 1.869) 3.691 5.653 ( 0.000 0.624 1.352) 1.489 6.107 ( 0.000 4.509 0.123) 4.511 6.123 ( 0.000 3.149 -0.242) 3.158 6.310 ( 0.000 5.049 5.995) 7.838 6.338 ( 0.000 2.678 5.732) 6.327 6.578 ( 0.000 5.264 -2.811) 5.967 6.607 ( 0.000 2.035 -5.961) 6.298 6.758 ( 0.000 6.100 2.337) 6.532 6.777 ( 0.000 3.829 2.088) 4.361 6.783 ( 0.000 0.249 -0.396) 0.468 6.846 ( 0.000 1.467 1.725) 2.264 7.048 ( 0.000 4.581 -1.171) 4.728 7.050 ( 0.000 4.295 1.096) 4.433 7.189 ( 0.000 5.849 -1.770) 6.111 7.220 ( 0.000 3.021 -1.338) 3.304 8.310 ( 0.000 1.013 0.781) 1.279 8.334 ( 0.000 -0.037 1.051) 1.052 8.352 ( 0.000 -3.071 -0.450) 3.103 8.394 ( 0.000 -5.652 -1.379) 5.818 9.628 ( 0.000 7.444 2.583) 7.879 9.740 ( 0.000 1.980 -1.719) 2.622 9.832 ( 0.000 -3.319 2.204) 3.984 9.920 ( 0.000 -6.615 -1.408) 6.763 10.141 ( 0.000 7.934 4.974) 9.364 10.215 ( 0.000 5.000 5.601) 7.508 10.326 ( 0.000 -8.168 5.915) 10.085 10.355 ( 0.000 -7.252 6.715) 9.884 10.887 ( 0.000 4.246 -0.966) 4.354 10.929 ( 0.000 0.886 -3.651) 3.757 10.937 ( 0.000 9.167 -2.677) 9.550 11.133 ( 0.000 -9.554 -2.855) 9.972 11.394 ( 0.000 0.879 -7.737) 7.787 11.407 ( 0.000 -0.564 -6.283) 6.308 11.520 ( 0.000 4.874 -2.681) 5.563 11.704 ( 0.000 -11.983 -6.661) 13.710 12.308 ( 0.000 1.935 1.452) 2.420 12.313 ( 0.000 0.948 -0.624) 1.135 12.446 ( 0.000 2.896 -9.661) 10.085 12.501 ( 0.000 -2.254 -9.695) 9.953 13.200 ( 0.000 7.006 14.945) 16.506 13.278 ( 0.000 0.120 12.076) 12.076 13.355 ( 0.000 2.560 4.746) 5.392 13.375 ( 0.000 0.480 6.630) 6.647 13.834 ( 0.000 4.317 0.378) 4.333 13.872 ( 0.000 1.388 -2.115) 2.530 14.082 ( 0.000 4.820 3.323) 5.855 14.124 ( 0.000 1.347 -2.545) 2.880 14.281 ( 0.000 8.456 0.737) 8.488 14.452 ( 0.000 -6.667 -4.727) 8.173 14.715 ( 0.000 6.270 -3.480) 7.171 14.855 ( 0.000 -6.104 -7.082) 9.350 15.294 ( 0.000 1.152 1.570) 1.947 15.315 ( 0.000 -1.035 0.831) 1.328 15.696 ( 0.000 0.103 1.614) 1.617 15.696 ( 0.000 0.168 1.354) 1.364 15.978 ( 0.000 -1.171 0.407) 1.239 16.010 ( 0.000 -4.216 -0.733) 4.279 16.136 ( 0.000 -0.418 0.398) 0.577 16.166 ( 0.000 -3.373 -0.623) 3.430======================= Grid point 111 (47/72) =======================q-point: ( 0.20 0.47 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.139 ( 0.415 2.524 -0.177) 2.564 3.147 ( 0.734 2.028 0.467) 2.207 3.190 ( 1.134 2.331 -1.511) 3.000 3.207 ( -0.376 2.910 1.278) 3.200 3.226 ( -1.083 3.607 -3.179) 4.928 3.286 ( -1.431 3.082 -0.801) 3.491 3.334 ( -1.411 -2.211 -3.110) 4.069 3.356 ( -2.291 -2.480 -2.499) 4.200 3.850 ( -1.650 5.095 6.020) 8.058 3.917 ( -0.507 -0.341 5.456) 5.490 3.981 ( 2.890 5.459 5.327) 8.157 4.038 ( 2.820 -0.131 5.149) 5.872 4.099 ( -1.395 2.857 3.620) 4.818 4.160 ( 0.175 0.413 -1.280) 1.357 4.234 ( 0.966 -0.144 0.127) 0.985 4.268 ( 2.337 -0.531 -1.897) 3.057 4.448 ( -2.007 1.702 0.633) 2.707 4.483 ( 1.035 3.609 -4.800) 6.094 4.527 ( 3.585 -6.962 -5.666) 9.666 4.652 ( 3.481 -10.000 -2.762) 10.943 4.898 ( 0.679 7.799 -2.466) 8.208 4.910 ( -0.034 5.959 -2.270) 6.377 5.075 ( -1.129 -9.159 -3.264) 9.788 5.098 ( 0.944 -10.621 -3.105) 11.106 5.652 ( 2.508 2.871 2.025) 4.317 5.668 ( 1.648 1.259 1.534) 2.580 6.013 ( -7.390 4.508 2.857) 9.116 6.032 ( -7.277 2.719 2.602) 8.192 6.358 ( 3.394 4.524 3.333) 6.565 6.381 ( 3.034 2.600 3.132) 5.077 6.551 ( -2.524 5.074 -2.075) 6.035 6.576 ( -2.754 2.034 -4.255) 5.461 6.761 ( 1.445 4.739 1.749) 5.254 6.791 ( 1.566 1.671 1.509) 2.742 6.821 ( 1.797 3.340 -0.360) 3.810 6.859 ( 0.723 1.936 0.444) 2.114 7.049 ( 0.801 5.878 0.120) 5.934 7.074 ( 1.690 3.655 -0.090) 4.028 7.173 ( -1.448 5.821 -1.416) 6.164 7.205 ( -1.439 2.944 -1.214) 3.495 8.338 ( 2.502 1.524 0.805) 3.038 8.355 ( 2.123 0.953 0.834) 2.472 8.401 ( 3.915 -4.178 -0.392) 5.739 8.423 ( 2.600 -5.537 -1.108) 6.217 9.582 ( -3.428 7.271 2.507) 8.421 9.696 ( -4.008 2.547 -1.942) 5.131 9.763 ( -5.956 -5.044 1.540) 7.955 9.829 ( -8.349 -4.865 -1.286) 9.748 10.155 ( 1.703 7.302 5.964) 9.581 10.230 ( 1.141 4.085 7.529) 8.641 10.311 ( -0.580 -7.245 4.364) 8.478 10.340 ( -1.702 -6.354 6.679) 9.375 10.902 ( 1.709 4.382 -2.072) 5.140 10.940 ( 0.904 6.321 -3.054) 7.078 10.965 ( 1.577 0.207 -4.562) 4.831 11.087 ( -2.721 -6.879 -3.759) 8.298 11.459 ( 5.047 2.002 -6.748) 8.661 11.509 ( 7.505 -1.602 -6.585) 10.112 11.546 ( 2.490 5.070 -2.172) 6.052 11.749 ( 2.909 -12.225 -7.982) 14.888 12.299 ( 2.038 4.061 0.820) 4.617 12.356 ( 4.507 -1.494 1.274) 4.916 12.500 ( 4.626 3.990 -8.632) 10.575 12.570 ( 6.275 -2.695 -8.559) 10.950 13.114 ( -7.259 6.271 11.697) 15.128 13.190 ( -8.248 -0.755 8.880) 12.143 13.276 ( -8.659 3.118 6.680) 11.372 13.312 ( -7.951 -0.429 3.578) 8.729 13.776 ( -2.673 7.167 3.834) 8.556 13.855 ( -0.200 0.595 0.395) 0.742 14.027 ( -4.407 4.960 4.635) 8.094 14.102 ( -2.861 -1.689 0.796) 3.417 14.338 ( 5.233 9.448 -2.051) 10.994 14.502 ( 4.203 -5.298 -5.627) 8.798 14.687 ( -2.611 4.923 -3.516) 6.589 14.816 ( -3.394 -6.034 -6.498) 9.495 15.363 ( 6.015 2.332 1.648) 6.659 15.396 ( 6.487 -0.892 0.155) 6.550 15.677 ( -1.716 0.534 1.753) 2.510 15.687 ( -1.208 -0.355 1.299) 1.809 15.999 ( 1.918 -1.105 0.367) 2.244 16.030 ( 1.899 -4.110 -0.763) 4.591 16.126 ( -1.003 -0.543 0.419) 1.215 16.157 ( -0.957 -3.529 -0.636) 3.711======================= Grid point 112 (48/72) =======================q-point: ( 0.40 0.47 0.25)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.150 ( 0.646 2.739 -0.096) 2.815 3.171 ( 0.498 2.868 0.038) 2.911 3.179 ( 0.069 3.458 -0.762) 3.542 3.215 ( -0.381 2.719 -1.668) 3.212 3.228 ( 1.406 2.565 -1.970) 3.526 3.259 ( -1.775 0.448 -1.350) 2.275 3.297 ( -1.551 -2.702 -3.698) 4.836 3.306 ( -1.379 -1.904 -3.309) 4.060 3.847 ( 1.407 5.492 6.974) 8.988 3.895 ( -2.226 5.488 7.254) 9.364 3.978 ( 0.183 -4.614 8.007) 9.243 4.033 ( -3.627 -4.972 8.201) 10.253 4.150 ( 5.612 5.925 1.212) 8.250 4.215 ( 2.856 2.534 -0.847) 3.911 4.263 ( -0.023 1.437 1.391) 2.000 4.287 ( 0.109 3.838 -0.977) 3.962 4.429 ( 0.725 7.316 -3.218) 8.025 4.464 ( -1.933 5.005 -3.353) 6.327 4.642 ( 5.017 -11.399 -6.455) 14.028 4.695 ( 0.085 -13.282 -5.815) 14.499 4.899 ( 0.131 7.090 -1.999) 7.367 4.910 ( -0.460 5.974 -2.557) 6.514 5.061 ( 0.707 -8.553 -4.616) 9.745 5.097 ( -1.581 -10.329 -4.424) 11.347 5.730 ( 4.606 2.799 3.025) 6.181 5.734 ( 5.481 2.357 3.122) 6.734 5.857 ( -7.238 3.643 4.524) 9.281 5.874 ( -7.587 1.966 4.143) 8.865 6.426 ( 3.170 4.142 1.434) 5.409 6.444 ( 3.151 2.406 0.604) 4.010 6.490 ( -3.129 4.496 -0.267) 5.484 6.511 ( -3.348 2.022 -1.533) 4.201 6.803 ( 2.027 4.355 0.364) 4.817 6.824 ( 0.747 3.668 0.452) 3.770 6.840 ( 0.591 1.973 -0.417) 2.102 6.860 ( -0.670 1.916 -0.288) 2.050 7.080 ( 2.046 6.861 -0.116) 7.161 7.109 ( 0.832 5.405 -0.945) 5.550 7.140 ( -0.882 4.118 -0.141) 4.214 7.167 ( -2.073 2.724 -0.725) 3.499 8.392 ( 2.080 2.378 0.851) 3.272 8.399 ( 1.428 2.181 0.804) 2.728 8.475 ( 2.409 -5.351 -0.540) 5.893 8.478 ( 1.949 -5.458 -0.640) 5.831 9.544 ( 0.917 4.690 1.646) 5.055 9.619 ( -2.417 0.789 -1.174) 2.800 9.641 ( -5.857 -1.634 0.015) 6.080 9.644 ( -6.641 -1.902 0.101) 6.908 10.204 ( 2.683 3.663 6.746) 8.132 10.243 ( -0.499 1.266 7.302) 7.427 10.303 ( -0.660 -5.068 5.463) 7.481 10.305 ( -0.770 -4.981 5.391) 7.380 10.950 ( 2.517 3.182 -3.538) 5.383 10.963 ( 0.805 4.283 -3.707) 5.721 10.982 ( 0.948 0.520 -4.297) 4.431 11.034 ( -2.984 -2.755 -4.161) 5.815 11.546 ( 2.934 4.268 -6.111) 8.010 11.572 ( 0.350 6.880 -5.495) 8.812 11.667 ( 6.314 -7.219 -5.446) 11.029 11.759 ( -2.408 -10.403 -7.889) 13.276 12.446 ( 11.325 5.390 -0.276) 12.546 12.530 ( 10.664 -1.537 -0.299) 10.778 12.598 ( 3.734 4.306 -4.917) 7.527 12.709 ( 3.641 -5.361 -5.536) 8.523 12.956 ( -5.878 3.871 8.293) 10.877 12.987 ( -8.253 1.033 5.962) 10.234 13.029 ( -11.966 3.149 5.744) 13.642 13.078 ( -12.132 -1.104 1.254) 12.246 13.794 ( 3.720 9.101 6.609) 11.846 13.869 ( -1.074 6.766 3.794) 7.831 13.950 ( -0.492 -1.543 6.835) 7.024 14.018 ( -4.764 -3.440 4.332) 7.300 14.463 ( 6.362 8.944 -4.490) 11.859 14.565 ( -1.566 6.221 -6.730) 9.298 14.646 ( 1.789 -5.614 -3.498) 6.852 14.732 ( -4.658 -6.580 -5.693) 9.869 15.495 ( 6.013 3.646 1.268) 7.146 15.525 ( 4.921 1.419 -0.232) 5.127 15.625 ( -2.932 -0.385 2.196) 3.683 15.644 ( -3.016 -1.497 1.208) 3.577 16.047 ( 2.534 -0.901 0.329) 2.710 16.077 ( 2.104 -3.336 -0.770) 4.018 16.097 ( -1.547 -1.384 0.429) 2.119 16.127 ( -1.964 -3.846 -0.655) 4.368======================= Grid point 150 (49/72) =======================q-point: ( 0.00 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 48Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.286 ( 0.000 0.000 -27.281) 27.281 1.286 ( 0.000 0.000 27.281) 27.281 1.305 ( 0.000 0.000 -27.348) 27.348 1.305 ( 0.000 0.000 27.348) 27.348 2.449 ( 0.000 0.000 -47.622) 47.622 2.449 ( 0.000 0.000 47.622) 47.622 2.533 ( 0.000 0.000 -7.348) 7.348 2.533 ( 0.000 0.000 7.348) 7.348 2.914 ( 0.000 0.000 -8.818) 8.818 2.914 ( 0.000 0.000 8.818) 8.818 2.977 ( 0.000 0.000 -1.167) 1.167 2.977 ( 0.000 0.000 1.167) 1.167 3.013 ( 0.000 0.000 -2.702) 2.702 3.013 ( 0.000 0.000 2.702) 2.702 3.026 ( 0.000 0.000 -3.905) 3.905 3.026 ( 0.000 0.000 3.905) 3.905 3.226 ( 0.000 0.000 -4.487) 4.487 3.226 ( 0.000 0.000 4.487) 4.487 3.247 ( 0.000 0.000 -6.268) 6.268 3.247 ( 0.000 0.000 6.268) 6.268 3.540 ( 0.000 0.000 -1.814) 1.814 3.540 ( 0.000 0.000 1.814) 1.814 4.326 ( 0.000 0.000 -12.094) 12.094 4.326 ( 0.000 0.000 12.094) 12.094 4.709 ( 0.000 0.000 -4.792) 4.792 4.709 ( 0.000 0.000 4.792) 4.792 5.362 ( 0.000 0.000 -7.811) 7.811 5.362 ( 0.000 0.000 7.811) 7.811 5.612 ( 0.000 0.000 -8.731) 8.731 5.612 ( 0.000 0.000 8.731) 8.731 5.972 ( 0.000 0.000 -8.876) 8.876 5.972 ( 0.000 0.000 8.876) 8.876 6.327 ( 0.000 0.000 -2.308) 2.308 6.327 ( 0.000 0.000 2.308) 2.308 6.427 ( 0.000 0.000 -2.447) 2.447 6.427 ( 0.000 0.000 2.447) 2.447 6.900 ( 0.000 0.000 -10.630) 10.630 6.900 ( 0.000 0.000 10.630) 10.630 7.171 ( 0.000 0.000 -8.488) 8.488 7.171 ( 0.000 0.000 8.488) 8.488 8.782 ( 0.000 0.000 -0.058) 0.058 8.782 ( 0.000 0.000 0.058) 0.058 9.036 ( 0.000 0.000 -5.462) 5.462 9.036 ( 0.000 0.000 5.462) 5.462 9.266 ( 0.000 0.000 -0.594) 0.594 9.266 ( 0.000 0.000 0.594) 0.594 9.521 ( 0.000 0.000 -0.250) 0.250 9.521 ( 0.000 0.000 0.250) 0.250 9.741 ( 0.000 0.000 -0.182) 0.182 9.741 ( 0.000 0.000 0.182) 0.182 9.780 ( 0.000 0.000 -3.052) 3.052 9.780 ( 0.000 0.000 3.052) 3.052 10.318 ( 0.000 0.000 -4.734) 4.734 10.318 ( 0.000 0.000 4.734) 4.734 10.407 ( 0.000 0.000 -6.537) 6.537 10.407 ( 0.000 0.000 6.537) 6.537 11.001 ( 0.000 0.000 -7.635) 7.635 11.001 ( 0.000 0.000 7.635) 7.635 11.008 ( 0.000 0.000 -1.563) 1.563 11.008 ( 0.000 0.000 1.563) 1.563 11.373 ( 0.000 0.000 -8.315) 8.315 11.373 ( 0.000 0.000 8.315) 8.315 11.978 ( 0.000 0.000 -0.301) 0.301 11.978 ( 0.000 0.000 0.301) 0.301 12.305 ( 0.000 0.000 -2.709) 2.709 12.305 ( 0.000 0.000 2.709) 2.709 12.496 ( 0.000 0.000 -2.322) 2.322 12.496 ( 0.000 0.000 2.322) 2.322 12.663 ( 0.000 0.000 -4.795) 4.795 12.663 ( 0.000 0.000 4.795) 4.795 13.742 ( 0.000 0.000 -3.274) 3.274 13.742 ( 0.000 0.000 3.274) 3.274 14.112 ( 0.000 0.000 -4.700) 4.700 14.112 ( 0.000 0.000 4.700) 4.700 15.355 ( 0.000 0.000 -0.572) 0.572 15.355 ( 0.000 0.000 0.572) 0.572 15.609 ( 0.000 0.000 -6.567) 6.567 15.609 ( 0.000 0.000 6.567) 6.567 15.971 ( 0.000 0.000 -0.864) 0.864 15.971 ( 0.000 0.000 0.864) 0.864 17.162 ( 0.000 0.000 -7.997) 7.997 17.162 ( 0.000 0.000 7.997) 7.997 17.591 ( 0.000 0.000 -0.822) 0.822 17.591 ( 0.000 0.000 0.822) 0.822======================= Grid point 152 (50/72) =======================q-point: ( 0.20 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 64Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.418 ( 10.509 0.000 -24.403) 26.569 1.418 ( 10.509 0.000 24.403) 26.569 1.437 ( 13.558 0.000 -23.829) 27.416 1.437 ( 13.558 0.000 23.829) 27.416 2.373 ( -13.448 0.000 -9.165) 16.274 2.373 ( -13.448 0.000 9.165) 16.274 2.568 ( -7.571 0.000 -8.644) 11.491 2.568 ( -7.571 0.000 8.644) 11.491 2.689 ( 6.418 0.000 -31.183) 31.836 2.689 ( 6.418 0.000 31.183) 31.836 2.991 ( 1.153 0.000 -4.891) 5.025 2.991 ( 1.153 0.000 4.891) 5.025 3.061 ( 1.378 0.000 -0.715) 1.552 3.061 ( 1.378 0.000 0.715) 1.552 3.209 ( 12.375 0.000 -8.235) 14.865 3.209 ( 12.375 0.000 8.235) 14.865 3.264 ( 3.820 0.000 -4.642) 6.012 3.264 ( 3.820 0.000 4.642) 6.012 3.407 ( 11.708 0.000 -6.520) 13.401 3.407 ( 11.708 0.000 6.520) 13.401 3.532 ( -0.800 0.000 -1.573) 1.764 3.532 ( -0.800 0.000 1.573) 1.764 4.226 ( -8.834 0.000 -11.866) 14.793 4.226 ( -8.834 0.000 11.866) 14.793 4.646 ( -8.713 0.000 -11.908) 14.756 4.646 ( -8.713 0.000 11.908) 14.756 4.928 ( -24.846 0.000 -14.642) 28.840 4.928 ( -24.846 0.000 14.642) 28.840 5.856 ( 3.959 0.000 -8.169) 9.078 5.856 ( 3.959 0.000 8.169) 9.078 6.000 ( 8.277 0.000 -4.269) 9.313 6.000 ( 8.277 0.000 4.269) 9.313 6.298 ( -1.390 0.000 -5.638) 5.807 6.298 ( -1.390 0.000 5.638) 5.807 6.560 ( 10.006 0.000 -2.046) 10.213 6.560 ( 10.006 0.000 2.046) 10.213 6.916 ( 0.274 0.000 -6.463) 6.469 6.916 ( 0.274 0.000 6.463) 6.469 7.173 ( 0.696 0.000 -5.190) 5.236 7.173 ( 0.696 0.000 5.190) 5.236 8.798 ( 1.479 0.000 -0.023) 1.479 8.798 ( 1.479 0.000 0.023) 1.479 9.077 ( 3.903 0.000 -2.731) 4.764 9.077 ( 3.903 0.000 2.731) 4.764 9.236 ( -2.528 0.000 -0.494) 2.576 9.236 ( -2.528 0.000 0.494) 2.576 9.547 ( 2.357 0.000 -0.709) 2.462 9.547 ( 2.357 0.000 0.709) 2.462 9.623 ( -8.979 0.000 -3.615) 9.679 9.623 ( -8.979 0.000 3.615) 9.679 9.756 ( -2.207 0.000 -2.937) 3.674 9.756 ( -2.207 0.000 2.937) 3.674 10.281 ( -3.096 0.000 -3.664) 4.797 10.281 ( -3.096 0.000 3.664) 4.797 10.429 ( 1.956 0.000 -5.598) 5.930 10.429 ( 1.956 0.000 5.598) 5.930 10.986 ( -1.382 0.000 -6.495) 6.641 10.986 ( -1.382 0.000 6.495) 6.641 11.110 ( 6.200 0.000 -1.791) 6.453 11.110 ( 6.200 0.000 1.791) 6.453 11.450 ( 7.773 0.000 -6.420) 10.082 11.450 ( 7.773 0.000 6.420) 10.082 11.943 ( -3.079 0.000 -5.921) 6.674 11.943 ( -3.079 0.000 5.921) 6.674 12.312 ( 0.570 0.000 -2.261) 2.332 12.312 ( 0.570 0.000 2.261) 2.332 12.493 ( -0.253 0.000 -1.963) 1.979 12.493 ( -0.253 0.000 1.963) 1.979 12.767 ( 9.252 0.000 -3.783) 9.995 12.767 ( 9.252 0.000 3.783) 9.995 13.619 ( -10.465 0.000 -2.033) 10.661 13.619 ( -10.465 0.000 2.033) 10.661 14.195 ( 6.204 0.000 -4.162) 7.471 14.195 ( 6.204 0.000 4.162) 7.471 15.304 ( -3.861 0.000 -3.102) 4.953 15.304 ( -3.861 0.000 3.102) 4.953 15.661 ( 4.046 0.000 -4.036) 5.715 15.661 ( 4.046 0.000 4.036) 5.715 15.932 ( -3.359 0.000 -1.071) 3.526 15.932 ( -3.359 0.000 1.071) 3.526 17.177 ( 1.444 0.000 -8.343) 8.467 17.177 ( 1.444 0.000 8.343) 8.467 17.493 ( -7.885 0.000 -3.927) 8.808 17.493 ( -7.885 0.000 3.927) 8.808======================= Grid point 154 (51/72) =======================q-point: ( 0.40 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 64Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.696 ( 15.715 0.000 -18.161) 24.016 1.696 ( 15.715 0.000 18.161) 24.016 1.780 ( 19.114 0.000 -19.200) 27.092 1.780 ( 19.114 0.000 19.200) 27.092 2.055 ( -16.636 0.000 -12.773) 20.974 2.055 ( -16.636 0.000 12.773) 20.974 2.189 ( -20.462 0.000 -15.245) 25.517 2.189 ( -20.462 0.000 15.245) 25.517 3.021 ( 1.769 0.000 -4.710) 5.032 3.021 ( 1.769 0.000 4.710) 5.032 3.056 ( -1.394 0.000 -3.076) 3.377 3.056 ( -1.394 0.000 3.076) 3.377 3.122 ( 23.893 0.000 -28.333) 37.062 3.122 ( 23.893 0.000 28.333) 37.062 3.349 ( 3.189 0.000 -2.175) 3.860 3.349 ( 3.189 0.000 2.175) 3.860 3.459 ( 8.778 0.000 -4.129) 9.700 3.459 ( 8.778 0.000 4.129) 9.700 3.509 ( -1.156 0.000 -0.924) 1.479 3.509 ( -1.156 0.000 0.924) 1.479 3.575 ( -0.107 0.000 -6.885) 6.886 3.575 ( -0.107 0.000 6.885) 6.886 4.007 ( -9.476 0.000 -10.680) 14.278 4.007 ( -9.476 0.000 10.680) 14.278 4.349 ( -12.538 0.000 -9.854) 15.947 4.349 ( -12.538 0.000 9.854) 15.947 4.577 ( -9.851 0.000 -5.871) 11.468 4.577 ( -9.851 0.000 5.871) 11.468 5.876 ( 0.520 0.000 -5.222) 5.248 5.876 ( 0.520 0.000 5.222) 5.248 6.101 ( 0.555 0.000 -1.377) 1.485 6.101 ( 0.555 0.000 1.377) 1.485 6.334 ( 3.208 0.000 -2.844) 4.288 6.334 ( 3.208 0.000 2.844) 4.288 6.747 ( 7.620 0.000 -6.927) 10.298 6.747 ( 7.620 0.000 6.927) 10.298 6.873 ( -4.322 0.000 -10.580) 11.429 6.873 ( -4.322 0.000 10.580) 11.429 7.202 ( 1.340 0.000 -2.936) 3.228 7.202 ( 1.340 0.000 2.936) 3.228 8.830 ( 1.129 0.000 -0.014) 1.130 8.830 ( 1.129 0.000 0.014) 1.130 9.174 ( 4.460 0.000 -0.987) 4.568 9.174 ( 4.460 0.000 0.987) 4.568 9.187 ( -1.678 0.000 -0.196) 1.689 9.187 ( -1.678 0.000 0.196) 1.689 9.457 ( -6.005 0.000 -3.572) 6.987 9.457 ( -6.005 0.000 3.572) 6.987 9.604 ( 2.698 0.000 -1.258) 2.977 9.604 ( 2.698 0.000 1.258) 2.977 9.701 ( -2.661 0.000 -2.098) 3.389 9.701 ( -2.661 0.000 2.098) 3.389 10.223 ( -1.832 0.000 -1.288) 2.239 10.223 ( -1.832 0.000 1.288) 2.239 10.467 ( 1.261 0.000 -2.392) 2.704 10.467 ( 1.261 0.000 2.392) 2.704 10.958 ( -0.946 0.000 -2.738) 2.897 10.958 ( -0.946 0.000 2.738) 2.897 11.180 ( 1.165 0.000 -0.364) 1.220 11.180 ( 1.165 0.000 0.364) 1.220 11.648 ( 9.456 0.000 -2.360) 9.746 11.648 ( 9.456 0.000 2.360) 9.746 11.854 ( -5.597 0.000 -3.848) 6.793 11.854 ( -5.597 0.000 3.848) 6.793 12.323 ( 0.368 0.000 -0.919) 0.990 12.323 ( 0.368 0.000 0.919) 0.990 12.488 ( -0.176 0.000 -0.814) 0.832 12.488 ( -0.176 0.000 0.814) 0.832 12.993 ( 11.267 0.000 -2.108) 11.462 12.993 ( 11.267 0.000 2.108) 11.462 13.373 ( -11.866 0.000 -1.220) 11.929 13.373 ( -11.866 0.000 1.220) 11.929 14.300 ( 3.102 0.000 -1.943) 3.660 14.300 ( 3.102 0.000 1.943) 3.660 15.238 ( -1.950 0.000 -1.950) 2.757 15.238 ( -1.950 0.000 1.950) 2.757 15.741 ( 3.189 0.000 -1.434) 3.496 15.741 ( 3.189 0.000 1.434) 3.496 15.859 ( -3.108 0.000 -0.678) 3.181 15.859 ( -3.108 0.000 0.678) 3.181 17.225 ( 3.247 0.000 -8.286) 8.900 17.225 ( 3.247 0.000 8.286) 8.900 17.339 ( -6.245 0.000 -7.642) 9.869 17.339 ( -6.245 0.000 7.642) 9.869======================= Grid point 160 (52/72) =======================q-point: ( 0.00 0.07 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.344 ( 0.000 8.144 -9.280) 12.347 1.344 ( 0.000 8.144 9.280) 12.347 1.536 ( 0.000 16.736 -10.939) 19.994 1.536 ( 0.000 16.736 10.939) 19.994 2.635 ( 0.000 18.148 -22.752) 29.103 2.635 ( 0.000 18.148 22.752) 29.103 2.755 ( 0.000 19.462 -6.955) 20.668 2.755 ( 0.000 19.462 6.955) 20.668 2.908 ( 0.000 1.643 -2.621) 3.094 2.908 ( 0.000 1.643 2.621) 3.094 2.952 ( 0.000 0.833 -3.027) 3.140 2.952 ( 0.000 0.833 3.027) 3.140 3.178 ( 0.000 10.397 -1.209) 10.467 3.178 ( 0.000 10.397 1.209) 10.467 3.207 ( 0.000 14.249 -0.506) 14.258 3.207 ( 0.000 14.249 0.506) 14.258 3.278 ( 0.000 7.874 -4.698) 9.169 3.278 ( 0.000 7.874 4.698) 9.169 3.393 ( 0.000 14.762 -5.482) 15.747 3.393 ( 0.000 14.762 5.482) 15.747 3.734 ( 0.000 17.784 -1.985) 17.895 3.734 ( 0.000 17.784 1.985) 17.895 4.321 ( 0.000 -0.090 -12.732) 12.732 4.321 ( 0.000 -0.090 12.732) 12.732 4.699 ( 0.000 -0.544 -6.235) 6.258 4.699 ( 0.000 -0.544 6.235) 6.258 5.350 ( 0.000 -1.021 -9.629) 9.683 5.350 ( 0.000 -1.021 9.629) 9.683 5.592 ( 0.000 -1.708 -6.885) 7.093 5.592 ( 0.000 -1.708 6.885) 7.093 5.925 ( 0.000 -4.254 -6.665) 7.906 5.925 ( 0.000 -4.254 6.665) 7.906 6.284 ( 0.000 -4.141 -2.267) 4.721 6.284 ( 0.000 -4.141 2.267) 4.721 6.401 ( 0.000 -2.140 -2.870) 3.580 6.401 ( 0.000 -2.140 2.870) 3.580 6.837 ( 0.000 -5.465 -9.145) 10.654 6.837 ( 0.000 -5.465 9.145) 10.654 7.112 ( 0.000 -5.358 -7.859) 9.511 7.112 ( 0.000 -5.358 7.859) 9.511 8.898 ( 0.000 5.481 -1.078) 5.586 8.898 ( 0.000 5.481 1.078) 5.586 9.001 ( 0.000 1.681 -3.715) 4.078 9.001 ( 0.000 1.681 3.715) 4.078 9.245 ( 0.000 -1.373 -2.636) 2.972 9.245 ( 0.000 -1.373 2.636) 2.972 9.622 ( 0.000 2.661 -0.258) 2.673 9.622 ( 0.000 2.661 0.258) 2.673 9.713 ( 0.000 5.117 -0.533) 5.145 9.713 ( 0.000 5.117 0.533) 5.145 9.939 ( 0.000 12.934 -0.057) 12.934 9.939 ( 0.000 12.934 0.057) 12.934 10.299 ( 0.000 0.636 -1.729) 1.842 10.299 ( 0.000 0.636 1.729) 1.842 10.561 ( 0.000 13.275 -6.584) 14.818 10.561 ( 0.000 13.275 6.584) 14.818 10.921 ( 0.000 -4.680 -7.709) 9.019 10.921 ( 0.000 -4.680 7.709) 9.019 11.030 ( 0.000 0.861 -3.061) 3.180 11.030 ( 0.000 0.861 3.061) 3.180 11.616 ( 0.000 18.589 -1.086) 18.621 11.616 ( 0.000 18.589 1.086) 18.621 11.970 ( 0.000 -0.538 -5.299) 5.327 11.970 ( 0.000 -0.538 5.299) 5.327 12.362 ( 0.000 3.317 -2.055) 3.902 12.362 ( 0.000 3.317 2.055) 3.902 12.521 ( 0.000 4.303 -4.534) 6.251 12.521 ( 0.000 4.303 4.534) 6.251 12.746 ( 0.000 6.985 -3.185) 7.677 12.746 ( 0.000 6.985 3.185) 7.677 13.748 ( 0.000 0.297 -2.778) 2.794 13.748 ( 0.000 0.297 2.778) 2.794 14.093 ( 0.000 -1.777 -5.770) 6.038 14.093 ( 0.000 -1.777 5.770) 6.038 15.311 ( 0.000 -4.128 -0.706) 4.188 15.311 ( 0.000 -4.128 0.706) 4.188 15.566 ( 0.000 -4.080 -5.775) 7.071 15.566 ( 0.000 -4.080 5.775) 7.071 15.943 ( 0.000 -2.389 -0.363) 2.416 15.943 ( 0.000 -2.389 0.363) 2.416 17.112 ( 0.000 -4.869 -7.692) 9.104 17.112 ( 0.000 -4.869 7.692) 9.104 17.452 ( 0.000 -12.112 -3.063) 12.494 17.452 ( 0.000 -12.112 3.063) 12.494======================= Grid point 162 (53/72) =======================q-point: ( 0.20 0.07 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.487 ( 12.803 7.879 -13.354) 20.108 1.487 ( 12.803 7.879 13.354) 20.108 1.649 ( 10.604 16.384 -13.023) 23.462 1.649 ( 10.604 16.384 13.023) 23.462 2.559 ( -12.481 15.199 -8.754) 21.527 2.559 ( -12.481 15.199 8.754) 21.527 2.612 ( -16.338 4.285 -7.784) 18.597 2.612 ( -16.338 4.285 7.784) 18.597 2.833 ( 12.076 16.910 -34.064) 39.902 2.833 ( 12.076 16.910 34.064) 39.902 3.104 ( 5.603 5.718 -2.318) 8.335 3.104 ( 5.603 5.718 2.318) 8.335 3.216 ( 1.854 15.063 -1.915) 15.297 3.216 ( 1.854 15.063 1.915) 15.297 3.283 ( 8.384 10.585 -8.391) 15.898 3.283 ( 8.384 10.585 8.391) 15.898 3.426 ( 6.160 10.036 -3.275) 12.222 3.426 ( 6.160 10.036 3.275) 12.222 3.427 ( 8.483 7.684 -8.250) 14.109 3.427 ( 8.483 7.684 8.250) 14.109 3.730 ( -0.271 17.847 -1.795) 17.940 3.730 ( -0.271 17.847 1.795) 17.940 4.230 ( -8.131 0.749 -12.124) 14.618 4.230 ( -8.131 0.749 12.124) 14.618 4.637 ( -7.838 -0.518 -10.874) 13.415 4.637 ( -7.838 -0.518 10.874) 13.415 4.923 ( -25.198 -0.133 -14.317) 28.981 4.923 ( -25.198 -0.133 14.317) 28.981 5.827 ( 3.864 -2.713 -7.740) 9.066 5.827 ( 3.864 -2.713 7.740) 9.066 5.965 ( 8.555 -3.199 -3.855) 9.914 5.965 ( 8.555 -3.199 3.855) 9.914 6.237 ( -1.903 -5.459 -4.799) 7.513 6.237 ( -1.903 -5.459 4.799) 7.513 6.534 ( 9.479 -2.459 -2.148) 10.025 6.534 ( 9.479 -2.459 2.148) 10.025 6.857 ( 0.820 -5.312 -6.038) 8.084 6.857 ( 0.820 -5.312 6.038) 8.084 7.102 ( -0.496 -6.097 -5.325) 8.110 7.102 ( -0.496 -6.097 5.325) 8.110 8.903 ( 0.633 5.643 -1.851) 5.972 8.903 ( 0.633 5.643 1.851) 5.972 9.031 ( 1.990 -1.145 -1.837) 2.941 9.031 ( 1.990 -1.145 1.837) 2.941 9.258 ( 2.142 2.535 -2.092) 3.923 9.258 ( 2.142 2.535 2.092) 3.923 9.628 ( -1.749 0.813 -1.168) 2.255 9.628 ( -1.749 0.813 1.168) 2.255 9.683 ( -0.531 11.446 -0.441) 11.467 9.683 ( -0.531 11.446 0.441) 11.467 9.911 ( -2.718 12.795 -1.156) 13.132 9.911 ( -2.718 12.795 1.156) 13.132 10.256 ( -4.421 0.390 -2.116) 4.917 10.256 ( -4.421 0.390 2.116) 4.917 10.555 ( 1.617 10.246 -5.446) 11.715 10.555 ( 1.617 10.246 5.446) 11.715 10.879 ( -3.200 -5.034 -7.171) 9.327 10.879 ( -3.200 -5.034 7.171) 9.327 11.127 ( 5.931 -0.225 -1.499) 6.122 11.127 ( 5.931 -0.225 1.499) 6.122 11.638 ( 3.040 13.869 -2.695) 14.452 11.638 ( 3.040 13.869 2.695) 14.452 11.963 ( -1.252 2.641 -6.102) 6.766 11.963 ( -1.252 2.641 6.102) 6.766 12.369 ( 0.779 3.549 -3.474) 5.027 12.369 ( 0.779 3.549 3.474) 5.027 12.506 ( -1.420 3.109 -4.575) 5.711 12.506 ( -1.420 3.109 4.575) 5.711 12.846 ( 8.891 6.634 -2.471) 11.365 12.846 ( 8.891 6.634 2.471) 11.365 13.646 ( -8.837 2.363 -1.297) 9.239 13.646 ( -8.837 2.363 1.297) 9.239 14.157 ( 4.832 -3.702 -4.631) 7.648 14.157 ( 4.832 -3.702 4.631) 7.648 15.265 ( -3.471 -3.596 -2.564) 5.617 15.265 ( -3.471 -3.596 2.564) 5.617 15.613 ( 3.682 -4.570 -3.884) 7.037 15.613 ( 3.682 -4.570 3.884) 7.037 15.907 ( -3.164 -2.175 -0.583) 3.883 15.907 ( -3.164 -2.175 0.583) 3.883 17.124 ( 1.251 -5.032 -8.024) 9.553 17.124 ( 1.251 -5.032 8.024) 9.553 17.381 ( -5.896 -10.075 -5.740) 13.008 17.381 ( -5.896 -10.075 5.740) 13.008======================= Grid point 164 (54/72) =======================q-point: ( 0.40 0.07 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.805 ( 16.990 7.145 -16.036) 24.431 1.805 ( 16.990 7.145 16.036) 24.431 1.924 ( 14.577 14.486 -12.364) 23.984 1.924 ( 14.577 14.486 12.364) 23.984 2.225 ( -17.331 8.588 -12.139) 22.836 2.225 ( -17.331 8.588 12.139) 22.836 2.281 ( -15.790 15.342 -12.253) 25.196 2.281 ( -15.790 15.342 12.253) 25.196 3.107 ( 6.575 9.313 -5.216) 12.536 3.107 ( 6.575 9.313 5.216) 12.536 3.187 ( 2.000 11.337 -3.293) 11.974 3.187 ( 2.000 11.337 3.293) 11.974 3.294 ( 11.428 14.460 -11.658) 21.808 3.294 ( 11.428 14.460 11.658) 21.808 3.476 ( 5.558 9.547 -5.915) 12.531 3.476 ( 5.558 9.547 5.915) 12.531 3.507 ( 4.343 9.605 -2.914) 10.936 3.507 ( 4.343 9.605 2.914) 10.936 3.609 ( 2.824 6.298 -2.340) 7.288 3.609 ( 2.824 6.298 2.340) 7.288 3.739 ( 1.636 17.761 -1.720) 17.919 3.739 ( 1.636 17.761 1.720) 17.919 4.029 ( -9.260 2.808 -10.617) 14.365 4.029 ( -9.260 2.808 10.617) 14.365 4.357 ( -13.358 1.321 -9.881) 16.668 4.357 ( -13.358 1.321 9.881) 16.668 4.554 ( -9.916 -1.885 -6.154) 11.822 4.554 ( -9.916 -1.885 6.154) 11.822 5.849 ( 0.579 -2.546 -4.673) 5.353 5.849 ( 0.579 -2.546 4.673) 5.353 6.061 ( 0.205 -3.744 -1.469) 4.027 6.061 ( 0.205 -3.744 1.469) 4.027 6.273 ( 3.402 -5.589 -2.790) 7.113 6.273 ( 3.402 -5.589 2.790) 7.113 6.710 ( 7.018 -3.540 -6.327) 10.090 6.710 ( 7.018 -3.540 6.327) 10.090 6.831 ( -3.365 -3.800 -9.896) 11.122 6.831 ( -3.365 -3.800 9.896) 11.122 7.106 ( 0.540 -7.991 -3.354) 8.684 7.106 ( 0.540 -7.991 3.354) 8.684 8.920 ( 0.748 6.076 -0.970) 6.198 8.920 ( 0.748 6.076 0.970) 6.198 9.052 ( 0.119 -5.627 -0.522) 5.652 9.052 ( 0.119 -5.627 0.522) 5.652 9.356 ( 7.143 8.808 -0.566) 11.354 9.356 ( 7.143 8.808 0.566) 11.354 9.515 ( -7.550 8.593 -2.039) 11.619 9.515 ( -7.550 8.593 2.039) 11.619 9.734 ( 3.855 10.278 -1.141) 11.036 9.734 ( 3.855 10.278 1.141) 11.036 9.834 ( -4.371 10.811 -1.896) 11.814 9.834 ( -4.371 10.811 1.896) 11.814 10.169 ( -2.682 -1.363 -1.159) 3.224 10.169 ( -2.682 -1.363 1.159) 3.224 10.622 ( 3.405 11.387 -3.517) 12.394 10.622 ( 3.405 11.387 3.517) 12.394 10.808 ( -3.109 -8.984 -4.448) 10.496 10.808 ( -3.109 -8.984 4.448) 10.496 11.199 ( 1.295 -0.186 -0.820) 1.544 11.199 ( 1.295 -0.186 0.820) 1.544 11.754 ( 7.535 7.246 -3.472) 11.015 11.754 ( 7.535 7.246 3.472) 11.015 11.897 ( -5.481 5.440 -4.288) 8.833 11.897 ( -5.481 5.440 4.288) 8.833 12.393 ( 1.275 5.723 -2.968) 6.572 12.393 ( 1.275 5.723 2.968) 6.572 12.472 ( -1.504 -0.104 -3.171) 3.511 12.472 ( -1.504 -0.104 3.171) 3.511 13.055 ( 9.682 5.335 -1.019) 11.101 13.055 ( 9.682 5.335 1.019) 11.101 13.439 ( -9.600 5.895 -0.368) 11.271 13.439 ( -9.600 5.895 0.368) 11.271 14.240 ( 2.492 -5.798 -1.956) 6.608 14.240 ( 2.492 -5.798 1.956) 6.608 15.206 ( -1.740 -2.927 -1.567) 3.749 15.206 ( -1.740 -2.927 1.567) 3.749 15.682 ( 2.461 -5.539 -1.530) 6.252 15.682 ( 2.461 -5.539 1.530) 6.252 15.841 ( -2.480 -1.515 -0.677) 2.984 15.841 ( -2.480 -1.515 0.677) 2.984 17.165 ( 2.761 -5.617 -8.010) 10.166 17.165 ( 2.761 -5.617 8.010) 10.166 17.260 ( -5.050 -7.304 -7.762) 11.794 17.260 ( -5.050 -7.304 7.762) 11.794======================= Grid point 170 (55/72) =======================q-point: ( 0.00 0.13 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.589 ( 0.000 15.295 -4.694) 15.999 1.589 ( 0.000 15.295 4.694) 15.999 1.899 ( 0.000 18.603 -8.998) 20.665 1.899 ( 0.000 18.603 8.998) 20.665 2.902 ( 0.000 4.018 -6.054) 7.267 2.902 ( 0.000 4.018 6.054) 7.267 2.949 ( 0.000 3.880 -0.992) 4.005 2.949 ( 0.000 3.880 0.992) 4.005 3.186 ( 0.000 15.928 -2.885) 16.187 3.186 ( 0.000 15.928 2.885) 16.187 3.242 ( 0.000 15.654 -2.854) 15.912 3.242 ( 0.000 15.654 2.854) 15.912 3.361 ( 0.000 29.222 -14.978) 32.837 3.361 ( 0.000 29.222 14.978) 32.837 3.541 ( 0.000 17.751 -1.865) 17.849 3.541 ( 0.000 17.751 1.865) 17.849 3.710 ( 0.000 26.662 -1.801) 26.723 3.710 ( 0.000 26.662 1.801) 26.723 3.757 ( 0.000 20.011 -4.222) 20.451 3.757 ( 0.000 20.011 4.222) 20.451 4.178 ( 0.000 21.919 -1.462) 21.968 4.178 ( 0.000 21.919 1.462) 21.968 4.352 ( 0.000 5.364 -11.749) 12.915 4.352 ( 0.000 5.364 11.749) 12.915 4.722 ( 0.000 4.181 -7.721) 8.781 4.722 ( 0.000 4.181 7.721) 8.781 5.330 ( 0.000 -0.634 -13.070) 13.085 5.330 ( 0.000 -0.634 13.070) 13.085 5.567 ( 0.000 -0.022 -1.903) 1.903 5.567 ( 0.000 -0.022 1.903) 1.903 5.818 ( 0.000 -5.641 -2.479) 6.161 5.818 ( 0.000 -5.641 2.479) 6.161 6.164 ( 0.000 -7.392 -2.832) 7.916 6.164 ( 0.000 -7.392 2.832) 7.916 6.356 ( 0.000 -2.086 -3.700) 4.247 6.356 ( 0.000 -2.086 3.700) 4.247 6.712 ( 0.000 -6.188 -5.767) 8.459 6.712 ( 0.000 -6.188 5.767) 8.459 6.978 ( 0.000 -7.219 -6.320) 9.595 6.978 ( 0.000 -7.219 6.320) 9.595 8.859 ( 0.000 -4.217 -4.271) 6.002 8.859 ( 0.000 -4.217 4.271) 6.002 9.004 ( 0.000 -6.262 -1.855) 6.531 9.004 ( 0.000 -6.262 1.855) 6.531 9.439 ( 0.000 18.217 -2.519) 18.390 9.439 ( 0.000 18.217 2.519) 18.390 9.549 ( 0.000 -3.576 -0.667) 3.638 9.549 ( 0.000 -3.576 0.667) 3.638 9.996 ( 0.000 13.954 -0.214) 13.956 9.996 ( 0.000 13.954 0.214) 13.956 10.167 ( 0.000 9.365 -5.524) 10.872 10.167 ( 0.000 9.365 5.524) 10.872 10.420 ( 0.000 10.727 -0.467) 10.737 10.420 ( 0.000 10.727 0.467) 10.737 10.762 ( 0.000 1.241 -1.197) 1.724 10.762 ( 0.000 1.241 1.197) 1.724 10.972 ( 0.000 14.382 -3.742) 14.861 10.972 ( 0.000 14.382 3.742) 14.861 11.059 ( 0.000 2.900 -0.238) 2.910 11.059 ( 0.000 2.900 0.238) 2.910 11.896 ( 0.000 1.076 -6.548) 6.636 11.896 ( 0.000 1.076 6.548) 6.636 12.054 ( 0.000 15.198 -11.069) 18.802 12.054 ( 0.000 15.198 11.069) 18.802 12.431 ( 0.000 4.917 -6.858) 8.438 12.431 ( 0.000 4.917 6.858) 8.438 12.645 ( 0.000 6.453 -11.125) 12.861 12.645 ( 0.000 6.453 11.125) 12.861 12.917 ( 0.000 9.346 -0.524) 9.361 12.917 ( 0.000 9.346 0.524) 9.361 13.737 ( 0.000 -1.732 -1.645) 2.388 13.737 ( 0.000 -1.732 1.645) 2.388 14.047 ( 0.000 -2.422 -6.483) 6.921 14.047 ( 0.000 -2.422 6.483) 6.921 15.204 ( 0.000 -5.746 -1.144) 5.859 15.204 ( 0.000 -5.746 1.144) 5.859 15.456 ( 0.000 -6.336 -3.548) 7.261 15.456 ( 0.000 -6.336 3.548) 7.261 15.890 ( 0.000 -2.564 -2.793) 3.791 15.890 ( 0.000 -2.564 2.793) 3.791 16.971 ( 0.000 -8.740 -6.879) 11.122 16.971 ( 0.000 -8.740 6.879) 11.122 17.166 ( 0.000 -14.912 -6.716) 16.355 17.166 ( 0.000 -14.912 6.716) 16.355======================= Grid point 172 (56/72) =======================q-point: ( 0.20 0.13 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.718 ( 11.506 14.239 -7.515) 19.789 1.718 ( 11.506 14.239 7.515) 19.789 1.998 ( 9.405 17.259 -10.218) 22.152 1.998 ( 9.405 17.259 10.218) 22.152 2.678 ( -13.841 5.260 -5.918) 15.946 2.678 ( -13.841 5.260 5.918) 15.946 2.948 ( -9.139 15.960 -7.659) 19.922 2.948 ( -9.139 15.960 7.659) 19.922 3.206 ( 5.640 6.346 -5.354) 10.038 3.206 ( 5.640 6.346 5.354) 10.038 3.321 ( 5.759 24.282 -9.066) 26.552 3.321 ( 5.759 24.282 9.066) 26.552 3.443 ( 8.513 11.890 -8.323) 16.826 3.443 ( 8.513 11.890 8.323) 16.826 3.640 ( 6.702 21.712 -3.905) 23.056 3.640 ( 6.702 21.712 3.905) 23.056 3.731 ( 2.765 23.492 -8.216) 25.041 3.731 ( 2.765 23.492 8.216) 25.041 3.785 ( 2.609 20.807 -5.295) 21.629 3.785 ( 2.609 20.807 5.295) 21.629 4.164 ( -1.373 19.948 -2.714) 20.178 4.164 ( -1.373 19.948 2.714) 20.178 4.299 ( -4.444 9.343 -8.957) 13.685 4.299 ( -4.444 9.343 8.957) 13.685 4.657 ( -6.628 3.915 -7.833) 10.982 4.657 ( -6.628 3.915 7.833) 10.982 4.955 ( -23.459 4.611 -13.976) 27.693 4.955 ( -23.459 4.611 13.976) 27.693 5.754 ( 3.284 -4.251 -5.498) 7.686 5.754 ( 3.284 -4.251 5.498) 7.686 5.889 ( 9.144 -3.578 -2.838) 10.221 5.889 ( 9.144 -3.578 2.838) 10.221 6.098 ( -3.279 -7.866 -3.499) 9.212 6.098 ( -3.279 -7.866 3.499) 9.212 6.468 ( 7.893 -3.813 -1.901) 8.969 6.468 ( 7.893 -3.813 1.901) 8.969 6.732 ( 1.435 -6.128 -5.306) 8.232 6.732 ( 1.435 -6.128 5.306) 8.232 6.960 ( -1.483 -7.263 -4.937) 8.907 6.960 ( -1.483 -7.263 4.937) 8.907 8.881 ( 1.893 -4.210 -4.051) 6.141 8.881 ( 1.893 -4.210 4.051) 6.141 8.999 ( -0.507 -4.964 -1.726) 5.280 8.999 ( -0.507 -4.964 1.726) 5.280 9.485 ( 4.120 16.377 -2.048) 17.011 9.485 ( 4.120 16.377 2.048) 17.011 9.580 ( 3.227 -2.432 -0.229) 4.048 9.580 ( 3.227 -2.432 0.229) 4.048 10.002 ( 0.069 15.710 -0.872) 15.734 10.002 ( 0.069 15.710 0.872) 15.734 10.158 ( -0.927 9.930 -3.973) 10.736 10.158 ( -0.927 9.930 3.973) 10.736 10.337 ( -7.569 7.450 -1.500) 10.725 10.337 ( -7.569 7.450 1.500) 10.725 10.698 ( -4.510 1.549 -2.360) 5.321 10.698 ( -4.510 1.549 2.360) 5.321 10.957 ( -0.073 14.383 -4.566) 15.090 10.957 ( -0.073 14.383 4.566) 15.090 11.138 ( 4.862 2.721 -1.262) 5.713 11.138 ( 4.862 2.721 1.262) 5.713 11.831 ( -2.865 3.220 -2.938) 5.217 11.831 ( -2.865 3.220 2.938) 5.217 12.113 ( 2.296 12.300 -5.843) 13.809 12.113 ( 2.296 12.300 5.843) 13.809 12.432 ( 0.446 4.295 -5.615) 7.083 12.432 ( 0.446 4.295 5.615) 7.083 12.633 ( -1.478 8.044 -8.203) 11.583 12.633 ( -1.478 8.044 8.203) 11.583 13.000 ( 7.771 8.073 -2.583) 11.500 13.000 ( 7.771 8.073 2.583) 11.500 13.691 ( -4.455 1.346 -1.167) 4.798 13.691 ( -4.455 1.346 1.167) 4.798 14.057 ( 0.937 -5.453 -5.144) 7.555 14.057 ( 0.937 -5.453 5.144) 7.555 15.173 ( -2.367 -4.882 -1.576) 5.650 15.173 ( -2.367 -4.882 1.576) 5.650 15.490 ( 2.648 -7.069 -2.617) 7.990 15.490 ( 2.648 -7.069 2.617) 7.990 15.860 ( -2.642 -2.239 -2.470) 4.254 15.860 ( -2.642 -2.239 2.470) 4.254 16.980 ( 0.880 -8.901 -7.188) 11.475 16.980 ( 0.880 -8.901 7.188) 11.475 17.132 ( -2.984 -13.510 -7.411) 15.695 17.132 ( -2.984 -13.510 7.411) 15.695======================= Grid point 174 (57/72) =======================q-point: ( 0.40 0.13 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.997 ( 14.586 11.842 -12.205) 22.404 1.997 ( 14.586 11.842 12.205) 22.404 2.210 ( 3.858 12.294 -2.435) 13.113 2.210 ( 3.858 12.294 2.435) 13.113 2.434 ( -3.278 12.754 -4.489) 13.912 2.434 ( -3.278 12.754 4.489) 13.912 2.671 ( -15.589 18.500 -11.893) 26.958 2.671 ( -15.589 18.500 11.893) 26.958 3.346 ( 4.559 7.281 -2.148) 8.855 3.346 ( 4.559 7.281 2.148) 8.855 3.451 ( 7.020 18.005 -5.325) 20.046 3.451 ( 7.020 18.005 5.325) 20.046 3.554 ( -0.023 10.587 -2.546) 10.889 3.554 ( -0.023 10.587 2.546) 10.889 3.766 ( 4.161 14.547 -0.288) 15.133 3.766 ( 4.161 14.547 0.288) 15.133 3.835 ( 4.342 23.584 -9.760) 25.890 3.835 ( 4.342 23.584 9.760) 25.890 3.863 ( 5.376 17.088 -8.631) 19.885 3.863 ( 5.376 17.088 8.631) 19.885 4.145 ( 1.322 17.773 -5.345) 18.606 4.145 ( 1.322 17.773 5.345) 18.606 4.220 ( -1.687 19.396 -3.953) 19.867 4.220 ( -1.687 19.396 3.953) 19.867 4.459 ( -13.219 11.533 -7.566) 19.105 4.459 ( -13.219 11.533 7.566) 19.105 4.537 ( -12.247 2.382 -9.762) 15.842 4.537 ( -12.247 2.382 9.762) 15.842 5.784 ( 0.950 -3.444 -3.288) 4.856 5.784 ( 0.950 -3.444 3.288) 4.856 5.961 ( -1.071 -5.846 -1.647) 6.168 5.961 ( -1.071 -5.846 1.647) 6.168 6.131 ( 3.838 -7.657 -2.371) 8.887 6.131 ( 3.838 -7.657 2.371) 8.887 6.607 ( 4.665 -6.444 -3.615) 8.738 6.607 ( 4.665 -6.444 3.615) 8.738 6.742 ( -0.621 -4.312 -7.277) 8.481 6.742 ( -0.621 -4.312 7.277) 8.481 6.935 ( -0.666 -7.968 -3.359) 8.673 6.935 ( -0.666 -7.968 3.359) 8.673 8.920 ( 1.537 -5.280 -2.506) 6.043 8.920 ( 1.537 -5.280 2.506) 6.043 8.984 ( -0.769 -2.187 -1.528) 2.777 8.984 ( -0.769 -2.187 1.528) 2.777 9.561 ( 2.194 8.111 -0.525) 8.418 9.561 ( 2.194 8.111 0.525) 8.418 9.694 ( 7.140 7.200 -0.826) 10.174 9.694 ( 7.140 7.200 0.826) 10.174 9.973 ( -3.592 13.310 -0.856) 13.813 9.973 ( -3.592 13.310 0.856) 13.813 10.089 ( -5.084 13.701 -0.670) 14.630 10.089 ( -5.084 13.701 0.670) 14.630 10.220 ( -1.448 4.996 -0.410) 5.217 10.220 ( -1.448 4.996 0.410) 5.217 10.626 ( -2.043 -2.563 -1.176) 3.482 10.626 ( -2.043 -2.563 1.176) 3.482 10.970 ( 0.843 17.964 -2.057) 18.101 10.970 ( 0.843 17.964 2.057) 18.101 11.199 ( 1.014 1.488 -1.552) 2.377 11.199 ( 1.014 1.488 1.552) 2.377 11.828 ( 1.666 0.621 -1.593) 2.388 11.828 ( 1.666 0.621 1.593) 2.388 12.106 ( -1.871 13.362 -1.820) 13.614 12.106 ( -1.871 13.362 1.820) 13.614 12.456 ( 1.399 2.542 -2.812) 4.040 12.456 ( 1.399 2.542 2.812) 4.040 12.593 ( -1.768 9.835 -3.530) 10.597 12.593 ( -1.768 9.835 3.530) 10.597 13.180 ( 7.574 6.494 -1.961) 10.168 13.180 ( 7.574 6.494 1.961) 10.168 13.574 ( -5.565 6.538 -1.070) 8.653 13.574 ( -5.565 6.538 1.070) 8.653 14.077 ( 0.700 -9.688 -1.903) 9.898 14.077 ( 0.700 -9.688 1.903) 9.898 15.133 ( -1.146 -3.751 -0.832) 4.009 15.133 ( -1.146 -3.751 0.832) 4.009 15.537 ( 1.508 -8.050 -1.040) 8.256 15.537 ( 1.508 -8.050 1.040) 8.256 15.807 ( -1.770 -1.646 -1.189) 2.694 15.807 ( -1.770 -1.646 1.189) 2.694 17.009 ( 1.932 -9.459 -7.525) 12.241 17.009 ( 1.932 -9.459 7.525) 12.241 17.065 ( -3.072 -11.277 -7.789) 14.046 17.065 ( -3.072 -11.277 7.789) 14.046======================= Grid point 180 (58/72) =======================q-point: ( 0.00 0.20 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.939 ( 0.000 18.529 -1.659) 18.603 1.939 ( 0.000 18.529 1.659) 18.603 2.291 ( 0.000 19.822 -4.979) 20.438 2.291 ( 0.000 19.822 4.979) 20.438 2.963 ( 0.000 2.971 -4.412) 5.319 2.963 ( 0.000 2.971 4.412) 5.319 3.050 ( 0.000 5.321 -2.313) 5.802 3.050 ( 0.000 5.321 2.313) 5.802 3.295 ( 0.000 5.401 -2.038) 5.773 3.295 ( 0.000 5.401 2.038) 5.773 3.680 ( 0.000 16.400 -5.745) 17.377 3.680 ( 0.000 16.400 5.745) 17.377 3.848 ( 0.000 13.621 -1.903) 13.754 3.848 ( 0.000 13.621 1.903) 13.754 3.966 ( 0.000 17.781 -4.276) 18.288 3.966 ( 0.000 17.781 4.276) 18.288 4.191 ( 0.000 28.157 -2.133) 28.238 4.191 ( 0.000 28.157 2.133) 28.238 4.328 ( 0.000 31.249 -13.730) 34.133 4.328 ( 0.000 31.249 13.730) 34.133 4.374 ( 0.000 6.553 -12.838) 14.413 4.374 ( 0.000 6.553 12.838) 14.413 4.674 ( 0.000 14.234 -9.550) 17.141 4.674 ( 0.000 14.234 9.550) 17.141 4.929 ( 0.000 16.725 -3.733) 17.137 4.929 ( 0.000 16.725 3.733) 17.137 5.370 ( 0.000 6.689 -10.858) 12.753 5.370 ( 0.000 6.689 10.858) 12.753 5.592 ( 0.000 0.600 -0.076) 0.605 5.592 ( 0.000 0.600 0.076) 0.605 5.750 ( 0.000 1.587 -1.438) 2.142 5.750 ( 0.000 1.587 1.438) 2.142 6.006 ( 0.000 -6.865 -4.587) 8.257 6.006 ( 0.000 -6.865 4.587) 8.257 6.326 ( 0.000 -0.506 -4.011) 4.043 6.326 ( 0.000 -0.506 4.011) 4.043 6.609 ( 0.000 -3.403 -2.692) 4.339 6.609 ( 0.000 -3.403 2.692) 4.339 6.844 ( 0.000 -5.358 -3.627) 6.471 6.844 ( 0.000 -5.358 3.627) 6.471 8.763 ( 0.000 -5.282 -4.875) 7.188 8.763 ( 0.000 -5.282 4.875) 7.188 8.859 ( 0.000 -7.066 -0.500) 7.084 8.859 ( 0.000 -7.066 0.500) 7.084 9.449 ( 0.000 -3.454 -1.485) 3.760 9.449 ( 0.000 -3.454 1.485) 3.760 9.827 ( 0.000 14.161 -3.391) 14.562 9.827 ( 0.000 14.161 3.391) 14.562 10.143 ( 0.000 4.115 -2.134) 4.635 10.143 ( 0.000 4.115 2.134) 4.635 10.406 ( 0.000 10.114 -1.286) 10.195 10.406 ( 0.000 10.114 1.286) 10.195 10.542 ( 0.000 0.838 -10.292) 10.326 10.542 ( 0.000 0.838 10.292) 10.326 10.903 ( 0.000 14.054 -0.141) 14.055 10.903 ( 0.000 14.054 0.141) 14.055 11.155 ( 0.000 7.482 -3.281) 8.170 11.155 ( 0.000 7.482 3.281) 8.170 11.293 ( 0.000 13.849 -0.561) 13.860 11.293 ( 0.000 13.849 0.561) 13.860 11.848 ( 0.000 -3.607 -6.377) 7.326 11.848 ( 0.000 -3.607 6.377) 7.326 12.340 ( 0.000 9.509 -4.442) 10.496 12.340 ( 0.000 9.509 4.442) 10.496 12.613 ( 0.000 13.644 -4.050) 14.233 12.613 ( 0.000 13.644 4.050) 14.233 12.793 ( 0.000 9.262 -15.272) 17.861 12.793 ( 0.000 9.262 15.272) 17.861 13.110 ( 0.000 9.523 -4.094) 10.366 13.110 ( 0.000 9.523 4.094) 10.366 13.677 ( 0.000 -3.900 -1.819) 4.304 13.677 ( 0.000 -3.900 1.819) 4.304 14.011 ( 0.000 -0.605 -4.386) 4.428 14.011 ( 0.000 -0.605 4.386) 4.428 15.104 ( 0.000 -3.726 -1.376) 3.972 15.104 ( 0.000 -3.726 1.376) 3.972 15.323 ( 0.000 -6.377 -0.456) 6.393 15.323 ( 0.000 -6.377 0.456) 6.393 15.843 ( 0.000 -2.138 -4.041) 4.572 15.843 ( 0.000 -2.138 4.041) 4.572 16.765 ( 0.000 -11.383 -5.627) 12.697 16.765 ( 0.000 -11.383 5.627) 12.697 16.870 ( 0.000 -13.931 -6.794) 15.499 16.870 ( 0.000 -13.931 6.794) 15.499======================= Grid point 182 (59/72) =======================q-point: ( 0.20 0.20 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.041 ( 9.349 17.057 -1.627) 19.519 2.041 ( 9.349 17.057 1.627) 19.519 2.355 ( 6.040 17.897 -4.819) 19.493 2.355 ( 6.040 17.897 4.819) 19.493 2.809 ( -9.601 7.242 -3.399) 12.498 2.809 ( -9.601 7.242 3.399) 12.498 3.144 ( 2.602 5.485 -6.357) 8.790 3.144 ( 2.602 5.485 6.357) 8.790 3.336 ( 0.654 5.796 -3.920) 7.028 3.336 ( 0.654 5.796 3.920) 7.028 3.604 ( 0.417 10.559 -6.135) 12.219 3.604 ( 0.417 10.559 6.135) 12.219 3.844 ( -1.787 14.532 -3.545) 15.065 3.844 ( -1.787 14.532 3.545) 15.065 4.019 ( 2.332 13.106 -5.512) 14.407 4.019 ( 2.332 13.106 5.512) 14.407 4.205 ( 1.205 26.221 -1.880) 26.316 4.205 ( 1.205 26.221 1.880) 26.316 4.331 ( -0.195 20.502 -12.585) 24.057 4.331 ( -0.195 20.502 12.585) 24.057 4.408 ( 4.032 19.662 -12.806) 23.808 4.408 ( 4.032 19.662 12.806) 23.808 4.651 ( -1.804 15.483 -6.621) 16.936 4.651 ( -1.804 15.483 6.621) 16.936 4.862 ( -5.794 16.655 -4.089) 18.102 4.862 ( -5.794 16.655 4.089) 18.102 5.178 ( -12.945 17.843 -9.553) 24.025 5.178 ( -12.945 17.843 9.553) 24.025 5.666 ( 3.157 -3.762 -0.388) 4.927 5.666 ( 3.157 -3.762 0.388) 4.927 5.857 ( 8.263 1.118 -1.716) 8.513 5.857 ( 8.263 1.118 1.716) 8.513 5.938 ( -4.766 -6.556 -3.329) 8.762 5.938 ( -4.766 -6.556 3.329) 8.762 6.391 ( 4.710 -3.240 -1.712) 5.967 6.391 ( 4.710 -3.240 1.712) 5.967 6.633 ( 2.078 -3.119 -3.934) 5.433 6.633 ( 2.078 -3.119 3.934) 5.433 6.829 ( -1.307 -5.078 -2.999) 6.041 6.829 ( -1.307 -5.078 2.999) 6.041 8.781 ( 1.312 -5.592 -4.565) 7.337 8.781 ( 1.312 -5.592 4.565) 7.337 8.877 ( 1.565 -6.293 -2.121) 6.822 8.877 ( 1.565 -6.293 2.121) 6.822 9.471 ( 2.667 -4.158 -1.115) 5.064 9.471 ( 2.667 -4.158 1.115) 5.064 9.845 ( 1.092 12.486 -2.312) 12.745 9.845 ( 1.092 12.486 2.312) 12.745 10.180 ( 2.987 3.208 -1.414) 4.605 10.180 ( 2.987 3.208 1.414) 4.605 10.364 ( -4.116 8.342 -1.040) 9.360 10.364 ( -4.116 8.342 1.040) 9.360 10.459 ( -6.209 4.283 -7.239) 10.455 10.459 ( -6.209 4.283 7.239) 10.455 10.842 ( -5.062 14.112 -2.669) 15.228 10.842 ( -5.062 14.112 2.669) 15.228 11.199 ( 3.572 7.669 -6.427) 10.624 11.199 ( 3.572 7.669 6.427) 10.624 11.326 ( 2.304 14.340 -3.847) 15.025 11.326 ( 2.304 14.340 3.847) 15.025 11.831 ( -1.364 -1.461 -4.704) 5.111 11.831 ( -1.364 -1.461 4.704) 5.111 12.347 ( 1.732 8.466 -4.754) 9.862 12.347 ( 1.732 8.466 4.754) 9.862 12.596 ( -2.367 12.415 -4.029) 13.265 12.596 ( -2.367 12.415 4.029) 13.265 12.812 ( 0.536 9.463 -9.429) 13.370 12.812 ( 0.536 9.463 9.429) 13.370 13.173 ( 6.295 9.306 -5.058) 12.321 13.173 ( 6.295 9.306 5.058) 12.321 13.669 ( -0.467 -3.934 -2.926) 4.925 13.669 ( -0.467 -3.934 2.926) 4.925 13.978 ( -3.288 -1.245 -3.348) 4.854 13.978 ( -3.288 -1.245 3.348) 4.854 15.090 ( -1.113 -3.047 -1.364) 3.519 15.090 ( -1.113 -3.047 1.364) 3.519 15.345 ( 1.843 -6.682 -0.423) 6.944 15.345 ( 1.843 -6.682 0.423) 6.944 15.818 ( -2.103 -1.848 -3.589) 4.552 15.818 ( -2.103 -1.848 3.589) 4.552 16.772 ( 0.643 -11.420 -5.869) 12.856 16.772 ( 0.643 -11.420 5.869) 12.856 16.856 ( -1.264 -13.241 -6.862) 14.966 16.856 ( -1.264 -13.241 6.862) 14.966======================= Grid point 184 (60/72) =======================q-point: ( 0.40 0.20 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.270 ( 11.614 14.372 -6.484) 19.583 2.270 ( 11.614 14.372 6.484) 19.583 2.455 ( -2.406 12.381 -4.244) 13.308 2.455 ( -2.406 12.381 4.244) 13.308 2.698 ( 4.687 12.862 -6.384) 15.105 2.698 ( 4.687 12.862 6.384) 15.105 2.977 ( -14.593 11.773 -11.717) 22.110 2.977 ( -14.593 11.773 11.717) 22.110 3.425 ( 5.995 2.735 -3.518) 7.470 3.425 ( 5.995 2.735 3.518) 7.470 3.698 ( 1.841 4.672 -3.704) 6.240 3.698 ( 1.841 4.672 3.704) 6.240 3.817 ( 2.901 12.419 -2.944) 13.089 3.817 ( 2.901 12.419 2.944) 13.089 4.002 ( -3.957 8.308 -3.550) 9.863 4.002 ( -3.957 8.308 3.550) 9.863 4.224 ( 0.609 20.494 -1.022) 20.529 4.224 ( 0.609 20.494 1.022) 20.529 4.307 ( -1.691 14.798 -2.672) 15.133 4.307 ( -1.691 14.798 2.672) 15.133 4.535 ( 7.114 22.171 -12.157) 26.267 4.535 ( 7.114 22.171 12.157) 26.267 4.633 ( -0.419 23.344 -1.953) 23.429 4.633 ( -0.419 23.344 1.953) 23.429 4.759 ( -1.836 20.852 -3.977) 21.307 4.759 ( -1.836 20.852 3.977) 21.307 4.918 ( -11.427 27.316 -8.472) 30.798 4.918 ( -11.427 27.316 8.472) 30.798 5.728 ( 2.917 -1.532 -1.321) 3.550 5.728 ( 2.917 -1.532 1.321) 3.550 5.838 ( -3.768 -5.318 -2.058) 6.835 5.838 ( -3.768 -5.318 2.058) 6.835 6.001 ( 3.909 -3.926 -1.252) 5.680 6.001 ( 3.909 -3.926 1.252) 5.680 6.467 ( 2.073 -6.572 -0.336) 6.899 6.467 ( 2.073 -6.572 0.336) 6.899 6.675 ( 1.505 -1.994 -3.998) 4.714 6.675 ( 1.505 -1.994 3.998) 4.714 6.801 ( -1.094 -4.877 -2.363) 5.528 6.801 ( -1.094 -4.877 2.363) 5.528 8.801 ( 0.560 -6.282 -1.788) 6.555 8.801 ( 0.560 -6.282 1.788) 6.555 8.907 ( 0.959 -4.827 -0.918) 5.006 8.907 ( 0.959 -4.827 0.918) 5.006 9.566 ( 5.631 -3.434 -0.867) 6.653 9.566 ( 5.631 -3.434 0.867) 6.653 9.825 ( -3.422 1.377 -0.477) 3.720 9.825 ( -3.422 1.377 0.477) 3.720 10.221 ( 0.362 7.071 -0.622) 7.108 10.221 ( 0.362 7.071 0.622) 7.108 10.289 ( -1.253 8.691 -2.176) 9.047 10.289 ( -1.253 8.691 2.176) 9.047 10.368 ( -2.222 9.136 -3.408) 10.001 10.368 ( -2.222 9.136 3.408) 10.001 10.742 ( -3.501 12.989 -1.633) 13.552 10.742 ( -3.501 12.989 1.633) 13.552 11.269 ( 2.704 7.772 -6.301) 10.365 11.269 ( 2.704 7.772 6.301) 10.365 11.348 ( -0.367 14.511 -6.116) 15.752 11.348 ( -0.367 14.511 6.116) 15.752 11.822 ( 0.572 0.685 -2.100) 2.282 11.822 ( 0.572 0.685 2.100) 2.282 12.394 ( 1.447 13.778 -2.171) 14.022 12.394 ( 1.447 13.778 2.171) 14.022 12.543 ( -1.562 6.245 -1.567) 6.626 12.543 ( -1.562 6.245 1.567) 6.626 12.795 ( -1.335 9.183 -2.875) 9.715 12.795 ( -1.335 9.183 2.875) 9.715 13.312 ( 4.951 6.210 -2.998) 8.489 13.312 ( 4.951 6.210 2.998) 8.489 13.676 ( 1.211 2.526 -2.156) 3.535 13.676 ( 1.211 2.526 2.156) 3.535 13.892 ( -4.053 -6.203 -1.107) 7.492 13.892 ( -4.053 -6.203 1.107) 7.492 15.071 ( -0.507 -2.196 -0.630) 2.340 15.071 ( -0.507 -2.196 0.630) 2.340 15.380 ( 1.125 -6.935 -0.389) 7.036 15.380 ( 1.125 -6.935 0.389) 7.036 15.777 ( -1.403 -1.367 -1.631) 2.549 15.777 ( -1.403 -1.367 1.631) 2.549 16.791 ( 1.200 -11.795 -6.005) 13.290 16.791 ( 1.200 -11.795 6.005) 13.290 16.825 ( -1.561 -11.897 -6.412) 13.605 16.825 ( -1.561 -11.897 6.412) 13.605======================= Grid point 190 (61/72) =======================q-point: ( 0.00 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.320 ( 0.000 18.519 -1.026) 18.547 2.320 ( 0.000 18.519 1.026) 18.547 2.690 ( 0.000 18.914 -2.723) 19.109 2.690 ( 0.000 18.914 2.723) 19.109 3.029 ( 0.000 3.556 -3.555) 5.028 3.029 ( 0.000 3.556 3.555) 5.028 3.145 ( 0.000 3.905 -2.386) 4.576 3.145 ( 0.000 3.905 2.386) 4.576 3.448 ( 0.000 9.323 -2.430) 9.634 3.448 ( 0.000 9.323 2.430) 9.634 3.840 ( 0.000 2.541 -5.333) 5.908 3.840 ( 0.000 2.541 5.333) 5.908 4.071 ( 0.000 5.343 -3.429) 6.349 4.071 ( 0.000 5.343 3.429) 6.349 4.180 ( 0.000 7.866 -7.962) 11.192 4.180 ( 0.000 7.866 7.962) 11.192 4.493 ( 0.000 5.900 -9.483) 11.169 4.493 ( 0.000 5.900 9.483) 11.169 4.718 ( 0.000 18.974 -2.615) 19.154 4.718 ( 0.000 18.974 2.615) 19.154 4.748 ( 0.000 -1.378 -5.855) 6.014 4.748 ( 0.000 -1.378 5.855) 6.014 5.028 ( 0.000 31.491 -14.029) 34.474 5.028 ( 0.000 31.491 14.029) 34.474 5.289 ( 0.000 13.329 -8.747) 15.943 5.289 ( 0.000 13.329 8.747) 15.943 5.526 ( 0.000 2.199 -4.109) 4.660 5.526 ( 0.000 2.199 4.109) 4.660 5.656 ( 0.000 11.085 -5.055) 12.183 5.656 ( 0.000 11.085 5.055) 12.183 5.812 ( 0.000 3.934 -2.169) 4.492 5.812 ( 0.000 3.934 2.169) 4.492 6.066 ( 0.000 14.886 -3.960) 15.404 6.066 ( 0.000 14.886 3.960) 15.404 6.361 ( 0.000 4.779 -2.525) 5.405 6.361 ( 0.000 4.779 2.525) 5.405 6.597 ( 0.000 2.864 -1.456) 3.213 6.597 ( 0.000 2.864 1.456) 3.213 6.777 ( 0.000 -0.991 -0.284) 1.031 6.777 ( 0.000 -0.991 0.284) 1.031 8.643 ( 0.000 -6.418 -4.502) 7.840 8.643 ( 0.000 -6.418 4.502) 7.840 8.721 ( 0.000 -6.708 -2.785) 7.263 8.721 ( 0.000 -6.708 2.785) 7.263 9.411 ( 0.000 0.029 -2.151) 2.151 9.411 ( 0.000 0.029 2.151) 2.151 9.986 ( 0.000 3.369 -5.797) 6.705 9.986 ( 0.000 3.369 5.797) 6.705 10.201 ( 0.000 0.131 -2.490) 2.494 10.201 ( 0.000 0.131 2.490) 2.494 10.530 ( 0.000 3.781 -1.841) 4.206 10.530 ( 0.000 3.781 1.841) 4.206 10.571 ( 0.000 2.349 -15.971) 16.143 10.571 ( 0.000 2.349 15.971) 16.143 11.187 ( 0.000 10.469 -5.343) 11.753 11.187 ( 0.000 10.469 5.343) 11.753 11.282 ( 0.000 3.307 -5.812) 6.687 11.282 ( 0.000 3.307 5.812) 6.687 11.544 ( 0.000 10.182 -1.163) 10.248 11.544 ( 0.000 10.182 1.163) 10.248 11.808 ( 0.000 2.477 -2.910) 3.821 11.808 ( 0.000 2.477 2.910) 3.821 12.442 ( 0.000 1.491 -5.566) 5.762 12.442 ( 0.000 1.491 5.566) 5.762 12.927 ( 0.000 15.409 -0.730) 15.426 12.927 ( 0.000 15.409 0.730) 15.426 13.036 ( 0.000 13.518 -9.824) 16.711 13.036 ( 0.000 13.518 9.824) 16.711 13.305 ( 0.000 9.326 -6.019) 11.100 13.305 ( 0.000 9.326 6.019) 11.100 13.603 ( 0.000 -1.857 -3.670) 4.113 13.603 ( 0.000 -1.857 3.670) 4.113 14.041 ( 0.000 3.701 -0.163) 3.704 14.041 ( 0.000 3.701 0.163) 3.704 15.040 ( 0.000 -3.597 -0.542) 3.637 15.040 ( 0.000 -3.597 0.542) 3.637 15.224 ( 0.000 -2.450 -3.068) 3.926 15.224 ( 0.000 -2.450 3.068) 3.926 15.802 ( 0.000 -1.884 -3.451) 3.932 15.802 ( 0.000 -1.884 3.451) 3.932 16.519 ( 0.000 -12.378 -3.599) 12.891 16.519 ( 0.000 -12.378 3.599) 12.891 16.608 ( 0.000 -11.794 -4.726) 12.706 16.608 ( 0.000 -11.794 4.726) 12.706======================= Grid point 192 (62/72) =======================q-point: ( 0.20 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.391 ( 6.628 16.929 -1.172) 18.218 2.391 ( 6.628 16.929 1.172) 18.218 2.715 ( 2.024 16.890 -2.881) 17.253 2.715 ( 2.024 16.890 2.881) 17.253 2.956 ( -4.484 7.013 -2.582) 8.715 2.956 ( -4.484 7.013 2.582) 8.715 3.227 ( 4.780 3.048 -6.667) 8.751 3.227 ( 4.780 3.048 6.667) 8.751 3.468 ( -0.429 7.576 -5.190) 9.193 3.468 ( -0.429 7.576 5.190) 9.193 3.755 ( -2.992 5.006 -8.053) 9.942 3.755 ( -2.992 5.006 8.053) 9.942 3.997 ( -5.117 3.228 -4.771) 7.706 3.997 ( -5.117 3.228 4.771) 7.706 4.216 ( -0.699 5.512 -1.838) 5.853 4.216 ( -0.699 5.512 1.838) 5.853 4.512 ( 1.562 7.296 -6.697) 10.026 4.512 ( 1.562 7.296 6.697) 10.026 4.659 ( -3.048 13.896 -7.218) 15.952 4.659 ( -3.048 13.896 7.218) 15.952 4.809 ( 4.170 7.034 -2.437) 8.533 4.809 ( 4.170 7.034 2.437) 8.533 5.074 ( 4.042 28.904 -12.146) 31.611 5.074 ( 4.042 28.904 12.146) 31.611 5.218 ( -5.276 13.590 -7.101) 16.216 5.218 ( -5.276 13.590 7.101) 16.216 5.530 ( -2.390 10.826 -3.009) 11.488 5.530 ( -2.390 10.826 3.009) 11.488 5.665 ( 2.756 6.558 -5.894) 9.238 5.665 ( 2.756 6.558 5.894) 9.238 5.842 ( 1.318 3.075 -3.951) 5.177 5.842 ( 1.318 3.075 3.951) 5.177 6.037 ( -1.462 14.494 -2.719) 14.819 6.037 ( -1.462 14.494 2.719) 14.819 6.379 ( 1.244 3.412 -2.346) 4.323 6.379 ( 1.244 3.412 2.346) 4.323 6.622 ( 2.213 2.381 -1.755) 3.694 6.622 ( 2.213 2.381 1.755) 3.694 6.768 ( -0.829 -0.692 -0.741) 1.310 6.768 ( -0.829 -0.692 0.741) 1.310 8.654 ( 0.751 -6.731 -3.890) 7.811 8.654 ( 0.751 -6.731 3.890) 7.811 8.750 ( 2.602 -6.275 -2.521) 7.246 8.750 ( 2.602 -6.275 2.521) 7.246 9.416 ( 1.394 -0.864 -2.238) 2.774 9.416 ( 1.394 -0.864 2.238) 2.774 9.987 ( -4.210 2.967 -2.298) 5.639 9.987 ( -4.210 2.967 2.298) 5.639 10.164 ( 0.155 -3.289 -0.960) 3.430 10.164 ( 0.155 -3.289 0.960) 3.430 10.508 ( -2.245 4.620 -0.767) 5.194 10.508 ( -2.245 4.620 0.767) 5.194 10.553 ( -0.154 5.734 -10.045) 11.568 10.553 ( -0.154 5.734 10.045) 11.568 11.132 ( -6.395 10.449 -7.025) 14.122 11.132 ( -6.395 10.449 7.025) 14.122 11.326 ( 5.017 3.677 -9.479) 11.338 11.326 ( 5.017 3.677 9.479) 11.338 11.555 ( 0.186 7.858 -6.526) 10.216 11.555 ( 0.186 7.858 6.526) 10.216 11.865 ( 4.745 7.041 -4.741) 9.725 11.865 ( 4.745 7.041 4.741) 9.725 12.444 ( 2.118 1.777 -4.656) 5.415 12.444 ( 2.118 1.777 4.656) 5.415 12.900 ( -4.780 15.202 -4.406) 16.533 12.900 ( -4.780 15.202 4.406) 16.533 13.010 ( -1.276 10.504 -9.629) 14.306 13.010 ( -1.276 10.504 9.629) 14.306 13.365 ( 3.326 6.719 -5.342) 9.206 13.365 ( 3.326 6.719 5.342) 9.206 13.583 ( 0.832 -0.433 -3.299) 3.429 13.583 ( 0.832 -0.433 3.299) 3.429 14.015 ( -3.030 4.369 -1.597) 5.551 14.015 ( -3.030 4.369 1.597) 5.551 15.034 ( -0.424 -3.372 -0.442) 3.427 15.034 ( -0.424 -3.372 0.442) 3.427 15.246 ( 1.899 -2.176 -2.998) 4.163 15.246 ( 1.899 -2.176 2.998) 4.163 15.783 ( -1.637 -1.651 -3.079) 3.859 15.783 ( -1.637 -1.651 3.079) 3.859 16.527 ( 0.731 -12.194 -3.630) 12.744 16.527 ( 0.731 -12.194 3.630) 12.744 16.603 ( -0.474 -11.556 -4.527) 12.420 16.603 ( -0.474 -11.556 4.527) 12.420======================= Grid point 194 (63/72) =======================q-point: ( 0.40 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.560 ( 8.848 13.839 -1.629) 16.507 2.560 ( 8.848 13.839 1.629) 16.507 2.709 ( -4.412 12.162 -4.224) 13.609 2.709 ( -4.412 12.162 4.224) 13.609 2.949 ( 5.693 11.433 -4.987) 13.711 2.949 ( 5.693 11.433 4.987) 13.711 3.163 ( -10.533 6.640 -10.087) 16.024 3.163 ( -10.533 6.640 10.087) 16.024 3.495 ( 4.312 4.789 -2.191) 6.807 3.495 ( 4.312 4.789 2.191) 6.807 3.777 ( -0.021 4.082 -3.387) 5.304 3.777 ( -0.021 4.082 3.387) 5.304 3.945 ( 3.794 2.704 -0.981) 4.761 3.945 ( 3.794 2.704 0.981) 4.761 4.111 ( -8.457 2.738 -2.052) 9.123 4.111 ( -8.457 2.738 2.052) 9.123 4.537 ( 0.715 9.407 -4.035) 10.261 4.537 ( 0.715 9.407 4.035) 10.261 4.620 ( -0.887 16.193 -4.382) 16.799 4.620 ( -0.887 16.193 4.382) 16.799 4.919 ( 6.426 10.267 -8.298) 14.682 4.919 ( 6.426 10.267 8.298) 14.682 5.056 ( -6.425 14.111 -8.341) 17.606 5.056 ( -6.425 14.111 8.341) 17.606 5.227 ( 6.130 21.574 -6.058) 23.232 5.227 ( 6.130 21.574 6.058) 23.232 5.427 ( -6.245 21.618 -4.568) 22.961 5.427 ( -6.245 21.618 4.568) 22.961 5.745 ( 3.948 5.254 -5.164) 8.358 5.745 ( 3.948 5.254 5.164) 8.358 5.824 ( -2.595 4.498 -5.321) 7.435 5.824 ( -2.595 4.498 5.321) 7.435 6.040 ( 0.933 9.952 -0.594) 10.013 6.040 ( 0.933 9.952 0.594) 10.013 6.397 ( 0.457 1.698 -1.075) 2.060 6.397 ( 0.457 1.698 1.075) 2.060 6.669 ( 1.855 1.564 -1.515) 2.861 6.669 ( 1.855 1.564 1.515) 2.861 6.747 ( -1.072 -0.223 -1.098) 1.550 6.747 ( -1.072 -0.223 1.098) 1.550 8.666 ( 0.308 -7.009 -1.377) 7.149 8.666 ( 0.308 -7.009 1.377) 7.149 8.800 ( 1.608 -5.547 -0.910) 5.846 8.800 ( 1.608 -5.547 0.910) 5.846 9.503 ( 6.929 -2.141 -2.248) 7.592 9.503 ( 6.929 -2.141 2.248) 7.592 9.782 ( -11.642 -3.737 -2.293) 12.440 9.782 ( -11.642 -3.737 2.293) 12.440 10.263 ( 6.736 0.556 -4.467) 8.102 10.263 ( 6.736 0.556 4.467) 8.102 10.417 ( -5.723 3.879 -4.566) 8.285 10.417 ( -5.723 3.879 4.566) 8.285 10.609 ( 3.763 10.830 -3.760) 12.066 10.609 ( 3.763 10.830 3.760) 12.066 10.977 ( -6.569 7.161 -4.896) 10.881 10.977 ( -6.569 7.161 4.896) 10.881 11.440 ( 5.312 5.290 -10.931) 13.255 11.440 ( 5.312 5.290 10.931) 13.255 11.528 ( -2.969 7.180 -10.765) 13.276 11.528 ( -2.969 7.180 10.765) 13.276 11.957 ( 3.225 11.875 -2.509) 12.559 11.957 ( 3.225 11.875 2.509) 12.559 12.559 ( 7.875 3.612 -1.299) 8.761 12.559 ( 7.875 3.612 1.299) 8.761 12.758 ( -7.694 11.552 -2.309) 14.071 12.758 ( -7.694 11.552 2.309) 14.071 12.962 ( -2.861 8.385 -3.972) 9.709 12.962 ( -2.861 8.385 3.972) 9.709 13.369 ( -1.021 -1.938 -1.263) 2.529 13.369 ( -1.021 -1.938 1.263) 2.529 13.715 ( 9.889 5.892 -2.882) 11.866 13.715 ( 9.889 5.892 2.882) 11.866 13.905 ( -7.774 5.564 -3.656) 10.235 13.905 ( -7.774 5.564 3.656) 10.235 15.027 ( -0.223 -3.117 -0.163) 3.129 15.027 ( -0.223 -3.117 0.163) 3.129 15.283 ( 1.247 -1.728 -1.470) 2.589 15.283 ( 1.247 -1.728 1.470) 2.589 15.751 ( -1.086 -1.233 -1.408) 2.163 15.751 ( -1.086 -1.233 1.408) 2.163 16.545 ( 0.746 -11.969 -2.554) 12.262 16.545 ( 0.746 -11.969 2.554) 12.262 16.590 ( -0.604 -11.125 -2.891) 11.511 16.590 ( -0.604 -11.125 2.891) 11.511======================= Grid point 200 (64/72) =======================q-point: ( 0.00 0.33 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.676 ( 0.000 16.190 -1.184) 16.233 2.676 ( 0.000 16.190 1.184) 16.233 3.018 ( 0.000 10.898 -1.966) 11.074 3.018 ( 0.000 10.898 1.966) 11.074 3.118 ( 0.000 6.443 -1.446) 6.603 3.118 ( 0.000 6.443 1.446) 6.603 3.214 ( 0.000 3.271 -0.858) 3.382 3.214 ( 0.000 3.271 0.858) 3.382 3.650 ( 0.000 9.978 -3.616) 10.613 3.650 ( 0.000 9.978 3.616) 10.613 3.873 ( 0.000 1.937 -5.389) 5.727 3.873 ( 0.000 1.937 5.389) 5.727 4.103 ( 0.000 -0.288 -4.762) 4.771 4.103 ( 0.000 -0.288 4.762) 4.771 4.300 ( 0.000 3.213 -5.442) 6.320 4.300 ( 0.000 3.213 5.442) 6.320 4.539 ( 0.000 -2.675 -13.211) 13.479 4.539 ( 0.000 -2.675 13.211) 13.479 4.660 ( 0.000 -2.163 -9.083) 9.337 4.660 ( 0.000 -2.163 9.083) 9.337 4.952 ( 0.000 0.308 -2.976) 2.992 4.952 ( 0.000 0.308 2.976) 2.992 5.368 ( 0.000 -0.998 -3.580) 3.716 5.368 ( 0.000 -0.998 3.580) 3.716 5.434 ( 0.000 4.986 -8.706) 10.033 5.434 ( 0.000 4.986 8.706) 10.033 5.667 ( 0.000 16.106 -2.176) 16.252 5.667 ( 0.000 16.106 2.176) 16.252 5.964 ( 0.000 17.032 -0.970) 17.060 5.964 ( 0.000 17.032 0.970) 17.060 6.050 ( 0.000 17.352 -6.043) 18.374 6.050 ( 0.000 17.352 6.043) 18.374 6.420 ( 0.000 15.361 -4.161) 15.914 6.420 ( 0.000 15.361 4.161) 15.914 6.512 ( 0.000 10.576 -3.861) 11.259 6.512 ( 0.000 10.576 3.861) 11.259 6.719 ( 0.000 6.415 -1.720) 6.642 6.719 ( 0.000 6.415 1.720) 6.642 6.829 ( 0.000 7.941 -0.661) 7.969 6.829 ( 0.000 7.941 0.661) 7.969 8.510 ( 0.000 -6.365 -3.751) 7.388 8.510 ( 0.000 -6.365 3.751) 7.388 8.582 ( 0.000 -6.929 -4.721) 8.384 8.582 ( 0.000 -6.929 4.721) 8.384 9.453 ( 0.000 3.931 -2.901) 4.885 9.453 ( 0.000 3.931 2.901) 4.885 10.039 ( 0.000 2.761 -7.533) 8.023 10.039 ( 0.000 2.761 7.533) 8.023 10.149 ( 0.000 -4.632 -1.482) 4.863 10.149 ( 0.000 -4.632 1.482) 4.863 10.569 ( 0.000 0.101 -5.468) 5.468 10.569 ( 0.000 0.101 5.468) 5.468 10.638 ( 0.000 4.156 -7.301) 8.401 10.638 ( 0.000 4.156 7.301) 8.401 11.240 ( 0.000 -5.159 -17.239) 17.994 11.240 ( 0.000 -5.159 17.239) 17.994 11.299 ( 0.000 0.189 -7.404) 7.406 11.299 ( 0.000 0.189 7.404) 7.406 11.676 ( 0.000 3.755 -11.197) 11.810 11.676 ( 0.000 3.755 11.197) 11.810 11.996 ( 0.000 12.378 -3.048) 12.748 11.996 ( 0.000 12.378 3.048) 12.748 12.429 ( 0.000 -2.141 -7.244) 7.553 12.429 ( 0.000 -2.141 7.244) 7.553 13.176 ( 0.000 8.665 -2.138) 8.925 13.176 ( 0.000 8.665 2.138) 8.925 13.308 ( 0.000 11.470 -9.204) 14.706 13.308 ( 0.000 11.470 9.204) 14.706 13.430 ( 0.000 5.027 -2.872) 5.790 13.430 ( 0.000 5.027 2.872) 5.790 13.710 ( 0.000 11.793 -1.451) 11.882 13.710 ( 0.000 11.793 1.451) 11.882 14.150 ( 0.000 6.432 -3.646) 7.394 14.150 ( 0.000 6.432 3.646) 7.394 14.937 ( 0.000 -6.148 -2.737) 6.730 14.937 ( 0.000 -6.148 2.737) 6.730 15.230 ( 0.000 2.233 -3.087) 3.810 15.230 ( 0.000 2.233 3.087) 3.810 15.766 ( 0.000 -1.683 -1.923) 2.556 15.766 ( 0.000 -1.683 1.923) 2.556 16.280 ( 0.000 -10.774 -2.687) 11.104 16.280 ( 0.000 -10.774 2.687) 11.104 16.391 ( 0.000 -9.407 -3.315) 9.974 16.391 ( 0.000 -9.407 3.315) 9.974======================= Grid point 202 (65/72) =======================q-point: ( 0.20 0.33 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.716 ( 3.847 14.792 -1.454) 15.353 2.716 ( 3.847 14.792 1.454) 15.353 2.997 ( -2.149 9.334 -2.911) 10.010 2.997 ( -2.149 9.334 2.911) 10.010 3.103 ( 0.130 8.030 -2.002) 8.277 3.103 ( 0.130 8.030 2.002) 8.277 3.273 ( 2.997 1.627 -5.577) 6.537 3.273 ( 2.997 1.627 5.577) 6.537 3.639 ( -1.748 8.954 -4.059) 9.985 3.639 ( -1.748 8.954 4.059) 9.985 3.848 ( 0.576 4.854 -7.088) 8.609 3.848 ( 0.576 4.854 7.088) 8.609 4.040 ( -5.141 1.761 -5.265) 7.566 4.040 ( -5.141 1.761 5.265) 7.566 4.278 ( -3.312 1.698 -2.467) 4.465 4.278 ( -3.312 1.698 2.467) 4.465 4.573 ( 2.890 -2.523 -12.858) 13.418 4.573 ( 2.890 -2.523 12.858) 13.418 4.733 ( 6.301 -0.139 -7.437) 9.748 4.733 ( 6.301 -0.139 7.437) 9.748 4.916 ( -2.373 -1.508 -8.153) 8.625 4.916 ( -2.373 -1.508 8.153) 8.625 5.360 ( -5.239 2.607 -9.142) 10.854 5.360 ( -5.239 2.607 9.142) 10.854 5.430 ( 3.420 4.846 -2.274) 6.352 5.430 ( 3.420 4.846 2.274) 6.352 5.701 ( 2.760 11.651 -1.974) 12.135 5.701 ( 2.760 11.651 1.974) 12.135 5.949 ( -0.522 18.338 -1.920) 18.446 5.949 ( -0.522 18.338 1.920) 18.446 6.069 ( 0.681 16.087 -5.640) 17.060 6.069 ( 0.681 16.087 5.640) 17.060 6.404 ( -1.139 17.912 -3.429) 18.273 6.404 ( -1.139 17.912 3.429) 18.273 6.521 ( 0.603 9.377 -3.017) 9.869 6.521 ( 0.603 9.377 3.017) 9.869 6.724 ( 0.553 5.901 -1.425) 6.096 6.724 ( 0.553 5.901 1.425) 6.096 6.826 ( -0.384 7.809 -0.688) 7.848 6.826 ( -0.384 7.809 0.688) 7.848 8.516 ( 0.483 -6.517 -2.227) 6.904 8.516 ( 0.483 -6.517 2.227) 6.904 8.620 ( 3.319 -6.431 -2.449) 7.641 8.620 ( 3.319 -6.431 2.449) 7.641 9.439 ( -0.291 2.972 -3.217) 4.389 9.439 ( -0.291 2.972 3.217) 4.389 9.991 ( -12.259 -2.634 -1.559) 12.635 9.991 ( -12.259 -2.634 1.559) 12.635 10.127 ( 6.515 0.968 -6.656) 9.363 10.127 ( 6.515 0.968 6.656) 9.363 10.543 ( -2.029 -0.669 -6.693) 7.026 10.543 ( -2.029 -0.669 6.693) 7.026 10.670 ( 2.358 5.427 -3.993) 7.138 10.670 ( 2.358 5.427 3.993) 7.138 11.177 ( -5.995 -4.693 -13.921) 15.867 11.177 ( -5.995 -4.693 13.921) 15.867 11.366 ( 5.155 1.240 -3.837) 6.545 11.366 ( 5.155 1.240 3.837) 6.545 11.690 ( 1.431 4.608 -8.860) 10.089 11.690 ( 1.431 4.608 8.860) 10.089 12.071 ( 6.176 10.807 -5.733) 13.704 12.071 ( 6.176 10.807 5.733) 13.704 12.451 ( 3.659 -0.422 -6.346) 7.338 12.451 ( 3.659 -0.422 6.346) 7.338 13.104 ( -7.579 6.146 -1.578) 9.884 13.104 ( -7.579 6.146 1.578) 9.884 13.269 ( -5.136 9.133 -11.740) 15.736 13.269 ( -5.136 9.133 11.740) 15.736 13.397 ( -1.771 5.275 -3.274) 6.457 13.397 ( -1.771 5.275 3.274) 6.457 13.755 ( 5.155 12.409 -1.725) 13.548 13.755 ( 5.155 12.409 1.725) 13.548 14.134 ( -2.006 6.904 -4.982) 8.747 14.134 ( -2.006 6.904 4.982) 8.747 14.932 ( -0.397 -6.336 -2.136) 6.698 14.932 ( -0.397 -6.336 2.136) 6.698 15.262 ( 2.758 2.993 -3.211) 5.184 15.262 ( 2.758 2.993 3.211) 5.184 15.751 ( -1.294 -1.524 -1.763) 2.665 15.751 ( -1.294 -1.524 1.763) 2.665 16.293 ( 1.159 -10.507 -2.620) 10.890 16.293 ( 1.159 -10.507 2.620) 10.890 16.388 ( -0.324 -9.436 -3.149) 9.953 16.388 ( -0.324 -9.436 3.149) 9.953======================= Grid point 204 (66/72) =======================q-point: ( 0.40 0.33 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.821 ( 5.857 11.628 -0.713) 13.040 2.821 ( 5.857 11.628 0.713) 13.040 2.931 ( -4.302 9.319 -2.155) 10.488 2.931 ( -4.302 9.319 2.155) 10.488 3.143 ( 3.883 7.246 -2.920) 8.724 3.143 ( 3.883 7.246 2.920) 8.724 3.249 ( -5.111 2.120 -6.920) 8.860 3.249 ( -5.111 2.120 6.920) 8.860 3.634 ( 1.813 8.757 -0.979) 8.997 3.634 ( 1.813 8.757 0.979) 8.997 3.879 ( -1.687 5.857 -2.032) 6.425 3.879 ( -1.687 5.857 2.032) 6.425 3.992 ( 4.330 2.698 -1.663) 5.366 3.992 ( 4.330 2.698 1.663) 5.366 4.161 ( -7.261 2.942 -2.261) 8.154 4.161 ( -7.261 2.942 2.261) 8.154 4.623 ( 1.437 -1.222 -6.581) 6.846 4.623 ( 1.437 -1.222 6.581) 6.846 4.823 ( 0.445 2.822 -3.939) 4.865 4.823 ( 0.445 2.822 3.939) 4.865 4.939 ( 5.499 -5.216 -1.425) 7.712 4.939 ( 5.499 -5.216 1.425) 7.712 5.220 ( -6.767 3.571 -5.544) 9.449 5.220 ( -6.767 3.571 5.544) 9.449 5.500 ( 2.316 8.034 -0.866) 8.406 5.500 ( 2.316 8.034 0.866) 8.406 5.746 ( 1.022 5.532 -0.484) 5.647 5.746 ( 1.022 5.532 0.484) 5.647 5.967 ( 2.102 18.941 -3.809) 19.434 5.967 ( 2.102 18.941 3.809) 19.434 6.053 ( -1.966 15.968 -4.913) 16.823 6.053 ( -1.966 15.968 4.913) 16.823 6.389 ( -0.263 20.528 -1.222) 20.566 6.389 ( -0.263 20.528 1.222) 20.566 6.530 ( 0.255 8.463 -1.102) 8.538 6.530 ( 0.255 8.463 1.102) 8.538 6.738 ( 0.574 4.812 -0.609) 4.884 6.738 ( 0.574 4.812 0.609) 4.884 6.815 ( -0.480 7.828 -0.408) 7.853 6.815 ( -0.480 7.828 0.408) 7.853 8.526 ( 0.370 -6.293 -0.632) 6.335 8.526 ( 0.370 -6.293 0.632) 6.335 8.684 ( 2.093 -5.805 -0.523) 6.193 8.684 ( 2.093 -5.805 0.523) 6.193 9.489 ( 5.874 0.799 -3.139) 6.708 9.489 ( 5.874 0.799 3.139) 6.708 9.713 ( -12.830 -2.654 -2.725) 13.382 9.713 ( -12.830 -2.654 2.725) 13.382 10.280 ( 6.734 1.338 -5.463) 8.774 10.280 ( 6.734 1.338 5.463) 8.774 10.473 ( -4.274 1.101 -4.118) 6.036 10.473 ( -4.274 1.101 4.118) 6.036 10.747 ( 4.735 3.900 -4.394) 7.545 10.747 ( 4.735 3.900 4.394) 7.545 11.022 ( -7.409 -1.696 -8.287) 11.245 11.022 ( -7.409 -1.696 8.287) 11.245 11.455 ( 2.695 -0.153 -1.321) 3.005 11.455 ( 2.695 -0.153 1.321) 3.005 11.719 ( 0.773 7.088 -2.751) 7.642 11.719 ( 0.773 7.088 2.751) 7.642 12.189 ( 4.143 9.452 -2.615) 10.646 12.189 ( 4.143 9.452 2.615) 10.646 12.620 ( 12.175 2.927 -4.322) 13.247 12.620 ( 12.175 2.927 4.322) 13.247 12.898 ( -12.127 3.943 -4.217) 13.431 12.898 ( -12.127 3.943 4.217) 13.431 13.093 ( -7.693 0.639 -1.775) 7.921 13.093 ( -7.693 0.639 1.775) 7.921 13.406 ( 0.962 10.221 -1.491) 10.374 13.406 ( 0.962 10.221 1.491) 10.374 13.896 ( 7.461 9.321 -4.631) 12.806 13.896 ( 7.461 9.321 4.631) 12.806 14.057 ( -5.355 9.052 -5.879) 12.049 14.057 ( -5.355 9.052 5.879) 12.049 14.925 ( -0.210 -6.587 -0.777) 6.636 14.925 ( -0.210 -6.587 0.778) 6.636 15.315 ( 1.709 4.109 -1.608) 4.732 15.315 ( 1.709 4.109 1.608) 4.732 15.725 ( -0.877 -1.341 -0.855) 1.816 15.725 ( -0.877 -1.341 0.855) 1.816 16.319 ( 1.051 -9.953 -1.741) 10.159 16.319 ( 1.051 -9.953 1.741) 10.159 16.378 ( -0.560 -9.597 -1.952) 9.810 16.378 ( -0.560 -9.597 1.952) 9.810======================= Grid point 210 (67/72) =======================q-point: ( 0.00 0.40 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.967 ( 0.000 12.093 -1.060) 12.140 2.967 ( 0.000 12.093 1.060) 12.140 3.123 ( 0.000 2.589 -0.364) 2.615 3.123 ( 0.000 2.589 0.364) 2.615 3.233 ( 0.000 2.536 -0.809) 2.662 3.233 ( 0.000 2.536 0.809) 2.662 3.311 ( 0.000 4.903 -1.361) 5.089 3.311 ( 0.000 4.903 1.361) 5.089 3.842 ( 0.000 8.968 -1.876) 9.162 3.842 ( 0.000 8.968 1.876) 9.162 3.941 ( 0.000 4.517 -2.986) 5.414 3.941 ( 0.000 4.517 2.986) 5.414 4.089 ( 0.000 -0.833 -3.742) 3.834 4.089 ( 0.000 -0.833 3.742) 3.834 4.308 ( 0.000 -2.239 -0.089) 2.241 4.308 ( 0.000 -2.239 0.089) 2.241 4.445 ( 0.000 -4.019 -9.526) 10.339 4.445 ( 0.000 -4.019 9.526) 10.339 4.670 ( 0.000 0.952 -3.295) 3.430 4.670 ( 0.000 0.952 3.295) 3.430 4.831 ( 0.000 -7.292 -0.068) 7.293 4.831 ( 0.000 -7.292 0.068) 7.293 5.238 ( 0.000 -8.820 -1.051) 8.882 5.238 ( 0.000 -8.820 1.051) 8.882 5.574 ( 0.000 6.495 -3.013) 7.160 5.574 ( 0.000 6.495 3.013) 7.160 5.949 ( 0.000 10.849 -0.503) 10.861 5.949 ( 0.000 10.849 0.503) 10.861 6.274 ( 0.000 12.589 -1.592) 12.689 6.274 ( 0.000 12.589 1.592) 12.689 6.378 ( 0.000 11.481 -1.829) 11.626 6.378 ( 0.000 11.481 1.829) 11.626 6.626 ( 0.000 9.241 -2.751) 9.642 6.626 ( 0.000 9.241 2.751) 9.642 6.750 ( 0.000 5.988 -1.094) 6.087 6.750 ( 0.000 5.988 1.094) 6.087 6.864 ( 0.000 11.355 -1.708) 11.483 6.864 ( 0.000 11.355 1.708) 11.483 7.045 ( 0.000 9.913 -2.163) 10.146 7.045 ( 0.000 9.913 2.163) 10.146 8.397 ( 0.000 -4.492 -2.628) 5.205 8.397 ( 0.000 -4.492 2.628) 5.205 8.448 ( 0.000 -5.870 -4.195) 7.216 8.448 ( 0.000 -5.870 4.195) 7.216 9.559 ( 0.000 6.227 -3.351) 7.072 9.559 ( 0.000 6.227 3.351) 7.072 10.024 ( 0.000 -6.849 -1.488) 7.009 10.024 ( 0.000 -6.849 1.488) 7.009 10.124 ( 0.000 5.314 -5.764) 7.839 10.124 ( 0.000 5.314 5.764) 7.839 10.540 ( 0.000 -2.990 -4.491) 5.396 10.540 ( 0.000 -2.990 4.491) 5.396 10.745 ( 0.000 6.368 -2.680) 6.909 10.745 ( 0.000 6.368 2.680) 6.909 11.090 ( 0.000 -7.761 -15.323) 17.177 11.090 ( 0.000 -7.761 15.323) 17.177 11.297 ( 0.000 -0.175 -4.187) 4.191 11.297 ( 0.000 -0.175 4.187) 4.191 11.677 ( 0.000 -3.811 -12.219) 12.800 11.677 ( 0.000 -3.811 12.219) 12.800 12.210 ( 0.000 7.872 -0.023) 7.872 12.210 ( 0.000 7.872 0.023) 7.872 12.383 ( 0.000 -1.857 -5.141) 5.466 12.383 ( 0.000 -1.857 5.141) 5.466 13.305 ( 0.000 4.505 -1.620) 4.787 13.305 ( 0.000 4.505 1.620) 4.787 13.440 ( 0.000 5.002 -9.877) 11.071 13.440 ( 0.000 5.002 9.877) 11.071 13.628 ( 0.000 10.474 -4.948) 11.584 13.628 ( 0.000 10.474 4.948) 11.584 13.954 ( 0.000 10.420 -1.229) 10.492 13.954 ( 0.000 10.420 1.229) 10.492 14.280 ( 0.000 5.841 -6.371) 8.644 14.280 ( 0.000 5.841 6.371) 8.644 14.806 ( 0.000 -6.366 -5.912) 8.687 14.806 ( 0.000 -6.366 5.912) 8.687 15.284 ( 0.000 2.555 -1.691) 3.064 15.284 ( 0.000 2.555 1.691) 3.064 15.735 ( 0.000 -1.304 -0.600) 1.435 15.735 ( 0.000 -1.304 0.600) 1.435 16.094 ( 0.000 -7.318 -2.108) 7.616 16.094 ( 0.000 -7.318 2.108) 7.616 16.232 ( 0.000 -6.038 -2.236) 6.438 16.232 ( 0.000 -6.038 2.236) 6.438======================= Grid point 212 (68/72) =======================q-point: ( 0.20 0.40 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.982 ( 1.498 11.166 -0.884) 11.301 2.982 ( 1.498 11.166 0.884) 11.301 3.112 ( -0.876 3.509 -1.222) 3.817 3.112 ( -0.876 3.509 1.222) 3.817 3.233 ( -0.093 3.110 -1.374) 3.401 3.233 ( -0.093 3.110 1.374) 3.401 3.303 ( -1.138 1.387 -3.715) 4.126 3.303 ( -1.138 1.387 3.715) 4.126 3.827 ( -1.057 9.230 -0.188) 9.293 3.827 ( -1.057 9.230 0.188) 9.293 3.958 ( 3.246 5.787 -3.947) 7.721 3.958 ( 3.246 5.787 3.947) 7.721 4.085 ( -2.163 2.834 -4.598) 5.818 4.085 ( -2.163 2.834 4.598) 5.818 4.297 ( -1.539 -0.354 -0.386) 1.625 4.297 ( -1.539 -0.354 0.386) 1.625 4.464 ( 2.657 -6.003 -10.318) 12.229 4.464 ( 2.657 -6.003 10.318) 12.229 4.720 ( 3.816 -4.133 -1.552) 5.835 4.720 ( 3.816 -4.133 1.552) 5.835 4.804 ( -1.496 -3.566 -3.509) 5.222 4.804 ( -1.496 -3.566 3.509) 5.222 5.248 ( -0.693 -9.155 -2.696) 9.569 5.248 ( -0.693 -9.155 2.696) 9.569 5.583 ( 1.854 7.321 -1.361) 7.674 5.583 ( 1.854 7.321 1.361) 7.674 5.918 ( -2.939 8.994 -1.762) 9.624 5.918 ( -2.939 8.994 1.762) 9.624 6.280 ( 0.717 12.691 -1.226) 12.770 6.280 ( 0.717 12.691 1.226) 12.770 6.371 ( -0.740 10.875 -2.540) 11.192 6.371 ( -0.740 10.875 2.540) 11.192 6.645 ( 1.574 9.108 -2.229) 9.508 6.645 ( 1.574 9.108 2.229) 9.508 6.748 ( -0.230 7.343 -0.756) 7.385 6.748 ( -0.230 7.343 0.756) 7.385 6.871 ( 0.578 11.068 -1.522) 11.187 6.871 ( 0.578 11.068 1.522) 11.187 7.035 ( -0.827 9.800 -1.990) 10.034 7.035 ( -0.827 9.800 1.990) 10.034 8.405 ( 0.929 -4.056 -0.769) 4.232 8.405 ( 0.929 -4.056 0.769) 4.232 8.494 ( 3.816 -5.713 -1.693) 7.076 8.494 ( 3.816 -5.713 1.693) 7.076 9.527 ( -2.118 5.365 -3.587) 6.792 9.527 ( -2.118 5.365 3.587) 6.792 9.908 ( -10.483 -5.024 -0.445) 11.633 9.908 ( -10.483 -5.024 0.445) 11.633 10.190 ( 5.924 4.507 -6.957) 10.189 10.190 ( 5.924 4.507 6.957) 10.189 10.495 ( -2.712 -3.414 -5.358) 6.908 10.495 ( -2.712 -3.414 5.358) 6.908 10.785 ( 2.198 5.828 -2.698) 6.788 10.785 ( 2.198 5.828 2.698) 6.788 11.047 ( -3.480 -6.677 -12.285) 14.409 11.047 ( -3.480 -6.677 12.285) 14.409 11.372 ( 5.427 -0.135 -3.571) 6.498 11.372 ( 5.427 -0.135 3.571) 6.498 11.701 ( 2.333 -3.433 -10.550) 11.337 11.701 ( 2.333 -3.433 10.550) 11.337 12.252 ( 3.625 6.628 -5.202) 9.173 12.252 ( 3.625 6.628 5.202) 9.173 12.442 ( 6.734 -0.417 -5.830) 8.917 12.442 ( 6.734 -0.417 5.830) 8.917 13.200 ( -9.020 3.744 -3.583) 10.403 13.200 ( -9.020 3.744 3.583) 10.403 13.338 ( -10.710 2.835 -2.884) 11.448 13.338 ( -10.710 2.835 2.884) 11.448 13.642 ( 1.764 12.580 -3.242) 13.110 13.642 ( 1.764 12.580 3.242) 13.110 13.978 ( 2.549 8.654 -1.717) 9.183 13.978 ( 2.549 8.654 1.717) 9.183 14.277 ( -0.573 6.675 -7.098) 9.760 14.277 ( -0.573 6.675 7.098) 9.760 14.794 ( -1.040 -6.943 -4.847) 8.531 14.794 ( -1.040 -6.943 4.847) 8.531 15.335 ( 4.347 3.614 -2.065) 6.018 15.335 ( 4.347 3.614 2.065) 6.018 15.722 ( -1.189 -1.271 -0.699) 1.875 15.722 ( -1.189 -1.271 0.699) 1.875 16.111 ( 1.611 -7.127 -2.040) 7.586 16.111 ( 1.611 -7.127 2.040) 7.586 16.227 ( -0.580 -6.251 -2.181) 6.646 16.227 ( -0.580 -6.251 2.181) 6.646======================= Grid point 214 (69/72) =======================q-point: ( 0.40 0.40 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.026 ( 2.562 8.336 -0.971) 8.774 3.026 ( 2.562 8.336 0.971) 8.774 3.085 ( -1.971 5.963 -0.829) 6.335 3.085 ( -1.971 5.963 0.829) 6.335 3.232 ( 0.205 1.449 -2.438) 2.843 3.232 ( 0.205 1.449 2.438) 2.843 3.269 ( -1.539 0.376 -2.775) 3.195 3.269 ( -1.539 0.376 2.775) 3.195 3.825 ( 0.681 9.172 -1.330) 9.293 3.825 ( 0.681 9.172 1.330) 9.293 4.006 ( -2.279 6.475 -1.704) 7.072 4.006 ( -2.279 6.475 1.704) 7.072 4.078 ( 5.627 5.952 -3.117) 8.764 4.078 ( 5.627 5.952 3.117) 8.764 4.225 ( -5.050 2.582 -1.475) 5.860 4.225 ( -5.050 2.582 1.475) 5.860 4.529 ( 2.291 -6.732 -6.895) 9.904 4.529 ( 2.291 -6.732 6.895) 9.904 4.736 ( -1.109 -8.297 -6.872) 10.830 4.736 ( -1.109 -8.297 6.872) 10.830 4.860 ( 4.999 -2.155 -3.394) 6.415 4.860 ( 4.999 -2.155 3.394) 6.415 5.182 ( -4.291 -6.300 -3.441) 8.363 5.182 ( -4.291 -6.300 3.441) 8.363 5.661 ( 4.476 7.556 -0.572) 8.801 5.661 ( 4.476 7.556 0.572) 8.801 5.840 ( -4.000 4.920 -1.316) 6.476 5.840 ( -4.000 4.920 1.316) 6.476 6.307 ( 1.847 12.160 -1.515) 12.393 6.307 ( 1.847 12.160 1.515) 12.393 6.345 ( -1.701 10.974 -2.574) 11.400 6.345 ( -1.701 10.974 2.574) 11.400 6.676 ( 1.097 7.753 -0.916) 7.884 6.676 ( 1.097 7.753 0.916) 7.884 6.741 ( -0.322 10.004 -0.166) 10.010 6.741 ( -0.322 10.004 0.166) 10.010 6.882 ( 0.353 10.709 -0.674) 10.736 6.882 ( 0.353 10.709 0.674) 10.736 7.019 ( -0.558 9.699 -0.938) 9.760 7.019 ( -0.558 9.699 0.938) 9.760 8.428 ( 0.868 -3.065 -0.108) 3.188 8.428 ( 0.868 -3.065 0.108) 3.188 8.568 ( 2.442 -5.534 -0.184) 6.052 8.568 ( 2.442 -5.534 0.184) 6.052 9.527 ( 3.211 2.599 -3.116) 5.175 9.527 ( 3.211 2.599 3.116) 5.175 9.674 ( -10.619 -1.395 -1.840) 10.868 9.674 ( -10.619 -1.395 1.840) 10.868 10.316 ( 5.117 1.855 -5.150) 7.493 10.316 ( 5.117 1.855 5.150) 7.493 10.444 ( -2.432 -3.344 -2.585) 4.876 10.444 ( -2.432 -3.344 2.585) 4.876 10.828 ( 2.324 4.426 -1.835) 5.325 10.828 ( 2.324 4.426 1.835) 5.325 10.962 ( -4.195 -3.065 -6.968) 8.692 10.962 ( -4.195 -3.065 6.968) 8.692 11.454 ( 2.066 0.123 -0.839) 2.233 11.454 ( 2.066 0.123 0.839) 2.233 11.752 ( 1.748 -3.525 -3.686) 5.392 11.752 ( 1.748 -3.525 3.686) 5.392 12.344 ( 4.489 6.617 -2.882) 8.500 12.344 ( 4.489 6.617 2.882) 8.500 12.658 ( 12.973 -0.091 -4.915) 13.873 12.658 ( 12.973 -0.091 4.915) 13.873 12.982 ( -11.820 4.516 -4.151) 13.317 12.982 ( -11.820 4.516 4.151) 13.317 13.076 ( -10.728 -0.062 -1.950) 10.904 13.076 ( -10.728 -0.062 1.950) 10.904 13.678 ( 1.132 13.707 -2.413) 13.963 13.678 ( 1.132 13.707 2.413) 13.963 14.039 ( 2.431 4.330 -2.877) 5.739 14.039 ( 2.431 4.330 2.877) 5.739 14.255 ( -1.154 9.708 -4.695) 10.846 14.255 ( -1.154 9.708 4.695) 10.846 14.775 ( -0.579 -7.916 -1.934) 8.169 14.775 ( -0.579 -7.916 1.934) 8.169 15.419 ( 2.789 5.530 -1.188) 6.307 15.419 ( 2.789 5.530 1.188) 6.307 15.695 ( -1.084 -1.695 -0.506) 2.074 15.695 ( -1.084 -1.695 0.506) 2.074 16.149 ( 1.662 -6.570 -1.525) 6.947 16.149 ( 1.662 -6.570 1.525) 6.947 16.209 ( -1.036 -6.814 -1.601) 7.076 16.209 ( -1.036 -6.814 1.601) 7.076======================= Grid point 220 (70/72) =======================q-point: ( 0.00 0.47 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.135 ( 0.000 2.835 -1.375) 3.151 3.135 ( 0.000 2.835 1.375) 3.151 3.172 ( 0.000 3.072 -2.069) 3.704 3.172 ( 0.000 3.072 2.069) 3.704 3.274 ( 0.000 2.202 -3.105) 3.807 3.274 ( 0.000 2.202 3.105) 3.807 3.342 ( 0.000 -1.271 -1.498) 1.965 3.342 ( 0.000 -1.271 1.498) 1.965 3.975 ( 0.000 2.774 -0.810) 2.889 3.975 ( 0.000 2.774 0.810) 2.889 4.053 ( 0.000 4.901 -2.152) 5.353 4.053 ( 0.000 4.901 2.152) 5.353 4.078 ( 0.000 0.844 -3.623) 3.720 4.078 ( 0.000 0.844 3.623) 3.720 4.246 ( 0.000 -2.712 -2.078) 3.417 4.246 ( 0.000 -2.712 2.078) 3.417 4.401 ( 0.000 -0.514 -2.787) 2.834 4.401 ( 0.000 -0.514 2.787) 2.834 4.567 ( 0.000 -6.987 -0.000) 6.987 4.567 ( 0.000 -6.987 0.000) 6.987 4.862 ( 0.000 7.679 -1.011) 7.745 4.862 ( 0.000 7.679 1.011) 7.745 5.047 ( 0.000 -9.622 -0.255) 9.625 5.047 ( 0.000 -9.622 0.255) 9.625 5.664 ( 0.000 2.211 -0.755) 2.336 5.664 ( 0.000 2.211 0.755) 2.336 6.102 ( 0.000 3.969 -0.432) 3.992 6.102 ( 0.000 3.969 0.432) 3.992 6.455 ( 0.000 4.981 -3.271) 5.960 6.455 ( 0.000 4.981 3.271) 5.960 6.501 ( 0.000 1.992 -2.336) 3.070 6.501 ( 0.000 1.992 2.336) 3.070 6.776 ( 0.000 3.051 -0.106) 3.052 6.776 ( 0.000 3.051 0.106) 3.052 6.827 ( 0.000 3.275 -2.260) 3.979 6.827 ( 0.000 3.275 2.260) 3.979 7.061 ( 0.000 5.792 -1.342) 5.946 7.061 ( 0.000 5.792 1.342) 5.946 7.178 ( 0.000 2.978 -1.736) 3.447 7.178 ( 0.000 2.978 1.736) 3.447 8.335 ( 0.000 -1.593 -1.165) 1.973 8.335 ( 0.000 -1.593 1.165) 1.973 8.360 ( 0.000 -2.359 -1.447) 2.767 8.360 ( 0.000 -2.359 1.447) 2.767 9.690 ( 0.000 6.008 -2.794) 6.626 9.690 ( 0.000 6.008 2.794) 6.626 9.880 ( 0.000 -6.405 -2.102) 6.741 9.880 ( 0.000 -6.405 2.102) 6.741 10.256 ( 0.000 6.731 -3.343) 7.516 10.256 ( 0.000 6.731 3.343) 7.516 10.446 ( 0.000 -5.745 -1.572) 5.956 10.446 ( 0.000 -5.745 1.572) 5.956 10.874 ( 0.000 5.234 -0.071) 5.235 10.874 ( 0.000 5.234 0.071) 5.235 10.967 ( 0.000 -3.992 -7.993) 8.935 10.967 ( 0.000 -3.992 7.993) 8.935 11.295 ( 0.000 -0.030 -1.279) 1.280 11.295 ( 0.000 -0.030 1.279) 1.280 11.572 ( 0.000 -4.315 -5.337) 6.863 11.572 ( 0.000 -4.315 5.337) 6.863 12.311 ( 0.000 2.216 -2.055) 3.022 12.311 ( 0.000 2.216 2.055) 3.022 12.360 ( 0.000 -0.372 -3.550) 3.569 12.360 ( 0.000 -0.372 3.550) 3.569 13.369 ( 0.000 1.695 -1.015) 1.976 13.369 ( 0.000 1.695 1.015) 1.976 13.529 ( 0.000 2.830 -3.347) 4.383 13.529 ( 0.000 2.830 3.347) 4.383 13.781 ( 0.000 4.063 -1.348) 4.280 13.781 ( 0.000 4.063 1.348) 4.280 14.101 ( 0.000 3.740 -1.070) 3.890 14.101 ( 0.000 3.740 1.070) 3.890 14.370 ( 0.000 2.569 -4.749) 5.400 14.370 ( 0.000 2.569 4.749) 5.400 14.700 ( 0.000 -3.269 -4.627) 5.665 14.700 ( 0.000 -3.269 4.627) 5.665 15.321 ( 0.000 0.975 -0.508) 1.100 15.321 ( 0.000 0.975 0.508) 1.100 15.716 ( 0.000 -0.507 -0.075) 0.512 15.716 ( 0.000 -0.507 0.075) 0.512 15.991 ( 0.000 -2.596 -0.821) 2.723 15.991 ( 0.000 -2.596 0.821) 2.723 16.150 ( 0.000 -2.039 -0.795) 2.189 16.150 ( 0.000 -2.039 0.795) 2.189======================= Grid point 222 (71/72) =======================q-point: ( 0.20 0.47 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.149 ( 1.003 3.348 -1.455) 3.786 3.149 ( 1.003 3.348 1.455) 3.786 3.168 ( -0.179 3.290 -1.602) 3.664 3.168 ( -0.179 3.290 1.602) 3.664 3.257 ( -1.321 0.640 -2.658) 3.036 3.257 ( -1.321 0.640 2.658) 3.036 3.305 ( -2.950 -1.394 -1.522) 3.601 3.305 ( -2.950 -1.394 1.522) 3.601 3.972 ( 0.187 3.900 -3.482) 5.232 3.972 ( 0.187 3.900 3.482) 5.232 4.081 ( 3.954 5.544 -4.233) 8.018 4.081 ( 3.954 5.544 4.233) 8.018 4.151 ( 1.288 3.249 -4.562) 5.747 4.151 ( 1.288 3.249 4.562) 5.747 4.238 ( 2.120 -4.917 -1.363) 5.525 4.238 ( 2.120 -4.917 1.363) 5.525 4.405 ( -0.215 1.443 -0.938) 1.734 4.405 ( -0.215 1.443 0.938) 1.734 4.541 ( -1.135 -9.402 -6.032) 11.228 4.541 ( -1.135 -9.402 6.032) 11.228 4.873 ( 0.565 7.243 -0.579) 7.288 4.873 ( 0.565 7.243 0.579) 7.288 5.051 ( -0.214 -9.653 -0.866) 9.694 5.051 ( -0.214 -9.653 0.866) 9.694 5.684 ( 2.413 2.496 -0.440) 3.499 5.684 ( 2.413 2.496 0.440) 3.499 6.050 ( -4.911 3.518 -0.620) 6.073 6.050 ( -4.911 3.518 0.620) 6.073 6.452 ( -0.045 4.311 -2.023) 4.762 6.452 ( -0.045 4.311 2.023) 4.762 6.493 ( -0.662 2.234 -1.114) 2.583 6.493 ( -0.662 2.234 1.114) 2.583 6.793 ( 1.324 3.745 -1.491) 4.243 6.793 ( 1.324 3.745 1.491) 4.243 6.836 ( 0.756 2.828 -2.031) 3.563 6.836 ( 0.756 2.828 2.031) 3.563 7.070 ( 0.790 6.037 -1.410) 6.249 7.070 ( 0.790 6.037 1.410) 6.249 7.167 ( -0.934 2.889 -1.599) 3.432 7.167 ( -0.934 2.889 1.599) 3.432 8.360 ( 2.292 -0.427 -0.757) 2.451 8.360 ( 2.292 -0.427 0.757) 2.451 8.400 ( 3.369 -3.211 -0.679) 4.703 8.400 ( 3.369 -3.211 0.679) 4.703 9.644 ( -3.792 5.583 -2.838) 7.321 9.644 ( -3.792 5.583 2.838) 7.321 9.797 ( -7.270 -5.444 -1.548) 9.213 9.797 ( -7.270 -5.444 1.548) 9.213 10.288 ( 2.666 4.394 -3.959) 6.488 10.288 ( 2.666 4.394 3.959) 6.488 10.422 ( -1.824 -3.328 -2.486) 4.536 10.422 ( -1.824 -3.328 2.486) 4.536 10.885 ( 0.810 3.343 -0.506) 3.477 10.885 ( 0.810 3.343 0.506) 3.477 10.939 ( -1.548 -3.497 -6.185) 7.272 10.939 ( -1.548 -3.497 6.185) 7.272 11.385 ( 6.652 1.417 -1.971) 7.081 11.385 ( 6.652 1.417 1.971) 7.081 11.596 ( 1.734 -4.915 -5.476) 7.560 11.596 ( 1.734 -4.915 5.476) 7.560 12.346 ( 3.912 2.797 -3.605) 6.010 12.346 ( 3.912 2.797 3.605) 6.010 12.428 ( 6.713 -0.933 -3.944) 7.842 12.428 ( 6.713 -0.933 3.944) 7.842 13.260 ( -9.233 1.820 -1.618) 9.549 13.260 ( -9.233 1.820 1.618) 9.549 13.391 ( -12.751 1.669 -0.664) 12.877 13.391 ( -12.751 1.669 0.664) 12.877 13.835 ( 4.270 5.498 -1.992) 7.241 13.835 ( 4.270 5.498 1.992) 7.241 14.091 ( -1.015 2.451 -1.202) 2.912 14.091 ( -1.015 2.451 1.202) 2.912 14.386 ( 1.715 3.464 -5.160) 6.447 14.386 ( 1.715 3.464 5.160) 6.447 14.673 ( -2.472 -3.993 -4.334) 6.391 14.673 ( -2.472 -3.993 4.334) 6.391 15.392 ( 6.001 1.581 -0.746) 6.251 15.392 ( 6.001 1.581 0.746) 6.251 15.702 ( -1.421 -0.576 -0.235) 1.551 15.702 ( -1.421 -0.576 0.235) 1.551 16.012 ( 1.874 -2.529 -0.817) 3.252 16.012 ( 1.874 -2.529 0.817) 3.252 16.140 ( -0.976 -2.189 -0.808) 2.530 16.140 ( -0.976 -2.189 0.808) 2.530======================= Grid point 224 (72/72) =======================q-point: ( 0.40 0.47 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 6.10e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 113Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 3.152 ( -0.153 4.071 -0.691) 4.132 3.152 ( -0.153 4.071 0.691) 4.132 3.180 ( 0.526 2.869 -0.689) 2.997 3.180 ( 0.526 2.869 0.689) 2.997 3.228 ( -1.158 -0.579 -1.933) 2.326 3.228 ( -1.158 -0.579 1.933) 2.326 3.261 ( -0.922 -1.472 -0.917) 1.964 3.261 ( -0.922 -1.472 0.917) 1.964 3.988 ( 0.986 6.583 -3.066) 7.329 3.988 ( 0.986 6.583 3.066) 7.329 4.108 ( -1.994 0.437 -2.488) 3.218 4.108 ( -1.994 0.437 2.488) 3.218 4.181 ( 3.950 3.961 -2.204) 6.013 4.181 ( 3.950 3.961 2.204) 6.013 4.283 ( -0.679 2.775 -0.118) 2.860 4.283 ( -0.679 2.775 0.118) 2.860 4.408 ( 1.149 -1.598 -2.732) 3.367 4.408 ( 1.149 -1.598 2.732) 3.367 4.551 ( 1.327 -9.606 -3.396) 10.275 4.551 ( 1.327 -9.606 3.396) 10.275 4.880 ( 0.330 4.652 -0.438) 4.684 4.880 ( 0.330 4.652 0.438) 4.684 5.023 ( -1.928 -8.266 -1.505) 8.620 5.023 ( -1.928 -8.266 1.505) 8.620 5.773 ( 5.989 2.935 -0.241) 6.674 5.773 ( 5.989 2.935 0.241) 6.674 5.921 ( -7.086 2.380 -0.558) 7.495 5.921 ( -7.086 2.380 0.558) 7.495 6.460 ( 0.741 3.414 -0.587) 3.542 6.460 ( 0.741 3.414 0.587) 3.542 6.477 ( -0.832 2.700 -0.368) 2.849 6.477 ( -0.832 2.700 0.368) 2.849 6.815 ( 0.578 4.743 -0.884) 4.859 6.815 ( 0.578 4.743 0.884) 4.859 6.849 ( 0.348 1.960 -0.889) 2.180 6.849 ( 0.348 1.960 0.889) 2.180 7.087 ( 0.686 6.858 -0.875) 6.947 7.087 ( 0.686 6.858 0.875) 6.947 7.147 ( -0.737 2.370 -0.890) 2.637 7.147 ( -0.737 2.370 0.890) 2.637 8.408 ( 1.746 1.110 -0.280) 2.088 8.408 ( 1.746 1.110 0.280) 2.088 8.467 ( 2.283 -4.166 -0.103) 4.752 8.467 ( 2.283 -4.166 0.103) 4.752 9.584 ( -0.775 2.774 -1.874) 3.436 9.584 ( -0.775 2.774 1.874) 3.436 9.643 ( -6.252 -1.874 -0.112) 6.528 9.643 ( -6.252 -1.874 0.112) 6.528 10.341 ( 2.230 0.534 -3.082) 3.842 10.341 ( 2.230 0.534 3.082) 3.842 10.385 ( -1.795 -1.682 -1.834) 3.069 10.385 ( -1.795 -1.682 1.834) 3.069 10.901 ( 0.970 2.017 -0.650) 2.331 10.901 ( 0.970 2.017 0.650) 2.331 10.923 ( -0.588 -0.731 -3.109) 3.248 10.923 ( -0.588 -0.731 3.109) 3.248 11.486 ( 2.449 3.670 -1.550) 4.676 11.486 ( 2.449 3.670 1.550) 4.676 11.624 ( 0.834 -7.364 -2.951) 7.977 11.624 ( 0.834 -7.364 2.951) 7.977 12.475 ( 7.031 6.017 -2.792) 9.666 12.475 ( 7.031 6.017 2.792) 9.666 12.607 ( 8.822 -4.311 -3.496) 10.423 12.607 ( 8.822 -4.311 3.496) 10.423 13.057 ( -8.704 2.182 -1.646) 9.123 13.057 ( -8.704 2.182 1.646) 9.123 13.094 ( -12.655 0.977 -1.184) 12.748 13.094 ( -12.655 0.977 1.184) 12.748 13.914 ( 2.636 8.561 -2.160) 9.215 13.914 ( 2.636 8.561 2.160) 9.215 14.065 ( -1.121 -1.633 -1.918) 2.757 14.065 ( -1.121 -1.633 1.918) 2.757 14.430 ( 1.921 7.128 -3.397) 8.126 14.430 ( 1.921 7.128 3.397) 8.126 14.618 ( -2.194 -6.902 -2.688) 7.725 14.618 ( -2.194 -6.902 2.688) 7.725 15.518 ( 5.220 3.542 -0.628) 6.339 15.518 ( 5.220 3.542 0.628) 6.339 15.656 ( -2.790 -1.808 -0.379) 3.346 15.656 ( -2.790 -1.808 0.379) 3.346 16.059 ( 2.432 -2.229 -0.772) 3.388 16.059 ( 2.432 -2.229 0.772) 3.388 16.110 ( -1.875 -2.618 -0.777) 3.313 16.110 ( -1.875 -2.618 0.777) 3.313=================== 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 3/25200 10.0 6762.111 6325.137 4360.094 0.000 0.000 -0.000 3/25200 20.0 1405.441 1479.176 1061.503 0.000 0.000 -0.000 3/25200 30.0 396.296 489.936 309.331 0.000 0.000 -0.000 3/25200 40.0 168.878 239.988 137.893 0.000 0.000 -0.000 3/25200 50.0 93.727 149.002 79.549 0.000 0.000 -0.000 3/25200 60.0 60.858 104.705 53.165 0.000 0.000 -0.000 3/25200 70.0 43.477 78.774 38.764 0.000 0.000 -0.000 3/25200 80.0 33.064 61.904 29.893 0.000 0.000 -0.000 3/25200 90.0 26.281 50.224 23.978 0.000 0.000 -0.000 3/25200 100.0 21.591 41.793 19.815 0.000 0.000 -0.000 3/25200 110.0 18.201 35.513 16.763 0.000 0.000 -0.000 3/25200 120.0 15.663 30.713 14.455 0.000 0.000 -0.000 3/25200 130.0 13.707 26.963 12.663 0.000 0.000 -0.000 3/25200 140.0 12.164 23.974 11.242 0.000 0.000 -0.000 3/25200 150.0 10.921 21.552 10.092 0.000 0.000 -0.000 3/25200 160.0 9.902 19.557 9.148 0.000 0.000 -0.000 3/25200 170.0 9.054 17.891 8.361 0.000 0.000 -0.000 3/25200 180.0 8.339 16.483 7.696 0.000 0.000 -0.000 3/25200 190.0 7.729 15.279 7.128 0.000 0.000 -0.000 3/25200 200.0 7.202 14.240 6.638 0.000 0.000 -0.000 3/25200 210.0 6.744 13.334 6.212 0.000 0.000 -0.000 3/25200 220.0 6.341 12.539 5.837 0.000 0.000 -0.000 3/25200 230.0 5.985 11.835 5.506 0.000 0.000 -0.000 3/25200 240.0 5.667 11.207 5.211 0.000 0.000 -0.000 3/25200 250.0 5.383 10.645 4.947 0.000 0.000 -0.000 3/25200 260.0 5.126 10.138 4.709 0.000 0.000 -0.000 3/25200 270.0 4.894 9.678 4.493 0.000 0.000 -0.000 3/25200 280.0 4.682 9.260 4.297 0.000 0.000 -0.000 3/25200 290.0 4.489 8.877 4.118 0.000 0.000 -0.000 3/25200 300.0 4.311 8.527 3.954 0.000 0.000 -0.000 3/25200 310.0 4.148 8.203 3.802 0.000 0.000 -0.000 3/25200 320.0 3.997 7.904 3.663 0.000 0.000 -0.000 3/25200 330.0 3.857 7.627 3.533 0.000 0.000 -0.000 3/25200 340.0 3.726 7.370 3.413 0.000 0.000 -0.000 3/25200 350.0 3.605 7.130 3.301 0.000 0.000 -0.000 3/25200 360.0 3.491 6.905 3.196 0.000 0.000 -0.000 3/25200 370.0 3.385 6.695 3.098 0.000 0.000 -0.000 3/25200 380.0 3.285 6.497 3.006 0.000 0.000 -0.000 3/25200 390.0 3.191 6.312 2.919 0.000 0.000 -0.000 3/25200 400.0 3.102 6.137 2.838 0.000 0.000 -0.000 3/25200 410.0 3.019 5.971 2.761 0.000 0.000 -0.000 3/25200 420.0 2.940 5.815 2.688 0.000 0.000 -0.000 3/25200 430.0 2.865 5.667 2.619 0.000 0.000 -0.000 3/25200 440.0 2.794 5.526 2.554 0.000 0.000 -0.000 3/25200 450.0 2.726 5.393 2.491 0.000 0.000 -0.000 3/25200 460.0 2.662 5.266 2.432 0.000 0.000 -0.000 3/25200 470.0 2.601 5.145 2.376 0.000 0.000 -0.000 3/25200 480.0 2.542 5.029 2.323 0.000 0.000 -0.000 3/25200 490.0 2.486 4.919 2.271 0.000 0.000 -0.000 3/25200 500.0 2.433 4.814 2.222 0.000 0.000 -0.000 3/25200 510.0 2.382 4.713 2.176 0.000 0.000 -0.000 3/25200 520.0 2.333 4.616 2.131 0.000 0.000 -0.000 3/25200 530.0 2.286 4.523 2.088 0.000 0.000 -0.000 3/25200 540.0 2.241 4.435 2.047 0.000 0.000 -0.000 3/25200 550.0 2.198 4.349 2.007 0.000 0.000 -0.000 3/25200 560.0 2.157 4.267 1.969 0.000 0.000 -0.000 3/25200 570.0 2.117 4.188 1.932 0.000 0.000 -0.000 3/25200 580.0 2.078 4.112 1.897 0.000 0.000 -0.000 3/25200 590.0 2.041 4.039 1.863 0.000 0.000 -0.000 3/25200 600.0 2.005 3.968 1.830 0.000 0.000 -0.000 3/25200 610.0 1.971 3.900 1.799 0.000 0.000 -0.000 3/25200 620.0 1.938 3.834 1.768 0.000 0.000 -0.000 3/25200 630.0 1.905 3.770 1.739 0.000 0.000 -0.000 3/25200 640.0 1.874 3.709 1.710 0.000 0.000 -0.000 3/25200 650.0 1.844 3.650 1.683 0.000 0.000 -0.000 3/25200 660.0 1.815 3.592 1.656 0.000 0.000 -0.000 3/25200 670.0 1.787 3.536 1.630 0.000 0.000 -0.000 3/25200 680.0 1.760 3.482 1.605 0.000 0.000 -0.000 3/25200 690.0 1.733 3.430 1.581 0.000 0.000 -0.000 3/25200 700.0 1.707 3.379 1.558 0.000 0.000 -0.000 3/25200 710.0 1.683 3.330 1.535 0.000 0.000 -0.000 3/25200 720.0 1.658 3.282 1.513 0.000 0.000 -0.000 3/25200 730.0 1.635 3.235 1.491 0.000 0.000 -0.000 3/25200 740.0 1.612 3.190 1.470 0.000 0.000 -0.000 3/25200 750.0 1.590 3.146 1.450 0.000 0.000 -0.000 3/25200 760.0 1.568 3.104 1.430 0.000 0.000 -0.000 3/25200 770.0 1.547 3.062 1.411 0.000 0.000 -0.000 3/25200 780.0 1.527 3.022 1.393 0.000 0.000 -0.000 3/25200 790.0 1.507 2.982 1.374 0.000 0.000 -0.000 3/25200 800.0 1.488 2.944 1.357 0.000 0.000 -0.000 3/25200 810.0 1.469 2.907 1.339 0.000 0.000 -0.000 3/25200 820.0 1.450 2.870 1.323 0.000 0.000 -0.000 3/25200 830.0 1.432 2.835 1.306 0.000 0.000 -0.000 3/25200 840.0 1.415 2.800 1.290 0.000 0.000 -0.000 3/25200 850.0 1.398 2.766 1.275 0.000 0.000 -0.000 3/25200 860.0 1.381 2.734 1.259 0.000 0.000 -0.000 3/25200 870.0 1.365 2.701 1.245 0.000 0.000 -0.000 3/25200 880.0 1.349 2.670 1.230 0.000 0.000 -0.000 3/25200 890.0 1.334 2.639 1.216 0.000 0.000 -0.000 3/25200 900.0 1.318 2.609 1.202 0.000 0.000 -0.000 3/25200 910.0 1.304 2.580 1.189 0.000 0.000 -0.000 3/25200 920.0 1.289 2.551 1.175 0.000 0.000 -0.000 3/25200 930.0 1.275 2.523 1.162 0.000 0.000 -0.000 3/25200 940.0 1.261 2.496 1.150 0.000 0.000 -0.000 3/25200 950.0 1.248 2.469 1.137 0.000 0.000 -0.000 3/25200 960.0 1.234 2.443 1.125 0.000 0.000 -0.000 3/25200 970.0 1.221 2.417 1.113 0.000 0.000 -0.000 3/25200 980.0 1.209 2.392 1.102 0.000 0.000 -0.000 3/25200 990.0 1.196 2.368 1.090 0.000 0.000 -0.000 3/25200 1000.0 1.184 2.343 1.079 0.000 0.000 -0.000 3/25200Thermal conductivity related properties were written into "kappa-m5154.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 10:03:39]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|