# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/765450a3-b2b2-460c-87ea-7b73a3651341/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 LiCuF4 / P2_1/c (14) / materials id 753257](https://mdr.nims.go.jp/datasets/f61b5b0f-d69e-4688-b987-bf4cb9879285) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-08 23:04:03]-------------------------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: [2 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P2_1/c (14)Number of symmetry operations in supercell: 48------------------------------ primitive cell ------------------------------Lattice vectors: a 5.470181250347299 0.000000000000000 0.000000000000000 b 0.000000000000000 4.751531030000000 0.000000000000000 c -2.701014640626202 0.000000000000000 5.021467350793264Atomic positions (fractional): *1 Li 0.50000000000000 0.00000000000000 0.50000000000000 6.941 2 Li 0.50000000000000 0.50000000000000 0.00000000000000 6.941 *3 Cu 0.00000000000000 0.50000000000000 0.50000000000000 63.546 4 Cu 0.00000000000000 0.00000000000000 0.00000000000000 63.546 *5 F 0.85450616733882 0.29438928720429 0.19951944927339 18.998 6 F 0.85450616733882 0.20561071279571 0.69951944927339 18.998 *7 F 0.67331822370402 0.68045328797888 0.36265727978258 18.998 8 F 0.32668177629598 0.18045328797888 0.13734272021742 18.998 9 F 0.67331822370402 0.81954671202112 0.86265727978258 18.998 10 F 0.32668177629598 0.31954671202112 0.63734272021742 18.998 11 F 0.14549383266118 0.79438928720429 0.30048055072661 18.998 12 F 0.14549383266118 0.70561071279571 0.80048055072661 18.998-------------------------------- unit cell ---------------------------------Lattice vectors: a 5.470181250347299 0.000000000000000 0.000000000000000 b 0.000000000000000 4.751531030000000 0.000000000000000 c -2.701014640626202 0.000000000000000 5.021467350793264Atomic positions (fractional): *1 Li 0.50000000000000 0.00000000000000 0.50000000000000 6.941 > 1 2 Li 0.50000000000000 0.50000000000000 0.00000000000000 6.941 > 2 *3 Cu 0.00000000000000 0.50000000000000 0.50000000000000 63.546 > 3 4 Cu 0.00000000000000 0.00000000000000 0.00000000000000 63.546 > 4 *5 F 0.85450616733882 0.29438928720429 0.19951944927339 18.998 > 5 6 F 0.85450616733882 0.20561071279571 0.69951944927339 18.998 > 6 *7 F 0.67331822370402 0.68045328797888 0.36265727978258 18.998 > 7 8 F 0.32668177629598 0.18045328797888 0.13734272021742 18.998 > 8 9 F 0.67331822370402 0.81954671202112 0.86265727978258 18.998 > 9 10 F 0.32668177629598 0.31954671202112 0.63734272021742 18.998 > 10 11 F 0.14549383266118 0.79438928720429 0.30048055072661 18.998 > 11 12 F 0.14549383266118 0.70561071279571 0.80048055072661 18.998 > 12-------------------------------- super cell --------------------------------Lattice vectors: a 10.940362500694597 0.000000000000000 0.000000000000000 b 0.000000000000000 14.254593090000000 0.000000000000000 c -5.402029281252404 0.000000000000000 10.042934701586528Atomic positions (fractional): *1 Li 0.25000000000000 0.00000000000000 0.25000000000000 6.941 > 1 2 Li 0.75000000000000 0.00000000000000 0.25000000000000 6.941 > 1 3 Li 0.25000000000000 0.33333333333333 0.25000000000000 6.941 > 1 4 Li 0.75000000000000 0.33333333333333 0.25000000000000 6.941 > 1 5 Li 0.25000000000000 0.66666666666667 0.25000000000000 6.941 > 1 6 Li 0.75000000000000 0.66666666666667 0.25000000000000 6.941 > 1 7 Li 0.25000000000000 0.00000000000000 0.75000000000000 6.941 > 1 8 Li 0.75000000000000 0.00000000000000 0.75000000000000 6.941 > 1 9 Li 0.25000000000000 0.33333333333333 0.75000000000000 6.941 > 1 10 Li 0.75000000000000 0.33333333333333 0.75000000000000 6.941 > 1 11 Li 0.25000000000000 0.66666666666667 0.75000000000000 6.941 > 1 12 Li 0.75000000000000 0.66666666666667 0.75000000000000 6.941 > 1 13 Li 0.25000000000000 0.16666666666667 0.00000000000000 6.941 > 2 14 Li 0.75000000000000 0.16666666666667 0.00000000000000 6.941 > 2 15 Li 0.25000000000000 0.50000000000000 0.00000000000000 6.941 > 2 16 Li 0.75000000000000 0.50000000000000 0.00000000000000 6.941 > 2 17 Li 0.25000000000000 0.83333333333333 0.00000000000000 6.941 > 2 18 Li 0.75000000000000 0.83333333333333 0.00000000000000 6.941 > 2 19 Li 0.25000000000000 0.16666666666667 0.50000000000000 6.941 > 2 20 Li 0.75000000000000 0.16666666666667 0.50000000000000 6.941 > 2 21 Li 0.25000000000000 0.50000000000000 0.50000000000000 6.941 > 2 22 Li 0.75000000000000 0.50000000000000 0.50000000000000 6.941 > 2 23 Li 0.25000000000000 0.83333333333333 0.50000000000000 6.941 > 2 24 Li 0.75000000000000 0.83333333333333 0.50000000000000 6.941 > 2 *25 Cu 0.00000000000000 0.16666666666667 0.25000000000000 63.546 > 3 26 Cu 0.50000000000000 0.16666666666667 0.25000000000000 63.546 > 3 27 Cu 0.00000000000000 0.50000000000000 0.25000000000000 63.546 > 3 28 Cu 0.50000000000000 0.50000000000000 0.25000000000000 63.546 > 3 29 Cu 0.00000000000000 0.83333333333333 0.25000000000000 63.546 > 3 30 Cu 0.50000000000000 0.83333333333333 0.25000000000000 63.546 > 3 31 Cu 0.00000000000000 0.16666666666667 0.75000000000000 63.546 > 3 32 Cu 0.50000000000000 0.16666666666667 0.75000000000000 63.546 > 3 33 Cu 0.00000000000000 0.50000000000000 0.75000000000000 63.546 > 3 34 Cu 0.50000000000000 0.50000000000000 0.75000000000000 63.546 > 3 35 Cu 0.00000000000000 0.83333333333333 0.75000000000000 63.546 > 3 36 Cu 0.50000000000000 0.83333333333333 0.75000000000000 63.546 > 3 37 Cu 0.00000000000000 0.00000000000000 0.00000000000000 63.546 > 4 38 Cu 0.50000000000000 0.00000000000000 0.00000000000000 63.546 > 4 39 Cu 0.00000000000000 0.33333333333333 0.00000000000000 63.546 > 4 40 Cu 0.50000000000000 0.33333333333333 0.00000000000000 63.546 > 4 41 Cu 0.00000000000000 0.66666666666667 0.00000000000000 63.546 > 4 42 Cu 0.50000000000000 0.66666666666667 0.00000000000000 63.546 > 4 43 Cu 0.00000000000000 0.00000000000000 0.50000000000000 63.546 > 4 44 Cu 0.50000000000000 0.00000000000000 0.50000000000000 63.546 > 4 45 Cu 0.00000000000000 0.33333333333333 0.50000000000000 63.546 > 4 46 Cu 0.50000000000000 0.33333333333333 0.50000000000000 63.546 > 4 47 Cu 0.00000000000000 0.66666666666667 0.50000000000000 63.546 > 4 48 Cu 0.50000000000000 0.66666666666667 0.50000000000000 63.546 > 4 *49 F 0.42725308366941 0.09812976240143 0.09975972463670 18.998 > 5 50 F 0.92725308366941 0.09812976240143 0.09975972463670 18.998 > 5 51 F 0.42725308366941 0.43146309573476 0.09975972463670 18.998 > 5 52 F 0.92725308366941 0.43146309573476 0.09975972463670 18.998 > 5 53 F 0.42725308366941 0.76479642906810 0.09975972463670 18.998 > 5 54 F 0.92725308366941 0.76479642906810 0.09975972463670 18.998 > 5 55 F 0.42725308366941 0.09812976240143 0.59975972463670 18.998 > 5 56 F 0.92725308366941 0.09812976240143 0.59975972463670 18.998 > 5 57 F 0.42725308366941 0.43146309573476 0.59975972463670 18.998 > 5 58 F 0.92725308366941 0.43146309573476 0.59975972463670 18.998 > 5 59 F 0.42725308366941 0.76479642906810 0.59975972463670 18.998 > 5 60 F 0.92725308366941 0.76479642906810 0.59975972463670 18.998 > 5 61 F 0.42725308366941 0.06853690426524 0.34975972463670 18.998 > 6 62 F 0.92725308366941 0.06853690426524 0.34975972463670 18.998 > 6 63 F 0.42725308366941 0.40187023759857 0.34975972463670 18.998 > 6 64 F 0.92725308366941 0.40187023759857 0.34975972463670 18.998 > 6 65 F 0.42725308366941 0.73520357093190 0.34975972463670 18.998 > 6 66 F 0.92725308366941 0.73520357093190 0.34975972463670 18.998 > 6 67 F 0.42725308366941 0.06853690426524 0.84975972463670 18.998 > 6 68 F 0.92725308366941 0.06853690426524 0.84975972463670 18.998 > 6 69 F 0.42725308366941 0.40187023759857 0.84975972463670 18.998 > 6 70 F 0.92725308366941 0.40187023759857 0.84975972463670 18.998 > 6 71 F 0.42725308366941 0.73520357093190 0.84975972463670 18.998 > 6 72 F 0.92725308366941 0.73520357093190 0.84975972463670 18.998 > 6 *73 F 0.33665911185201 0.22681776265963 0.18132863989129 18.998 > 7 74 F 0.83665911185201 0.22681776265963 0.18132863989129 18.998 > 7 75 F 0.33665911185201 0.56015109599296 0.18132863989129 18.998 > 7 76 F 0.83665911185201 0.56015109599296 0.18132863989129 18.998 > 7 77 F 0.33665911185201 0.89348442932629 0.18132863989129 18.998 > 7 78 F 0.83665911185201 0.89348442932629 0.18132863989129 18.998 > 7 79 F 0.33665911185201 0.22681776265963 0.68132863989129 18.998 > 7 80 F 0.83665911185201 0.22681776265963 0.68132863989129 18.998 > 7 81 F 0.33665911185201 0.56015109599296 0.68132863989129 18.998 > 7 82 F 0.83665911185201 0.56015109599296 0.68132863989129 18.998 > 7 83 F 0.33665911185201 0.89348442932629 0.68132863989129 18.998 > 7 84 F 0.83665911185201 0.89348442932629 0.68132863989129 18.998 > 7 85 F 0.16334088814799 0.06015109599296 0.06867136010871 18.998 > 8 86 F 0.66334088814799 0.06015109599296 0.06867136010871 18.998 > 8 87 F 0.16334088814799 0.39348442932629 0.06867136010871 18.998 > 8 88 F 0.66334088814799 0.39348442932629 0.06867136010871 18.998 > 8 89 F 0.16334088814799 0.72681776265963 0.06867136010871 18.998 > 8 90 F 0.66334088814799 0.72681776265963 0.06867136010871 18.998 > 8 91 F 0.16334088814799 0.06015109599296 0.56867136010871 18.998 > 8 92 F 0.66334088814799 0.06015109599296 0.56867136010871 18.998 > 8 93 F 0.16334088814799 0.39348442932629 0.56867136010871 18.998 > 8 94 F 0.66334088814799 0.39348442932629 0.56867136010871 18.998 > 8 95 F 0.16334088814799 0.72681776265963 0.56867136010871 18.998 > 8 96 F 0.66334088814799 0.72681776265963 0.56867136010871 18.998 > 8 97 F 0.33665911185201 0.27318223734037 0.43132863989129 18.998 > 9 98 F 0.83665911185201 0.27318223734037 0.43132863989129 18.998 > 9 99 F 0.33665911185201 0.60651557067371 0.43132863989129 18.998 > 9 100 F 0.83665911185201 0.60651557067371 0.43132863989129 18.998 > 9 101 F 0.33665911185201 0.93984890400704 0.43132863989129 18.998 > 9 102 F 0.83665911185201 0.93984890400704 0.43132863989129 18.998 > 9 103 F 0.33665911185201 0.27318223734037 0.93132863989129 18.998 > 9 104 F 0.83665911185201 0.27318223734037 0.93132863989129 18.998 > 9 105 F 0.33665911185201 0.60651557067371 0.93132863989129 18.998 > 9 106 F 0.83665911185201 0.60651557067371 0.93132863989129 18.998 > 9 107 F 0.33665911185201 0.93984890400704 0.93132863989129 18.998 > 9 108 F 0.83665911185201 0.93984890400704 0.93132863989129 18.998 > 9 109 F 0.16334088814799 0.10651557067371 0.31867136010871 18.998 > 10 110 F 0.66334088814799 0.10651557067371 0.31867136010871 18.998 > 10 111 F 0.16334088814799 0.43984890400704 0.31867136010871 18.998 > 10 112 F 0.66334088814799 0.43984890400704 0.31867136010871 18.998 > 10 113 F 0.16334088814799 0.77318223734037 0.31867136010871 18.998 > 10 114 F 0.66334088814799 0.77318223734037 0.31867136010871 18.998 > 10 115 F 0.16334088814799 0.10651557067371 0.81867136010871 18.998 > 10 116 F 0.66334088814799 0.10651557067371 0.81867136010871 18.998 > 10 117 F 0.16334088814799 0.43984890400704 0.81867136010871 18.998 > 10 118 F 0.66334088814799 0.43984890400704 0.81867136010871 18.998 > 10 119 F 0.16334088814799 0.77318223734037 0.81867136010871 18.998 > 10 120 F 0.66334088814799 0.77318223734037 0.81867136010871 18.998 > 10 121 F 0.07274691633059 0.26479642906810 0.15024027536330 18.998 > 11 122 F 0.57274691633059 0.26479642906810 0.15024027536330 18.998 > 11 123 F 0.07274691633059 0.59812976240143 0.15024027536330 18.998 > 11 124 F 0.57274691633059 0.59812976240143 0.15024027536330 18.998 > 11 125 F 0.07274691633059 0.93146309573476 0.15024027536330 18.998 > 11 126 F 0.57274691633059 0.93146309573476 0.15024027536330 18.998 > 11 127 F 0.07274691633059 0.26479642906810 0.65024027536330 18.998 > 11 128 F 0.57274691633059 0.26479642906810 0.65024027536330 18.998 > 11 129 F 0.07274691633059 0.59812976240143 0.65024027536330 18.998 > 11 130 F 0.57274691633059 0.59812976240143 0.65024027536330 18.998 > 11 131 F 0.07274691633059 0.93146309573476 0.65024027536330 18.998 > 11 132 F 0.57274691633059 0.93146309573476 0.65024027536330 18.998 > 11 133 F 0.07274691633059 0.23520357093190 0.40024027536330 18.998 > 12 134 F 0.57274691633059 0.23520357093190 0.40024027536330 18.998 > 12 135 F 0.07274691633059 0.56853690426524 0.40024027536330 18.998 > 12 136 F 0.57274691633059 0.56853690426524 0.40024027536330 18.998 > 12 137 F 0.07274691633059 0.90187023759857 0.40024027536330 18.998 > 12 138 F 0.57274691633059 0.90187023759857 0.40024027536330 18.998 > 12 139 F 0.07274691633059 0.23520357093190 0.90024027536330 18.998 > 12 140 F 0.57274691633059 0.23520357093190 0.90024027536330 18.998 > 12 141 F 0.07274691633059 0.56853690426524 0.90024027536330 18.998 > 12 142 F 0.57274691633059 0.56853690426524 0.90024027536330 18.998 > 12 143 F 0.07274691633059 0.90187023759857 0.90024027536330 18.998 > 12 144 F 0.57274691633059 0.90187023759857 0.90024027536330 18.998 > 12----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 6.0353690 0.0000000 -3.8444107 0.0000000 9.9550598 0.0000000 -3.8444329 0.0000000 12.4318341-------------------------- Born effective charges -------------------------- 1 Li 1.1088327 -0.4220837 0.1324070 -0.3595777 0.9073929 0.0902423 0.5418054 0.0194543 1.3493890 2 Li 1.1088327 0.4220837 0.1324070 0.3595777 0.9073929 -0.0902423 0.5418054 -0.0194543 1.3493890 3 Cu 0.5627462 -0.0019688 -0.3089869 0.3546310 1.0756440 0.3754488 2.2439926 -0.0941912 2.9616081 4 Cu 0.5627462 0.0019688 -0.3089869 -0.3546310 1.0756440 -0.3754488 2.2439926 0.0941912 2.9616081 5 F -0.0194871 -0.1580864 0.3075685 -0.9425429 -0.5032988 -0.7896455 -0.9445075 -0.0595982 -1.5040231 6 F -0.0194871 0.1580864 0.3075685 0.9425429 -0.5032988 0.7896455 -0.9445075 0.0595982 -1.5040231 7 F -0.8163023 0.1485953 -0.2192785 0.0280297 -0.4882196 0.2086212 -0.4483915 0.3886584 -0.6514754 8 F -0.8163023 -0.1485953 -0.2192785 -0.0280297 -0.4882196 -0.2086212 -0.4483915 -0.3886584 -0.6514754 9 F -0.8163023 -0.1485953 -0.2192785 -0.0280297 -0.4882196 -0.2086212 -0.4483915 -0.3886584 -0.6514754 10 F -0.8163023 0.1485953 -0.2192785 0.0280297 -0.4882196 0.2086212 -0.4483915 0.3886584 -0.6514754 11 F -0.0194871 0.1580864 0.3075685 0.9425429 -0.5032988 0.7896455 -0.9445075 0.0595982 -1.5040231 12 F -0.0194871 -0.1580864 0.3075685 -0.9425429 -0.5032988 -0.7896455 -0.9445075 -0.0595982 -1.5040231----------------------------------------------------------------------------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: 432/432Permutation basis: 8352/8352Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 2052Number of blocks in projector: 2052Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 436Use standard eigh solver.--- Eigsh_solver_block: 2 / 6 ---Block_size: 436Use standard eigh solver.--- Eigsh_solver_block: 3 / 6 ---Block_size: 436Use standard eigh solver.--- Eigsh_solver_block: 4 / 6 ---Block_size: 248Use standard eigh solver.--- Eigsh_solver_block: 5 / 6 ---Block_size: 248Use standard eigh solver.--- Eigsh_solver_block: 6 / 6 ---Block_size: 248Use standard eigh solver.Tree of FC basis block matrices:- (2052, 2017), data: False|-- (248, 244), data: True|-- (248, 244), data: True|-- (248, 244), data: True|-- (436, 429), data: True|-- (436, 428), data: True|-- (436, 428), data: True-----Solver_atoms: 1 -- 144 / 144Time (Solver_compr_matrix_reshape): 0.006Solver_block: 100 / 400 - Time: 1.041Solver_block: 200 / 400 - Time: 0.935Solver_block: 300 / 400 - Time: 0.926Solver_block: 400 / 400 - Time: 0.926Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.918--------------------------------- Symfc end --------------------------------Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 432/432Permutation basis: 8352/8352Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 2052Number of blocks in projector: 2052Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 436Use standard eigh solver.--- Eigsh_solver_block: 2 / 6 ---Block_size: 436Use standard eigh solver.--- Eigsh_solver_block: 3 / 6 ---Block_size: 436Use standard eigh solver.--- Eigsh_solver_block: 4 / 6 ---Block_size: 248Use standard eigh solver.--- Eigsh_solver_block: 5 / 6 ---Block_size: 248Use standard eigh solver.--- Eigsh_solver_block: 6 / 6 ---Block_size: 248Use standard eigh solver.Tree of FC basis block matrices:- (2052, 2017), data: False|-- (248, 244), data: True|-- (248, 244), data: True|-- (248, 244), data: True|-- (436, 429), data: True|-- (436, 428), data: True|-- (436, 428), 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 23:04:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 23:04:30]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: force constantsHDF5 data compression filter: gzipCrystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz".Supercell (dim): [2 3 2]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P2_1/c (14)------------------------------ primitive cell ------------------------------Lattice vectors: a 5.470181250347299 0.000000000000000 0.000000000000000 b 0.000000000000000 4.751531030000000 0.000000000000000 c -2.701014640626202 0.000000000000000 5.021467350793264Atomic positions (fractional): 1 Li 0.50000000000000 0.00000000000000 0.50000000000000 6.941 2 Li 0.50000000000000 0.50000000000000 0.00000000000000 6.941 3 Cu 0.00000000000000 0.50000000000000 0.50000000000000 63.546 4 Cu 0.00000000000000 0.00000000000000 0.00000000000000 63.546 5 F 0.85450616733882 0.29438928720429 0.19951944927339 18.998 6 F 0.85450616733882 0.20561071279571 0.69951944927339 18.998 7 F 0.67331822370402 0.68045328797888 0.36265727978258 18.998 8 F 0.32668177629598 0.18045328797888 0.13734272021742 18.998 9 F 0.67331822370402 0.81954671202112 0.86265727978258 18.998 10 F 0.32668177629598 0.31954671202112 0.63734272021742 18.998 11 F 0.14549383266118 0.79438928720429 0.30048055072661 18.998 12 F 0.14549383266118 0.70561071279571 0.80048055072661 18.998-------------------------------- supercell ---------------------------------Lattice vectors: a 10.940362500694597 0.000000000000000 0.000000000000000 b 0.000000000000000 14.254593090000000 0.000000000000000 c -5.402029281252404 0.000000000000000 10.042934701586528Atomic positions (fractional): 1 Li 0.25000000000000 0.00000000000000 0.25000000000000 6.941 > 1 2 Li 0.75000000000000 0.00000000000000 0.25000000000000 6.941 > 1 3 Li 0.25000000000000 0.33333333333333 0.25000000000000 6.941 > 1 4 Li 0.75000000000000 0.33333333333333 0.25000000000000 6.941 > 1 5 Li 0.25000000000000 0.66666666666667 0.25000000000000 6.941 > 1 6 Li 0.75000000000000 0.66666666666667 0.25000000000000 6.941 > 1 7 Li 0.25000000000000 0.00000000000000 0.75000000000000 6.941 > 1 8 Li 0.75000000000000 0.00000000000000 0.75000000000000 6.941 > 1 9 Li 0.25000000000000 0.33333333333333 0.75000000000000 6.941 > 1 10 Li 0.75000000000000 0.33333333333333 0.75000000000000 6.941 > 1 11 Li 0.25000000000000 0.66666666666667 0.75000000000000 6.941 > 1 12 Li 0.75000000000000 0.66666666666667 0.75000000000000 6.941 > 1 13 Li 0.25000000000000 0.16666666666667 0.00000000000000 6.941 > 13 14 Li 0.75000000000000 0.16666666666667 0.00000000000000 6.941 > 13 15 Li 0.25000000000000 0.50000000000000 0.00000000000000 6.941 > 13 16 Li 0.75000000000000 0.50000000000000 0.00000000000000 6.941 > 13 17 Li 0.25000000000000 0.83333333333333 0.00000000000000 6.941 > 13 18 Li 0.75000000000000 0.83333333333333 0.00000000000000 6.941 > 13 19 Li 0.25000000000000 0.16666666666667 0.50000000000000 6.941 > 13 20 Li 0.75000000000000 0.16666666666667 0.50000000000000 6.941 > 13 21 Li 0.25000000000000 0.50000000000000 0.50000000000000 6.941 > 13 22 Li 0.75000000000000 0.50000000000000 0.50000000000000 6.941 > 13 23 Li 0.25000000000000 0.83333333333333 0.50000000000000 6.941 > 13 24 Li 0.75000000000000 0.83333333333333 0.50000000000000 6.941 > 13 25 Cu 0.00000000000000 0.16666666666667 0.25000000000000 63.546 > 25 26 Cu 0.50000000000000 0.16666666666667 0.25000000000000 63.546 > 25 27 Cu 0.00000000000000 0.50000000000000 0.25000000000000 63.546 > 25 28 Cu 0.50000000000000 0.50000000000000 0.25000000000000 63.546 > 25 29 Cu 0.00000000000000 0.83333333333333 0.25000000000000 63.546 > 25 30 Cu 0.50000000000000 0.83333333333333 0.25000000000000 63.546 > 25 31 Cu 0.00000000000000 0.16666666666667 0.75000000000000 63.546 > 25 32 Cu 0.50000000000000 0.16666666666667 0.75000000000000 63.546 > 25 33 Cu 0.00000000000000 0.50000000000000 0.75000000000000 63.546 > 25 34 Cu 0.50000000000000 0.50000000000000 0.75000000000000 63.546 > 25 35 Cu 0.00000000000000 0.83333333333333 0.75000000000000 63.546 > 25 36 Cu 0.50000000000000 0.83333333333333 0.75000000000000 63.546 > 25 37 Cu 0.00000000000000 0.00000000000000 0.00000000000000 63.546 > 37 38 Cu 0.50000000000000 0.00000000000000 0.00000000000000 63.546 > 37 39 Cu 0.00000000000000 0.33333333333333 0.00000000000000 63.546 > 37 40 Cu 0.50000000000000 0.33333333333333 0.00000000000000 63.546 > 37 41 Cu 0.00000000000000 0.66666666666667 0.00000000000000 63.546 > 37 42 Cu 0.50000000000000 0.66666666666667 0.00000000000000 63.546 > 37 43 Cu 0.00000000000000 0.00000000000000 0.50000000000000 63.546 > 37 44 Cu 0.50000000000000 0.00000000000000 0.50000000000000 63.546 > 37 45 Cu 0.00000000000000 0.33333333333333 0.50000000000000 63.546 > 37 46 Cu 0.50000000000000 0.33333333333333 0.50000000000000 63.546 > 37 47 Cu 0.00000000000000 0.66666666666667 0.50000000000000 63.546 > 37 48 Cu 0.50000000000000 0.66666666666667 0.50000000000000 63.546 > 37 49 F 0.42725308366941 0.09812976240143 0.09975972463670 18.998 > 49 50 F 0.92725308366941 0.09812976240143 0.09975972463670 18.998 > 49 51 F 0.42725308366941 0.43146309573476 0.09975972463670 18.998 > 49 52 F 0.92725308366941 0.43146309573476 0.09975972463670 18.998 > 49 53 F 0.42725308366941 0.76479642906810 0.09975972463670 18.998 > 49 54 F 0.92725308366941 0.76479642906810 0.09975972463670 18.998 > 49 55 F 0.42725308366941 0.09812976240143 0.59975972463670 18.998 > 49 56 F 0.92725308366941 0.09812976240143 0.59975972463670 18.998 > 49 57 F 0.42725308366941 0.43146309573476 0.59975972463670 18.998 > 49 58 F 0.92725308366941 0.43146309573476 0.59975972463670 18.998 > 49 59 F 0.42725308366941 0.76479642906810 0.59975972463670 18.998 > 49 60 F 0.92725308366941 0.76479642906810 0.59975972463670 18.998 > 49 61 F 0.42725308366941 0.06853690426524 0.34975972463670 18.998 > 61 62 F 0.92725308366941 0.06853690426524 0.34975972463670 18.998 > 61 63 F 0.42725308366941 0.40187023759857 0.34975972463670 18.998 > 61 64 F 0.92725308366941 0.40187023759857 0.34975972463670 18.998 > 61 65 F 0.42725308366941 0.73520357093190 0.34975972463670 18.998 > 61 66 F 0.92725308366941 0.73520357093190 0.34975972463670 18.998 > 61 67 F 0.42725308366941 0.06853690426524 0.84975972463670 18.998 > 61 68 F 0.92725308366941 0.06853690426524 0.84975972463670 18.998 > 61 69 F 0.42725308366941 0.40187023759857 0.84975972463670 18.998 > 61 70 F 0.92725308366941 0.40187023759857 0.84975972463670 18.998 > 61 71 F 0.42725308366941 0.73520357093190 0.84975972463670 18.998 > 61 72 F 0.92725308366941 0.73520357093190 0.84975972463670 18.998 > 61 73 F 0.33665911185201 0.22681776265963 0.18132863989129 18.998 > 73 74 F 0.83665911185201 0.22681776265963 0.18132863989129 18.998 > 73 75 F 0.33665911185201 0.56015109599296 0.18132863989129 18.998 > 73 76 F 0.83665911185201 0.56015109599296 0.18132863989129 18.998 > 73 77 F 0.33665911185201 0.89348442932629 0.18132863989129 18.998 > 73 78 F 0.83665911185201 0.89348442932629 0.18132863989129 18.998 > 73 79 F 0.33665911185201 0.22681776265963 0.68132863989129 18.998 > 73 80 F 0.83665911185201 0.22681776265963 0.68132863989129 18.998 > 73 81 F 0.33665911185201 0.56015109599296 0.68132863989129 18.998 > 73 82 F 0.83665911185201 0.56015109599296 0.68132863989129 18.998 > 73 83 F 0.33665911185201 0.89348442932629 0.68132863989129 18.998 > 73 84 F 0.83665911185201 0.89348442932629 0.68132863989129 18.998 > 73 85 F 0.16334088814799 0.06015109599296 0.06867136010871 18.998 > 85 86 F 0.66334088814799 0.06015109599296 0.06867136010871 18.998 > 85 87 F 0.16334088814799 0.39348442932629 0.06867136010871 18.998 > 85 88 F 0.66334088814799 0.39348442932629 0.06867136010871 18.998 > 85 89 F 0.16334088814799 0.72681776265963 0.06867136010871 18.998 > 85 90 F 0.66334088814799 0.72681776265963 0.06867136010871 18.998 > 85 91 F 0.16334088814799 0.06015109599296 0.56867136010871 18.998 > 85 92 F 0.66334088814799 0.06015109599296 0.56867136010871 18.998 > 85 93 F 0.16334088814799 0.39348442932629 0.56867136010871 18.998 > 85 94 F 0.66334088814799 0.39348442932629 0.56867136010871 18.998 > 85 95 F 0.16334088814799 0.72681776265963 0.56867136010871 18.998 > 85 96 F 0.66334088814799 0.72681776265963 0.56867136010871 18.998 > 85 97 F 0.33665911185201 0.27318223734037 0.43132863989129 18.998 > 97 98 F 0.83665911185201 0.27318223734037 0.43132863989129 18.998 > 97 99 F 0.33665911185201 0.60651557067371 0.43132863989129 18.998 > 97 100 F 0.83665911185201 0.60651557067371 0.43132863989129 18.998 > 97 101 F 0.33665911185201 0.93984890400704 0.43132863989129 18.998 > 97 102 F 0.83665911185201 0.93984890400704 0.43132863989129 18.998 > 97 103 F 0.33665911185201 0.27318223734037 0.93132863989129 18.998 > 97 104 F 0.83665911185201 0.27318223734037 0.93132863989129 18.998 > 97 105 F 0.33665911185201 0.60651557067371 0.93132863989129 18.998 > 97 106 F 0.83665911185201 0.60651557067371 0.93132863989129 18.998 > 97 107 F 0.33665911185201 0.93984890400704 0.93132863989129 18.998 > 97 108 F 0.83665911185201 0.93984890400704 0.93132863989129 18.998 > 97 109 F 0.16334088814799 0.10651557067371 0.31867136010871 18.998 > 109 110 F 0.66334088814799 0.10651557067371 0.31867136010871 18.998 > 109 111 F 0.16334088814799 0.43984890400704 0.31867136010871 18.998 > 109 112 F 0.66334088814799 0.43984890400704 0.31867136010871 18.998 > 109 113 F 0.16334088814799 0.77318223734037 0.31867136010871 18.998 > 109 114 F 0.66334088814799 0.77318223734037 0.31867136010871 18.998 > 109 115 F 0.16334088814799 0.10651557067371 0.81867136010871 18.998 > 109 116 F 0.66334088814799 0.10651557067371 0.81867136010871 18.998 > 109 117 F 0.16334088814799 0.43984890400704 0.81867136010871 18.998 > 109 118 F 0.66334088814799 0.43984890400704 0.81867136010871 18.998 > 109 119 F 0.16334088814799 0.77318223734037 0.81867136010871 18.998 > 109 120 F 0.66334088814799 0.77318223734037 0.81867136010871 18.998 > 109 121 F 0.07274691633059 0.26479642906810 0.15024027536330 18.998 > 121 122 F 0.57274691633059 0.26479642906810 0.15024027536330 18.998 > 121 123 F 0.07274691633059 0.59812976240143 0.15024027536330 18.998 > 121 124 F 0.57274691633059 0.59812976240143 0.15024027536330 18.998 > 121 125 F 0.07274691633059 0.93146309573476 0.15024027536330 18.998 > 121 126 F 0.57274691633059 0.93146309573476 0.15024027536330 18.998 > 121 127 F 0.07274691633059 0.26479642906810 0.65024027536330 18.998 > 121 128 F 0.57274691633059 0.26479642906810 0.65024027536330 18.998 > 121 129 F 0.07274691633059 0.59812976240143 0.65024027536330 18.998 > 121 130 F 0.57274691633059 0.59812976240143 0.65024027536330 18.998 > 121 131 F 0.07274691633059 0.93146309573476 0.65024027536330 18.998 > 121 132 F 0.57274691633059 0.93146309573476 0.65024027536330 18.998 > 121 133 F 0.07274691633059 0.23520357093190 0.40024027536330 18.998 > 133 134 F 0.57274691633059 0.23520357093190 0.40024027536330 18.998 > 133 135 F 0.07274691633059 0.56853690426524 0.40024027536330 18.998 > 133 136 F 0.57274691633059 0.56853690426524 0.40024027536330 18.998 > 133 137 F 0.07274691633059 0.90187023759857 0.40024027536330 18.998 > 133 138 F 0.57274691633059 0.90187023759857 0.40024027536330 18.998 > 133 139 F 0.07274691633059 0.23520357093190 0.90024027536330 18.998 > 133 140 F 0.57274691633059 0.23520357093190 0.90024027536330 18.998 > 133 141 F 0.07274691633059 0.56853690426524 0.90024027536330 18.998 > 133 142 F 0.57274691633059 0.56853690426524 0.90024027536330 18.998 > 133 143 F 0.07274691633059 0.90187023759857 0.90024027536330 18.998 > 133 144 F 0.57274691633059 0.90187023759857 0.90024027536330 18.998 > 133----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 6.0353690 0.0000000 -3.8444107 0.0000000 9.9550598 0.0000000 -3.8444329 0.0000000 12.4318341-------------------------- Born effective charges -------------------------- 1 Li 1.1088327 -0.4220837 0.1324070 -0.3595777 0.9073929 0.0902423 0.5418054 0.0194543 1.3493890 2 Li 1.1088327 0.4220837 0.1324070 0.3595777 0.9073929 -0.0902423 0.5418054 -0.0194543 1.3493890 3 Cu 0.5627462 -0.0019688 -0.3089869 0.3546310 1.0756440 0.3754488 2.2439926 -0.0941912 2.9616081 4 Cu 0.5627462 0.0019688 -0.3089869 -0.3546310 1.0756440 -0.3754488 2.2439926 0.0941912 2.9616081 5 F -0.0194871 -0.1580864 0.3075685 -0.9425429 -0.5032988 -0.7896455 -0.9445075 -0.0595982 -1.5040231 6 F -0.0194871 0.1580864 0.3075685 0.9425429 -0.5032988 0.7896455 -0.9445075 0.0595982 -1.5040231 7 F -0.8163023 0.1485953 -0.2192785 0.0280297 -0.4882196 0.2086212 -0.4483915 0.3886584 -0.6514754 8 F -0.8163023 -0.1485953 -0.2192785 -0.0280297 -0.4882196 -0.2086212 -0.4483915 -0.3886584 -0.6514754 9 F -0.8163023 -0.1485953 -0.2192785 -0.0280297 -0.4882196 -0.2086212 -0.4483915 -0.3886584 -0.6514754 10 F -0.8163023 0.1485953 -0.2192785 0.0280297 -0.4882196 0.2086212 -0.4483915 0.3886584 -0.6514754 11 F -0.0194871 0.1580864 0.3075685 0.9425429 -0.5032988 0.7896455 -0.9445075 0.0595982 -1.5040231 12 F -0.0194871 -0.1580864 0.3075685 -0.9425429 -0.5032988 -0.7896455 -0.9445075 -0.0595982 -1.5040231----------------------------------------------------------------------------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] [-0.0047 0.0000 0.0088] [ 0.0047 0.0000 -0.0088]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] [-0.0047 0.0000 0.0088] [ 0.0047 0.0000 -0.0088]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] [-0.0047 0.0000 0.0088] [ 0.0047 0.0000 -0.0088]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] [-0.0047 0.0000 0.0088] [ 0.0047 0.0000 -0.0088]Expanding fc3.Symmetrizing fc3 by traditional approach (N=3).Symmetrizing fc2 by traditional approach (N=3).Max drift of fc3: 0.00000001 (zzz) 0.00000001 (zzz) 0.00000001 (zzz)fc3 was written into "fc3.hdf5".Max drift of fc2: -0.00000002 (xz) -0.00000002 (xz) 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 23:04:56]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 23:04:56]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: conductivity-RTAHDF5 data compression filter: gzipCrystal structure was read from "phono3py.yaml".Supercell (dim): [2 3 2]Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.]Spacegroup: P2_1/c (14)------------------------------ primitive cell ------------------------------Lattice vectors: a 5.470181250347299 0.000000000000000 0.000000000000000 b 0.000000000000000 4.751531030000000 0.000000000000000 c -2.701014640626202 0.000000000000000 5.021467350793264Atomic positions (fractional): 1 Li 0.50000000000000 0.00000000000000 0.50000000000000 6.941 2 Li 0.50000000000000 0.50000000000000 0.00000000000000 6.941 3 Cu 0.00000000000000 0.50000000000000 0.50000000000000 63.546 4 Cu 0.00000000000000 0.00000000000000 0.00000000000000 63.546 5 F 0.85450616733882 0.29438928720429 0.19951944927339 18.998 6 F 0.85450616733882 0.20561071279571 0.69951944927339 18.998 7 F 0.67331822370402 0.68045328797888 0.36265727978258 18.998 8 F 0.32668177629598 0.18045328797888 0.13734272021742 18.998 9 F 0.67331822370402 0.81954671202112 0.86265727978258 18.998 10 F 0.32668177629598 0.31954671202112 0.63734272021742 18.998 11 F 0.14549383266118 0.79438928720429 0.30048055072661 18.998 12 F 0.14549383266118 0.70561071279571 0.80048055072661 18.998-------------------------------- supercell ---------------------------------Lattice vectors: a 10.940362500694597 0.000000000000000 0.000000000000000 b 0.000000000000000 14.254593090000000 0.000000000000000 c -5.402029281252404 0.000000000000000 10.042934701586528Atomic positions (fractional): 1 Li 0.25000000000000 0.00000000000000 0.25000000000000 6.941 > 1 2 Li 0.75000000000000 0.00000000000000 0.25000000000000 6.941 > 1 3 Li 0.25000000000000 0.33333333333333 0.25000000000000 6.941 > 1 4 Li 0.75000000000000 0.33333333333333 0.25000000000000 6.941 > 1 5 Li 0.25000000000000 0.66666666666667 0.25000000000000 6.941 > 1 6 Li 0.75000000000000 0.66666666666667 0.25000000000000 6.941 > 1 7 Li 0.25000000000000 0.00000000000000 0.75000000000000 6.941 > 1 8 Li 0.75000000000000 0.00000000000000 0.75000000000000 6.941 > 1 9 Li 0.25000000000000 0.33333333333333 0.75000000000000 6.941 > 1 10 Li 0.75000000000000 0.33333333333333 0.75000000000000 6.941 > 1 11 Li 0.25000000000000 0.66666666666667 0.75000000000000 6.941 > 1 12 Li 0.75000000000000 0.66666666666667 0.75000000000000 6.941 > 1 13 Li 0.25000000000000 0.16666666666667 0.00000000000000 6.941 > 13 14 Li 0.75000000000000 0.16666666666667 0.00000000000000 6.941 > 13 15 Li 0.25000000000000 0.50000000000000 0.00000000000000 6.941 > 13 16 Li 0.75000000000000 0.50000000000000 0.00000000000000 6.941 > 13 17 Li 0.25000000000000 0.83333333333333 0.00000000000000 6.941 > 13 18 Li 0.75000000000000 0.83333333333333 0.00000000000000 6.941 > 13 19 Li 0.25000000000000 0.16666666666667 0.50000000000000 6.941 > 13 20 Li 0.75000000000000 0.16666666666667 0.50000000000000 6.941 > 13 21 Li 0.25000000000000 0.50000000000000 0.50000000000000 6.941 > 13 22 Li 0.75000000000000 0.50000000000000 0.50000000000000 6.941 > 13 23 Li 0.25000000000000 0.83333333333333 0.50000000000000 6.941 > 13 24 Li 0.75000000000000 0.83333333333333 0.50000000000000 6.941 > 13 25 Cu 0.00000000000000 0.16666666666667 0.25000000000000 63.546 > 25 26 Cu 0.50000000000000 0.16666666666667 0.25000000000000 63.546 > 25 27 Cu 0.00000000000000 0.50000000000000 0.25000000000000 63.546 > 25 28 Cu 0.50000000000000 0.50000000000000 0.25000000000000 63.546 > 25 29 Cu 0.00000000000000 0.83333333333333 0.25000000000000 63.546 > 25 30 Cu 0.50000000000000 0.83333333333333 0.25000000000000 63.546 > 25 31 Cu 0.00000000000000 0.16666666666667 0.75000000000000 63.546 > 25 32 Cu 0.50000000000000 0.16666666666667 0.75000000000000 63.546 > 25 33 Cu 0.00000000000000 0.50000000000000 0.75000000000000 63.546 > 25 34 Cu 0.50000000000000 0.50000000000000 0.75000000000000 63.546 > 25 35 Cu 0.00000000000000 0.83333333333333 0.75000000000000 63.546 > 25 36 Cu 0.50000000000000 0.83333333333333 0.75000000000000 63.546 > 25 37 Cu 0.00000000000000 0.00000000000000 0.00000000000000 63.546 > 37 38 Cu 0.50000000000000 0.00000000000000 0.00000000000000 63.546 > 37 39 Cu 0.00000000000000 0.33333333333333 0.00000000000000 63.546 > 37 40 Cu 0.50000000000000 0.33333333333333 0.00000000000000 63.546 > 37 41 Cu 0.00000000000000 0.66666666666667 0.00000000000000 63.546 > 37 42 Cu 0.50000000000000 0.66666666666667 0.00000000000000 63.546 > 37 43 Cu 0.00000000000000 0.00000000000000 0.50000000000000 63.546 > 37 44 Cu 0.50000000000000 0.00000000000000 0.50000000000000 63.546 > 37 45 Cu 0.00000000000000 0.33333333333333 0.50000000000000 63.546 > 37 46 Cu 0.50000000000000 0.33333333333333 0.50000000000000 63.546 > 37 47 Cu 0.00000000000000 0.66666666666667 0.50000000000000 63.546 > 37 48 Cu 0.50000000000000 0.66666666666667 0.50000000000000 63.546 > 37 49 F 0.42725308366941 0.09812976240143 0.09975972463670 18.998 > 49 50 F 0.92725308366941 0.09812976240143 0.09975972463670 18.998 > 49 51 F 0.42725308366941 0.43146309573476 0.09975972463670 18.998 > 49 52 F 0.92725308366941 0.43146309573476 0.09975972463670 18.998 > 49 53 F 0.42725308366941 0.76479642906810 0.09975972463670 18.998 > 49 54 F 0.92725308366941 0.76479642906810 0.09975972463670 18.998 > 49 55 F 0.42725308366941 0.09812976240143 0.59975972463670 18.998 > 49 56 F 0.92725308366941 0.09812976240143 0.59975972463670 18.998 > 49 57 F 0.42725308366941 0.43146309573476 0.59975972463670 18.998 > 49 58 F 0.92725308366941 0.43146309573476 0.59975972463670 18.998 > 49 59 F 0.42725308366941 0.76479642906810 0.59975972463670 18.998 > 49 60 F 0.92725308366941 0.76479642906810 0.59975972463670 18.998 > 49 61 F 0.42725308366941 0.06853690426524 0.34975972463670 18.998 > 61 62 F 0.92725308366941 0.06853690426524 0.34975972463670 18.998 > 61 63 F 0.42725308366941 0.40187023759857 0.34975972463670 18.998 > 61 64 F 0.92725308366941 0.40187023759857 0.34975972463670 18.998 > 61 65 F 0.42725308366941 0.73520357093190 0.34975972463670 18.998 > 61 66 F 0.92725308366941 0.73520357093190 0.34975972463670 18.998 > 61 67 F 0.42725308366941 0.06853690426524 0.84975972463670 18.998 > 61 68 F 0.92725308366941 0.06853690426524 0.84975972463670 18.998 > 61 69 F 0.42725308366941 0.40187023759857 0.84975972463670 18.998 > 61 70 F 0.92725308366941 0.40187023759857 0.84975972463670 18.998 > 61 71 F 0.42725308366941 0.73520357093190 0.84975972463670 18.998 > 61 72 F 0.92725308366941 0.73520357093190 0.84975972463670 18.998 > 61 73 F 0.33665911185201 0.22681776265963 0.18132863989129 18.998 > 73 74 F 0.83665911185201 0.22681776265963 0.18132863989129 18.998 > 73 75 F 0.33665911185201 0.56015109599296 0.18132863989129 18.998 > 73 76 F 0.83665911185201 0.56015109599296 0.18132863989129 18.998 > 73 77 F 0.33665911185201 0.89348442932629 0.18132863989129 18.998 > 73 78 F 0.83665911185201 0.89348442932629 0.18132863989129 18.998 > 73 79 F 0.33665911185201 0.22681776265963 0.68132863989129 18.998 > 73 80 F 0.83665911185201 0.22681776265963 0.68132863989129 18.998 > 73 81 F 0.33665911185201 0.56015109599296 0.68132863989129 18.998 > 73 82 F 0.83665911185201 0.56015109599296 0.68132863989129 18.998 > 73 83 F 0.33665911185201 0.89348442932629 0.68132863989129 18.998 > 73 84 F 0.83665911185201 0.89348442932629 0.68132863989129 18.998 > 73 85 F 0.16334088814799 0.06015109599296 0.06867136010871 18.998 > 85 86 F 0.66334088814799 0.06015109599296 0.06867136010871 18.998 > 85 87 F 0.16334088814799 0.39348442932629 0.06867136010871 18.998 > 85 88 F 0.66334088814799 0.39348442932629 0.06867136010871 18.998 > 85 89 F 0.16334088814799 0.72681776265963 0.06867136010871 18.998 > 85 90 F 0.66334088814799 0.72681776265963 0.06867136010871 18.998 > 85 91 F 0.16334088814799 0.06015109599296 0.56867136010871 18.998 > 85 92 F 0.66334088814799 0.06015109599296 0.56867136010871 18.998 > 85 93 F 0.16334088814799 0.39348442932629 0.56867136010871 18.998 > 85 94 F 0.66334088814799 0.39348442932629 0.56867136010871 18.998 > 85 95 F 0.16334088814799 0.72681776265963 0.56867136010871 18.998 > 85 96 F 0.66334088814799 0.72681776265963 0.56867136010871 18.998 > 85 97 F 0.33665911185201 0.27318223734037 0.43132863989129 18.998 > 97 98 F 0.83665911185201 0.27318223734037 0.43132863989129 18.998 > 97 99 F 0.33665911185201 0.60651557067371 0.43132863989129 18.998 > 97 100 F 0.83665911185201 0.60651557067371 0.43132863989129 18.998 > 97 101 F 0.33665911185201 0.93984890400704 0.43132863989129 18.998 > 97 102 F 0.83665911185201 0.93984890400704 0.43132863989129 18.998 > 97 103 F 0.33665911185201 0.27318223734037 0.93132863989129 18.998 > 97 104 F 0.83665911185201 0.27318223734037 0.93132863989129 18.998 > 97 105 F 0.33665911185201 0.60651557067371 0.93132863989129 18.998 > 97 106 F 0.83665911185201 0.60651557067371 0.93132863989129 18.998 > 97 107 F 0.33665911185201 0.93984890400704 0.93132863989129 18.998 > 97 108 F 0.83665911185201 0.93984890400704 0.93132863989129 18.998 > 97 109 F 0.16334088814799 0.10651557067371 0.31867136010871 18.998 > 109 110 F 0.66334088814799 0.10651557067371 0.31867136010871 18.998 > 109 111 F 0.16334088814799 0.43984890400704 0.31867136010871 18.998 > 109 112 F 0.66334088814799 0.43984890400704 0.31867136010871 18.998 > 109 113 F 0.16334088814799 0.77318223734037 0.31867136010871 18.998 > 109 114 F 0.66334088814799 0.77318223734037 0.31867136010871 18.998 > 109 115 F 0.16334088814799 0.10651557067371 0.81867136010871 18.998 > 109 116 F 0.66334088814799 0.10651557067371 0.81867136010871 18.998 > 109 117 F 0.16334088814799 0.43984890400704 0.81867136010871 18.998 > 109 118 F 0.66334088814799 0.43984890400704 0.81867136010871 18.998 > 109 119 F 0.16334088814799 0.77318223734037 0.81867136010871 18.998 > 109 120 F 0.66334088814799 0.77318223734037 0.81867136010871 18.998 > 109 121 F 0.07274691633059 0.26479642906810 0.15024027536330 18.998 > 121 122 F 0.57274691633059 0.26479642906810 0.15024027536330 18.998 > 121 123 F 0.07274691633059 0.59812976240143 0.15024027536330 18.998 > 121 124 F 0.57274691633059 0.59812976240143 0.15024027536330 18.998 > 121 125 F 0.07274691633059 0.93146309573476 0.15024027536330 18.998 > 121 126 F 0.57274691633059 0.93146309573476 0.15024027536330 18.998 > 121 127 F 0.07274691633059 0.26479642906810 0.65024027536330 18.998 > 121 128 F 0.57274691633059 0.26479642906810 0.65024027536330 18.998 > 121 129 F 0.07274691633059 0.59812976240143 0.65024027536330 18.998 > 121 130 F 0.57274691633059 0.59812976240143 0.65024027536330 18.998 > 121 131 F 0.07274691633059 0.93146309573476 0.65024027536330 18.998 > 121 132 F 0.57274691633059 0.93146309573476 0.65024027536330 18.998 > 121 133 F 0.07274691633059 0.23520357093190 0.40024027536330 18.998 > 133 134 F 0.57274691633059 0.23520357093190 0.40024027536330 18.998 > 133 135 F 0.07274691633059 0.56853690426524 0.40024027536330 18.998 > 133 136 F 0.57274691633059 0.56853690426524 0.40024027536330 18.998 > 133 137 F 0.07274691633059 0.90187023759857 0.40024027536330 18.998 > 133 138 F 0.57274691633059 0.90187023759857 0.40024027536330 18.998 > 133 139 F 0.07274691633059 0.23520357093190 0.90024027536330 18.998 > 133 140 F 0.57274691633059 0.23520357093190 0.90024027536330 18.998 > 133 141 F 0.07274691633059 0.56853690426524 0.90024027536330 18.998 > 133 142 F 0.57274691633059 0.56853690426524 0.90024027536330 18.998 > 133 143 F 0.07274691633059 0.90187023759857 0.90024027536330 18.998 > 133 144 F 0.57274691633059 0.90187023759857 0.90024027536330 18.998 > 133----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 6.0353690 0.0000000 -3.8444107 0.0000000 9.9550598 0.0000000 -3.8444329 0.0000000 12.4318341-------------------------- Born effective charges -------------------------- 1 Li 1.1088327 -0.4220837 0.1324070 -0.3595777 0.9073929 0.0902423 0.5418054 0.0194543 1.3493890 2 Li 1.1088327 0.4220837 0.1324070 0.3595777 0.9073929 -0.0902423 0.5418054 -0.0194543 1.3493890 3 Cu 0.5627462 -0.0019688 -0.3089869 0.3546310 1.0756440 0.3754488 2.2439926 -0.0941912 2.9616081 4 Cu 0.5627462 0.0019688 -0.3089869 -0.3546310 1.0756440 -0.3754488 2.2439926 0.0941912 2.9616081 5 F -0.0194871 -0.1580864 0.3075685 -0.9425429 -0.5032988 -0.7896455 -0.9445075 -0.0595982 -1.5040231 6 F -0.0194871 0.1580864 0.3075685 0.9425429 -0.5032988 0.7896455 -0.9445075 0.0595982 -1.5040231 7 F -0.8163023 0.1485953 -0.2192785 0.0280297 -0.4882196 0.2086212 -0.4483915 0.3886584 -0.6514754 8 F -0.8163023 -0.1485953 -0.2192785 -0.0280297 -0.4882196 -0.2086212 -0.4483915 -0.3886584 -0.6514754 9 F -0.8163023 -0.1485953 -0.2192785 -0.0280297 -0.4882196 -0.2086212 -0.4483915 -0.3886584 -0.6514754 10 F -0.8163023 0.1485953 -0.2192785 0.0280297 -0.4882196 0.2086212 -0.4483915 0.3886584 -0.6514754 11 F -0.0194871 0.1580864 0.3075685 0.9425429 -0.5032988 0.7896455 -0.9445075 0.0595982 -1.5040231 12 F -0.0194871 -0.1580864 0.3075685 -0.9425429 -0.5032988 -0.7896455 -0.9445075 -0.0595982 -1.5040231----------------------------------------------------------------------------fc3 was read from "fc3.hdf5".fc2 was read from "fc2.hdf5".----------------------------- Force constants ------------------------------Max drift of fc3: 0.00000001 (zzz) 0.00000001 (zzz) 0.00000001 (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 ... [ 10 11 10 ]fc3-r2q-transformation over three atoms: True--------------------------- Phonon calculations ----------------------------Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.82, Number of G-points: 283, Lambda: 0.26Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/312) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating 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 2.061 ( 0.000 0.000 0.000) 0.000 3.610 ( 0.000 0.000 0.000) 0.000 4.218 ( 0.000 0.000 0.000) 0.000 4.283 ( 0.000 0.000 0.000) 0.000 4.359 ( 0.000 0.000 0.000) 0.000 4.536 ( 0.000 0.000 0.000) 0.000 4.876 ( 0.000 0.000 0.000) 0.000 4.940 ( 0.000 0.000 0.000) 0.000 5.207 ( 0.000 0.000 0.000) 0.000 5.493 ( 0.000 0.000 0.000) 0.000 5.543 ( 0.000 0.000 0.000) 0.000 5.919 ( 0.000 0.000 0.000) 0.000 6.219 ( 0.000 0.000 0.000) 0.000 7.094 ( 0.000 0.000 0.000) 0.000 7.341 ( 0.000 0.000 0.000) 0.000 7.546 ( 0.000 0.000 0.000) 0.000 7.633 ( 0.000 0.000 0.000) 0.000 9.327 ( 0.000 0.000 0.000) 0.000 9.704 ( 0.000 0.000 0.000) 0.000 9.890 ( 0.000 0.000 0.000) 0.000 10.227 ( 0.000 0.000 0.000) 0.000 10.234 ( 0.000 0.000 0.000) 0.000 10.442 ( 0.000 0.000 0.000) 0.000 12.410 ( 0.000 0.000 0.000) 0.000 13.048 ( 0.000 0.000 0.000) 0.000 13.078 ( 0.000 0.000 0.000) 0.000 13.381 ( 0.000 0.000 0.000) 0.000 14.712 ( 0.000 0.000 0.000) 0.000 15.208 ( 0.000 0.000 0.000) 0.000 18.321 ( 0.000 0.000 0.000) 0.000 18.335 ( 0.000 0.000 0.000) 0.000 18.486 ( 0.000 0.000 0.000) 0.000 18.595 ( 0.000 0.000 0.000) 0.000======================= Grid point 1 (2/312) =======================q-point: ( 0.10 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.462 ( 16.259 0.000 16.932) 23.474 0.519 ( 24.286 0.000 7.268) 25.350 1.094 ( 40.862 0.000 32.709) 52.341 2.105 ( 3.623 0.000 1.703) 4.004 3.663 ( 0.968 0.000 7.925) 7.984 4.194 ( -2.658 0.000 -10.593) 10.921 4.290 ( -2.954 0.000 -7.358) 7.929 4.607 ( 1.332 0.000 9.138) 9.234 4.702 ( 0.095 0.000 -25.115) 25.115 4.884 ( -5.125 0.000 5.379) 7.430 5.135 ( 0.132 0.000 -13.357) 13.358 5.247 ( 19.376 0.000 -18.834) 27.021 5.472 ( -4.422 0.000 5.444) 7.014 5.573 ( 2.451 0.000 0.631) 2.531 6.099 ( 10.531 0.000 -18.907) 21.642 6.214 ( -1.034 0.000 1.156) 1.551 7.248 ( 15.233 0.000 -7.722) 17.078 7.445 ( 5.587 0.000 6.259) 8.390 7.651 ( 2.227 0.000 2.134) 3.084 7.855 ( 0.189 0.000 -3.968) 3.973 9.283 ( -2.386 0.000 -4.498) 5.091 9.680 ( -0.114 0.000 -4.443) 4.445 9.878 ( -1.472 0.000 -4.339) 4.582 10.156 ( -4.348 0.000 -4.459) 6.228 10.227 ( -1.347 0.000 1.274) 1.854 10.490 ( 3.169 0.000 2.095) 3.799 12.424 ( 0.841 0.000 1.111) 1.393 13.066 ( 0.396 0.000 2.872) 2.899 13.403 ( 0.610 0.000 3.116) 3.175 14.509 ( -24.354 0.000 22.863) 33.404 14.947 ( -16.438 0.000 50.974) 53.559 15.212 ( 0.672 0.000 -0.458) 0.813 18.315 ( 0.031 0.000 -1.222) 1.223 18.408 ( -3.610 0.000 2.437) 4.355 18.548 ( -3.689 0.000 -2.430) 4.417 19.078 ( -27.119 0.000 54.262) 60.662======================= Grid point 2 (3/312) =======================q-point: ( 0.20 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.925 ( 16.276 0.000 16.213) 22.973 1.026 ( 22.938 0.000 7.720) 24.203 2.089 ( 30.132 0.000 22.438) 37.569 2.230 ( 11.165 0.000 8.748) 14.184 3.762 ( 0.280 0.000 6.782) 6.788 4.009 ( -6.201 0.000 -8.632) 10.628 4.128 ( -5.103 0.000 -10.178) 11.386 4.435 ( -2.480 0.000 -22.140) 22.278 4.721 ( 0.762 0.000 8.241) 8.276 4.815 ( -6.640 0.000 3.124) 7.338 4.996 ( 1.148 0.000 -14.572) 14.617 5.433 ( 11.277 0.000 -1.668) 11.400 5.458 ( -2.183 0.000 5.029) 5.483 5.636 ( 2.238 0.000 2.987) 3.733 6.108 ( 5.642 0.000 -8.839) 10.486 6.212 ( -0.851 0.000 2.313) 2.465 7.467 ( 13.591 0.000 -7.948) 15.744 7.524 ( 1.573 0.000 -3.548) 3.881 7.847 ( -2.214 0.000 10.907) 11.130 7.854 ( 9.413 0.000 15.095) 17.789 9.154 ( -5.027 0.000 -7.763) 9.248 9.616 ( -0.216 0.000 -7.787) 7.790 9.775 ( -3.759 0.000 -6.799) 7.769 10.005 ( -6.013 0.000 -6.342) 8.739 10.217 ( -0.966 0.000 1.032) 1.413 10.576 ( 3.752 0.000 2.052) 4.277 12.456 ( 1.064 0.000 1.613) 1.932 13.115 ( 0.717 0.000 4.682) 4.737 13.461 ( 1.107 0.000 5.179) 5.296 14.301 ( -14.668 0.000 7.945) 16.682 15.134 ( -5.252 0.000 27.351) 27.850 15.224 ( 1.202 0.000 -0.670) 1.377 18.299 ( 0.085 0.000 -2.197) 2.198 18.345 ( -2.562 0.000 -3.591) 4.411 18.422 ( -6.316 0.000 -3.982) 7.467 19.132 ( -10.793 0.000 26.852) 28.940======================= Grid point 3 (4/312) =======================q-point: ( 0.30 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.363 ( 14.712 0.000 14.452) 20.622 1.501 ( 20.227 0.000 8.017) 21.758 2.286 ( 3.273 0.000 1.695) 3.686 2.985 ( 29.059 0.000 21.206) 35.974 3.671 ( -7.492 0.000 -11.790) 13.969 3.902 ( -7.958 0.000 -10.871) 13.472 3.920 ( -2.107 0.000 6.402) 6.739 4.225 ( 0.214 0.000 -15.063) 15.065 4.714 ( -6.780 0.000 2.001) 7.070 4.743 ( -4.842 0.000 2.839) 5.612 4.949 ( 5.514 0.000 -6.534) 8.549 5.502 ( 1.439 0.000 4.932) 5.137 5.601 ( 6.341 0.000 1.938) 6.630 5.701 ( 0.892 0.000 3.718) 3.823 6.142 ( 4.912 0.000 -3.351) 5.946 6.234 ( 0.482 0.000 2.686) 2.728 7.492 ( 0.333 0.000 -5.000) 5.011 7.499 ( 3.396 0.000 -13.510) 13.930 8.053 ( 5.718 0.000 19.812) 20.621 8.198 ( 10.011 0.000 16.271) 19.104 8.961 ( -6.668 0.000 -8.486) 10.792 9.526 ( -0.338 0.000 -8.982) 8.989 9.614 ( -5.087 0.000 -8.869) 10.224 9.821 ( -6.591 0.000 -6.989) 9.606 10.214 ( -0.372 0.000 0.805) 0.887 10.662 ( 3.444 0.000 1.650) 3.819 12.487 ( 0.576 0.000 1.321) 1.441 13.177 ( 0.780 0.000 4.715) 4.779 13.537 ( 1.315 0.000 5.384) 5.542 14.139 ( -9.084 0.000 3.760) 9.831 15.242 ( 1.393 0.000 -0.543) 1.495 15.289 ( -1.836 0.000 16.977) 17.076 18.251 ( -5.109 0.000 -5.842) 7.761 18.253 ( -2.575 0.000 -4.915) 5.549 18.283 ( -1.579 0.000 -0.727) 1.739 19.202 ( -4.564 0.000 15.494) 16.153======================= Grid point 4 (5/312) =======================q-point: ( 0.40 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.718 ( 9.902 0.000 9.889) 13.994 1.899 ( 14.196 0.000 6.648) 15.675 2.335 ( 0.992 0.000 0.658) 1.190 3.399 ( -8.511 0.000 -9.600) 12.829 3.541 ( 14.598 0.000 -3.030) 14.909 3.694 ( -4.538 0.000 6.290) 7.756 3.950 ( -0.207 0.000 2.770) 2.778 4.137 ( 1.612 0.000 -7.326) 7.501 4.622 ( -4.635 0.000 1.195) 4.787 4.661 ( -4.662 0.000 0.792) 4.729 5.007 ( 4.043 0.000 -1.992) 4.507 5.587 ( 2.305 0.000 3.834) 4.473 5.692 ( 2.186 0.000 1.098) 2.446 5.737 ( -0.222 0.000 2.501) 2.511 6.216 ( 4.022 0.000 0.379) 4.040 6.272 ( 0.914 0.000 1.698) 1.928 7.409 ( -0.194 0.000 -8.245) 8.247 7.453 ( 0.041 0.000 -3.190) 3.190 8.348 ( 6.661 0.000 14.022) 15.524 8.501 ( 7.034 0.000 11.708) 13.658 8.771 ( -5.593 0.000 -5.763) 8.031 9.434 ( -4.562 0.000 -8.223) 9.404 9.437 ( -0.520 0.000 -7.013) 7.032 9.647 ( -5.043 0.000 -5.294) 7.311 10.216 ( -0.052 0.000 0.422) 0.425 10.727 ( 2.127 0.000 0.956) 2.332 12.502 ( 0.044 0.000 0.639) 0.641 13.228 ( 0.499 0.000 2.926) 2.968 13.604 ( 0.946 0.000 3.446) 3.574 14.045 ( -4.258 0.000 1.811) 4.627 15.261 ( 0.992 0.000 -0.241) 1.021 15.395 ( -0.459 0.000 8.503) 8.515 18.110 ( -4.198 0.000 -3.314) 5.349 18.169 ( -1.743 0.000 -3.345) 3.772 18.263 ( -0.210 0.000 -0.981) 1.003 19.260 ( -1.612 0.000 7.315) 7.491======================= Grid point 5 (6/312) =======================q-point: (-0.50 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 156Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.869 ( 0.001 0.000 0.000) 0.001 2.081 ( -0.000 0.000 -0.000) 0.000 2.344 ( -0.000 0.000 0.000) 0.001 3.254 ( 0.002 0.000 0.001) 0.003 3.517 ( -0.005 0.000 0.007) 0.009 3.821 ( 0.004 0.000 -0.010) 0.011 3.962 ( -0.000 0.000 -0.001) 0.001 4.119 ( 0.001 0.000 -0.000) 0.001 4.583 ( -0.001 0.000 0.001) 0.001 4.618 ( 0.001 0.000 -0.000) 0.001 5.036 ( 0.001 0.000 0.003) 0.003 5.632 ( 0.000 0.000 -0.000) 0.000 5.715 ( 0.003 0.000 0.002) 0.003 5.746 ( 0.001 0.000 -0.000) 0.001 6.261 ( 0.001 0.000 0.002) 0.002 6.290 ( 0.001 0.000 0.002) 0.002 7.362 ( 0.000 0.000 0.001) 0.001 7.437 ( -0.000 0.000 -0.000) 0.000 8.502 ( 0.006 0.000 0.002) 0.006 8.635 ( -0.000 0.000 0.000) 0.000 8.678 ( -0.001 0.000 0.001) 0.001 9.338 ( 0.000 0.000 0.001) 0.001 9.390 ( 0.000 0.000 0.000) 0.000 9.568 ( 0.000 0.000 0.000) 0.000 10.218 ( -0.000 0.000 0.000) 0.000 10.752 ( -0.000 0.000 0.000) 0.000 12.505 ( 0.000 0.000 0.000) 0.001 13.248 ( 0.002 0.000 0.001) 0.002 13.631 ( 0.001 0.000 0.000) 0.001 14.016 ( 0.007 0.000 0.004) 0.008 15.269 ( 0.000 0.000 0.000) 0.000 15.433 ( 0.003 0.000 0.001) 0.003 18.053 ( 0.001 0.000 0.000) 0.001 18.135 ( 0.001 0.000 -0.000) 0.001 18.256 ( 0.000 0.000 0.000) 0.000 19.282 ( 0.002 0.000 0.002) 0.003======================= Grid point 11 (7/312) =======================q-point: ( 0.00 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.471 ( 0.000 24.453 0.000) 24.453 0.628 ( 0.000 32.478 0.000) 32.478 0.638 ( 0.000 33.301 0.000) 33.301 2.145 ( 0.000 8.504 0.000) 8.504 3.580 ( 0.000 -4.857 0.000) 4.857 4.249 ( 0.000 3.026 0.000) 3.026 4.340 ( 0.000 -1.837 0.000) 1.837 4.505 ( 0.000 -2.906 0.000) 2.906 4.719 ( 0.000 -1.120 0.000) 1.120 4.875 ( 0.000 -6.479 0.000) 6.479 4.964 ( 0.000 7.139 0.000) 7.139 5.369 ( 0.000 -3.991 0.000) 3.991 5.539 ( 0.000 4.331 0.000) 4.331 5.555 ( 0.000 0.104 0.000) 0.104 5.894 ( 0.000 -2.666 0.000) 2.666 6.148 ( 0.000 -6.945 0.000) 6.945 7.149 ( 0.000 5.399 0.000) 5.399 7.581 ( 0.000 3.504 0.000) 3.504 7.621 ( 0.000 2.605 0.000) 2.605 8.043 ( 0.000 -1.496 0.000) 1.496 9.381 ( 0.000 5.201 0.000) 5.201 9.748 ( 0.000 -0.907 0.000) 0.907 9.873 ( 0.000 -2.515 0.000) 2.515 10.069 ( 0.000 -6.925 0.000) 6.925 10.391 ( 0.000 7.619 0.000) 7.619 10.443 ( 0.000 -2.951 0.000) 2.951 12.513 ( 0.000 10.289 0.000) 10.289 13.071 ( 0.000 -0.136 0.000) 0.136 13.075 ( 0.000 -0.243 0.000) 0.243 13.390 ( 0.000 0.906 0.000) 0.906 14.700 ( 0.000 -1.196 0.000) 1.196 15.204 ( 0.000 -0.431 0.000) 0.431 18.332 ( 0.000 -0.337 0.000) 0.337 18.477 ( 0.000 -1.192 0.000) 1.192 18.489 ( 0.000 0.432 0.000) 0.432 18.597 ( 0.000 0.088 0.000) 0.088======================= Grid point 12 (8/312) =======================q-point: ( 0.10 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.642 ( 5.965 19.081 16.935) 26.200 0.831 ( 19.199 23.646 1.782) 30.510 1.253 ( 34.634 15.754 27.701) 47.064 2.187 ( 3.448 8.353 1.732) 9.202 3.601 ( -0.713 -5.947 6.875) 9.118 4.154 ( -2.003 0.236 -7.074) 7.356 4.344 ( -4.340 0.387 -6.876) 8.141 4.588 ( 6.949 -2.249 0.777) 7.345 4.676 ( 0.523 -0.447 -10.043) 10.067 4.846 ( -5.267 -4.934 3.405) 7.980 5.081 ( 11.335 -2.584 0.673) 11.646 5.246 ( -5.126 3.588 -10.428) 12.161 5.465 ( -4.605 -1.373 2.211) 5.290 5.635 ( 4.074 3.690 0.230) 5.502 5.967 ( 7.191 -6.973 -3.516) 10.616 6.144 ( -0.660 -6.942 0.731) 7.011 7.223 ( 5.298 2.799 4.096) 7.258 7.582 ( 3.079 4.976 5.289) 7.888 7.685 ( 1.661 3.594 1.271) 4.159 7.965 ( 0.676 4.565 -9.520) 10.580 9.315 ( -3.708 3.941 -4.580) 7.089 9.697 ( -0.948 0.377 -5.601) 5.693 9.853 ( -1.993 -2.730 -1.806) 3.833 10.044 ( -0.794 -5.983 -4.431) 7.487 10.331 ( -3.558 5.198 -0.920) 6.366 10.489 ( 2.830 -0.243 1.334) 3.138 12.529 ( 1.108 10.510 1.051) 10.620 13.068 ( 0.437 0.219 2.986) 3.026 13.412 ( 0.635 0.953 3.198) 3.397 13.745 ( 11.491 -39.726 58.261) 71.446 14.659 ( -2.388 -3.216 0.124) 4.007 15.208 ( 0.678 -0.475 -0.565) 1.002 18.329 ( 0.218 0.315 -1.556) 1.602 18.406 ( -2.989 -0.337 -0.860) 3.128 18.555 ( -3.367 0.643 -2.016) 3.977 18.707 ( 4.740 -11.538 19.186) 22.884======================= Grid point 13 (9/312) =======================q-point: ( 0.20 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.002 ( 12.300 9.899 19.307) 24.940 1.228 ( 21.437 17.646 1.789) 27.823 2.150 ( 27.741 6.286 21.662) 35.754 2.313 ( 10.662 8.442 8.707) 16.148 3.662 ( -1.214 -8.743 6.372) 10.887 4.036 ( -5.122 2.588 -4.171) 7.094 4.158 ( -5.690 1.371 -10.373) 11.911 4.443 ( -1.336 0.787 -21.274) 21.331 4.720 ( -3.887 -3.139 2.363) 5.527 4.816 ( 2.248 1.023 3.216) 4.055 5.052 ( -5.345 4.735 -7.342) 10.241 5.306 ( 10.301 -6.326 3.188) 12.501 5.421 ( -2.145 -4.451 2.176) 5.399 5.706 ( 1.731 3.915 2.818) 5.125 6.043 ( 5.651 -5.482 -4.659) 9.148 6.148 ( 0.502 -6.531 1.162) 6.653 7.374 ( 7.229 -2.095 -0.470) 7.541 7.659 ( 0.871 5.518 -8.866) 10.479 7.791 ( 3.834 0.445 18.013) 18.422 7.994 ( 6.020 7.607 6.004) 11.409 9.170 ( -5.541 2.091 -7.416) 9.491 9.617 ( -0.446 -0.148 -8.083) 8.097 9.760 ( -4.155 -1.727 -5.339) 6.983 9.949 ( -3.670 -3.988 -6.507) 8.468 10.273 ( -1.922 4.264 -0.517) 4.706 10.561 ( 3.089 -1.395 2.079) 3.976 12.567 ( 1.418 11.069 1.579) 11.271 13.120 ( 0.817 0.545 4.879) 4.977 13.472 ( 1.167 1.137 5.319) 5.563 14.159 ( -7.689 -16.794 20.768) 27.794 14.750 ( 3.718 -22.793 17.275) 28.841 15.218 ( 1.199 -0.656 -0.900) 1.637 18.309 ( -0.283 0.078 -2.712) 2.728 18.328 ( -2.543 -1.021 -4.307) 5.105 18.443 ( -5.714 1.764 -3.202) 6.783 18.950 ( 0.817 -11.812 18.768) 22.191======================= Grid point 14 (10/312) =======================q-point: ( 0.30 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.428 ( 13.182 6.928 18.066) 23.413 1.629 ( 19.674 12.540 2.399) 23.454 2.361 ( 3.532 7.623 1.738) 8.579 2.993 ( 25.130 1.068 19.866) 32.052 3.646 ( -2.940 -5.456 -0.992) 6.277 3.846 ( -10.010 0.908 -7.003) 12.250 3.975 ( -4.848 2.221 -5.710) 7.813 4.269 ( 2.508 3.735 -13.315) 14.054 4.619 ( -4.758 -6.626 -2.686) 8.588 4.863 ( -7.039 8.258 4.882) 11.899 4.951 ( 3.888 -0.116 -3.844) 5.469 5.441 ( 1.315 -6.466 3.281) 7.369 5.509 ( 7.252 -5.715 4.377) 10.219 5.744 ( -0.769 1.654 2.959) 3.476 6.098 ( 3.253 -4.274 0.256) 5.377 6.188 ( 3.027 -4.753 -0.333) 5.645 7.436 ( 3.045 -1.810 -5.382) 6.443 7.558 ( -0.828 2.459 -9.447) 9.796 8.067 ( 5.994 1.635 19.167) 20.149 8.255 ( 9.055 5.005 13.836) 17.277 8.979 ( -6.448 2.002 -8.025) 10.487 9.524 ( -0.347 -0.406 -8.966) 8.982 9.605 ( -5.321 -0.925 -7.799) 9.487 9.792 ( -5.387 -2.357 -7.739) 9.719 10.249 ( -0.697 3.174 0.179) 3.254 10.637 ( 2.999 -2.337 1.757) 4.188 12.604 ( 0.862 11.662 1.277) 11.764 13.186 ( 0.850 0.887 4.866) 5.019 13.552 ( 1.423 1.436 5.549) 5.906 14.110 ( -7.632 -3.274 5.249) 9.824 14.995 ( 2.291 -25.350 17.369) 30.815 15.233 ( 1.415 -0.988 -0.888) 1.941 18.218 ( -3.302 -1.706 -5.249) 6.431 18.280 ( -0.818 0.993 -5.054) 5.216 18.306 ( -4.926 2.016 -1.129) 5.441 19.111 ( 0.070 -7.532 12.774) 14.830======================= Grid point 15 (11/312) =======================q-point: ( 0.40 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.799 ( 9.104 7.889 13.238) 17.899 1.971 ( 14.339 7.692 2.041) 16.399 2.416 ( 1.331 8.204 0.739) 8.345 3.317 ( -1.335 -5.487 -3.746) 6.777 3.599 ( -6.696 -3.484 -8.162) 11.117 3.709 ( 9.441 6.656 8.057) 14.084 3.871 ( -3.287 -3.048 -0.236) 4.489 4.254 ( 4.285 8.059 -5.119) 10.465 4.522 ( -3.025 -7.346 -1.918) 8.173 4.746 ( -7.390 5.562 2.646) 9.620 5.013 ( 3.498 0.339 -1.057) 3.670 5.514 ( 2.388 -7.564 3.070) 8.505 5.643 ( 3.572 -3.682 2.737) 5.814 5.739 ( -1.947 -0.719 1.503) 2.563 6.173 ( 2.116 -4.416 4.306) 6.521 6.233 ( 2.850 -3.928 -2.268) 5.356 7.406 ( 0.257 0.212 -5.397) 5.407 7.473 ( -0.553 1.521 -4.445) 4.731 8.355 ( 6.726 0.726 13.361) 14.976 8.518 ( 4.736 1.623 10.244) 11.402 8.811 ( -3.955 3.980 -4.262) 7.046 9.429 ( -3.158 -0.597 -7.230) 7.912 9.442 ( -1.603 0.526 -6.920) 7.122 9.622 ( -4.753 -2.176 -6.290) 8.179 10.244 ( -0.155 2.637 0.243) 2.652 10.697 ( 1.897 -2.891 1.008) 3.601 12.622 ( 0.184 12.032 0.595) 12.048 13.239 ( 0.525 1.085 2.996) 3.230 13.622 ( 1.057 1.792 3.574) 4.136 14.037 ( -3.831 -0.889 1.940) 4.385 15.156 ( 0.891 -22.155 9.388) 24.078 15.249 ( 1.075 -1.403 -0.691) 1.898 18.117 ( -2.652 0.501 -3.297) 4.260 18.176 ( -2.922 0.928 -3.340) 4.533 18.270 ( -0.401 0.456 -0.898) 1.084 19.207 ( 0.104 -4.909 6.354) 8.030======================= Grid point 16 (12/312) =======================q-point: (-0.50 0.09 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.959 ( 0.001 9.151 0.000) 9.151 2.130 ( -0.000 5.249 -0.000) 5.249 2.431 ( -0.001 8.708 0.000) 8.708 3.230 ( 0.001 -2.693 0.001) 2.693 3.491 ( -0.002 -3.387 0.007) 3.387 3.832 ( 0.006 -6.912 -0.006) 6.912 3.878 ( -0.003 5.836 -0.004) 5.836 4.277 ( -0.000 10.506 0.000) 10.506 4.483 ( -0.000 -7.669 0.001) 7.669 4.685 ( 0.001 3.998 -0.000) 3.998 5.041 ( 0.001 0.145 0.002) 0.145 5.556 ( 0.000 -7.801 0.000) 7.801 5.702 ( 0.011 -1.265 0.003) 1.265 5.712 ( -0.008 -3.267 -0.002) 3.267 6.230 ( 0.003 -3.237 -0.011) 3.237 6.239 ( -0.001 -5.233 0.014) 5.233 7.376 ( 0.000 1.364 0.001) 1.364 7.448 ( -0.000 1.013 -0.000) 1.013 8.516 ( 0.009 1.327 0.003) 1.327 8.577 ( -0.005 -2.596 -0.001) 2.596 8.777 ( 0.001 6.736 0.001) 6.736 9.346 ( 0.000 0.818 0.001) 0.818 9.395 ( 0.000 0.468 0.000) 0.468 9.538 ( 0.000 -2.830 0.000) 2.830 10.244 ( -0.000 2.500 0.000) 2.500 10.720 ( -0.000 -3.087 0.000) 3.087 12.626 ( 0.000 12.142 0.000) 12.142 13.259 ( 0.002 1.141 0.001) 1.141 13.651 ( 0.001 1.974 0.000) 1.974 14.012 ( 0.007 -0.468 0.004) 0.468 15.211 ( 0.002 -21.105 0.002) 21.105 15.256 ( 0.001 -1.474 -0.001) 1.474 18.074 ( 0.000 2.156 0.000) 2.156 18.132 ( 0.001 -0.360 -0.000) 0.360 18.262 ( -0.000 0.358 0.000) 0.358 19.239 ( 0.002 -4.102 0.002) 4.102======================= Grid point 22 (13/312) =======================q-point: ( 0.00 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.933 ( 0.000 23.847 0.000) 23.847 1.236 ( 0.000 30.940 0.000) 30.940 1.272 ( 0.000 32.819 0.000) 32.819 2.368 ( 0.000 14.158 0.000) 14.158 3.444 ( 0.000 -9.249 0.000) 9.249 4.293 ( 0.000 -2.997 0.000) 2.997 4.305 ( 0.000 0.926 0.000) 0.926 4.457 ( 0.000 -0.365 0.000) 0.365 4.707 ( 0.000 -10.763 0.000) 10.763 4.726 ( 0.000 1.805 0.000) 1.805 5.101 ( 0.000 5.784 0.000) 5.784 5.256 ( 0.000 -6.882 0.000) 6.882 5.581 ( 0.000 2.826 0.000) 2.826 5.631 ( 0.000 4.316 0.000) 4.316 5.806 ( 0.000 -6.942 0.000) 6.942 5.992 ( 0.000 -7.828 0.000) 7.828 7.280 ( 0.000 7.835 0.000) 7.835 7.671 ( 0.000 5.586 0.000) 5.586 7.687 ( 0.000 4.091 0.000) 4.091 8.012 ( 0.000 -1.611 0.000) 1.611 9.498 ( 0.000 5.974 0.000) 5.974 9.725 ( 0.000 -1.133 0.000) 1.133 9.763 ( 0.000 -8.321 0.000) 8.321 10.003 ( 0.000 -0.580 0.000) 0.580 10.387 ( 0.000 -2.286 0.000) 2.286 10.516 ( 0.000 5.296 0.000) 5.296 12.772 ( 0.000 15.693 0.000) 15.693 13.071 ( 0.000 0.131 0.000) 0.131 13.071 ( 0.000 0.150 0.000) 0.150 13.414 ( 0.000 1.507 0.000) 1.507 14.672 ( 0.000 -1.581 0.000) 1.581 15.189 ( 0.000 -1.278 0.000) 1.278 18.319 ( 0.000 -1.100 0.000) 1.100 18.439 ( 0.000 -2.747 0.000) 2.747 18.505 ( 0.000 1.299 0.000) 1.299 18.604 ( 0.000 0.701 0.000) 0.701======================= Grid point 23 (14/312) =======================q-point: ( 0.10 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.056 ( 5.082 22.444 6.970) 24.044 1.323 ( 8.522 27.020 10.845) 30.337 1.648 ( 25.428 24.182 14.967) 38.149 2.407 ( 3.367 14.048 1.501) 14.524 3.453 ( -2.255 -9.226 6.400) 11.453 4.174 ( -2.551 1.013 -5.873) 6.483 4.308 ( -2.957 -3.420 -4.824) 6.611 4.551 ( 5.866 -1.268 -2.627) 6.552 4.676 ( 2.074 -7.751 -3.695) 8.834 4.700 ( -3.754 -1.109 1.237) 4.105 5.114 ( 1.032 2.926 0.486) 3.140 5.231 ( -0.691 -4.648 -1.858) 5.053 5.496 ( -8.306 4.930 2.832) 10.065 5.696 ( 3.062 2.016 1.597) 3.999 5.839 ( 4.979 -7.016 -2.108) 8.858 5.985 ( -0.202 -8.185 -0.500) 8.202 7.315 ( 1.147 5.928 4.246) 7.382 7.660 ( 0.211 3.659 5.638) 6.725 7.778 ( 2.303 5.745 3.620) 7.170 8.004 ( 3.546 0.815 -4.874) 6.083 9.411 ( -5.180 4.912 -5.940) 9.287 9.681 ( -0.822 -2.484 -5.815) 6.376 9.766 ( -0.800 -5.008 -0.115) 5.073 9.981 ( -0.492 -0.910 -4.140) 4.267 10.375 ( -0.476 -0.014 -1.420) 1.497 10.516 ( -0.337 3.066 1.162) 3.296 12.793 ( 1.766 15.975 0.927) 16.099 13.075 ( 0.528 0.597 3.374) 3.467 13.337 ( 9.141 -9.942 25.921) 29.229 13.438 ( 0.754 1.573 3.748) 4.134 14.616 ( -4.455 -1.854 -1.860) 5.172 15.191 ( 0.682 -1.399 -0.907) 1.802 18.318 ( -0.556 -1.351 0.102) 1.465 18.389 ( -1.456 -1.612 -4.621) 5.106 18.568 ( -2.657 0.449 0.604) 2.762 18.607 ( 4.961 -1.177 5.111) 7.220======================= Grid point 24 (15/312) =======================q-point: ( 0.20 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.279 ( 7.054 17.719 16.706) 25.354 1.630 ( 18.029 23.329 -0.537) 29.488 2.321 ( 21.443 11.314 18.595) 30.554 2.538 ( 9.873 14.507 8.383) 19.447 3.479 ( -3.089 -9.764 7.731) 12.832 4.081 ( -4.174 1.724 -2.572) 5.197 4.161 ( -4.808 -0.777 -8.175) 9.516 4.460 ( 0.500 0.760 -18.762) 18.784 4.589 ( -4.689 -9.440 -2.926) 10.939 4.816 ( 6.015 -1.399 3.980) 7.347 5.103 ( -3.802 0.015 1.140) 3.969 5.260 ( 3.221 -4.168 2.731) 5.934 5.369 ( -5.938 4.330 1.698) 7.543 5.738 ( -1.257 -1.608 3.845) 4.353 5.936 ( 5.442 -5.112 -1.123) 7.550 5.992 ( 2.855 -8.290 -0.941) 8.819 7.388 ( 3.324 2.651 1.015) 4.371 7.690 ( -2.791 -0.751 -1.720) 3.363 7.877 ( 3.908 6.966 12.092) 14.492 8.116 ( 7.942 5.273 5.610) 11.061 9.230 ( -6.342 3.573 -8.177) 10.948 9.595 ( -1.042 -2.741 -7.836) 8.367 9.712 ( -2.999 -2.393 -3.897) 5.469 9.898 ( -2.316 -1.127 -7.302) 7.743 10.345 ( -0.932 3.012 -1.710) 3.587 10.538 ( 0.950 -0.629 2.198) 2.475 12.847 ( 2.339 16.970 1.669) 17.211 13.135 ( 1.008 1.044 5.472) 5.661 13.501 ( 1.321 1.759 5.659) 6.072 13.774 ( 6.057 -17.806 26.772) 32.718 14.517 ( -3.773 -5.451 0.349) 6.638 15.195 ( 1.025 -1.817 -1.384) 2.504 18.281 ( -2.350 -2.120 -3.666) 4.843 18.320 ( -0.347 -0.828 -4.114) 4.211 18.481 ( -5.126 2.213 -2.011) 5.934 18.793 ( 5.962 -4.911 9.218) 12.026======================= Grid point 25 (16/312) =======================q-point: ( 0.30 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.622 ( 10.212 12.865 19.174) 25.247 1.947 ( 17.992 19.752 -3.212) 26.910 2.557 ( 4.392 12.076 1.969) 12.999 3.038 ( 16.184 4.023 16.900) 23.742 3.483 ( -3.439 -9.547 6.015) 11.796 3.922 ( -6.776 5.098 -5.424) 10.066 4.006 ( -5.462 1.021 -6.350) 8.438 4.335 ( 4.371 2.193 -11.872) 12.839 4.472 ( -2.325 -7.657 -6.757) 10.474 4.930 ( 2.671 -2.354 1.814) 3.995 5.006 ( -8.191 5.171 3.124) 10.178 5.276 ( -0.705 -9.955 1.827) 10.146 5.441 ( 5.656 -0.751 5.529) 7.946 5.735 ( -2.279 -2.648 2.407) 4.243 5.984 ( -0.004 -7.796 4.565) 9.034 6.078 ( 6.681 -5.422 -3.531) 9.301 7.433 ( 2.152 1.240 -2.512) 3.533 7.586 ( -2.392 0.473 -6.691) 7.122 8.119 ( 5.523 3.858 17.056) 18.338 8.356 ( 7.443 5.122 11.987) 15.011 9.036 ( -5.668 3.666 -7.746) 10.275 9.495 ( -1.396 -3.084 -7.624) 8.341 9.590 ( -3.887 -0.167 -7.162) 8.150 9.757 ( -3.953 -0.995 -9.341) 10.191 10.317 ( -0.709 3.639 -0.693) 3.772 10.586 ( 1.780 -2.687 1.916) 3.749 12.900 ( 1.633 18.229 1.417) 18.356 13.209 ( 0.981 1.552 5.362) 5.668 13.588 ( 1.672 2.195 5.917) 6.528 13.998 ( -1.820 -8.728 11.037) 14.188 14.545 ( 1.735 -17.772 9.092) 20.038 15.201 ( 1.047 -2.515 -1.317) 3.025 18.187 ( -2.078 -1.499 -5.364) 5.944 18.285 ( 0.114 -0.642 -3.566) 3.625 18.354 ( -6.265 3.016 -1.841) 7.193 18.977 ( 4.452 -5.916 7.869) 10.805======================= Grid point 26 (17/312) =======================q-point: ( 0.40 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.990 ( 8.170 11.465 18.772) 23.465 2.197 ( 13.672 15.563 -6.690) 21.769 2.629 ( 2.271 13.366 0.825) 13.583 3.229 ( -2.037 -3.161 -0.370) 3.779 3.442 ( -6.600 -9.718 1.683) 11.867 3.832 ( -0.644 2.968 -8.423) 8.954 3.921 ( 2.483 7.963 7.206) 11.022 4.333 ( 0.071 -6.974 -2.690) 7.476 4.419 ( 5.729 4.010 -6.853) 9.791 4.838 ( -9.880 3.268 3.253) 10.903 5.006 ( 1.927 -1.382 0.189) 2.378 5.313 ( 1.532 -12.776 2.526) 13.113 5.576 ( 3.401 -3.117 3.843) 6.004 5.706 ( -2.263 -2.402 0.425) 3.327 6.048 ( 0.450 -8.573 6.776) 10.937 6.136 ( 3.863 -5.758 -4.456) 8.242 7.425 ( 0.383 1.726 -2.813) 3.322 7.499 ( -1.009 1.146 -4.082) 4.358 8.379 ( 6.297 1.981 12.028) 13.720 8.557 ( 1.357 2.230 8.403) 8.799 8.910 ( -1.438 5.895 -2.258) 6.475 9.404 ( -1.750 -2.160 -4.320) 5.138 9.457 ( -1.998 1.116 -6.864) 7.236 9.585 ( -4.321 -1.292 -9.068) 10.128 10.305 ( -0.258 3.438 -0.077) 3.448 10.630 ( 1.279 -3.762 1.059) 4.112 12.930 ( 0.565 19.143 0.658) 19.162 13.268 ( 0.569 1.885 3.243) 3.794 13.666 ( 1.321 2.676 3.867) 4.885 14.007 ( -2.457 -2.383 2.675) 4.344 14.682 ( 2.024 -24.080 7.978) 25.448 15.207 ( 0.683 -3.230 -0.810) 3.399 18.121 ( -0.093 -0.094 -3.294) 3.297 18.214 ( -4.006 2.906 -3.642) 6.145 18.270 ( -1.251 -0.439 -0.133) 1.333 19.100 ( 2.298 -5.769 4.324) 7.567======================= Grid point 27 (18/312) =======================q-point: (-0.50 0.18 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.196 ( 0.001 14.718 -0.001) 14.718 2.282 ( -0.001 10.467 0.001) 10.467 2.657 ( -0.001 14.225 0.000) 14.225 3.161 ( 0.000 -3.767 0.000) 3.767 3.377 ( 0.003 -7.692 0.002) 7.692 3.774 ( 0.001 0.661 -0.001) 0.661 4.018 ( 0.001 7.411 -0.003) 7.411 4.310 ( -0.000 -9.710 0.002) 9.710 4.466 ( -0.001 9.071 -0.000) 9.071 4.745 ( 0.001 1.793 -0.000) 1.793 5.025 ( 0.001 -2.252 0.002) 2.252 5.346 ( 0.000 -13.648 0.000) 13.648 5.634 ( 0.005 -4.569 0.002) 4.569 5.676 ( -0.002 -1.202 0.000) 1.202 6.098 ( 0.002 -9.175 -0.005) 9.175 6.142 ( 0.001 -5.776 0.008) 5.776 7.412 ( 0.000 2.317 0.000) 2.317 7.471 ( -0.000 1.254 -0.000) 1.254 8.547 ( 0.063 1.788 0.023) 1.789 8.554 ( -0.059 0.165 -0.021) 0.176 8.911 ( 0.001 7.020 0.002) 7.020 9.368 ( 0.000 1.470 0.000) 1.470 9.405 ( 0.000 0.399 0.000) 0.399 9.477 ( 0.000 -3.112 0.001) 3.112 10.303 ( 0.000 3.329 0.000) 3.329 10.648 ( -0.000 -4.137 0.000) 4.137 12.938 ( 0.000 19.446 0.000) 19.446 13.289 ( 0.002 1.987 0.001) 1.987 13.700 ( 0.000 2.938 0.000) 2.938 13.995 ( 0.007 -1.337 0.004) 1.337 14.742 ( 0.002 -24.925 0.001) 24.925 15.209 ( 0.000 -3.540 -0.000) 3.540 18.123 ( -0.001 -0.534 -0.000) 0.534 18.135 ( 0.003 4.276 0.001) 4.276 18.260 ( -0.000 -0.737 0.000) 0.737 19.142 ( 0.002 -5.609 0.002) 5.609======================= Grid point 33 (19/312) =======================q-point: ( 0.00 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.381 ( 0.000 22.890 0.000) 22.890 1.804 ( 0.000 28.206 0.000) 28.206 1.885 ( 0.000 30.875 0.000) 30.875 2.660 ( 0.000 15.629 0.000) 15.629 3.233 ( 0.000 -12.579 0.000) 12.579 4.233 ( 0.000 -3.071 0.000) 3.071 4.245 ( 0.000 -6.233 0.000) 6.233 4.451 ( 0.000 -10.843 0.000) 10.843 4.547 ( 0.000 3.659 0.000) 3.659 4.771 ( 0.000 2.074 0.000) 2.074 5.056 ( 0.000 -7.896 0.000) 7.896 5.244 ( 0.000 4.058 0.000) 4.058 5.572 ( 0.000 -12.593 0.000) 12.593 5.667 ( 0.000 6.032 0.000) 6.032 5.713 ( 0.000 -1.254 0.000) 1.254 5.901 ( 0.000 -1.093 0.000) 1.093 7.435 ( 0.000 8.017 0.000) 8.017 7.765 ( 0.000 3.731 0.000) 3.731 7.784 ( 0.000 5.909 0.000) 5.909 7.985 ( 0.000 -1.174 0.000) 1.174 9.550 ( 0.000 -1.546 0.000) 1.546 9.598 ( 0.000 -8.198 0.000) 8.198 9.746 ( 0.000 4.116 0.000) 4.116 10.008 ( 0.000 0.541 0.000) 0.541 10.374 ( 0.000 1.111 0.000) 1.111 10.591 ( 0.000 2.473 0.000) 2.473 13.015 ( 0.000 4.790 0.000) 4.790 13.071 ( 0.000 0.061 0.000) 0.061 13.148 ( 0.000 11.540 0.000) 11.540 13.447 ( 0.000 1.986 0.000) 1.986 14.652 ( 0.000 -0.121 0.000) 0.121 15.150 ( 0.000 -2.902 0.000) 2.902 18.291 ( 0.000 -1.650 0.000) 1.650 18.377 ( 0.000 -3.536 0.000) 3.536 18.538 ( 0.000 2.026 0.000) 2.026 18.621 ( 0.000 0.894 0.000) 0.894======================= Grid point 34 (20/312) =======================q-point: ( 0.10 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.477 ( 5.400 21.506 4.222) 22.572 1.845 ( 1.179 27.052 15.149) 31.028 2.131 ( 19.043 25.199 4.729) 31.937 2.698 ( 3.448 15.691 1.519) 16.137 3.253 ( -1.769 -11.529 7.137) 13.674 4.178 ( -1.654 -0.639 -4.751) 5.071 4.231 ( -1.149 -4.640 -2.971) 5.628 4.422 ( -2.246 -13.303 -1.578) 13.583 4.584 ( 2.766 2.008 -1.856) 3.889 4.733 ( -1.302 1.523 -2.081) 2.889 5.044 ( -0.119 -7.974 -1.656) 8.145 5.227 ( -0.411 2.797 -2.159) 3.557 5.581 ( -1.294 -10.028 4.126) 10.920 5.618 ( -7.576 4.079 5.918) 10.443 5.772 ( 4.877 -2.007 -0.761) 5.329 5.890 ( 1.569 -0.445 -3.803) 4.138 7.432 ( -1.521 6.047 3.215) 7.015 7.717 ( -3.631 2.030 3.274) 5.294 7.893 ( 3.237 5.963 5.886) 8.982 8.024 ( 6.143 1.531 -0.702) 6.370 9.459 ( -4.734 -0.520 -6.674) 8.199 9.579 ( -0.713 -6.715 -3.594) 7.649 9.744 ( 0.259 2.399 -2.003) 3.136 9.980 ( -1.172 0.245 -3.791) 3.975 10.382 ( 1.045 1.361 -0.563) 1.806 10.571 ( -2.056 2.108 0.235) 2.954 13.047 ( 2.060 5.196 2.357) 6.066 13.114 ( 1.219 4.593 4.117) 6.287 13.259 ( 5.202 3.606 13.182) 14.623 13.475 ( 0.866 2.193 3.856) 4.520 14.594 ( -4.600 -0.041 -2.447) 5.210 15.149 ( 0.540 -3.156 -1.368) 3.482 18.285 ( -1.007 -1.933 0.082) 2.181 18.344 ( -0.599 -2.949 -4.788) 5.655 18.579 ( -0.121 1.017 2.872) 3.049 18.615 ( 2.103 1.109 -0.241) 2.390======================= Grid point 35 (21/312) =======================q-point: ( 0.20 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.641 ( 4.627 19.388 12.262) 23.402 2.090 ( 13.926 24.124 2.070) 27.932 2.561 ( 13.635 12.787 12.113) 22.275 2.845 ( 9.468 16.948 8.433) 21.166 3.296 ( -3.215 -9.153 9.992) 13.927 4.095 ( -3.693 -0.470 -3.026) 4.798 4.139 ( -3.283 -1.347 -5.651) 6.672 4.364 ( -0.319 -11.044 -5.735) 12.448 4.508 ( -0.648 2.250 -12.794) 13.006 4.765 ( 1.251 -3.961 5.741) 7.087 5.031 ( 0.739 -7.294 -2.221) 7.660 5.192 ( -1.715 -1.581 -1.688) 2.880 5.512 ( -8.768 7.683 6.239) 13.222 5.612 ( -0.804 -9.629 5.214) 10.980 5.818 ( 0.200 -6.778 0.018) 6.781 5.927 ( 5.551 0.514 -2.117) 5.963 7.450 ( 0.752 3.454 1.347) 3.782 7.665 ( -4.169 -1.597 0.097) 4.465 8.018 ( 2.932 7.315 10.473) 13.107 8.205 ( 8.279 4.084 8.023) 12.230 9.282 ( -5.497 1.369 -9.087) 10.708 9.507 ( -1.561 -5.695 -6.133) 8.514 9.702 ( -1.065 1.273 -5.326) 5.578 9.891 ( -2.550 -0.106 -7.219) 7.657 10.392 ( 0.799 2.231 -1.417) 2.761 10.539 ( -1.730 0.517 1.495) 2.344 13.128 ( 3.304 5.850 3.580) 7.613 13.187 ( 1.255 8.344 5.754) 10.213 13.518 ( 3.625 -1.653 11.940) 12.587 13.571 ( 4.479 -0.920 12.963) 13.746 14.461 ( -6.118 -0.692 -3.009) 6.852 15.142 ( 0.605 -3.905 -2.100) 4.475 18.240 ( -1.752 -2.050 -4.360) 5.126 18.289 ( -0.408 -2.221 -3.236) 3.946 18.528 ( -4.158 2.690 -1.085) 5.070 18.735 ( 5.943 -1.784 4.368) 7.588======================= Grid point 36 (22/312) =======================q-point: ( 0.30 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.898 ( 7.577 15.506 16.839) 24.112 2.352 ( 15.841 21.861 -5.365) 27.525 2.782 ( 5.349 9.993 3.555) 11.879 3.160 ( 6.702 8.787 11.839) 16.196 3.319 ( -4.624 -6.831 9.286) 12.421 3.989 ( -5.369 -1.093 1.036) 5.576 4.025 ( -2.081 2.960 -6.888) 7.780 4.270 ( -0.203 -6.509 -11.188) 12.946 4.438 ( 5.494 2.899 -8.260) 10.335 4.845 ( -0.048 -6.792 7.480) 10.104 5.012 ( -0.586 -5.790 -2.934) 6.517 5.107 ( -6.130 -5.692 -0.097) 8.366 5.476 ( -1.712 3.083 6.130) 7.072 5.650 ( -0.500 -5.335 4.297) 6.869 5.819 ( -0.244 -8.312 1.920) 8.534 5.999 ( 3.455 -3.168 -1.309) 4.867 7.469 ( 0.928 2.223 -1.053) 2.629 7.582 ( -2.478 -0.738 -3.666) 4.486 8.212 ( 4.152 5.584 14.797) 16.352 8.441 ( 5.713 3.571 11.960) 13.727 9.104 ( -3.961 3.125 -7.840) 9.323 9.414 ( -1.695 -4.802 -5.888) 7.785 9.604 ( -2.102 1.516 -8.099) 8.503 9.749 ( -3.573 -0.127 -9.893) 10.519 10.381 ( -0.303 3.054 -1.092) 3.257 10.543 ( 0.057 -1.719 1.787) 2.481 13.224 ( 3.500 7.306 2.643) 8.521 13.263 ( 0.304 10.180 6.277) 11.964 13.631 ( 1.879 2.253 6.606) 7.228 13.822 ( 3.894 -7.009 13.896) 16.043 14.344 ( -3.958 -4.467 -0.429) 5.984 15.131 ( 0.415 -5.009 -2.039) 5.424 18.162 ( -0.874 -1.098 -5.386) 5.566 18.257 ( -0.144 -2.084 -2.628) 3.357 18.423 ( -5.501 4.267 -1.647) 7.154 18.883 ( 5.131 -4.126 4.283) 7.855======================= Grid point 37 (23/312) =======================q-point: ( 0.40 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.225 ( 7.857 12.748 18.913) 24.123 2.533 ( 11.763 18.492 -11.422) 24.714 2.887 ( 3.778 11.751 1.390) 12.421 3.221 ( -5.359 3.266 2.015) 6.592 3.278 ( -6.356 -6.419 3.881) 9.832 3.884 ( -4.655 2.227 -1.131) 5.283 4.022 ( 3.668 -0.797 -2.866) 4.722 4.197 ( 0.948 -2.142 -2.207) 3.218 4.517 ( 9.363 4.572 -5.240) 11.663 4.855 ( -7.925 -1.850 4.183) 9.150 4.949 ( -1.602 -4.777 0.359) 5.052 5.049 ( -0.534 -13.936 0.940) 13.978 5.523 ( 0.609 -2.555 3.445) 4.332 5.666 ( -0.558 -1.398 0.899) 1.753 5.862 ( 0.834 -10.212 4.762) 11.299 6.023 ( 1.110 -5.982 -2.006) 6.406 7.466 ( 0.260 2.253 -1.436) 2.685 7.517 ( -0.933 0.752 -2.854) 3.096 8.431 ( 5.035 3.282 10.859) 12.411 8.597 ( -0.398 1.730 7.354) 7.565 9.021 ( 0.252 5.362 -1.196) 5.500 9.351 ( -0.374 -3.084 -1.651) 3.518 9.484 ( -2.004 1.630 -7.318) 7.761 9.574 ( -3.934 -0.013 -10.892) 11.581 10.368 ( -0.302 3.052 -0.310) 3.082 10.563 ( 0.429 -3.096 0.974) 3.274 13.296 ( 2.818 12.280 -0.245) 12.602 13.314 ( -1.033 7.808 5.449) 9.577 13.720 ( 1.601 2.878 4.302) 5.418 13.946 ( 0.186 -3.363 4.610) 5.709 14.323 ( -0.398 -12.120 3.103) 12.517 15.119 ( 0.179 -6.065 -1.270) 6.199 18.117 ( 0.672 -0.247 -3.189) 3.268 18.231 ( 0.117 -1.702 -2.643) 3.146 18.311 ( -4.935 5.411 -0.508) 7.341 18.992 ( 2.853 -5.550 2.516) 6.728======================= Grid point 38 (24/312) =======================q-point: (-0.50 0.27 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.481 ( -0.001 13.787 -0.022) 13.787 2.521 ( -0.002 14.190 0.022) 14.190 2.938 ( -0.005 13.037 0.001) 13.037 3.125 ( 0.007 1.210 -0.000) 1.210 3.247 ( 0.002 -3.854 -0.002) 3.854 3.834 ( 0.001 5.153 0.001) 5.153 4.028 ( 0.001 -9.601 0.002) 9.601 4.221 ( 0.000 3.340 -0.001) 3.340 4.618 ( -0.001 6.648 0.000) 6.648 4.747 ( 0.002 -1.419 -0.000) 1.419 4.945 ( 0.001 -6.088 0.000) 6.088 5.057 ( -0.000 -16.006 0.001) 16.006 5.547 ( 0.001 -4.232 0.002) 4.232 5.662 ( 0.002 -0.232 0.001) 0.232 5.903 ( 0.001 -10.664 -0.002) 10.664 6.017 ( 0.003 -6.993 0.005) 6.993 7.460 ( 0.000 2.575 0.000) 2.575 7.494 ( -0.000 1.165 -0.000) 1.165 8.576 ( 0.103 1.866 0.040) 1.870 8.579 ( -0.100 1.509 -0.038) 1.513 9.037 ( 0.001 5.985 0.001) 5.985 9.389 ( -0.001 -2.300 -0.002) 2.300 9.400 ( 0.001 1.821 0.002) 1.821 9.447 ( 0.000 0.207 0.001) 0.207 10.364 ( 0.000 2.968 0.000) 2.968 10.572 ( 0.000 -3.571 0.000) 3.571 13.319 ( -0.005 18.605 0.007) 18.605 13.333 ( 0.008 2.473 -0.006) 2.473 13.759 ( 0.000 3.240 0.000) 3.240 13.962 ( 0.007 -1.633 0.004) 1.633 14.343 ( 0.000 -15.295 0.001) 15.295 15.115 ( 0.001 -6.512 0.000) 6.512 18.113 ( 0.000 -0.399 -0.000) 0.399 18.213 ( 0.001 0.423 0.001) 0.423 18.261 ( 0.001 4.409 0.000) 4.409 19.031 ( 0.002 -6.013 0.002) 6.013======================= Grid point 44 (25/312) =======================q-point: ( 0.00 0.36 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.807 ( 0.000 21.563 0.000) 21.563 2.304 ( 0.000 23.610 0.000) 23.610 2.420 ( 0.000 22.847 0.000) 22.847 2.935 ( 0.000 9.636 0.000) 9.636 2.985 ( 0.000 -9.063 0.000) 9.063 4.039 ( 0.000 -16.428 0.000) 16.428 4.182 ( 0.000 -2.102 0.000) 2.102 4.255 ( 0.000 -6.522 0.000) 6.522 4.658 ( 0.000 5.792 0.000) 5.792 4.770 ( 0.000 -2.217 0.000) 2.217 4.950 ( 0.000 -2.153 0.000) 2.153 5.297 ( 0.000 -14.739 0.000) 14.739 5.323 ( 0.000 4.357 0.000) 4.357 5.646 ( 0.000 -5.235 0.000) 5.235 5.793 ( 0.000 6.482 0.000) 6.482 5.923 ( 0.000 1.940 0.000) 1.940 7.580 ( 0.000 7.066 0.000) 7.066 7.813 ( 0.000 0.747 0.000) 0.747 7.887 ( 0.000 4.603 0.000) 4.603 7.970 ( 0.000 -0.247 0.000) 0.247 9.465 ( 0.000 -5.390 0.000) 5.390 9.481 ( 0.000 -4.332 0.000) 4.332 9.845 ( 0.000 5.246 0.000) 5.246 10.012 ( 0.000 -0.363 0.000) 0.363 10.424 ( 0.000 3.837 0.000) 3.837 10.610 ( 0.000 -0.435 0.000) 0.435 13.045 ( 0.000 0.625 0.000) 0.625 13.071 ( 0.000 -0.087 0.000) 0.087 13.386 ( 0.000 10.335 0.000) 10.335 13.489 ( 0.000 2.249 0.000) 2.249 14.684 ( 0.000 3.803 0.000) 3.803 15.073 ( 0.000 -5.326 0.000) 5.326 18.261 ( 0.000 -1.310 0.000) 1.310 18.311 ( 0.000 -3.120 0.000) 3.120 18.579 ( 0.000 2.084 0.000) 2.084 18.634 ( 0.000 0.398 0.000) 0.398======================= Grid point 45 (26/312) =======================q-point: ( 0.10 0.36 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.878 ( 3.557 20.292 4.884) 21.172 2.337 ( -0.393 23.783 12.924) 27.071 2.553 ( 11.114 15.734 -0.321) 19.266 2.980 ( 3.073 10.712 4.740) 12.111 3.039 ( 2.502 -6.049 5.785) 8.737 4.066 ( 1.267 -15.369 1.630) 15.507 4.158 ( -0.225 -1.215 -3.400) 3.617 4.210 ( -3.017 -5.471 -2.657) 6.789 4.650 ( -0.018 4.014 -2.237) 4.595 4.736 ( -2.233 -0.901 -2.637) 3.571 4.920 ( -0.326 -4.117 -3.936) 5.705 5.219 ( -2.563 -7.720 -4.984) 9.539 5.387 ( 1.211 -3.151 4.731) 5.812 5.647 ( -1.395 -4.650 2.192) 5.327 5.782 ( -3.675 5.457 3.845) 7.620 5.924 ( 1.639 2.054 -2.234) 3.449 7.541 ( -3.836 5.290 2.097) 6.863 7.731 ( -6.315 -0.564 1.152) 6.444 7.997 ( 4.260 4.673 6.959) 9.403 8.060 ( 7.455 1.912 2.971) 8.250 9.412 ( -2.150 -3.253 -5.924) 7.092 9.463 ( -0.610 -5.146 -3.171) 6.075 9.818 ( -0.964 4.503 -3.418) 5.735 9.978 ( -1.563 -0.548 -3.783) 4.130 10.430 ( 0.659 3.455 -0.231) 3.525 10.589 ( -2.075 -0.237 -0.103) 2.091 13.079 ( 1.420 0.755 3.909) 4.227 13.129 ( 2.254 -1.001 6.754) 7.190 13.442 ( 2.855 9.685 5.789) 11.639 13.521 ( 1.238 2.564 4.101) 4.993 14.632 ( -3.788 4.408 -2.970) 6.527 15.065 ( 0.120 -5.784 -1.914) 6.094 18.250 ( -0.890 -1.516 -0.778) 1.922 18.286 ( -0.448 -2.792 -3.676) 4.638 18.604 ( 0.447 1.476 1.867) 2.422 18.634 ( 1.378 0.750 -0.539) 1.659======================= Grid point 46 (27/312) =======================q-point: ( 0.20 0.36 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.005 ( 2.971 18.449 9.812) 21.106 2.535 ( 10.685 21.815 4.220) 24.655 2.738 ( 5.068 2.706 6.390) 8.593 3.150 ( 2.278 1.745 13.967) 14.259 3.174 ( 7.341 10.749 5.643) 14.187 4.026 ( -5.450 -8.783 -2.554) 10.648 4.118 ( -1.488 -0.792 -3.690) 4.057 4.180 ( 3.677 -5.831 -1.636) 7.085 4.582 ( -0.347 5.219 -10.781) 11.982 4.677 ( -3.365 -4.090 3.824) 6.532 4.887 ( 1.460 -7.172 -4.972) 8.848 5.117 ( -3.434 -8.096 -4.671) 9.958 5.449 ( 1.077 -3.882 3.461) 5.311 5.622 ( -5.818 -0.986 6.135) 8.513 5.740 ( -3.073 2.069 1.673) 4.064 5.941 ( 0.966 0.138 -0.110) 0.982 7.512 ( -1.306 2.923 1.484) 3.529 7.633 ( -4.899 -1.714 0.350) 5.202 8.147 ( 3.061 6.024 10.676) 12.635 8.267 ( 7.313 2.240 9.756) 12.397 9.286 ( -3.094 -0.473 -8.864) 9.400 9.401 ( -1.089 -5.122 -5.847) 7.849 9.748 ( -1.394 3.167 -6.361) 7.241 9.884 ( -2.718 -0.717 -7.114) 7.650 10.439 ( 0.620 2.685 -0.759) 2.858 10.545 ( -2.564 -0.147 0.594) 2.636 13.166 ( 2.332 1.188 6.211) 6.740 13.262 ( 3.299 -1.394 8.786) 9.488 13.577 ( 1.747 5.891 9.738) 11.514 13.620 ( 4.199 4.129 7.527) 9.557 14.503 ( -5.558 5.563 -4.764) 9.195 15.040 ( -0.141 -6.975 -3.035) 7.608 18.207 ( -0.876 -1.335 -4.606) 4.875 18.243 ( -0.502 -2.354 -2.633) 3.567 18.582 ( -2.577 2.884 -0.423) 3.890 18.708 ( 4.341 -1.311 2.011) 4.960======================= Grid point 47 (28/312) =======================q-point: ( 0.30 0.36 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.197 ( 5.284 15.312 13.973) 21.392 2.744 ( 12.529 15.859 -7.071) 21.413 2.885 ( 3.815 2.240 8.369) 9.466 3.260 ( -1.650 1.832 9.065) 9.394 3.360 ( 1.007 10.438 8.095) 13.247 3.888 ( -5.382 -8.198 -3.005) 10.257 4.088 ( 1.604 2.979 -2.603) 4.269 4.193 ( 1.191 -1.688 -5.462) 5.840 4.517 ( 4.833 5.254 -7.299) 10.209 4.683 ( -2.581 -8.624 7.784) 11.901 4.860 ( 0.831 -8.467 -5.148) 9.944 4.999 ( -5.183 -7.475 -3.432) 9.722 5.481 ( -0.313 -2.260 0.935) 2.466 5.595 ( -4.629 -1.949 10.391) 11.542 5.712 ( -0.919 -0.772 -0.229) 1.222 5.941 ( -1.393 -3.206 0.816) 3.590 7.509 ( -0.050 1.782 -0.216) 1.796 7.566 ( -1.906 -0.793 -1.401) 2.495 8.322 ( 2.943 5.650 13.316) 14.761 8.487 ( 4.078 1.072 12.070) 12.785 9.153 ( -1.704 2.101 -7.393) 7.873 9.324 ( -0.739 -4.454 -5.295) 6.958 9.643 ( -1.884 2.390 -8.742) 9.256 9.744 ( -3.345 -0.512 -9.826) 10.392 10.433 ( -0.253 2.366 -0.926) 2.553 10.518 ( -1.288 -0.994 1.188) 2.015 13.272 ( 2.229 1.882 6.071) 6.736 13.404 ( 3.048 0.077 7.388) 7.993 13.687 ( 1.019 4.066 8.579) 9.548 13.795 ( 4.270 2.512 9.477) 10.693 14.355 ( -5.016 5.997 -4.749) 9.148 15.003 ( -0.433 -8.475 -3.054) 9.019 18.147 ( -0.017 -0.364 -5.003) 5.016 18.213 ( -0.155 -2.350 -2.463) 3.408 18.515 ( -3.741 5.235 -1.005) 6.512 18.807 ( 3.865 -4.130 2.126) 6.043======================= Grid point 48 (29/312) =======================q-point: ( 0.40 0.36 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.461 ( 6.734 11.541 16.144) 20.957 2.842 ( 7.249 9.388 -10.166) 15.621 3.012 ( 3.594 4.854 -0.151) 6.041 3.258 ( -6.528 5.194 7.149) 10.986 3.373 ( -2.369 10.691 2.202) 11.170 3.799 ( -2.182 -10.683 -0.150) 10.905 4.030 ( -1.013 4.751 -9.109) 10.323 4.230 ( 3.464 1.942 2.684) 4.794 4.590 ( 8.105 3.223 -4.245) 9.700 4.721 ( -2.017 -11.288 7.325) 13.606 4.819 ( -0.803 -8.686 -2.988) 9.221 4.864 ( -6.414 -4.816 -1.381) 8.139 5.480 ( -0.565 -1.652 1.440) 2.263 5.642 ( -0.931 -3.957 6.761) 7.889 5.701 ( 0.320 -3.266 -0.357) 3.301 5.910 ( -2.227 -5.680 0.226) 6.105 7.505 ( 0.178 1.708 -0.666) 1.842 7.530 ( -0.511 0.627 -1.661) 1.848 8.498 ( 3.262 3.563 9.613) 10.758 8.617 ( -0.669 0.244 6.819) 6.856 9.111 ( 1.335 4.064 -0.402) 4.296 9.293 ( 0.839 -2.974 -0.089) 3.091 9.518 ( -2.090 1.809 -8.198) 8.651 9.576 ( -3.497 0.012 -10.997) 11.540 10.419 ( -0.416 2.251 -0.350) 2.316 10.514 ( -0.349 -2.026 0.693) 2.169 13.353 ( 1.208 2.523 3.657) 4.604 13.506 ( 1.658 1.951 4.223) 4.939 13.781 ( 1.062 3.678 5.842) 6.985 13.932 ( 2.156 1.294 5.467) 6.018 14.243 ( -2.842 4.635 -2.833) 6.131 14.969 ( -0.406 -9.739 -1.958) 9.942 18.115 ( 0.720 0.156 -2.884) 2.977 18.190 ( 0.102 -2.273 -1.939) 2.989 18.439 ( -3.224 7.602 -0.701) 8.287 18.881 ( 2.185 -6.304 1.271) 6.792======================= Grid point 49 (30/312) =======================q-point: (-0.50 0.36 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.680 ( -0.005 6.907 -0.017) 6.907 2.802 ( 0.001 13.528 0.016) 13.528 3.015 ( -0.002 -1.635 0.002) 1.635 3.237 ( 0.007 9.955 -0.005) 9.955 3.361 ( 0.001 12.837 -0.001) 12.837 3.791 ( 0.002 -13.720 0.006) 13.720 3.959 ( 0.001 7.620 0.000) 7.620 4.284 ( 0.001 1.319 -0.001) 1.319 4.701 ( -0.019 -3.419 0.007) 3.420 4.707 ( 0.020 0.568 -0.008) 0.569 4.765 ( -0.000 -11.618 -0.001) 11.618 4.804 ( -0.000 -7.595 0.002) 7.595 5.485 ( -0.001 -1.969 0.002) 1.969 5.661 ( 0.004 -0.873 0.001) 0.873 5.715 ( -0.001 -7.475 -0.001) 7.475 5.885 ( 0.004 -6.590 0.003) 6.590 7.504 ( 0.000 1.929 0.000) 1.929 7.515 ( -0.000 1.037 -0.000) 1.037 8.604 ( 0.021 1.129 0.008) 1.130 8.612 ( -0.017 1.552 -0.006) 1.552 9.138 ( 0.001 4.674 0.001) 4.674 9.339 ( -0.000 -2.721 -0.000) 2.721 9.434 ( 0.000 1.654 0.000) 1.654 9.459 ( 0.000 0.693 0.000) 0.693 10.414 ( 0.000 2.175 0.000) 2.175 10.515 ( 0.000 -2.425 0.000) 2.425 13.383 ( 0.003 2.770 0.002) 2.770 13.543 ( 0.003 2.780 -0.001) 2.780 13.823 ( -0.000 3.443 0.001) 3.443 13.977 ( 0.003 2.168 0.002) 2.168 14.203 ( 0.002 2.791 0.002) 2.791 14.955 ( 0.001 -10.242 0.000) 10.242 18.110 ( 0.000 0.079 0.000) 0.079 18.181 ( 0.000 -2.171 0.000) 2.171 18.402 ( 0.001 8.768 0.001) 8.768 18.907 ( 0.002 -7.112 0.002) 7.112======================= Grid point 55 (31/312) =======================q-point: ( 0.00 0.45 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.202 ( 0.000 19.540 0.000) 19.540 2.530 ( 0.000 -12.461 0.000) 12.461 2.684 ( 0.000 15.283 0.000) 15.283 2.851 ( 0.000 -1.976 0.000) 1.976 3.244 ( 0.000 19.927 0.000) 19.927 3.661 ( 0.000 -21.876 0.000) 21.876 4.158 ( 0.000 -0.196 0.000) 0.196 4.178 ( 0.000 -2.283 0.000) 2.283 4.742 ( 0.000 2.422 0.000) 2.422 4.746 ( 0.000 0.543 0.000) 0.543 4.945 ( 0.000 1.366 0.000) 1.366 5.047 ( 0.000 -10.117 0.000) 10.117 5.419 ( 0.000 5.649 0.000) 5.649 5.534 ( 0.000 -6.162 0.000) 6.162 5.897 ( 0.000 4.047 0.000) 4.047 5.941 ( 0.000 -0.540 0.000) 0.540 7.701 ( 0.000 5.541 0.000) 5.541 7.787 ( 0.000 -3.201 0.000) 3.201 7.952 ( 0.000 2.174 0.000) 2.174 7.971 ( 0.000 -0.045 0.000) 0.045 9.400 ( 0.000 -1.361 0.000) 1.361 9.412 ( 0.000 -2.454 0.000) 2.454 9.933 ( 0.000 3.843 0.000) 3.843 9.990 ( 0.000 -2.032 0.000) 2.032 10.506 ( 0.000 4.298 0.000) 4.298 10.577 ( 0.000 -2.907 0.000) 2.907 13.057 ( 0.000 0.575 0.000) 0.575 13.066 ( 0.000 -0.418 0.000) 0.418 13.513 ( 0.000 3.087 0.000) 3.087 13.525 ( 0.000 1.172 0.000) 1.172 14.796 ( 0.000 7.532 0.000) 7.532 14.947 ( 0.000 -7.623 0.000) 7.623 18.247 ( 0.000 -0.022 0.000) 0.022 18.264 ( 0.000 -1.721 0.000) 1.721 18.614 ( 0.000 1.492 0.000) 1.492 18.633 ( 0.000 -0.530 0.000) 0.530======================= Grid point 56 (32/312) =======================q-point: ( 0.10 0.45 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.250 ( 1.368 18.395 5.549) 19.263 2.560 ( 0.180 -12.352 4.989) 13.323 2.731 ( 2.528 16.089 6.347) 17.479 2.927 ( 5.292 -4.171 4.595) 8.156 3.319 ( 5.625 19.832 3.861) 20.972 3.712 ( 2.944 -20.271 3.565) 20.791 4.142 ( -0.256 -0.285 -2.482) 2.512 4.153 ( -1.178 -1.548 -2.394) 3.085 4.710 ( -2.522 2.596 -0.649) 3.678 4.742 ( 1.470 0.627 -4.281) 4.570 4.886 ( -3.672 1.232 -4.392) 5.856 5.005 ( -2.491 -10.561 -3.303) 11.342 5.431 ( 0.550 4.754 1.167) 4.926 5.537 ( -0.042 -5.988 0.513) 6.010 5.885 ( -3.236 4.410 3.272) 6.374 5.937 ( -0.760 -0.943 0.600) 1.352 7.632 ( -5.688 4.184 1.128) 7.151 7.699 ( -6.730 -2.683 0.599) 7.270 8.065 ( 5.526 2.327 6.755) 9.032 8.084 ( 6.880 0.306 5.407) 8.756 9.369 ( -0.782 -0.800 -4.829) 4.957 9.387 ( -0.567 -2.642 -3.926) 4.766 9.898 ( -1.549 3.678 -3.853) 5.547 9.954 ( -1.693 -2.087 -3.863) 4.706 10.502 ( -0.344 3.723 -0.175) 3.743 10.563 ( -1.383 -2.420 -0.179) 2.793 13.093 ( 1.429 0.804 4.552) 4.838 13.110 ( 1.641 -0.962 5.474) 5.795 13.559 ( 1.494 2.567 5.607) 6.345 13.565 ( 2.065 1.584 4.259) 4.992 14.760 ( -2.168 8.470 -3.015) 9.248 14.928 ( -0.733 -8.362 -2.523) 8.765 18.232 ( -0.651 -0.221 -1.723) 1.855 18.244 ( -0.510 -1.480 -2.615) 3.048 18.629 ( 0.718 1.027 0.859) 1.520 18.641 ( 1.020 -0.134 0.012) 1.029======================= Grid point 57 (33/312) =======================q-point: ( 0.20 0.45 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.341 ( 1.105 16.472 8.746) 18.683 2.621 ( 0.363 -12.053 6.559) 13.727 2.907 ( 8.684 15.745 6.642) 19.169 3.108 ( 7.724 -4.820 6.325) 11.086 3.479 ( 3.808 16.151 7.314) 18.134 3.781 ( -1.362 -15.077 3.529) 15.544 4.111 ( 0.321 0.229 -2.554) 2.585 4.127 ( 2.163 -1.370 -2.106) 3.315 4.648 ( -2.826 2.670 -1.288) 4.095 4.713 ( 0.562 6.005 -7.059) 9.285 4.758 ( -3.274 -4.692 -4.995) 7.595 4.911 ( -2.631 -11.388 -5.155) 12.774 5.453 ( 0.285 3.011 1.470) 3.362 5.536 ( -1.064 -5.220 1.097) 5.439 5.839 ( -5.797 5.427 4.521) 9.138 5.918 ( -3.072 -2.653 2.252) 4.642 7.561 ( -3.141 2.233 1.276) 4.060 7.600 ( -4.496 -1.827 0.782) 4.916 8.242 ( 4.076 3.673 10.853) 12.161 8.283 ( 5.684 -0.645 10.615) 12.058 9.284 ( -1.265 0.685 -7.810) 7.941 9.320 ( -0.755 -3.142 -6.610) 7.358 9.810 ( -2.123 3.083 -6.887) 7.839 9.859 ( -2.588 -1.961 -7.057) 7.768 10.490 ( -0.648 2.524 -0.344) 2.628 10.530 ( -1.940 -1.490 0.031) 2.446 13.190 ( 2.499 1.424 7.199) 7.752 13.223 ( 2.859 -2.041 8.307) 9.019 13.655 ( 1.437 2.793 8.291) 8.866 13.679 ( 3.058 0.765 8.094) 8.686 14.667 ( -3.282 10.713 -5.064) 12.296 14.874 ( -1.339 -10.145 -4.134) 11.037 18.193 ( -0.393 -0.048 -4.008) 4.027 18.206 ( -0.402 -1.397 -3.012) 3.345 18.635 ( -0.420 2.577 0.140) 2.615 18.678 ( 2.043 -1.892 0.826) 2.905======================= Grid point 58 (34/312) =======================q-point: ( 0.30 0.45 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.475 ( 2.944 13.576 11.203) 17.846 2.707 ( 1.602 -10.235 7.224) 12.630 3.128 ( 10.916 14.332 -0.507) 18.022 3.296 ( 6.163 -1.983 4.201) 7.718 3.537 ( -4.124 8.676 5.069) 10.862 3.714 ( -6.180 -9.492 -0.485) 11.337 4.138 ( 3.154 2.273 -0.031) 3.888 4.172 ( 2.725 -1.166 -0.515) 3.008 4.589 ( -3.709 0.136 1.768) 4.111 4.631 ( -0.058 4.383 -5.088) 6.716 4.708 ( 1.129 -4.592 -4.730) 6.688 4.827 ( -0.849 -9.561 -5.057) 10.850 5.467 ( -0.128 1.226 1.069) 1.632 5.521 ( -2.200 -4.084 2.847) 5.443 5.776 ( -5.477 5.039 4.283) 8.587 5.869 ( -4.845 -4.411 2.912) 7.170 7.536 ( -0.736 1.061 0.139) 1.299 7.552 ( -1.260 -0.695 -0.159) 1.447 8.419 ( 2.483 4.277 12.444) 13.391 8.479 ( 2.892 -1.868 12.089) 12.570 9.194 ( -0.133 2.353 -6.345) 6.768 9.248 ( 0.064 -3.416 -5.472) 6.451 9.689 ( -2.358 2.304 -9.231) 9.802 9.726 ( -2.932 -1.463 -9.583) 10.128 10.472 ( -0.859 1.715 -0.383) 1.956 10.499 ( -1.487 -1.125 0.364) 1.900 13.310 ( 2.544 2.245 7.029) 7.805 13.360 ( 2.967 -2.943 7.856) 8.899 13.763 ( 1.094 3.586 8.540) 9.327 13.814 ( 2.237 -1.234 8.573) 8.946 14.555 ( -3.001 13.218 -5.457) 14.611 14.805 ( -1.460 -12.112 -4.295) 12.934 18.150 ( 0.258 0.658 -4.096) 4.156 18.173 ( 0.079 -1.709 -3.050) 3.497 18.619 ( -1.200 5.502 -0.211) 5.635 18.720 ( 1.560 -4.958 0.765) 5.254======================= Grid point 59 (35/312) =======================q-point: ( 0.40 0.45 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.658 ( 4.114 9.019 11.317) 15.045 2.810 ( 2.069 -6.765 5.591) 9.017 3.229 ( 4.364 13.141 -10.991) 17.678 3.385 ( -0.009 2.509 3.801) 4.555 3.518 ( 0.374 3.074 2.067) 3.723 3.602 ( -4.714 -6.974 0.238) 8.421 4.139 ( -0.585 5.772 -3.051) 6.555 4.225 ( 1.998 -2.622 0.940) 3.428 4.560 ( -2.236 -3.218 3.117) 5.008 4.604 ( -0.890 -4.663 -0.476) 4.771 4.705 ( 3.262 0.986 -3.770) 5.082 4.777 ( -0.784 -4.641 -2.591) 5.373 5.474 ( -0.170 1.251 1.287) 1.803 5.532 ( -0.051 -4.856 3.355) 5.903 5.727 ( -3.308 3.378 2.179) 5.206 5.808 ( -4.096 -4.908 1.887) 6.665 7.529 ( 0.101 0.867 -0.447) 0.980 7.537 ( -0.102 0.032 -0.794) 0.801 8.561 ( 1.497 2.877 8.167) 8.787 8.604 ( 0.106 -1.529 7.071) 7.235 9.179 ( 1.816 3.217 0.352) 3.711 9.237 ( 1.636 -2.893 0.597) 3.377 9.550 ( -2.451 1.442 -9.278) 9.704 9.570 ( -2.978 -0.671 -10.306) 10.749 10.455 ( -0.624 1.568 -0.142) 1.693 10.483 ( -0.704 -1.422 0.265) 1.609 13.405 ( 1.453 2.980 4.244) 5.385 13.468 ( 1.766 -3.501 4.690) 6.113 13.853 ( 0.716 3.695 5.725) 6.851 13.916 ( 1.079 -2.660 5.541) 6.241 14.463 ( -1.713 15.159 -3.772) 15.715 14.746 ( -0.969 -13.549 -2.825) 13.874 18.125 ( 0.520 0.907 -2.446) 2.660 18.151 ( 0.263 -1.756 -2.056) 2.716 18.593 ( -1.168 8.304 -0.244) 8.389 18.747 ( 0.753 -7.626 0.407) 7.674======================= Grid point 60 (36/312) =======================q-point: (-0.50 0.45 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.779 ( -0.002 4.345 -0.008) 4.345 2.862 ( -0.000 -4.029 -0.005) 4.029 3.170 ( -0.000 15.042 0.010) 15.042 3.400 ( 0.000 -0.787 0.000) 0.787 3.552 ( -0.022 4.531 0.011) 4.531 3.557 ( 0.030 -5.053 -0.010) 5.053 4.111 ( 0.001 8.003 0.001) 8.003 4.246 ( 0.001 -5.197 0.001) 5.197 4.557 ( 0.000 -4.615 -0.000) 4.615 4.590 ( -0.000 -6.504 0.001) 6.504 4.732 ( -0.000 -0.105 0.000) 0.105 4.744 ( 0.000 -0.365 -0.000) 0.365 5.483 ( -0.001 1.906 0.002) 1.906 5.557 ( 0.000 -5.714 0.001) 5.714 5.705 ( 0.004 2.407 0.001) 2.407 5.774 ( 0.004 -4.788 0.002) 4.788 7.530 ( -0.000 0.670 -0.000) 0.670 7.531 ( 0.000 0.479 -0.000) 0.479 8.623 ( 0.005 0.736 0.002) 0.736 8.629 ( -0.001 0.201 0.000) 0.201 9.218 ( 0.000 3.779 0.001) 3.779 9.284 ( 0.000 -3.108 0.000) 3.108 9.459 ( 0.000 0.890 0.000) 0.890 9.467 ( 0.000 0.065 0.000) 0.065 10.449 ( 0.000 1.560 0.000) 1.560 10.478 ( 0.000 -1.602 0.000) 1.602 13.440 ( 0.004 3.278 0.002) 3.278 13.508 ( 0.005 -3.700 0.001) 3.700 13.890 ( -0.000 3.512 0.001) 3.512 13.955 ( -0.000 -3.073 0.000) 3.073 14.428 ( 0.002 15.934 0.001) 15.934 14.722 ( 0.001 -14.076 0.001) 14.076 18.118 ( 0.000 0.844 0.000) 0.844 18.143 ( 0.000 -1.692 0.000) 1.692 18.580 ( 0.002 9.518 0.001) 9.518 18.756 ( 0.002 -8.686 0.001) 8.686======================= Grid point 121 (37/312) =======================q-point: ( 0.00 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.501 ( 8.374 0.000 25.350) 26.697 0.571 ( -8.042 0.000 28.492) 29.605 1.034 ( 8.049 0.000 51.193) 51.822 2.183 ( -4.356 0.000 11.774) 12.554 3.660 ( 5.273 0.000 3.386) 6.266 4.099 ( -3.510 0.000 -8.154) 8.877 4.162 ( -3.403 0.000 -6.973) 7.759 4.377 ( 0.148 0.000 -4.789) 4.791 4.674 ( 1.510 0.000 9.098) 9.223 4.793 ( 6.698 0.000 1.243) 6.813 5.009 ( -1.586 0.000 -14.984) 15.068 5.063 ( -6.550 0.000 5.436) 8.512 5.501 ( 4.159 0.000 -2.596) 4.903 5.581 ( -2.967 0.000 3.107) 4.296 5.932 ( -0.740 0.000 1.269) 1.469 6.192 ( 2.839 0.000 -2.195) 3.588 7.207 ( -4.674 0.000 2.631) 5.364 7.410 ( 4.551 0.000 5.260) 6.956 7.664 ( -0.190 0.000 4.214) 4.218 7.758 ( 6.600 0.000 6.999) 9.620 9.318 ( -4.204 0.000 -0.956) 4.311 9.646 ( -1.709 0.000 -5.613) 5.867 9.869 ( -2.099 0.000 -2.272) 3.093 10.183 ( -3.434 0.000 -4.316) 5.515 10.369 ( -5.731 0.000 -2.897) 6.421 10.437 ( 3.421 0.000 -0.518) 3.460 12.518 ( -3.474 0.000 10.575) 11.131 13.085 ( 1.145 0.000 3.657) 3.832 13.430 ( 0.865 0.000 4.680) 4.759 14.012 ( 55.062 0.000 -1.765) 55.091 14.706 ( -2.621 0.000 -0.549) 2.678 15.188 ( 0.700 0.000 -2.013) 2.131 18.294 ( 0.018 0.000 -2.719) 2.719 18.456 ( -1.720 0.000 -2.870) 3.346 18.608 ( -3.352 0.000 1.308) 3.599 18.819 ( 26.222 0.000 -1.114) 26.246======================= Grid point 122 (38/312) =======================q-point: ( 0.10 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.871 ( 9.490 0.000 23.845) 25.664 0.930 ( 9.670 0.000 25.559) 27.327 1.848 ( 25.899 0.000 39.999) 47.651 2.259 ( -0.864 0.000 13.281) 13.309 3.744 ( 2.330 0.000 -3.675) 4.351 4.021 ( 1.914 0.000 -12.934) 13.075 4.056 ( -3.928 0.000 -1.460) 4.191 4.248 ( -1.760 0.000 -16.942) 17.033 4.759 ( 1.595 0.000 1.040) 1.904 4.873 ( 0.271 0.000 -5.740) 5.747 4.961 ( -3.929 0.000 2.556) 4.687 5.095 ( 15.199 0.000 3.589) 15.617 5.512 ( -1.260 0.000 -1.556) 2.002 5.595 ( 3.545 0.000 1.068) 3.702 5.952 ( 2.073 0.000 -0.694) 2.186 6.219 ( 1.415 0.000 -0.412) 1.474 7.258 ( 4.747 0.000 1.475) 4.971 7.478 ( 0.417 0.000 -1.666) 1.717 7.839 ( 8.468 0.000 14.756) 17.013 7.934 ( 3.945 0.000 11.165) 11.842 9.194 ( -6.235 0.000 -4.194) 7.514 9.547 ( -1.302 0.000 -8.444) 8.544 9.773 ( -3.878 0.000 -6.161) 7.280 10.043 ( -5.358 0.000 -6.851) 8.697 10.275 ( -3.145 0.000 -0.346) 3.164 10.510 ( 4.441 0.000 -0.069) 4.441 12.561 ( -4.035 0.000 12.148) 12.801 13.152 ( 0.996 0.000 5.474) 5.564 13.504 ( 0.919 0.000 6.735) 6.797 14.499 ( -1.980 0.000 -5.787) 6.116 14.789 ( 28.916 0.000 -18.147) 34.139 15.188 ( 1.426 0.000 -1.772) 2.275 18.263 ( 0.208 0.000 -3.967) 3.972 18.372 ( -3.313 0.000 -4.028) 5.216 18.519 ( -6.531 0.000 -0.486) 6.549 19.181 ( 16.895 0.000 -8.462) 18.895======================= Grid point 123 (39/312) =======================q-point: ( 0.20 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.315 ( 14.523 0.000 19.784) 24.543 1.355 ( 9.490 0.000 24.812) 26.565 2.336 ( -0.711 0.000 12.665) 12.685 2.705 ( 25.473 0.000 26.198) 36.540 3.663 ( -2.969 0.000 -10.225) 10.647 3.904 ( -2.719 0.000 -8.263) 8.699 3.956 ( -3.329 0.000 -5.677) 6.581 4.052 ( 0.119 0.000 -16.173) 16.174 4.795 ( 5.502 0.000 -3.099) 6.315 4.868 ( -7.035 0.000 2.022) 7.320 4.884 ( -3.180 0.000 7.076) 7.758 5.419 ( 14.719 0.000 1.623) 14.809 5.485 ( 1.261 0.000 -1.988) 2.354 5.686 ( 4.060 0.000 1.709) 4.405 5.989 ( 4.157 0.000 -2.872) 5.052 6.238 ( 0.816 0.000 0.216) 0.844 7.331 ( 3.806 0.000 -3.704) 5.310 7.448 ( -0.224 0.000 -3.242) 3.250 8.148 ( 4.610 0.000 16.057) 16.705 8.174 ( 10.148 0.000 15.811) 18.787 9.020 ( -7.431 0.000 -5.142) 9.037 9.444 ( -0.470 0.000 -8.603) 8.616 9.613 ( -5.070 0.000 -9.173) 10.481 9.863 ( -6.116 0.000 -7.885) 9.978 10.233 ( -1.220 0.000 -0.453) 1.301 10.592 ( 4.669 0.000 -0.385) 4.685 12.604 ( -4.834 0.000 12.721) 13.609 13.221 ( 0.339 0.000 5.664) 5.674 13.586 ( 0.400 0.000 6.994) 7.006 14.329 ( -9.507 0.000 -1.131) 9.574 15.061 ( 20.946 0.000 -20.165) 29.075 15.206 ( 1.894 0.000 -0.966) 2.127 18.224 ( 0.098 0.000 -4.736) 4.737 18.268 ( -3.348 0.000 -4.168) 5.346 18.377 ( -7.525 0.000 -0.978) 7.588 19.314 ( 4.931 0.000 -2.340) 5.458======================= Grid point 124 (40/312) =======================q-point: ( 0.30 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.741 ( 6.420 0.000 22.166) 23.077 1.761 ( 13.520 0.000 17.210) 21.886 2.411 ( -3.114 0.000 10.169) 10.635 3.260 ( 15.380 0.000 4.304) 15.970 3.467 ( -7.674 0.000 -7.667) 10.847 3.820 ( -2.128 0.000 6.043) 6.406 3.850 ( 2.485 0.000 -13.133) 13.366 3.970 ( 5.287 0.000 -10.874) 12.091 4.758 ( -7.076 0.000 2.264) 7.429 4.846 ( -8.215 0.000 7.683) 11.248 4.892 ( 6.084 0.000 -1.240) 6.209 5.525 ( 4.828 0.000 -2.537) 5.454 5.633 ( 6.783 0.000 1.535) 6.954 5.755 ( 1.369 0.000 1.372) 1.938 6.058 ( 7.474 0.000 -4.770) 8.866 6.255 ( 1.243 0.000 -0.549) 1.359 7.341 ( 1.379 0.000 -2.232) 2.624 7.423 ( 0.406 0.000 -1.618) 1.668 8.384 ( 4.527 0.000 12.498) 13.292 8.477 ( 7.696 0.000 10.481) 13.003 8.843 ( -7.043 0.000 -2.730) 7.554 9.375 ( 0.625 0.000 -4.827) 4.867 9.428 ( -4.412 0.000 -8.867) 9.904 9.680 ( -5.250 0.000 -6.915) 8.682 10.215 ( -0.146 0.000 -0.830) 0.843 10.668 ( 4.158 0.000 -1.008) 4.278 12.630 ( -5.998 0.000 12.567) 13.924 13.268 ( -0.710 0.000 4.134) 4.194 13.647 ( -0.607 0.000 5.197) 5.233 14.163 ( -7.440 0.000 -0.531) 7.459 15.178 ( 14.512 0.000 -21.547) 25.979 15.236 ( 1.785 0.000 0.069) 1.786 18.157 ( -3.245 0.000 -3.369) 4.677 18.180 ( -2.261 0.000 -2.576) 3.428 18.266 ( -2.648 0.000 -1.070) 2.857 19.344 ( -0.123 0.000 -0.013) 0.124======================= Grid point 125 (41/312) =======================q-point: ( 0.40 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.974 ( -2.517 0.000 15.054) 15.263 2.096 ( 5.061 0.000 12.439) 13.429 2.429 ( -4.379 0.000 8.185) 9.282 3.294 ( -4.444 0.000 -0.577) 4.481 3.403 ( 6.750 0.000 -4.323) 8.016 3.792 ( 6.612 0.000 -16.112) 17.416 3.909 ( -1.437 0.000 8.247) 8.371 4.014 ( 6.903 0.000 -4.333) 8.151 4.665 ( -5.722 0.000 3.212) 6.562 4.753 ( -8.234 0.000 5.922) 10.143 4.985 ( 4.707 0.000 -0.589) 4.744 5.572 ( 3.614 0.000 -5.365) 6.469 5.712 ( 1.226 0.000 0.949) 1.551 5.760 ( -1.143 0.000 -0.214) 1.162 6.141 ( 7.236 0.000 -7.583) 10.481 6.266 ( 1.159 0.000 -2.107) 2.405 7.369 ( 1.495 0.000 3.597) 3.895 7.435 ( 0.990 0.000 1.360) 1.682 8.508 ( 0.160 0.000 1.229) 1.240 8.614 ( 1.314 0.000 -1.428) 1.940 8.720 ( -4.545 0.000 0.184) 4.549 9.333 ( 0.311 0.000 -0.056) 0.316 9.388 ( 1.991 0.000 3.066) 3.656 9.568 ( -1.173 0.000 -2.215) 2.506 10.208 ( 0.325 0.000 -1.076) 1.124 10.717 ( 2.652 0.000 -1.957) 3.296 12.634 ( -6.768 0.000 12.189) 13.942 13.272 ( -1.789 0.000 1.393) 2.268 13.660 ( -1.911 0.000 1.910) 2.702 14.049 ( -4.102 0.000 -1.372) 4.325 15.173 ( 10.887 0.000 -26.557) 28.702 15.266 ( 0.896 0.000 0.725) 1.153 18.079 ( -2.506 0.000 0.327) 2.527 18.145 ( -0.318 0.000 0.517) 0.607 18.243 ( 0.634 0.000 -1.108) 1.277 19.312 ( -2.484 0.000 -1.634) 2.973======================= Grid point 126 (42/312) =======================q-point: (-0.50 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.917 ( -13.960 0.000 5.268) 14.921 2.124 ( -10.951 0.000 4.414) 11.807 2.427 ( -4.501 0.000 7.971) 9.154 3.362 ( 6.338 0.000 10.289) 12.084 3.531 ( 8.208 0.000 -1.749) 8.392 3.760 ( 7.476 0.000 -17.389) 18.928 3.821 ( -12.305 0.000 1.897) 12.450 4.122 ( 7.259 0.000 0.093) 7.259 4.622 ( -2.901 0.000 4.502) 5.356 4.687 ( -3.887 0.000 3.997) 5.575 5.047 ( 1.920 0.000 0.917) 2.127 5.538 ( 0.557 0.000 -8.821) 8.839 5.715 ( -1.220 0.000 -0.057) 1.222 5.721 ( -1.561 0.000 -2.379) 2.845 6.159 ( 4.102 0.000 -9.265) 10.133 6.251 ( 0.183 0.000 -3.675) 3.680 7.470 ( 2.816 0.000 8.322) 8.785 7.483 ( 1.067 0.000 4.315) 4.445 8.360 ( -8.843 0.000 -11.919) 14.841 8.496 ( -5.738 0.000 -12.274) 13.549 8.751 ( 3.620 0.000 6.993) 7.875 9.430 ( 4.462 0.000 7.995) 9.156 9.493 ( 2.132 0.000 8.529) 8.792 9.606 ( 4.236 0.000 3.679) 5.611 10.205 ( 0.388 0.000 -0.870) 0.953 10.722 ( 0.526 0.000 -3.009) 3.055 12.626 ( -6.953 0.000 11.670) 13.584 13.232 ( -2.400 0.000 -1.545) 2.855 13.615 ( -2.965 0.000 -1.492) 3.319 13.984 ( -0.497 0.000 -3.477) 3.513 15.056 ( 8.811 0.000 -33.592) 34.728 15.279 ( -0.337 0.000 0.720) 0.795 18.090 ( 1.643 0.000 3.514) 3.879 18.179 ( 1.649 0.000 3.688) 4.040 18.257 ( 1.273 0.000 0.189) 1.287 19.219 ( -3.868 0.000 -5.519) 6.740======================= Grid point 127 (43/312) =======================q-point: (-0.40 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.622 ( -20.365 0.000 1.194) 20.400 1.852 ( -20.380 0.000 2.087) 20.487 2.410 ( -6.200 0.000 8.031) 10.146 3.270 ( -22.737 0.000 -19.152) 29.728 3.635 ( 7.934 0.000 6.099) 10.007 3.731 ( 7.981 0.000 -8.858) 11.924 3.864 ( 6.824 0.000 10.914) 12.872 4.281 ( 7.428 0.000 5.208) 9.072 4.650 ( 0.300 0.000 5.911) 5.919 4.684 ( 0.398 0.000 0.216) 0.453 5.082 ( -0.601 0.000 4.994) 5.030 5.442 ( -0.623 0.000 -9.309) 9.330 5.659 ( -3.694 0.000 -2.687) 4.568 5.663 ( -0.648 0.000 -4.991) 5.033 6.137 ( 2.999 0.000 -7.189) 7.790 6.205 ( -0.432 0.000 -4.575) 4.596 7.551 ( 0.390 0.000 6.085) 6.098 7.613 ( 3.733 0.000 7.290) 8.190 8.034 ( -11.664 0.000 -13.582) 17.903 8.209 ( -9.211 0.000 -16.532) 18.924 8.936 ( 6.361 0.000 10.113) 11.947 9.605 ( 5.021 0.000 8.339) 9.734 9.607 ( 0.821 0.000 8.899) 8.937 9.766 ( 6.768 0.000 6.401) 9.316 10.208 ( 0.310 0.000 0.560) 0.640 10.679 ( -1.395 0.000 -3.844) 4.090 12.608 ( -7.104 0.000 10.700) 12.844 13.162 ( -2.254 0.000 -3.530) 4.188 13.532 ( -3.089 0.000 -3.516) 4.680 13.952 ( 3.293 0.000 -9.491) 10.047 14.846 ( 7.626 0.000 -38.578) 39.325 15.269 ( -1.113 0.000 0.299) 1.152 18.195 ( 4.822 0.000 4.216) 6.405 18.267 ( 2.607 0.000 5.501) 6.087 18.291 ( 1.224 0.000 2.617) 2.889 19.062 ( -4.653 0.000 -10.510) 11.494======================= Grid point 128 (44/312) =======================q-point: (-0.30 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.234 ( -23.462 0.000 2.891) 23.639 1.462 ( -24.884 0.000 3.995) 25.203 2.350 ( -9.784 0.000 7.420) 12.279 2.531 ( -33.246 0.000 -21.996) 39.864 3.606 ( 4.052 0.000 -16.410) 16.903 4.004 ( 8.368 0.000 15.592) 17.695 4.088 ( 7.191 0.000 6.902) 9.968 4.489 ( 8.982 0.000 4.992) 10.275 4.660 ( -0.878 0.000 -6.030) 6.094 4.740 ( 1.674 0.000 8.089) 8.260 5.158 ( 0.941 0.000 10.917) 10.958 5.351 ( 0.069 0.000 -7.990) 7.991 5.528 ( -5.545 0.000 -6.401) 8.468 5.604 ( 0.488 0.000 -6.431) 6.450 6.133 ( 3.103 0.000 -5.893) 6.660 6.160 ( 0.667 0.000 -4.295) 4.346 7.598 ( -1.834 0.000 4.451) 4.814 7.656 ( -2.195 0.000 -16.080) 16.229 7.776 ( -5.519 0.000 8.652) 10.262 7.872 ( -9.100 0.000 -15.084) 17.616 9.146 ( 5.323 0.000 9.383) 10.788 9.691 ( -0.246 0.000 6.847) 6.851 9.760 ( 4.058 0.000 5.802) 7.081 9.953 ( 6.506 0.000 6.211) 8.994 10.238 ( 0.510 0.000 4.937) 4.963 10.602 ( -2.478 0.000 -4.353) 5.009 12.575 ( -7.198 0.000 9.324) 11.780 13.090 ( -1.398 0.000 -3.721) 3.975 13.447 ( -2.206 0.000 -3.416) 4.066 13.849 ( 5.147 0.000 -33.078) 33.476 14.629 ( 6.288 0.000 -26.684) 27.415 15.248 ( -1.177 0.000 -0.330) 1.222 18.289 ( 2.433 0.000 0.018) 2.433 18.367 ( 1.843 0.000 5.556) 5.854 18.387 ( 3.893 0.000 7.407) 8.368 18.848 ( -4.843 0.000 -14.825) 15.596======================= Grid point 129 (45/312) =======================q-point: (-0.20 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.856 ( -24.304 0.000 11.531) 26.900 1.041 ( -27.427 0.000 8.758) 28.791 1.608 ( -41.154 0.000 -19.751) 45.648 2.270 ( -9.751 0.000 8.518) 12.948 3.536 ( 4.010 0.000 -11.335) 12.023 4.255 ( 5.183 0.000 3.703) 6.370 4.269 ( 3.504 0.000 14.455) 14.873 4.543 ( -2.083 0.000 -9.275) 9.506 4.666 ( 8.620 0.000 -3.240) 9.209 4.843 ( 1.042 0.000 3.575) 3.724 5.274 ( -2.133 0.000 -3.277) 3.910 5.317 ( 5.455 0.000 5.637) 7.844 5.330 ( -6.815 0.000 -11.463) 13.336 5.566 ( 1.296 0.000 -3.777) 3.993 6.100 ( 1.318 0.000 -10.611) 10.693 6.149 ( 2.437 0.000 -3.948) 4.639 7.477 ( -3.591 0.000 -0.537) 3.631 7.484 ( -6.921 0.000 -8.915) 11.286 7.696 ( -2.852 0.000 1.204) 3.095 7.755 ( -1.924 0.000 -8.837) 9.044 9.295 ( 2.197 0.000 6.501) 6.863 9.729 ( -1.100 0.000 3.135) 3.323 9.860 ( 2.186 0.000 2.829) 3.575 10.115 ( 5.102 0.000 4.644) 6.899 10.343 ( 2.273 0.000 11.654) 11.873 10.509 ( -2.599 0.000 -4.638) 5.317 12.530 ( -6.573 0.000 6.978) 9.586 13.046 ( -0.221 0.000 -2.019) 2.031 13.393 ( -0.910 0.000 -1.435) 1.699 13.426 ( -3.540 0.000 -50.508) 50.632 14.601 ( 5.662 0.000 -3.455) 6.633 15.223 ( -0.753 0.000 -1.062) 1.302 18.313 ( 0.798 0.000 -0.426) 0.905 18.421 ( -1.875 0.000 3.984) 4.403 18.527 ( 3.330 0.000 6.066) 6.920 18.626 ( -3.004 0.000 -12.258) 12.621======================= Grid point 130 (46/312) =======================q-point: (-0.10 0.00 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.587 ( -26.650 0.000 9.207) 28.196 0.670 ( -25.973 0.000 18.701) 32.005 0.779 ( -30.998 0.000 20.655) 37.249 2.192 ( -8.168 0.000 9.949) 12.872 3.550 ( 5.093 0.000 -2.366) 5.615 4.303 ( -4.527 0.000 -4.719) 6.540 4.338 ( 1.533 0.000 -1.370) 2.056 4.542 ( 3.245 0.000 7.265) 7.957 4.608 ( -16.588 0.000 -29.531) 33.871 4.742 ( 5.226 0.000 -6.571) 8.396 5.130 ( -7.911 0.000 5.233) 9.485 5.170 ( -1.381 0.000 -11.116) 11.202 5.441 ( 3.936 0.000 0.780) 4.012 5.580 ( -0.349 0.000 3.355) 3.373 5.985 ( -2.909 0.000 -5.956) 6.628 6.165 ( 3.310 0.000 -3.819) 5.053 7.341 ( -0.999 0.000 -1.853) 2.105 7.456 ( -11.475 0.000 -15.054) 18.929 7.560 ( 3.825 0.000 7.619) 8.525 7.671 ( -2.522 0.000 2.371) 3.462 9.355 ( -1.049 0.000 3.414) 3.572 9.712 ( -1.622 0.000 -1.356) 2.115 9.896 ( -0.143 0.000 0.773) 0.786 10.217 ( 1.928 0.000 1.419) 2.394 10.429 ( -0.776 0.000 -3.813) 3.891 10.476 ( 1.342 0.000 -1.200) 1.800 12.484 ( -4.000 0.000 7.445) 8.452 13.045 ( 0.734 0.000 0.825) 1.104 13.143 ( 7.424 0.000 18.007) 19.478 13.388 ( 0.214 0.000 1.611) 1.625 14.692 ( 3.194 0.000 1.943) 3.738 15.201 ( -0.075 0.000 -1.708) 1.709 18.313 ( 0.165 0.000 -1.384) 1.394 18.424 ( 1.336 0.000 6.768) 6.899 18.547 ( 0.940 0.000 -1.480) 1.754 18.611 ( 0.352 0.000 3.718) 3.734======================= Grid point 131 (47/312) =======================q-point: ( 0.00 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.592 ( 4.993 10.289 20.050) 23.083 0.756 ( 9.693 19.995 18.625) 28.993 1.320 ( -1.802 23.938 42.107) 48.469 2.259 ( -4.024 7.773 11.102) 14.138 3.627 ( 4.279 -3.967 3.753) 6.938 4.124 ( -4.040 2.254 -8.004) 9.245 4.303 ( 1.219 6.837 -16.232) 17.655 4.360 ( -1.132 -1.719 -4.501) 4.950 4.643 ( 2.936 -3.338 3.563) 5.697 4.809 ( 6.624 -2.232 -4.976) 8.580 4.971 ( -2.953 3.183 -2.578) 5.049 5.219 ( -2.335 7.278 -2.851) 8.158 5.505 ( 4.594 0.592 -2.805) 5.415 5.600 ( -4.181 2.878 2.916) 5.853 5.906 ( -0.892 -2.660 1.289) 3.087 6.123 ( 2.388 -6.906 -2.244) 7.644 7.238 ( -0.683 4.018 4.986) 6.439 7.533 ( 4.044 7.947 0.007) 8.916 7.694 ( -0.608 3.034 2.586) 4.033 7.820 ( 5.191 5.104 0.992) 7.347 9.358 ( -4.339 4.045 -1.797) 6.198 9.655 ( -1.678 0.404 -6.371) 6.600 9.867 ( -1.984 -0.726 -1.489) 2.585 10.066 ( -3.402 -8.541 -2.609) 9.556 10.391 ( -1.865 -0.709 -4.177) 4.629 10.460 ( 0.721 3.602 1.824) 4.102 12.598 ( -2.506 8.118 8.788) 12.224 13.089 ( 1.114 0.335 3.785) 3.960 13.438 ( 1.038 0.759 4.586) 4.763 13.668 ( 29.382 -22.204 20.856) 42.323 14.693 ( -2.309 -1.350 -0.719) 2.769 15.189 ( 0.438 -0.123 -1.723) 1.782 18.312 ( -0.484 1.380 -3.361) 3.666 18.445 ( -2.773 -1.601 -2.850) 4.287 18.614 ( -2.912 0.270 1.844) 3.457 18.641 ( 13.418 -9.978 6.876) 18.080======================= Grid point 132 (48/312) =======================q-point: ( 0.10 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.954 ( 12.544 9.301 18.160) 23.951 1.109 ( 7.371 16.411 21.480) 28.018 1.964 ( 21.507 11.552 38.391) 45.496 2.336 ( -0.312 7.848 13.066) 15.245 3.695 ( 0.543 -4.640 -0.479) 4.696 4.032 ( 0.868 1.549 -8.249) 8.438 4.144 ( -3.954 5.603 -8.916) 11.248 4.242 ( -1.384 -0.614 -15.613) 15.686 4.727 ( 2.408 -7.113 -9.239) 11.906 4.779 ( 0.299 -2.214 2.069) 3.045 5.054 ( 7.010 2.971 0.684) 7.644 5.175 ( 0.287 9.012 4.429) 10.046 5.493 ( -3.886 -1.145 -0.187) 4.055 5.628 ( 6.217 3.078 -0.505) 6.955 5.918 ( 1.383 -3.471 -0.351) 3.753 6.148 ( 1.453 -7.060 -0.137) 7.209 7.285 ( 2.579 2.975 1.631) 4.262 7.565 ( 0.161 7.031 -6.372) 9.490 7.847 ( 8.346 1.486 15.981) 18.090 7.975 ( 4.858 3.559 10.177) 11.825 9.221 ( -6.640 2.650 -4.760) 8.589 9.549 ( -1.486 -0.001 -8.691) 8.817 9.777 ( -4.028 0.153 -5.450) 6.779 9.961 ( -4.060 -6.556 -5.226) 9.315 10.310 ( -2.502 2.164 -2.319) 4.040 10.515 ( 3.187 0.787 0.684) 3.354 12.644 ( -2.736 8.363 10.213) 13.480 13.158 ( 1.070 0.615 5.714) 5.846 13.514 ( 1.077 1.009 6.693) 6.854 14.265 ( 16.070 -24.940 3.267) 29.848 14.639 ( 3.567 -5.702 -3.521) 7.592 15.188 ( 1.211 -0.453 -1.615) 2.068 18.271 ( 0.206 0.556 -4.578) 4.616 18.350 ( -3.744 -2.073 -4.128) 5.946 18.537 ( -6.016 1.534 0.040) 6.209 18.956 ( 12.795 -15.771 3.973) 20.693======================= Grid point 133 (49/312) =======================q-point: ( 0.20 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.380 ( 14.903 6.892 16.442) 23.236 1.472 ( 8.225 11.556 22.874) 26.915 2.402 ( -0.140 6.711 12.409) 14.108 2.770 ( 22.534 6.692 25.971) 35.029 3.645 ( -1.113 -2.707 -6.816) 7.418 3.901 ( -5.411 0.789 -11.772) 12.980 4.004 ( -4.843 3.658 -4.309) 7.443 4.069 ( 2.214 1.861 -15.307) 15.577 4.655 ( -1.578 -11.276 -2.686) 11.699 4.843 ( 3.506 2.019 0.389) 4.064 5.057 ( -5.126 7.993 3.718) 10.198 5.371 ( 8.923 -1.431 4.279) 9.999 5.447 ( 1.373 -4.517 -0.093) 4.722 5.739 ( 4.540 4.051 0.573) 6.111 5.952 ( 4.556 -3.776 -3.108) 6.684 6.172 ( 0.998 -6.436 0.806) 6.563 7.338 ( 2.775 1.258 -1.724) 3.501 7.492 ( -0.785 3.575 -5.801) 6.859 8.157 ( 5.093 1.227 16.873) 17.667 8.222 ( 9.722 4.441 14.287) 17.843 9.038 ( -7.428 1.849 -5.341) 9.334 9.442 ( -0.547 -0.251 -8.641) 8.662 9.620 ( -5.326 0.541 -8.472) 10.022 9.812 ( -5.221 -4.462 -7.323) 10.040 10.261 ( -1.012 2.417 -1.319) 2.933 10.584 ( 3.758 -0.736 0.156) 3.832 12.692 ( -3.440 8.853 10.619) 14.247 13.231 ( 0.393 0.983 5.885) 5.979 13.599 ( 0.573 1.281 6.983) 7.123 14.284 ( -7.277 -5.226 0.154) 8.960 14.826 ( 17.103 -19.655 -9.583) 27.761 15.202 ( 1.685 -0.846 -0.894) 2.087 18.228 ( 0.011 -1.048 -5.448) 5.548 18.238 ( -3.309 -1.155 -4.148) 5.431 18.410 ( -7.055 2.668 -0.539) 7.562 19.162 ( 6.269 -12.492 2.946) 14.284======================= Grid point 134 (50/312) =======================q-point: ( 0.30 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.781 ( 11.417 5.007 12.363) 17.557 1.852 ( 8.626 8.449 23.433) 26.361 2.484 ( -2.651 7.365 9.955) 12.664 3.249 ( 8.694 -0.223 4.986) 10.025 3.540 ( -1.802 6.152 -10.333) 12.160 3.721 ( -2.135 -7.571 -2.994) 8.416 3.889 ( -1.560 3.638 -0.620) 4.007 4.044 ( 7.846 5.729 -11.187) 14.817 4.599 ( -4.371 -11.399 2.119) 12.390 4.914 ( 3.998 2.124 -1.567) 4.790 4.969 ( -8.564 6.763 5.454) 12.200 5.456 ( 4.117 -6.175 -1.345) 7.542 5.593 ( 6.076 -3.117 3.142) 7.517 5.782 ( -0.464 1.099 0.931) 1.513 6.028 ( 7.979 -2.901 -5.942) 10.363 6.203 ( 1.532 -5.207 0.747) 5.479 7.355 ( 1.255 1.483 -1.417) 2.405 7.441 ( 0.015 1.673 -2.418) 2.940 8.382 ( 4.198 0.184 11.193) 11.956 8.519 ( 6.930 3.784 10.948) 13.498 8.867 ( -6.214 2.443 -2.665) 7.189 9.373 ( 0.595 -0.197 -4.937) 4.977 9.439 ( -4.429 0.987 -7.935) 9.141 9.644 ( -4.861 -3.358 -6.781) 8.994 10.241 ( -0.030 2.404 -1.131) 2.657 10.650 ( 3.459 -1.717 -0.486) 3.892 12.722 ( -4.597 9.270 10.298) 14.599 13.279 ( -0.721 1.212 4.288) 4.514 13.663 ( -0.425 1.586 5.163) 5.418 14.147 ( -6.778 -1.719 -0.228) 6.996 14.978 ( 12.731 -18.211 -15.287) 26.970 15.229 ( 1.651 -1.255 0.029) 2.074 18.137 ( -2.791 -2.064 -2.932) 4.543 18.183 ( -0.746 0.705 -4.032) 4.161 18.296 ( -4.152 2.496 -0.296) 4.853 19.255 ( 1.559 -8.037 1.818) 8.387======================= Grid point 135 (51/312) =======================q-point: ( 0.40 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.994 ( 0.332 3.050 7.190) 7.818 2.194 ( 3.581 8.927 18.287) 20.662 2.508 ( -3.872 8.016 7.919) 11.915 3.256 ( -2.775 -2.993 -0.973) 4.196 3.438 ( 1.454 2.173 -4.796) 5.463 3.699 ( 5.239 -6.489 -10.826) 13.666 3.946 ( -0.505 3.736 6.109) 7.179 4.116 ( 9.088 8.082 -7.021) 14.043 4.547 ( -3.963 -9.358 3.692) 10.812 4.831 ( -8.960 5.151 4.265) 11.181 4.993 ( 3.802 0.286 -0.918) 3.922 5.504 ( 3.192 -6.686 -4.156) 8.495 5.680 ( 1.844 -2.587 0.842) 3.287 5.755 ( -2.717 -1.317 0.136) 3.022 6.092 ( 6.310 -4.585 -8.965) 11.883 6.240 ( 1.928 -3.024 -0.199) 3.591 7.381 ( 1.222 1.241 2.948) 3.424 7.446 ( 0.952 1.030 1.318) 1.925 8.501 ( 1.581 -0.535 1.039) 1.967 8.609 ( -3.236 0.260 -1.710) 3.669 8.784 ( -1.538 5.532 0.022) 5.742 9.342 ( 0.286 0.884 0.130) 0.938 9.396 ( 1.899 0.771 3.324) 3.905 9.539 ( -0.955 -2.734 -1.607) 3.312 10.233 ( 0.396 2.429 -1.170) 2.725 10.693 ( 2.135 -2.328 -1.435) 3.469 12.728 ( -5.390 9.515 9.808) 14.690 13.284 ( -1.847 1.264 1.493) 2.690 13.678 ( -1.786 1.798 1.762) 3.087 14.043 ( -3.844 -0.680 -1.273) 4.107 14.993 ( 8.982 -16.810 -21.855) 28.998 15.257 ( 0.902 -1.424 0.606) 1.792 18.085 ( -1.062 0.368 0.059) 1.126 18.141 ( -0.581 0.040 -0.331) 0.670 18.257 ( -0.235 1.240 -0.302) 1.298 19.260 ( -1.440 -4.975 -0.835) 5.246======================= Grid point 136 (52/312) =======================q-point: (-0.50 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.913 ( -11.429 1.309 -1.570) 11.610 2.258 ( -11.857 12.172 10.310) 19.875 2.509 ( -4.526 8.395 7.523) 12.147 3.302 ( 4.846 -5.580 5.767) 9.374 3.490 ( 5.789 -5.049 -1.962) 7.928 3.713 ( 6.714 -1.877 -9.326) 11.643 3.880 ( -8.609 5.193 0.474) 10.065 4.221 ( 8.120 8.460 -3.682) 12.290 4.538 ( -1.436 -7.132 4.663) 8.642 4.740 ( -4.633 3.622 3.698) 6.947 5.040 ( 1.638 -1.008 0.119) 1.927 5.476 ( 0.381 -6.451 -7.734) 10.079 5.689 ( -3.588 -2.990 -1.542) 4.918 5.701 ( 0.463 -1.480 -0.683) 1.694 6.081 ( 3.218 -6.272 -9.843) 12.107 6.254 ( 0.789 -1.308 -2.416) 2.858 7.456 ( 1.468 -0.510 6.134) 6.328 7.501 ( 1.815 1.026 4.980) 5.398 8.371 ( -9.132 1.113 -12.223) 15.298 8.490 ( -3.377 -0.418 -9.744) 10.321 8.800 ( 2.287 4.746 4.823) 7.143 9.427 ( 3.856 -0.372 7.153) 8.135 9.498 ( 1.768 0.242 8.300) 8.490 9.596 ( 4.578 -0.598 5.482) 7.167 10.231 ( 0.512 2.522 -0.913) 2.730 10.696 ( 0.206 -2.573 -2.493) 3.588 12.721 ( -5.617 9.611 9.240) 14.467 13.243 ( -2.498 1.195 -1.487) 3.143 13.633 ( -2.957 1.701 -1.783) 3.849 13.979 ( -0.599 -0.527 -3.614) 3.701 14.882 ( 6.354 -16.178 -28.589) 33.457 15.270 ( -0.214 -1.252 0.688) 1.445 18.107 ( 1.858 1.797 3.098) 4.035 18.167 ( 1.895 -1.122 2.810) 3.571 18.268 ( 0.887 0.935 0.999) 1.631 19.187 ( -3.550 -3.162 -4.673) 6.666======================= Grid point 137 (53/312) =======================q-point: (-0.40 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.597 ( -18.088 0.328 -5.356) 18.867 2.031 ( -20.609 15.395 7.250) 26.727 2.486 ( -6.261 7.643 7.461) 12.381 3.224 ( -17.638 -3.972 -14.834) 23.386 3.543 ( 4.836 -9.621 -7.919) 13.367 3.746 ( 7.393 4.229 6.005) 10.421 3.920 ( 6.702 3.104 6.797) 10.038 4.341 ( 6.422 5.518 1.627) 8.622 4.587 ( 1.022 -5.329 5.881) 8.002 4.739 ( 1.720 4.148 0.238) 4.497 5.059 ( -1.203 -2.508 3.739) 4.661 5.391 ( -0.228 -5.340 -8.254) 9.833 5.585 ( -5.440 -4.524 -2.995) 7.683 5.688 ( 0.648 -0.083 -4.170) 4.221 6.044 ( 2.557 -6.802 -7.251) 10.266 6.224 ( -0.635 -0.682 -3.509) 3.631 7.527 ( -0.511 -2.016 5.826) 6.186 7.604 ( 3.027 -0.589 5.169) 6.019 8.041 ( -10.718 1.148 -15.359) 18.764 8.267 ( -7.050 4.702 -13.001) 15.519 8.957 ( 5.757 2.351 9.655) 11.484 9.583 ( 4.282 -2.241 7.893) 9.255 9.610 ( 1.310 0.385 8.845) 8.949 9.766 ( 5.924 0.202 7.532) 9.585 10.238 ( 0.672 2.818 0.409) 2.926 10.654 ( -1.522 -2.471 -3.380) 4.455 12.703 ( -5.886 9.559 8.317) 13.972 13.172 ( -2.406 0.982 -3.549) 4.399 13.546 ( -3.128 1.351 -3.844) 5.137 13.932 ( 2.184 -2.293 -11.027) 11.473 14.683 ( 4.618 -14.397 -30.145) 33.724 15.264 ( -0.971 -0.842 0.427) 1.354 18.206 ( 4.281 1.070 4.566) 6.350 18.249 ( 3.148 -1.433 2.932) 4.534 18.309 ( 1.214 1.350 4.122) 4.504 19.041 ( -5.067 -2.064 -8.881) 10.431======================= Grid point 138 (54/312) =======================q-point: (-0.30 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.184 ( -20.865 0.267 -4.902) 21.435 1.691 ( -24.037 17.927 7.716) 30.962 2.414 ( -10.997 6.327 5.383) 13.782 2.569 ( -29.359 4.540 -18.716) 35.112 3.513 ( 4.126 -8.526 -12.940) 16.036 4.000 ( 7.276 0.570 11.424) 13.556 4.121 ( 7.388 1.736 6.920) 10.271 4.492 ( 8.340 -0.223 0.429) 8.354 4.675 ( 0.862 -1.778 5.597) 5.936 4.753 ( 1.089 4.351 -3.398) 5.627 5.107 ( 0.765 -5.366 8.020) 9.679 5.323 ( 0.636 -3.063 -6.367) 7.094 5.438 ( -6.441 -4.823 -3.117) 8.629 5.652 ( 1.559 1.719 -6.584) 6.981 6.035 ( 2.544 -6.437 -4.796) 8.421 6.172 ( -1.118 -1.916 -3.494) 4.139 7.514 ( -6.669 -5.234 0.719) 8.508 7.644 ( 0.736 -1.421 -10.592) 10.713 7.765 ( -4.897 2.975 -1.979) 6.062 8.041 ( -5.501 9.640 -6.411) 12.818 9.159 ( 5.196 1.687 9.565) 11.015 9.692 ( -0.033 -0.312 7.194) 7.201 9.738 ( 3.789 -1.864 5.812) 7.185 9.939 ( 5.023 -1.146 6.649) 8.412 10.273 ( 1.140 3.193 3.771) 5.071 10.580 ( -2.306 -2.038 -3.937) 4.998 12.668 ( -6.213 9.351 7.166) 13.319 13.096 ( -1.565 0.595 -3.852) 4.200 13.457 ( -2.215 0.998 -3.706) 4.431 13.764 ( 0.666 -8.267 -32.701) 33.737 14.532 ( 4.835 -7.419 -14.299) 16.819 15.246 ( -1.119 -0.366 -0.038) 1.178 18.302 ( 2.827 0.674 -0.468) 2.944 18.338 ( 2.246 -1.889 6.175) 6.837 18.407 ( 3.397 1.373 6.234) 7.231 18.835 ( -5.870 -1.024 -11.770) 13.193======================= Grid point 139 (55/312) =======================q-point: (-0.20 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.766 ( -20.750 1.957 -0.644) 20.852 1.303 ( -26.306 15.781 4.168) 30.959 1.741 ( -35.741 14.521 -9.942) 39.839 2.342 ( -9.487 7.605 7.840) 14.467 3.472 ( 4.302 -6.249 -9.477) 12.139 4.187 ( 3.008 -1.582 8.048) 8.736 4.327 ( 5.847 0.447 8.586) 10.397 4.579 ( -1.116 0.950 -9.510) 9.622 4.640 ( 5.932 -1.191 -7.165) 9.378 4.802 ( 0.083 -3.291 2.590) 4.189 5.150 ( -2.581 -7.715 -4.404) 9.251 5.286 ( -0.686 -0.573 2.405) 2.566 5.372 ( 2.027 0.458 0.692) 2.190 5.623 ( 1.521 3.519 -4.681) 6.051 6.018 ( 0.231 -5.778 -5.633) 8.072 6.121 ( -0.246 -4.253 -3.232) 5.347 7.316 ( -8.159 -4.311 -5.146) 10.566 7.554 ( 0.053 1.918 -3.762) 4.223 7.721 ( -2.816 2.576 -0.108) 3.818 7.940 ( -0.493 10.247 -7.307) 12.596 9.317 ( 2.790 2.668 7.276) 8.237 9.737 ( -0.767 0.524 3.298) 3.426 9.838 ( 1.971 -2.397 3.559) 4.722 10.072 ( 3.109 -3.921 4.770) 6.913 10.352 ( 1.051 1.726 6.857) 7.149 10.505 ( -1.368 -0.695 -3.263) 3.606 12.619 ( -5.868 9.068 5.382) 12.068 13.048 ( -0.282 0.205 -2.112) 2.141 13.341 ( -6.365 -6.468 -34.553) 35.725 13.401 ( -0.875 0.780 -1.658) 2.031 14.575 ( 5.867 -2.088 -0.193) 6.230 15.224 ( -0.851 -0.000 -0.649) 1.071 18.338 ( 1.995 0.933 -0.198) 2.211 18.404 ( -0.945 -0.991 3.478) 3.738 18.526 ( 3.051 -0.211 4.006) 5.040 18.626 ( -4.440 0.478 -8.380) 9.495======================= Grid point 140 (56/312) =======================q-point: (-0.10 0.09 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.484 ( -12.593 7.562 11.349) 18.562 0.759 ( -25.859 13.608 -1.622) 29.266 1.258 ( -23.859 29.867 23.520) 44.883 2.266 ( -7.658 7.758 9.358) 14.367 3.510 ( 5.865 -4.337 -1.487) 7.444 4.284 ( 0.780 0.112 3.573) 3.659 4.353 ( -6.319 0.142 -8.320) 10.448 4.488 ( 0.090 -3.079 -1.614) 3.477 4.644 ( -1.490 -2.308 -11.839) 12.154 4.733 ( 5.523 1.036 -7.983) 9.762 5.062 ( -4.568 -0.974 1.701) 4.970 5.278 ( 0.607 2.238 -5.094) 5.597 5.447 ( 4.053 0.329 -0.783) 4.141 5.622 ( -0.989 4.069 2.508) 4.882 5.942 ( -2.788 -3.566 -2.036) 4.963 6.109 ( 2.059 -5.753 -3.366) 6.977 7.204 ( -2.143 -0.918 2.709) 3.574 7.578 ( -0.330 2.996 -0.370) 3.037 7.638 ( -1.591 3.454 -0.349) 3.819 7.836 ( 1.140 11.908 -12.468) 17.278 9.395 ( -0.299 4.212 3.188) 5.291 9.725 ( -1.188 0.685 -2.112) 2.518 9.882 ( -0.003 -1.871 1.733) 2.551 10.125 ( -0.871 -7.964 0.544) 8.030 10.399 ( 0.770 -0.481 0.380) 0.984 10.485 ( -1.064 0.763 0.164) 1.319 12.574 ( -3.613 8.969 5.569) 11.158 13.053 ( 0.748 0.546 0.011) 0.927 13.121 ( 3.339 -1.586 11.764) 12.331 13.395 ( 0.314 0.741 1.472) 1.678 14.679 ( 3.215 -1.327 1.719) 3.879 15.204 ( -0.333 0.091 -1.288) 1.333 18.360 ( -1.013 2.883 -3.389) 4.563 18.410 ( 3.321 -1.790 5.627) 6.775 18.509 ( -1.474 -1.877 -2.732) 3.628 18.614 ( 0.156 0.363 3.605) 3.626======================= Grid point 141 (57/312) =======================q-point: ( 0.00 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.926 ( 8.418 22.338 4.811) 24.352 1.197 ( 11.858 24.698 10.007) 29.167 1.824 ( -7.383 27.340 34.413) 44.567 2.467 ( -3.561 13.501 9.834) 17.078 3.511 ( 3.277 -8.060 5.867) 10.494 4.164 ( -3.979 1.304 -7.491) 8.582 4.307 ( -0.772 -3.714 -4.659) 6.008 4.375 ( 1.417 1.232 -12.886) 13.022 4.558 ( 4.540 -5.520 -3.196) 7.829 4.734 ( 1.033 -2.313 -4.445) 5.117 5.081 ( 0.135 5.261 -0.848) 5.331 5.236 ( -0.899 -3.891 0.302) 4.005 5.538 ( 6.750 2.870 -2.522) 7.756 5.695 ( -3.779 4.975 3.599) 7.210 5.829 ( -2.677 -4.997 2.409) 6.160 5.959 ( 1.351 -8.844 -3.036) 9.447 7.347 ( 0.473 6.842 4.375) 8.135 7.662 ( 5.105 6.044 3.228) 8.545 7.770 ( 0.204 4.416 0.767) 4.487 7.901 ( 2.482 2.984 -1.232) 4.072 9.452 ( -4.730 4.821 -3.946) 7.822 9.647 ( -2.204 -1.440 -6.026) 6.575 9.799 ( -1.784 -6.232 1.737) 6.711 9.964 ( -2.081 -1.232 -3.963) 4.642 10.360 ( 0.134 -1.442 -2.531) 2.916 10.541 ( -0.610 3.993 1.095) 4.185 12.809 ( -0.403 13.053 4.422) 13.788 13.099 ( 1.146 0.789 4.207) 4.431 13.368 ( 11.817 -9.063 18.756) 23.949 13.464 ( 1.700 1.235 5.436) 5.828 14.660 ( -2.026 -1.806 -1.067) 2.916 15.177 ( -0.183 -1.301 -1.434) 1.945 18.331 ( -1.002 0.278 -4.570) 4.687 18.376 ( -1.520 -4.819 0.006) 5.053 18.544 ( 5.667 -0.918 2.402) 6.223 18.627 ( -2.392 0.656 2.016) 3.196======================= Grid point 142 (58/312) =======================q-point: ( 0.10 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.214 ( 12.967 17.236 10.342) 23.921 1.489 ( 7.483 22.043 12.979) 26.652 2.253 ( 12.285 17.382 33.489) 39.681 2.549 ( 1.224 14.227 13.825) 19.875 3.586 ( -1.328 -6.579 4.704) 8.195 4.062 ( 0.221 1.302 -7.404) 7.521 4.198 ( -5.479 -0.822 -3.842) 6.742 4.243 ( 1.432 1.584 -18.672) 18.793 4.530 ( 0.484 -11.152 -13.036) 17.162 4.775 ( 4.265 0.325 3.367) 5.443 5.094 ( 1.639 1.006 -0.904) 2.124 5.246 ( 1.148 -3.213 2.995) 4.540 5.564 ( -8.220 9.091 2.984) 12.615 5.700 ( 7.838 4.356 -1.043) 9.028 5.818 ( -0.296 -7.227 0.371) 7.242 5.977 ( 1.607 -9.831 0.318) 9.967 7.365 ( 0.251 4.990 0.874) 5.072 7.678 ( -2.459 3.842 -8.527) 9.670 7.914 ( 8.927 5.576 15.704) 18.905 8.053 ( 6.305 4.434 10.258) 12.831 9.281 ( -7.283 3.026 -6.612) 10.292 9.537 ( -1.811 -1.490 -8.355) 8.678 9.748 ( -3.998 -3.714 -1.911) 5.782 9.869 ( -2.519 -1.650 -6.940) 7.566 10.334 ( -0.079 0.720 -2.685) 2.781 10.545 ( 0.201 2.086 1.007) 2.325 12.860 ( 0.272 13.338 5.721) 14.516 13.176 ( 1.263 1.304 6.352) 6.606 13.540 ( 1.519 1.570 6.680) 7.028 13.816 ( 13.490 -18.237 16.388) 27.984 14.574 ( -4.404 -2.417 -2.366) 5.553 15.166 ( 0.731 -1.921 -1.752) 2.701 18.262 ( -0.499 -2.107 -7.045) 7.370 18.311 ( -3.244 -1.258 -1.970) 3.999 18.569 ( -4.978 1.663 0.706) 5.296 18.737 ( 8.953 -6.901 5.794) 12.703======================= Grid point 143 (59/312) =======================q-point: ( 0.20 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.574 ( 14.111 13.164 11.869) 22.655 1.764 ( 7.340 17.992 15.780) 25.031 2.576 ( 1.061 10.834 11.776) 16.036 2.953 ( 15.081 12.126 25.328) 31.874 3.564 ( -2.116 -4.935 -0.423) 5.386 3.933 ( -5.342 2.192 -14.127) 15.261 4.064 ( -5.296 2.404 -3.023) 6.555 4.121 ( 4.917 3.113 -12.286) 13.594 4.414 ( -0.651 -13.523 -8.001) 15.726 4.877 ( 4.175 0.845 0.268) 4.268 5.106 ( -0.381 -2.238 0.547) 2.335 5.321 ( 0.973 -8.001 1.907) 8.283 5.464 ( -3.754 9.818 6.813) 12.526 5.786 ( -1.137 -2.015 1.237) 2.624 5.869 ( 9.057 -2.234 -4.383) 10.307 6.016 ( 1.181 -9.082 2.567) 9.512 7.383 ( 1.327 3.202 -0.668) 3.530 7.555 ( -2.167 2.600 -6.939) 7.721 8.201 ( 4.464 3.552 16.074) 17.056 8.324 ( 9.907 5.792 13.525) 17.738 9.082 ( -7.045 2.386 -6.200) 9.683 9.429 ( -0.711 -1.306 -8.150) 8.285 9.617 ( -5.712 -1.257 -5.774) 8.219 9.735 ( -3.691 -2.496 -8.641) 9.722 10.310 ( 0.035 2.545 -2.024) 3.252 10.571 ( 1.481 -0.468 0.949) 1.821 12.921 ( -0.054 14.172 5.667) 15.263 13.258 ( 0.537 1.908 6.482) 6.778 13.632 ( 0.934 2.102 7.045) 7.411 14.095 ( 2.862 -13.884 6.391) 15.550 14.519 ( 2.567 -9.725 -1.735) 10.207 15.169 ( 1.288 -2.644 -1.309) 3.219 18.171 ( -1.837 -3.247 -6.313) 7.333 18.245 ( -0.872 0.363 -3.716) 3.834 18.463 ( -6.551 2.845 0.039) 7.142 18.947 ( 7.203 -8.951 5.372) 12.683======================= Grid point 144 (60/312) =======================q-point: ( 0.30 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.933 ( 13.267 10.684 6.431) 18.207 2.065 ( 6.717 13.288 20.230) 25.118 2.675 ( -1.397 11.938 9.541) 15.345 3.273 ( -0.034 2.799 6.158) 6.764 3.562 ( -0.611 -6.914 0.150) 6.943 3.673 ( -2.749 6.068 -14.465) 15.926 3.985 ( -0.789 5.950 2.346) 6.445 4.158 ( 9.831 5.903 -9.552) 14.925 4.352 ( -1.719 -14.251 -0.607) 14.368 4.934 ( 3.831 -0.480 -2.985) 4.880 5.055 ( -7.642 1.170 2.903) 8.258 5.317 ( -0.097 -8.215 1.737) 8.397 5.557 ( 3.383 0.485 4.879) 5.957 5.754 ( -2.496 -4.256 -0.004) 4.934 5.966 ( 7.009 -3.337 -6.992) 10.448 6.076 ( 2.006 -7.249 3.695) 8.380 7.396 ( 0.871 2.637 -0.614) 2.844 7.477 ( -0.679 1.830 -3.055) 3.626 8.402 ( 3.416 2.059 9.605) 10.400 8.599 ( 4.801 4.199 10.440) 12.234 8.930 ( -3.844 3.851 -2.504) 5.990 9.366 ( 0.673 -0.716 -4.066) 4.183 9.457 ( -4.289 0.692 -5.682) 7.152 9.576 ( -4.140 -3.019 -7.866) 9.387 10.296 ( 0.319 3.143 -1.499) 3.496 10.610 ( 1.798 -2.237 0.435) 2.902 12.962 ( -1.136 14.936 4.759) 15.717 13.313 ( -0.760 2.312 4.724) 5.313 13.703 ( -0.054 2.543 5.208) 5.796 14.091 ( -4.117 -4.450 0.757) 6.109 14.598 ( 7.076 -18.419 -5.363) 20.447 15.186 ( 1.336 -3.395 -0.380) 3.668 18.093 ( -0.631 -2.196 -4.009) 4.614 18.201 ( -0.227 0.942 -3.513) 3.644 18.348 ( -5.767 2.887 0.413) 6.462 19.091 ( 3.799 -8.165 3.220) 9.564======================= Grid point 145 (61/312) =======================q-point: ( 0.40 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.108 ( 2.835 8.885 -2.006) 9.540 2.400 ( 4.824 11.702 21.363) 24.831 2.717 ( -2.702 13.165 7.568) 15.424 3.215 ( -5.558 -0.441 -0.327) 5.585 3.412 ( -5.304 -5.535 -3.259) 8.330 3.644 ( 6.061 1.997 -9.046) 11.071 4.047 ( 1.093 6.336 2.639) 6.950 4.268 ( 9.679 5.997 -6.132) 12.933 4.340 ( -0.183 -10.793 2.075) 10.992 4.910 ( -8.661 2.319 2.071) 9.202 4.975 ( 2.127 -2.455 -1.662) 3.649 5.336 ( 0.513 -10.458 -0.961) 10.514 5.631 ( 1.367 -2.396 1.305) 3.051 5.700 ( -2.775 -3.961 -0.842) 4.909 5.988 ( 4.056 -5.958 -8.775) 11.355 6.147 ( 2.253 -6.416 1.796) 7.034 7.414 ( 0.785 2.197 1.854) 2.980 7.469 ( 0.715 1.326 1.067) 1.846 8.501 ( 2.130 0.777 0.281) 2.284 8.627 ( -5.783 1.246 -2.253) 6.330 8.903 ( 0.309 6.438 -0.355) 6.455 9.366 ( 0.367 1.669 0.931) 1.946 9.410 ( 1.170 0.296 2.412) 2.697 9.481 ( 0.028 -2.666 0.905) 2.815 10.290 ( 0.533 3.265 -1.296) 3.553 10.637 ( 1.000 -3.282 -0.457) 3.461 12.974 ( -1.987 15.263 3.778) 15.849 13.319 ( -2.039 2.398 1.789) 3.621 13.723 ( -1.556 2.885 1.577) 3.637 14.019 ( -3.002 -1.933 -1.244) 3.781 14.621 ( 4.757 -19.535 -12.551) 23.701 15.207 ( 0.869 -3.873 0.477) 3.998 18.080 ( 2.066 -0.761 -1.079) 2.452 18.165 ( -1.221 2.423 -0.669) 2.795 18.280 ( -2.200 1.154 1.103) 2.718 19.146 ( 0.348 -6.456 0.223) 6.469======================= Grid point 146 (62/312) =======================q-point: (-0.50 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.994 ( -8.302 7.158 -9.318) 14.387 2.539 ( -10.165 16.319 14.984) 24.375 2.734 ( -4.988 14.507 7.519) 17.084 3.184 ( 3.221 -5.889 0.860) 6.767 3.350 ( 0.674 -8.509 -3.145) 9.097 3.716 ( 8.170 1.579 -2.817) 8.785 4.003 ( -5.394 7.078 -2.335) 9.200 4.367 ( 1.046 -8.534 6.302) 10.660 4.395 ( 8.660 7.268 -7.317) 13.467 4.796 ( -5.328 1.733 3.364) 6.535 4.996 ( 1.549 -3.914 -1.825) 4.587 5.304 ( -0.881 -10.931 -4.127) 11.717 5.613 ( -3.588 -4.726 -1.653) 6.160 5.669 ( 0.894 -1.690 -1.295) 2.309 5.950 ( 1.948 -7.207 -9.213) 11.858 6.180 ( 0.758 -6.242 -0.799) 6.339 7.460 ( 0.629 0.882 4.052) 4.195 7.517 ( 1.570 0.672 3.974) 4.325 8.398 ( -9.279 1.651 -12.473) 15.634 8.491 ( -0.439 0.645 -7.626) 7.666 8.912 ( 1.134 6.422 2.710) 7.062 9.410 ( 2.040 -1.668 4.779) 5.458 9.500 ( 2.241 0.459 8.173) 8.487 9.599 ( 4.474 0.885 9.481) 10.521 10.290 ( 0.734 3.362 -0.986) 3.580 10.634 ( -0.365 -3.614 -1.487) 3.925 12.967 ( -2.318 15.119 2.908) 15.570 13.276 ( -2.820 2.239 -1.285) 3.823 13.676 ( -3.029 2.780 -2.277) 4.700 13.957 ( -0.970 -2.046 -4.744) 5.257 14.533 ( 2.342 -17.817 -17.344) 24.975 15.224 ( 0.141 -3.701 0.876) 3.806 18.140 ( 3.735 -0.996 0.873) 3.962 18.163 ( 0.566 3.553 2.898) 4.620 18.281 ( 0.058 0.239 2.580) 2.592 19.110 ( -2.709 -4.686 -3.055) 6.215======================= Grid point 147 (63/312) =======================q-point: (-0.40 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.676 ( -13.708 7.835 -11.929) 19.789 2.373 ( -19.889 19.357 10.077) 29.526 2.685 ( -6.846 12.417 5.960) 15.381 3.155 ( -9.076 -2.308 -9.214) 13.138 3.339 ( 3.416 -10.733 -7.328) 13.437 3.839 ( 6.043 4.198 1.776) 7.570 3.970 ( 4.149 2.851 5.013) 7.104 4.421 ( 4.503 -3.477 -6.799) 8.865 4.495 ( 0.844 1.627 11.164) 11.314 4.814 ( 5.248 2.989 -0.453) 6.056 4.985 ( -1.909 -5.227 0.004) 5.564 5.249 ( -0.092 -8.825 -4.048) 9.709 5.506 ( -5.521 -3.630 -2.486) 7.059 5.661 ( 1.435 -2.637 -4.967) 5.804 5.908 ( 2.200 -7.123 -5.749) 9.415 6.161 ( -1.321 -5.583 -2.028) 6.085 7.498 ( -1.097 -0.732 3.469) 3.712 7.593 ( 2.110 -0.688 3.369) 4.035 8.082 ( -8.692 3.114 -15.635) 18.158 8.348 ( -4.086 3.418 -10.687) 11.941 9.027 ( 4.547 4.714 8.863) 11.020 9.523 ( 3.093 -3.817 7.386) 8.871 9.626 ( 1.779 1.291 8.854) 9.123 9.776 ( 4.250 0.769 9.183) 10.148 10.302 ( 1.230 3.618 0.163) 3.825 10.596 ( -1.567 -3.276 -2.466) 4.389 12.945 ( -2.814 14.697 2.107) 15.112 13.198 ( -2.901 1.787 -3.535) 4.910 13.581 ( -3.326 2.303 -4.412) 5.986 13.853 ( -1.154 -6.095 -15.488) 16.684 14.413 ( 2.398 -11.379 -12.282) 16.914 15.229 ( -0.449 -2.915 0.888) 3.080 18.208 ( 1.881 -1.486 4.314) 4.935 18.245 ( 4.488 1.757 0.483) 4.844 18.334 ( 1.504 1.224 5.726) 6.046 18.992 ( -5.163 -2.922 -5.905) 8.370======================= Grid point 148 (64/312) =======================q-point: (-0.30 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.301 ( -13.543 11.527 -11.845) 21.368 2.046 ( -23.075 17.813 3.192) 29.325 2.567 ( -14.383 9.482 -0.007) 17.227 2.734 ( -18.623 12.885 -6.111) 23.456 3.324 ( 4.106 -10.532 -9.610) 14.837 4.024 ( 7.001 1.489 7.729) 10.534 4.133 ( 6.094 -0.255 5.700) 8.348 4.434 ( 6.643 -6.629 -9.837) 13.595 4.632 ( -0.058 -0.999 13.587) 13.624 4.862 ( -0.193 4.129 -8.652) 9.589 4.983 ( 3.036 -5.302 3.930) 7.265 5.233 ( 1.952 -5.627 -2.751) 6.561 5.393 ( -4.873 -0.623 1.353) 5.096 5.638 ( 3.128 -3.542 -7.324) 8.716 5.912 ( 2.176 -6.246 -2.785) 7.177 6.097 ( -3.557 -4.996 -1.408) 6.292 7.459 ( -5.318 -0.767 -1.260) 5.519 7.615 ( 1.285 -1.676 -6.558) 6.890 7.851 ( -2.873 5.505 -5.943) 8.595 8.178 ( -4.691 4.804 -6.121) 9.086 9.216 ( 5.221 3.906 9.840) 11.804 9.646 ( 1.901 -4.370 7.441) 8.836 9.727 ( 0.977 0.751 6.132) 6.254 9.923 ( 2.944 -0.406 6.865) 7.480 10.343 ( 1.701 3.744 2.469) 4.796 10.535 ( -1.675 -2.360 -3.198) 4.313 12.906 ( -3.664 14.380 1.921) 14.964 13.112 ( -2.058 0.991 -4.172) 4.756 13.484 ( -2.358 1.737 -4.232) 5.146 13.584 ( -4.789 -9.057 -26.416) 28.333 14.419 ( 5.285 -3.878 -1.527) 6.730 15.226 ( -0.751 -1.934 0.642) 2.171 18.278 ( 2.206 -2.442 0.952) 3.426 18.327 ( 2.516 0.029 4.095) 4.806 18.438 ( 3.153 1.956 5.253) 6.431 18.817 ( -6.471 -0.900 -7.109) 9.656======================= Grid point 149 (65/312) =======================q-point: (-0.20 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.989 ( -7.213 19.095 -10.482) 22.946 1.566 ( -25.035 12.971 -10.645) 30.138 2.128 ( -26.252 23.644 6.682) 35.956 2.552 ( -9.160 13.842 6.721) 17.907 3.319 ( 4.881 -9.322 -6.813) 12.535 4.186 ( 3.032 0.760 6.607) 7.309 4.298 ( 4.411 -2.693 6.466) 8.277 4.468 ( 8.109 -10.197 -11.439) 17.338 4.653 ( -5.548 -0.380 -5.910) 8.115 4.770 ( -0.522 0.402 0.205) 0.690 5.071 ( 2.519 -0.962 0.908) 2.845 5.244 ( 0.712 -3.090 -0.589) 3.225 5.394 ( 1.851 1.903 3.231) 4.182 5.640 ( 3.798 -2.928 -4.997) 6.926 5.909 ( -0.106 -5.627 -2.733) 6.256 6.022 ( -3.619 -4.446 0.875) 5.799 7.310 ( -3.990 2.368 -6.187) 7.734 7.588 ( 2.484 1.549 -2.939) 4.148 7.790 ( -2.378 4.429 -2.304) 5.530 8.063 ( -2.764 3.566 -4.133) 6.119 9.392 ( 4.177 4.429 7.665) 9.789 9.730 ( 0.095 -2.845 5.451) 6.149 9.775 ( -0.289 -2.261 2.628) 3.479 10.012 ( 0.919 -1.738 3.615) 4.115 10.390 ( -0.220 1.442 2.083) 2.543 10.497 ( 0.950 0.504 -1.132) 1.561 12.853 ( -4.048 14.317 1.732) 14.979 13.053 ( -0.424 0.358 -2.469) 2.530 13.235 ( -6.071 -4.208 -18.736) 20.139 13.422 ( -0.812 1.462 -2.121) 2.701 14.538 ( 6.097 -1.570 2.249) 6.685 15.215 ( -0.866 -1.184 0.147) 1.475 18.313 ( 1.513 -2.698 -0.108) 3.095 18.400 ( 0.806 -0.254 3.250) 3.358 18.527 ( 1.810 0.586 1.545) 2.451 18.646 ( -4.791 1.381 -3.567) 6.130======================= Grid point 150 (66/312) =======================q-point: (-0.10 0.18 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.870 ( 4.000 26.982 -9.652) 28.934 1.081 ( -14.011 18.943 0.364) 23.564 1.832 ( -21.361 29.513 21.947) 42.532 2.476 ( -6.967 13.647 8.174) 17.367 3.386 ( 5.969 -8.440 0.181) 10.340 4.283 ( 2.119 -0.994 2.610) 3.505 4.336 ( -3.889 -3.091 -4.027) 6.395 4.442 ( -0.722 -1.358 -5.245) 5.466 4.547 ( 3.988 -6.278 -8.722) 11.463 4.748 ( 1.577 1.201 -5.127) 5.497 5.096 ( -0.702 2.830 0.873) 3.043 5.248 ( 0.054 -3.590 -0.494) 3.624 5.462 ( 4.630 1.668 -2.255) 5.413 5.678 ( 1.764 -0.745 1.446) 2.399 5.864 ( -2.855 -4.240 0.732) 5.164 5.984 ( -1.035 -5.448 -1.271) 5.690 7.266 ( 2.152 5.759 1.252) 6.274 7.648 ( 2.580 4.023 1.321) 4.959 7.704 ( -2.283 3.783 -1.113) 4.557 7.971 ( -1.288 3.348 -7.736) 8.528 9.496 ( 1.006 5.335 2.348) 5.915 9.729 ( -2.069 -0.016 -1.873) 2.791 9.794 ( -0.818 -7.278 3.515) 8.123 10.021 ( -1.439 -2.028 -0.477) 2.532 10.379 ( -0.244 -1.282 -1.438) 1.942 10.530 ( 0.668 3.254 1.797) 3.777 12.801 ( -2.417 13.838 1.540) 14.132 13.062 ( 1.010 0.567 0.527) 1.272 13.096 ( 0.940 -0.922 5.912) 6.057 13.415 ( 0.516 1.345 1.208) 1.881 14.648 ( 3.168 -1.628 1.346) 3.807 15.197 ( -0.795 -0.961 -0.610) 1.389 18.345 ( 1.052 -3.650 2.395) 4.491 18.397 ( -0.548 0.277 -3.924) 3.972 18.508 ( -0.988 1.205 -0.962) 1.831 18.625 ( -0.291 0.704 2.929) 3.026======================= Grid point 151 (67/312) =======================q-point: ( 0.00 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.385 ( 6.289 24.719 0.451) 25.511 1.675 ( 13.293 24.916 3.368) 28.440 2.327 ( -8.335 24.168 26.716) 36.977 2.756 ( -3.492 16.242 10.163) 19.475 3.322 ( 3.098 -11.622 8.219) 14.567 4.152 ( -0.123 -3.942 -6.422) 7.536 4.211 ( -0.022 -5.651 -6.061) 8.287 4.314 ( 1.168 -6.728 -9.658) 11.828 4.520 ( 0.496 2.767 -4.566) 5.362 4.748 ( -0.039 2.816 -3.452) 4.455 5.051 ( -1.712 -7.935 1.269) 8.217 5.216 ( -0.817 1.995 -2.040) 2.968 5.575 ( 4.027 -6.462 -1.074) 7.689 5.644 ( 5.509 -0.494 1.762) 5.805 5.788 ( -0.455 -3.924 2.394) 4.619 5.885 ( -5.390 3.597 0.220) 6.484 7.483 ( -0.311 7.101 2.988) 7.710 7.773 ( 3.986 5.453 4.643) 8.197 7.842 ( 2.102 2.845 -2.413) 4.281 7.948 ( 2.853 2.392 3.430) 5.062 9.493 ( -5.117 -1.401 -4.885) 7.212 9.580 ( -3.083 -5.699 -2.840) 7.074 9.739 ( -0.952 1.694 -0.279) 1.963 9.967 ( -1.811 0.572 -4.035) 4.460 10.359 ( 0.381 1.519 -1.418) 2.113 10.599 ( -0.536 1.912 0.316) 2.010 13.034 ( 1.516 7.423 1.747) 7.775 13.132 ( 1.551 3.274 4.406) 5.704 13.278 ( 6.816 0.452 12.344) 14.108 13.497 ( 1.679 2.059 4.842) 5.523 14.634 ( -1.898 -0.542 -1.576) 2.526 15.133 ( -0.499 -3.409 -1.941) 3.955 18.283 ( 0.001 -3.657 -4.217) 5.582 18.333 ( -2.132 -1.017 -0.121) 2.366 18.552 ( 2.748 1.252 0.438) 3.051 18.638 ( -1.709 0.481 1.788) 2.519======================= Grid point 152 (68/312) =======================q-point: ( 0.10 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.587 ( 10.599 21.083 6.195) 24.397 1.919 ( 8.624 22.365 5.434) 24.579 2.579 ( 4.393 15.445 22.966) 28.023 2.869 ( 2.561 18.660 18.680) 26.527 3.439 ( -0.799 -8.934 10.097) 13.505 4.079 ( -0.528 0.412 -6.143) 6.180 4.156 ( -0.872 -3.479 -4.297) 5.597 4.207 ( 1.023 -7.429 -14.904) 16.684 4.402 ( -2.353 0.757 -14.136) 14.351 4.779 ( 3.704 -0.065 1.481) 3.990 5.026 ( -1.934 -8.376 1.070) 8.663 5.187 ( -0.308 -1.577 -1.407) 2.136 5.628 ( 1.546 -10.567 0.644) 10.699 5.743 ( -3.491 6.130 3.176) 7.737 5.803 ( 0.695 3.897 4.992) 6.371 5.809 ( 1.920 -4.181 -2.300) 5.143 7.464 ( -1.435 5.159 0.051) 5.355 7.716 ( -4.416 0.623 -5.744) 7.272 8.040 ( 8.876 6.959 12.697) 16.983 8.141 ( 7.584 4.561 11.125) 14.215 9.310 ( -6.971 -0.318 -7.694) 10.387 9.481 ( -2.460 -4.426 -6.315) 8.095 9.695 ( -2.634 -0.437 -2.646) 3.759 9.867 ( -2.964 0.409 -7.299) 7.888 10.358 ( 1.064 2.164 -1.647) 2.920 10.580 ( -1.455 1.307 0.364) 1.989 13.099 ( 2.963 9.130 2.563) 9.935 13.218 ( 1.871 3.899 6.290) 7.633 13.551 ( 5.935 -2.213 11.038) 12.726 13.611 ( 4.629 -1.425 11.411) 12.397 14.540 ( -5.443 -0.809 -2.624) 6.097 15.109 ( 0.435 -4.194 -2.791) 5.057 18.207 ( -1.280 -2.904 -6.982) 7.669 18.292 ( -2.194 -1.338 -1.088) 2.791 18.598 ( -3.316 1.460 0.645) 3.680 18.663 ( 6.001 -1.722 3.275) 7.050======================= Grid point 153 (69/312) =======================q-point: ( 0.20 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.868 ( 11.670 17.052 9.193) 22.616 2.128 ( 7.824 19.394 6.957) 22.039 2.787 ( 1.916 10.277 10.659) 14.930 3.214 ( 6.408 14.320 23.268) 28.063 3.478 ( -3.545 -3.661 6.672) 8.396 3.980 ( -3.375 2.598 -11.490) 12.254 4.088 ( -2.333 -7.449 -0.453) 7.819 4.105 ( 2.528 -2.283 -10.770) 11.296 4.243 ( 2.752 1.673 -13.955) 14.322 4.859 ( 3.861 -2.858 -1.219) 4.956 5.011 ( -1.426 -7.789 2.557) 8.321 5.173 ( -1.093 -6.841 0.238) 6.932 5.615 ( -4.734 -3.454 3.061) 6.611 5.688 ( -1.592 3.183 1.594) 3.899 5.830 ( 0.755 -7.090 1.349) 7.257 5.914 ( 4.441 1.682 1.726) 5.053 7.450 ( 0.113 3.569 -0.676) 3.634 7.586 ( -3.155 0.825 -5.478) 6.375 8.290 ( 3.802 5.431 14.269) 15.734 8.430 ( 9.379 4.942 13.286) 16.997 9.116 ( -5.675 1.029 -6.905) 8.997 9.381 ( -1.237 -3.828 -6.167) 7.363 9.590 ( -4.124 -0.503 -5.445) 6.849 9.719 ( -3.899 0.038 -9.685) 10.440 10.360 ( 0.856 2.833 -1.722) 3.424 10.566 ( -0.720 -0.218 0.949) 1.211 13.180 ( 3.265 10.524 1.632) 11.139 13.312 ( 1.241 4.464 6.340) 7.852 13.680 ( 1.295 2.982 7.598) 8.264 13.857 ( 5.882 -8.837 10.275) 14.773 14.415 ( -5.070 -2.431 -1.560) 5.835 15.095 ( 1.026 -5.272 -2.680) 6.003 18.117 ( -0.918 -2.191 -6.453) 6.877 18.241 ( -1.154 -0.914 -2.400) 2.815 18.518 ( -5.489 2.945 0.102) 6.230 18.820 ( 6.513 -4.752 3.730) 8.883======================= Grid point 154 (70/312) =======================q-point: ( 0.30 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.178 ( 12.954 14.500 5.389) 20.176 2.336 ( 5.926 14.445 10.298) 18.704 2.905 ( 0.424 10.714 8.985) 13.989 3.341 ( -5.231 3.304 3.775) 7.248 3.478 ( -7.454 0.198 6.545) 9.922 3.799 ( 0.515 6.738 -13.718) 15.292 4.054 ( -2.203 -11.716 2.640) 12.210 4.105 ( 4.582 1.620 -2.699) 5.559 4.267 ( 10.174 5.560 -7.581) 13.852 4.883 ( 2.821 -5.105 -5.374) 7.931 5.007 ( -3.370 -5.683 2.577) 7.092 5.144 ( -3.730 -9.485 3.873) 10.903 5.577 ( -2.676 -2.630 3.135) 4.889 5.678 ( -0.635 0.458 -0.424) 0.890 5.859 ( 1.716 -8.040 -0.698) 8.251 5.983 ( 1.737 -2.167 1.321) 3.075 7.449 ( 0.411 2.804 -0.490) 2.876 7.507 ( -1.056 1.272 -2.561) 3.048 8.461 ( 2.423 3.882 8.166) 9.361 8.666 ( 2.137 2.569 8.819) 9.431 9.004 ( -0.674 3.746 -1.862) 4.237 9.335 ( 0.756 -2.602 -1.359) 3.032 9.466 ( -2.885 0.543 -4.289) 5.197 9.545 ( -4.172 -0.396 -9.849) 10.703 10.356 ( 0.507 3.093 -1.486) 3.469 10.570 ( 0.010 -1.888 0.878) 2.082 13.239 ( 2.501 11.586 -0.688) 11.873 13.376 ( -0.278 5.081 4.443) 6.755 13.761 ( 0.100 3.616 5.831) 6.862 13.979 ( 0.690 -6.172 2.457) 6.679 14.348 ( -1.429 -7.422 -0.392) 7.569 15.094 ( 1.191 -6.381 -1.750) 6.723 18.061 ( 0.867 -1.001 -4.233) 4.436 18.209 ( -0.056 -0.317 -1.675) 1.706 18.411 ( -5.962 3.938 0.094) 7.146 18.953 ( 4.423 -6.336 2.478) 8.114======================= Grid point 155 (71/312) =======================q-point: ( 0.40 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.324 ( 3.766 13.201 -8.919) 16.371 2.610 ( 7.508 9.600 18.510) 22.162 2.972 ( -1.669 11.428 7.140) 13.578 3.255 ( -4.588 2.832 -1.065) 5.496 3.313 ( -11.499 -0.012 2.337) 11.734 3.729 ( 3.188 5.280 -8.841) 10.780 4.075 ( 0.758 -12.526 4.601) 13.366 4.171 ( 3.051 5.216 -1.890) 6.331 4.405 ( 11.172 5.602 -5.992) 13.860 4.874 ( 1.632 -6.483 -5.629) 8.739 4.924 ( -6.975 -2.466 2.939) 7.961 5.118 ( -3.396 -12.065 2.942) 12.875 5.560 ( -1.302 -5.112 -0.106) 5.277 5.660 ( -0.385 0.432 -1.047) 1.197 5.860 ( 1.125 -7.668 -4.849) 9.142 6.016 ( 0.786 -6.662 0.998) 6.782 7.460 ( 0.558 2.458 1.079) 2.742 7.494 ( 0.377 1.257 0.786) 1.529 8.531 ( 1.573 2.267 -0.662) 2.838 8.648 ( -6.005 0.881 -2.860) 6.710 9.019 ( 1.184 5.568 -0.825) 5.752 9.384 ( 0.494 -2.649 -0.201) 2.702 9.404 ( -0.266 2.020 0.634) 2.133 9.465 ( 1.885 0.615 6.157) 6.469 10.352 ( 0.535 3.050 -1.279) 3.350 10.576 ( -0.120 -2.980 0.221) 2.991 13.256 ( 1.562 11.621 -3.248) 12.167 13.386 ( -1.829 5.436 1.449) 5.915 13.787 ( -1.635 3.832 1.934) 4.593 13.967 ( -1.220 -3.067 -2.023) 3.871 14.322 ( -0.263 -10.517 -3.284) 11.021 15.104 ( 1.129 -7.038 -0.470) 7.144 18.069 ( 2.865 -0.193 -1.405) 3.196 18.210 ( 0.750 1.207 0.800) 1.631 18.317 ( -4.508 3.562 0.872) 5.811 19.022 ( 1.436 -6.516 0.348) 6.681======================= Grid point 156 (72/312) =======================q-point: (-0.50 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.176 ( -6.042 11.341 -14.246) 19.185 2.848 ( -3.798 14.517 15.527) 21.592 3.015 ( -2.800 10.075 7.385) 12.801 3.117 ( -5.160 1.428 -1.855) 5.666 3.214 ( 0.059 -2.426 -2.311) 3.351 3.753 ( 6.022 1.457 -3.134) 6.943 4.126 ( -3.693 3.825 -0.594) 5.350 4.179 ( 4.207 -7.224 1.831) 8.558 4.540 ( 9.316 6.238 -6.384) 12.902 4.797 ( -4.814 -1.843 2.301) 5.645 4.886 ( 0.455 -7.159 -2.254) 7.519 5.081 ( -2.035 -11.849 0.957) 12.061 5.518 ( -1.775 -4.840 -2.741) 5.839 5.641 ( -0.002 -1.312 -2.887) 3.172 5.811 ( -0.016 -7.095 -5.714) 9.110 6.032 ( 0.867 -8.703 -0.809) 8.784 7.486 ( 0.137 1.662 2.155) 2.724 7.528 ( 1.069 0.594 3.069) 3.303 8.434 ( -8.139 2.038 -12.282) 14.875 8.512 ( 0.462 1.358 -7.706) 7.838 9.030 ( 0.865 5.715 1.993) 6.114 9.364 ( 0.683 -2.825 2.894) 4.102 9.524 ( 2.826 1.883 9.154) 9.763 9.620 ( 3.715 1.054 11.452) 12.085 10.352 ( 0.868 3.037 -1.010) 3.316 10.567 ( -0.700 -3.220 -0.637) 3.356 13.236 ( 0.963 10.018 -5.306) 11.377 13.342 ( -2.788 5.792 -1.585) 6.620 13.735 ( -3.486 3.057 -2.546) 5.290 13.901 ( -1.484 -2.945 -7.598) 8.282 14.277 ( 0.060 -7.801 -3.783) 8.670 15.124 ( 0.945 -6.805 0.579) 6.895 18.122 ( 2.731 -0.510 0.907) 2.922 18.258 ( 2.214 5.773 2.295) 6.595 18.274 ( -1.548 -0.561 3.319) 3.706 19.012 ( -1.640 -5.565 -1.914) 6.109======================= Grid point 157 (73/312) =======================q-point: (-0.40 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.881 ( -9.171 12.995 -14.933) 21.817 2.738 ( -19.040 17.866 5.503) 26.683 2.902 ( -7.491 8.022 3.167) 11.423 3.123 ( 4.589 -6.139 -9.893) 12.515 3.218 ( -3.261 5.581 2.304) 6.862 3.868 ( 7.181 -1.523 0.616) 7.366 4.049 ( -0.673 5.042 0.366) 5.100 4.280 ( 4.379 -7.358 -1.878) 8.767 4.579 ( -1.643 3.674 3.984) 5.663 4.817 ( 0.003 -4.939 2.972) 5.764 4.888 ( 6.578 -2.078 -4.351) 8.156 5.081 ( 0.462 -8.424 1.847) 8.636 5.443 ( -2.382 -2.976 -4.178) 5.656 5.588 ( -0.279 -4.863 -6.665) 8.255 5.783 ( 1.317 -5.579 -2.018) 6.077 6.030 ( 0.203 -7.622 -1.695) 7.811 7.498 ( -0.717 0.547 1.095) 1.419 7.577 ( 0.769 -0.930 1.930) 2.276 8.156 ( -6.245 4.407 -14.879) 16.728 8.398 ( -2.262 1.811 -10.928) 11.306 9.121 ( 3.275 4.706 8.375) 10.149 9.446 ( 1.955 -4.102 7.152) 8.474 9.659 ( 1.720 2.120 9.014) 9.419 9.790 ( 2.986 0.590 10.054) 10.505 10.368 ( 1.564 3.135 -0.054) 3.504 10.538 ( -1.177 -2.591 -1.592) 3.261 13.189 ( 0.290 6.758 -6.451) 9.347 13.259 ( -3.163 6.697 -3.647) 8.255 13.625 ( -3.893 1.313 -5.576) 6.926 13.739 ( -3.734 -3.176 -15.303) 16.069 14.285 ( 2.787 -2.084 0.927) 3.601 15.147 ( 0.628 -5.770 1.093) 5.906 18.181 ( 1.973 -1.021 2.513) 3.354 18.276 ( 0.272 0.726 2.077) 2.217 18.370 ( 3.674 3.221 5.404) 7.285 18.929 ( -4.234 -3.737 -3.655) 6.727======================= Grid point 158 (74/312) =======================q-point: (-0.30 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.589 ( -6.494 17.531 -13.510) 23.066 2.346 ( -20.152 13.814 -10.623) 26.642 2.780 ( -11.923 11.556 5.715) 17.560 3.016 ( -10.380 12.163 -0.970) 16.019 3.146 ( 0.868 -3.838 -5.940) 7.125 4.024 ( 7.697 -3.145 3.254) 8.929 4.125 ( 4.074 -0.102 4.721) 6.237 4.278 ( 3.656 -7.570 -10.976) 13.826 4.636 ( -1.099 1.152 10.717) 10.834 4.790 ( -3.318 -7.567 1.049) 8.328 5.007 ( 5.937 2.225 -2.842) 6.948 5.136 ( 3.975 -3.480 2.200) 5.723 5.387 ( 0.625 -0.658 -1.661) 1.892 5.525 ( 1.196 -6.861 -7.033) 9.898 5.799 ( 1.448 -5.608 -1.128) 5.901 6.007 ( -1.493 -4.317 -0.295) 4.577 7.465 ( -2.909 0.939 -2.514) 3.957 7.579 ( 1.916 -1.981 -4.555) 5.324 7.965 ( -1.725 6.186 -8.160) 10.384 8.242 ( -4.123 2.248 -7.764) 9.074 9.289 ( 4.379 3.263 10.059) 11.446 9.551 ( 1.155 -5.112 7.551) 9.191 9.753 ( 0.136 1.954 6.392) 6.685 9.920 ( 1.981 -0.039 6.970) 7.246 10.407 ( 1.306 2.880 1.711) 3.595 10.500 ( -0.150 -1.131 -2.466) 2.717 13.123 ( -0.820 2.074 -5.661) 6.085 13.166 ( -2.516 8.517 -4.060) 9.765 13.452 ( -5.065 -2.537 -16.294) 17.250 13.538 ( -3.152 3.249 -6.790) 8.160 14.387 ( 5.328 0.703 3.624) 6.482 15.166 ( 0.164 -4.471 1.064) 4.599 18.236 ( 1.757 -1.761 0.910) 2.648 18.319 ( 0.851 -0.893 4.460) 4.627 18.483 ( 3.195 2.811 3.992) 5.836 18.797 ( -5.589 -1.334 -4.086) 7.051======================= Grid point 159 (75/312) =======================q-point: (-0.20 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.412 ( 0.983 23.528 -10.564) 25.809 1.837 ( -18.284 15.858 -17.471) 29.850 2.569 ( -18.977 20.639 11.119) 30.162 2.847 ( -10.036 16.020 6.359) 19.945 3.131 ( 3.890 -9.351 -5.498) 11.524 4.176 ( 5.362 -6.089 0.609) 8.136 4.239 ( 1.723 -4.440 -2.500) 5.379 4.253 ( 6.154 -6.450 -1.709) 9.077 4.645 ( -4.005 0.189 -1.885) 4.430 4.775 ( 0.112 -0.521 3.352) 3.394 5.044 ( 0.916 -3.353 0.334) 3.492 5.227 ( 2.427 2.133 1.436) 3.536 5.438 ( 4.891 1.208 -0.133) 5.040 5.502 ( 3.282 -8.671 -5.660) 10.862 5.800 ( 0.157 -5.734 -1.762) 6.001 5.980 ( -2.603 -0.648 2.780) 3.863 7.372 ( -0.286 3.716 -5.912) 6.988 7.607 ( 4.925 0.249 -2.025) 5.331 7.884 ( -1.990 5.211 -4.710) 7.301 8.108 ( -4.181 1.572 -3.774) 5.847 9.456 ( 3.653 1.684 7.857) 8.827 9.624 ( -0.497 -6.272 5.745) 8.520 9.785 ( -1.506 2.213 2.694) 3.798 9.997 ( 0.829 -0.218 3.292) 3.402 10.409 ( -1.701 1.126 -0.212) 2.051 10.523 ( 3.297 1.534 0.332) 3.651 13.056 ( -1.604 0.860 -2.878) 3.405 13.099 ( -1.095 5.592 -2.519) 6.230 13.211 ( -3.811 5.469 -11.966) 13.698 13.458 ( -1.000 2.326 -2.681) 3.687 14.527 ( 5.524 0.842 3.287) 6.483 15.172 ( -0.416 -3.475 0.511) 3.536 18.263 ( 1.322 -2.189 -0.629) 2.633 18.379 ( 0.336 -1.896 4.094) 4.525 18.551 ( 1.046 1.794 0.814) 2.230 18.670 ( -4.132 0.916 -1.602) 4.525======================= Grid point 160 (76/312) =======================q-point: (-0.10 0.27 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.415 ( 4.841 28.637 -17.149) 33.729 1.462 ( -2.805 20.922 3.470) 21.392 2.363 ( -18.129 25.078 18.480) 36.043 2.764 ( -6.934 15.860 8.056) 19.092 3.193 ( 4.965 -11.464 1.479) 12.580 4.198 ( 3.431 -11.331 -9.285) 15.045 4.252 ( 0.000 -2.405 0.370) 2.433 4.337 ( 3.022 -6.821 -2.426) 7.845 4.548 ( -1.927 4.522 -2.896) 5.705 4.789 ( 0.223 2.648 -2.355) 3.551 5.058 ( -0.571 -6.486 1.534) 6.689 5.245 ( -0.384 3.119 -0.788) 3.240 5.519 ( 5.245 1.865 -4.476) 7.143 5.541 ( 4.130 -9.411 1.117) 10.338 5.784 ( -0.490 -4.553 -0.025) 4.579 5.955 ( -3.636 1.351 2.556) 4.645 7.391 ( 4.878 6.882 0.880) 8.481 7.715 ( 6.081 2.592 2.581) 7.096 7.785 ( -2.912 4.713 -3.784) 6.709 8.006 ( -3.304 0.910 -3.911) 5.200 9.551 ( 0.614 -0.426 1.939) 2.078 9.639 ( -2.706 -7.752 2.672) 8.635 9.761 ( -1.708 3.704 -0.265) 4.087 10.012 ( -0.635 0.229 -0.542) 0.866 10.375 ( -0.819 1.199 -1.204) 1.886 10.582 ( 1.776 1.877 1.060) 2.793 13.018 ( -0.539 4.319 -0.491) 4.380 13.082 ( 0.043 -0.354 2.000) 2.032 13.132 ( 1.676 10.025 0.344) 10.170 13.446 ( 0.641 1.925 0.936) 2.234 14.629 ( 2.786 0.005 0.962) 2.947 15.160 ( -0.857 -3.113 -0.583) 3.281 18.281 ( 1.392 -2.768 -0.557) 3.148 18.384 ( -1.839 -1.574 -0.572) 2.487 18.539 ( -0.656 1.930 -0.546) 2.111 18.639 ( -0.696 0.689 1.772) 2.025======================= Grid point 161 (77/312) =======================q-point: ( 0.00 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.852 ( 3.764 23.731 2.627) 24.171 2.138 ( 13.139 23.087 -2.813) 26.713 2.693 ( -5.224 11.907 14.229) 19.275 3.062 ( -0.082 -0.086 8.756) 8.757 3.090 ( -0.521 3.639 14.390) 14.853 3.955 ( 6.544 -13.491 -7.669) 16.842 4.159 ( -2.670 -1.355 -2.654) 4.001 4.212 ( -1.655 -3.855 -3.243) 5.303 4.598 ( -0.500 4.503 -5.998) 7.517 4.808 ( -1.920 2.721 -1.262) 3.561 4.894 ( -2.549 -6.807 -0.602) 7.293 5.195 ( -0.849 -6.848 -6.237) 9.301 5.404 ( 1.481 -4.257 4.125) 6.110 5.635 ( 2.277 -5.056 -1.052) 5.644 5.790 ( 4.619 5.485 -0.250) 7.175 5.957 ( -3.454 2.483 3.304) 5.386 7.612 ( -1.479 6.243 1.552) 6.601 7.832 ( -3.474 -0.137 0.275) 3.487 7.904 ( 9.081 4.348 1.170) 10.136 7.993 ( 5.230 1.994 6.150) 8.316 9.429 ( -4.745 -3.838 -3.238) 6.908 9.473 ( -3.032 -4.949 -1.367) 5.963 9.812 ( -1.884 4.629 -2.961) 5.809 9.971 ( -1.909 -0.339 -3.940) 4.391 10.415 ( 0.357 4.054 -0.852) 4.158 10.611 ( -0.345 -0.706 -0.126) 0.796 13.092 ( 1.722 1.226 4.253) 4.749 13.154 ( 2.603 -0.802 6.770) 7.298 13.402 ( 5.398 8.649 2.467) 10.490 13.539 ( 2.227 2.123 4.584) 5.520 14.655 ( -1.695 3.073 -2.563) 4.346 15.043 ( -0.479 -6.076 -3.106) 6.840 18.233 ( -0.524 -1.427 -3.156) 3.503 18.302 ( -2.427 -2.128 -0.226) 3.235 18.582 ( 1.723 1.740 -0.021) 2.449 18.643 ( -0.850 -0.002 1.067) 1.364======================= Grid point 162 (78/312) =======================q-point: ( 0.10 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.001 ( 6.842 21.707 6.024) 23.543 2.328 ( 9.399 19.803 -0.681) 21.931 2.801 ( 0.796 6.677 12.437) 14.138 3.197 ( 2.508 1.831 13.597) 13.948 3.277 ( 2.413 5.123 19.879) 20.670 3.993 ( 3.912 -10.220 -9.377) 14.411 4.084 ( -0.061 0.060 -4.403) 4.404 4.128 ( -2.997 -2.016 -3.056) 4.731 4.483 ( -1.938 6.082 -12.280) 13.840 4.772 ( 0.654 -0.636 -2.634) 2.788 4.847 ( -3.636 -8.906 3.279) 10.163 5.112 ( -1.669 -7.873 -5.751) 9.891 5.461 ( 0.913 -4.766 2.813) 5.610 5.655 ( 1.370 -6.998 -1.363) 7.260 5.874 ( 1.157 5.346 3.427) 6.454 5.921 ( -3.167 4.916 3.793) 6.970 7.557 ( -2.957 4.426 -0.692) 5.368 7.712 ( -5.352 -0.900 -3.876) 6.669 8.162 ( 8.940 5.402 11.468) 15.512 8.218 ( 8.328 3.296 11.540) 14.608 9.282 ( -5.405 -1.873 -6.749) 8.847 9.384 ( -2.949 -5.190 -4.742) 7.624 9.728 ( -2.859 3.108 -5.255) 6.741 9.868 ( -3.315 -0.500 -7.064) 7.819 10.417 ( 0.729 3.816 -0.923) 3.993 10.588 ( -1.712 -0.599 -0.125) 1.818 13.183 ( 2.551 1.962 5.724) 6.567 13.276 ( 3.377 -0.085 6.274) 7.126 13.578 ( 7.205 5.463 8.032) 12.094 13.646 ( 2.385 2.725 7.774) 8.576 14.559 ( -4.955 3.227 -3.786) 7.021 15.001 ( 0.112 -7.065 -4.411) 8.329 18.167 ( -1.345 -1.030 -5.575) 5.827 18.255 ( -2.129 -2.402 -1.006) 3.364 18.624 ( -1.259 1.153 0.213) 1.720 18.649 ( 3.421 -0.124 1.736) 3.839======================= Grid point 163 (79/312) =======================q-point: ( 0.20 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.207 ( 7.704 17.901 9.145) 21.528 2.484 ( 8.719 17.138 -1.295) 19.272 2.925 ( 1.449 3.224 8.727) 9.416 3.353 ( 0.619 -4.313 10.877) 11.717 3.530 ( -0.470 11.661 20.197) 23.327 3.882 ( -1.566 -7.643 -11.785) 14.133 4.029 ( -0.070 2.600 -6.097) 6.629 4.117 ( 1.463 0.395 -1.000) 1.815 4.347 ( 2.506 7.647 -11.489) 14.027 4.766 ( 2.680 -6.712 -6.126) 9.475 4.839 ( -3.499 -8.682 8.464) 12.620 5.029 ( -2.224 -9.481 -3.586) 10.378 5.490 ( 0.122 -4.392 1.162) 4.544 5.663 ( 1.016 -7.092 -1.255) 7.274 5.843 ( -7.189 6.232 6.959) 11.788 5.955 ( 0.812 1.806 1.522) 2.497 7.513 ( -1.006 2.834 -0.915) 3.143 7.591 ( -3.419 -0.193 -3.542) 4.927 8.396 ( 3.725 5.318 12.805) 14.357 8.504 ( 7.972 2.591 12.931) 15.410 9.127 ( -3.514 0.436 -6.456) 7.363 9.293 ( -1.284 -4.967 -4.557) 6.862 9.608 ( -3.334 2.032 -7.168) 8.163 9.717 ( -4.169 -0.493 -9.340) 10.240 10.419 ( 0.464 3.277 -1.087) 3.484 10.557 ( -1.695 -0.867 0.451) 1.957 13.285 ( 2.557 2.666 4.876) 6.117 13.393 ( 3.709 1.162 3.939) 5.534 13.756 ( 1.707 4.705 8.270) 9.667 13.789 ( 5.475 1.138 7.788) 9.587 14.420 ( -6.025 3.433 -2.930) 7.528 14.963 ( 0.593 -8.581 -4.528) 9.721 18.094 ( -0.424 -0.111 -5.282) 5.300 18.210 ( -1.283 -2.292 -1.437) 2.994 18.577 ( -3.512 3.113 -0.127) 4.695 18.748 ( 4.689 -3.095 1.782) 5.894======================= Grid point 164 (80/312) =======================q-point: ( 0.30 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.464 ( 9.900 14.520 9.897) 20.169 2.602 ( 5.884 13.105 -3.068) 14.690 3.022 ( 0.616 1.275 5.745) 5.917 3.411 ( -4.267 4.105 6.798) 9.015 3.569 ( -8.540 6.235 9.224) 14.032 3.745 ( -0.041 -10.881 -11.791) 16.044 3.986 ( -0.579 7.829 -2.790) 8.331 4.167 ( 4.513 2.229 1.614) 5.286 4.378 ( 8.778 6.358 -6.246) 12.510 4.745 ( 1.873 -8.430 -6.210) 10.637 4.859 ( -2.787 -9.148 5.738) 11.153 4.960 ( -4.046 -10.103 0.702) 10.905 5.491 ( -0.355 -3.380 -0.060) 3.399 5.673 ( 1.376 -6.806 -0.905) 7.002 5.777 ( -6.264 3.520 4.493) 8.474 5.952 ( -2.057 -1.542 0.669) 2.656 7.497 ( -0.005 2.054 -0.565) 2.130 7.526 ( -0.921 0.771 -1.623) 2.020 8.541 ( 1.273 4.291 6.821) 8.158 8.692 ( 0.221 0.094 6.922) 6.926 9.072 ( 1.970 3.428 -0.572) 3.995 9.274 ( 1.700 -3.529 0.746) 3.987 9.486 ( -2.197 1.420 -5.372) 5.975 9.544 ( -4.164 -0.055 -9.353) 10.239 10.413 ( 0.108 2.832 -1.093) 3.038 10.537 ( -1.119 -1.641 0.680) 2.099 13.359 ( 1.533 3.214 1.996) 4.082 13.477 ( 2.935 2.147 0.117) 3.638 13.842 ( -0.329 4.019 6.249) 7.437 13.923 ( 3.122 1.133 2.534) 4.177 14.301 ( -4.912 2.757 -0.296) 5.641 14.937 ( 0.973 -9.992 -3.411) 10.603 18.059 ( 1.301 0.853 -3.108) 3.476 18.187 ( -0.270 -1.912 -0.062) 1.932 18.500 ( -4.161 5.317 -0.607) 6.779 18.840 ( 3.559 -5.777 1.046) 6.866======================= Grid point 165 (81/312) =======================q-point: ( 0.40 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.586 ( 1.954 12.924 -12.957) 18.404 2.771 ( 8.470 8.236 13.913) 18.253 3.030 ( -2.680 -3.548 -0.185) 4.450 3.372 ( -4.796 10.627 4.698) 12.570 3.469 ( -9.410 11.476 6.326) 16.133 3.695 ( 3.567 -11.517 -7.104) 13.994 3.978 ( 0.742 5.614 2.957) 6.389 4.244 ( 2.614 1.606 -1.591) 3.456 4.500 ( 9.934 4.701 -4.925) 12.044 4.715 ( 0.809 -9.018 -5.040) 10.363 4.843 ( -2.669 -6.735 1.816) 7.469 4.888 ( -5.867 -10.864 3.649) 12.875 5.478 ( -0.403 -2.658 -1.509) 3.083 5.690 ( -0.053 -0.528 -0.469) 0.708 5.702 ( -2.711 -5.557 -1.384) 6.336 5.906 ( -2.616 -4.899 -0.510) 5.577 7.503 ( 0.537 1.853 0.709) 2.056 7.517 ( 0.156 1.062 0.560) 1.210 8.579 ( 0.362 2.462 -1.457) 2.884 8.657 ( -4.978 -0.000 -3.111) 5.870 9.115 ( 1.586 4.504 -1.262) 4.939 9.327 ( 0.368 -3.095 -1.574) 3.492 9.443 ( 0.584 1.917 2.912) 3.536 9.480 ( 1.813 0.694 6.606) 6.885 10.405 ( 0.222 2.515 -1.011) 2.720 10.526 ( -0.785 -2.289 0.373) 2.448 13.374 ( 0.086 3.281 -1.784) 3.736 13.496 ( 1.500 2.537 -4.451) 5.339 13.853 ( -2.341 2.489 0.502) 3.454 13.956 ( 0.710 2.116 -2.503) 3.354 14.242 ( -2.641 2.943 2.427) 4.639 14.935 ( 1.457 -10.651 -1.485) 10.852 18.078 ( 2.311 1.167 -0.321) 2.609 18.201 ( 0.286 -1.672 2.818) 3.289 18.425 ( -2.900 7.293 -0.677) 7.878 18.892 ( 1.599 -7.206 -0.194) 7.383======================= Grid point 166 (82/312) =======================q-point: (-0.50 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.406 ( -4.946 12.021 -15.541) 20.261 2.951 ( -3.105 -7.384 -1.910) 8.235 3.038 ( 8.155 5.857 4.639) 11.061 3.285 ( -11.679 12.817 5.018) 18.052 3.406 ( -3.445 14.549 5.913) 16.078 3.702 ( 4.140 -7.933 -4.522) 10.026 4.078 ( 3.945 1.383 6.333) 7.588 4.223 ( -0.984 2.586 -4.731) 5.480 4.608 ( 4.208 -0.622 -6.078) 7.418 4.697 ( 4.510 -6.678 -1.591) 8.214 4.792 ( -5.645 -2.300 3.936) 7.256 4.865 ( 0.067 -10.166 3.458) 10.738 5.443 ( -0.251 -2.573 -4.161) 4.899 5.602 ( -2.967 -3.622 -5.696) 7.374 5.700 ( 0.420 -3.393 -0.619) 3.474 5.870 ( 0.480 -7.704 -1.998) 7.973 7.517 ( -0.215 1.471 0.965) 1.773 7.540 ( 0.582 0.558 2.212) 2.354 8.475 ( -6.072 2.168 -11.673) 13.335 8.534 ( -0.116 0.769 -8.444) 8.480 9.126 ( 0.723 4.254 1.696) 4.637 9.309 ( 0.217 -2.895 1.899) 3.469 9.565 ( 2.807 2.230 9.919) 10.547 9.634 ( 3.157 0.291 11.847) 12.264 10.404 ( 0.765 2.346 -0.863) 2.614 10.514 ( -0.633 -2.298 -0.157) 2.388 13.331 ( -1.044 2.719 -4.985) 5.773 13.448 ( 0.214 1.875 -8.167) 8.382 13.772 ( -3.585 1.672 -5.145) 6.490 13.898 ( -1.670 1.310 -7.601) 7.892 14.255 ( 0.224 5.937 4.772) 7.621 14.961 ( 1.888 -10.286 0.325) 10.463 18.125 ( 1.727 0.831 1.879) 2.684 18.242 ( -0.777 -2.107 5.180) 5.646 18.401 ( 1.098 8.364 0.128) 8.437 18.893 ( -0.598 -6.966 -1.431) 7.137======================= Grid point 167 (83/312) =======================q-point: (-0.40 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.149 ( -5.815 14.444 -14.643) 21.374 2.866 ( -2.464 -9.335 -4.923) 10.837 3.006 ( -10.511 9.487 -11.208) 18.058 3.176 ( -2.735 12.267 4.731) 13.429 3.424 ( -3.985 11.501 8.231) 14.693 3.771 ( 6.971 -8.304 -2.927) 11.230 4.138 ( -2.539 3.870 -0.228) 4.634 4.198 ( 3.360 -0.807 -1.415) 3.734 4.583 ( -0.121 -4.096 0.779) 4.171 4.722 ( -5.901 -1.826 5.731) 8.426 4.849 ( 7.621 -4.872 0.903) 9.090 4.941 ( 3.845 -5.001 4.994) 8.046 5.396 ( 1.960 -1.533 -8.409) 8.770 5.495 ( -1.822 -4.190 -5.196) 6.919 5.703 ( 0.459 -2.728 -0.402) 2.795 5.882 ( 3.044 -7.551 -2.557) 8.534 7.512 ( -0.504 0.858 -0.419) 1.079 7.560 ( -0.399 -0.806 0.435) 0.999 8.245 ( -3.980 4.784 -14.090) 15.403 8.416 ( -1.472 -0.043 -11.790) 11.881 9.199 ( 1.959 3.401 7.985) 8.898 9.371 ( 1.036 -3.626 7.037) 7.984 9.703 ( 1.637 2.444 9.243) 9.699 9.795 ( 2.299 -0.208 10.210) 10.468 10.420 ( 1.597 2.222 -0.199) 2.744 10.499 ( -0.416 -1.509 -0.846) 1.779 13.245 ( -1.849 1.756 -6.639) 7.112 13.349 ( -1.073 0.234 -10.046) 10.105 13.638 ( -3.138 2.216 -8.877) 9.673 13.761 ( -3.157 2.184 -10.054) 10.762 14.337 ( 2.818 7.658 5.796) 10.009 15.005 ( 1.911 -9.154 1.303) 9.442 18.174 ( 1.079 0.333 2.901) 3.113 18.266 ( -1.523 -1.488 4.751) 5.207 18.464 ( 3.579 6.216 2.230) 7.512 18.844 ( -2.590 -5.178 -2.278) 6.221======================= Grid point 168 (84/312) =======================q-point: (-0.30 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.937 ( -2.505 18.162 -11.760) 21.782 2.603 ( -13.132 13.236 -18.549) 26.300 2.811 ( -2.112 -8.647 -2.796) 9.330 3.117 ( -5.031 8.733 -1.655) 10.213 3.362 ( -10.902 13.650 6.778) 18.738 3.873 ( 8.436 -10.504 -6.342) 14.890 4.134 ( 0.721 0.853 3.079) 3.275 4.207 ( 0.254 -0.478 -1.201) 1.317 4.644 ( 1.623 -4.940 4.853) 7.113 4.687 ( -2.882 2.342 5.927) 6.994 4.944 ( 0.618 -7.220 3.331) 7.975 5.091 ( 4.854 -5.044 5.917) 9.166 5.356 ( 5.164 -0.147 -12.419) 13.451 5.466 ( 1.930 0.389 -0.516) 2.035 5.706 ( 0.821 -3.441 -1.428) 3.816 5.921 ( 2.811 -4.946 -0.843) 5.751 7.485 ( -1.057 0.987 -3.399) 3.694 7.544 ( 2.106 -1.627 -3.692) 4.551 8.081 ( -1.189 5.820 -9.673) 11.351 8.266 ( -3.080 0.211 -9.431) 9.923 9.334 ( 2.391 1.537 9.955) 10.353 9.460 ( 0.127 -4.195 7.937) 8.978 9.799 ( 0.320 2.742 6.545) 7.103 9.915 ( 1.615 -0.623 6.997) 7.208 10.452 ( 0.566 1.806 0.953) 2.120 10.491 ( 1.664 -0.050 -1.497) 2.239 13.144 ( -2.017 0.837 -6.108) 6.487 13.220 ( -2.234 -1.400 -9.464) 9.824 13.497 ( -1.400 4.945 -10.621) 11.800 13.609 ( -3.091 3.273 -7.976) 9.159 14.461 ( 4.421 7.292 5.289) 10.034 15.050 ( 1.401 -7.737 1.323) 7.973 18.216 ( 0.784 -0.261 1.681) 1.873 18.293 ( -0.654 -1.738 5.095) 5.423 18.547 ( 2.597 3.799 2.232) 5.115 18.761 ( -3.757 -2.486 -2.324) 5.070======================= Grid point 169 (85/312) =======================q-point: (-0.20 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.844 ( 2.180 20.882 -6.235) 21.901 2.184 ( -9.253 20.332 -21.130) 30.749 2.766 ( -3.210 -5.454 2.524) 6.813 2.997 ( -4.696 3.159 -1.890) 5.967 3.201 ( -13.054 16.058 7.775) 22.106 3.930 ( 7.259 -13.420 -11.506) 19.109 4.190 ( 1.306 -1.756 2.663) 3.447 4.219 ( -1.192 -0.858 5.240) 5.442 4.652 ( -0.706 0.002 0.018) 0.706 4.773 ( 2.157 1.661 5.740) 6.353 4.954 ( -1.655 -5.692 2.012) 6.260 5.210 ( 3.230 -10.706 3.805) 11.812 5.330 ( 2.000 1.767 -6.571) 7.092 5.535 ( 5.563 3.230 -2.160) 6.786 5.708 ( 1.534 -2.351 -2.121) 3.518 5.960 ( 0.823 -2.119 1.519) 2.734 7.443 ( 2.739 3.562 -4.808) 6.581 7.596 ( 6.418 -1.285 -1.638) 6.747 7.982 ( -1.932 4.927 -6.426) 8.325 8.128 ( -4.068 0.361 -5.136) 6.562 9.457 ( 0.969 -1.046 7.749) 7.879 9.517 ( -1.599 -4.662 5.830) 7.634 9.846 ( -0.346 3.762 3.250) 4.984 9.991 ( 0.983 -0.673 3.399) 3.602 10.443 ( -0.880 2.369 -0.478) 2.572 10.541 ( 3.323 0.229 0.350) 3.349 13.065 ( -1.122 0.398 -3.391) 3.593 13.104 ( -1.709 -1.143 -5.308) 5.693 13.387 ( 0.042 8.105 -8.670) 11.869 13.508 ( -1.282 2.612 -3.986) 4.935 14.587 ( 4.243 5.701 3.235) 7.808 15.077 ( 0.477 -6.535 0.443) 6.567 18.236 ( 0.632 -0.500 0.151) 0.820 18.334 ( -0.511 -2.674 4.377) 5.155 18.590 ( 0.524 2.233 0.305) 2.314 18.678 ( -2.993 -0.135 -0.879) 3.123======================= Grid point 170 (86/312) =======================q-point: (-0.10 0.36 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.845 ( -3.445 20.111 1.243) 20.441 1.970 ( 10.440 27.701 -14.887) 33.135 2.717 ( -8.527 7.475 9.397) 14.727 2.966 ( 1.528 -8.611 2.657) 9.141 3.079 ( -9.149 15.813 9.889) 20.774 3.933 ( 5.693 -14.491 -10.404) 18.726 4.209 ( -1.499 -2.007 1.007) 2.700 4.241 ( -0.507 -3.702 1.162) 3.913 4.637 ( 0.072 4.039 -2.125) 4.565 4.831 ( -0.510 1.418 2.397) 2.831 4.936 ( -1.190 -4.931 -0.581) 5.106 5.256 ( 1.301 -10.716 -5.540) 12.133 5.333 ( 1.156 0.598 3.997) 4.204 5.596 ( 3.720 -0.223 -2.349) 4.405 5.730 ( 3.146 1.867 -1.892) 4.118 5.974 ( -1.422 -0.093 2.399) 2.790 7.518 ( 6.826 6.278 1.218) 9.354 7.738 ( 8.093 -0.313 2.517) 8.482 7.877 ( -2.665 4.650 -4.774) 7.178 8.015 ( -4.000 0.017 -3.104) 5.063 9.505 ( -1.527 -3.346 1.791) 4.091 9.513 ( -3.237 -5.121 3.207) 6.855 9.852 ( -0.815 4.963 -0.081) 5.030 10.013 ( -0.317 -0.416 -0.360) 0.635 10.424 ( -0.386 3.577 -0.847) 3.697 10.596 ( 1.860 -0.489 0.451) 1.975 13.045 ( 0.452 0.610 0.748) 1.066 13.075 ( 0.626 -0.387 1.830) 1.972 13.342 ( 2.156 9.280 -3.899) 10.294 13.486 ( 0.806 1.986 0.236) 2.156 14.664 ( 1.997 3.957 0.180) 4.436 15.074 ( -0.403 -5.920 -1.197) 6.053 18.246 ( 0.632 -0.804 -0.656) 1.215 18.342 ( -1.902 -2.680 1.335) 3.547 18.578 ( -0.572 2.082 -0.683) 2.265 18.647 ( -0.804 0.078 0.714) 1.078======================= Grid point 171 (87/312) =======================q-point: ( 0.00 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.280 ( 2.043 20.557 6.377) 21.620 2.510 ( 7.677 9.831 -3.136) 12.861 2.703 ( 3.042 -5.219 6.762) 9.068 2.856 ( 5.250 -9.488 -0.610) 10.860 3.406 ( -2.719 16.427 13.994) 21.750 3.693 ( 2.439 -13.861 3.086) 14.408 4.143 ( -2.167 -0.133 -1.453) 2.612 4.159 ( -1.833 -1.788 -1.723) 3.087 4.685 ( -0.506 4.883 -4.320) 6.539 4.777 ( -3.407 -4.242 0.961) 5.525 4.881 ( -1.596 3.592 -5.246) 6.556 5.004 ( -1.256 -9.688 -4.407) 10.717 5.423 ( 0.981 4.023 0.567) 4.179 5.522 ( 1.036 -5.917 -1.114) 6.110 5.901 ( 3.172 5.069 0.816) 6.035 5.966 ( -0.081 -1.551 2.402) 2.860 7.719 ( -2.507 4.896 0.225) 5.505 7.797 ( -3.321 -3.116 -0.798) 4.623 7.979 ( 8.574 3.012 4.153) 9.992 8.011 ( 7.162 -0.298 5.589) 9.089 9.380 ( -4.208 -0.901 -1.967) 4.732 9.398 ( -3.650 -2.639 -1.489) 4.744 9.894 ( -2.133 3.707 -3.702) 5.657 9.949 ( -2.060 -2.009 -3.878) 4.829 10.500 ( 0.156 4.442 -0.560) 4.480 10.574 ( -0.102 -3.065 -0.366) 3.089 13.112 ( 1.865 1.074 5.164) 5.594 13.134 ( 2.165 -1.135 6.028) 6.505 13.527 ( 4.893 4.118 1.778) 6.638 13.564 ( 3.497 0.005 3.365) 4.853 14.755 ( -1.111 7.092 -3.786) 8.116 14.905 ( -0.569 -7.989 -4.042) 8.972 18.228 ( -1.452 0.826 -1.778) 2.439 18.259 ( -2.203 -2.174 -0.591) 3.151 18.614 ( 0.934 1.486 -0.021) 1.756 18.636 ( 0.066 -0.770 0.374) 0.858======================= Grid point 172 (88/312) =======================q-point: ( 0.10 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.397 ( 2.584 18.895 7.792) 20.601 2.615 ( 5.403 4.040 -0.328) 6.754 2.827 ( 3.279 1.374 7.117) 7.955 3.000 ( 8.606 -11.344 2.319) 14.427 3.571 ( 2.106 14.661 18.195) 23.461 3.805 ( 3.406 -10.120 4.867) 11.734 4.088 ( -0.885 0.318 -2.881) 3.030 4.099 ( -1.673 -1.008 -2.392) 3.088 4.611 ( -0.844 6.588 -8.119) 10.489 4.710 ( -2.464 -4.832 -3.453) 6.430 4.779 ( -4.194 2.176 -1.936) 5.106 4.912 ( -2.721 -10.806 -5.600) 12.471 5.450 ( 0.986 2.588 0.846) 2.896 5.532 ( 1.046 -5.614 -0.837) 5.772 5.956 ( 0.052 2.918 3.195) 4.328 5.977 ( -2.194 0.852 3.869) 4.529 7.631 ( -4.339 3.322 -1.550) 5.681 7.683 ( -5.270 -2.125 -2.606) 6.251 8.239 ( 8.954 2.587 11.316) 14.660 8.258 ( 8.754 0.649 11.502) 14.469 9.263 ( -4.130 0.291 -5.519) 6.899 9.299 ( -3.389 -3.375 -4.759) 6.747 9.792 ( -3.298 3.277 -6.462) 7.961 9.844 ( -3.440 -2.029 -6.872) 7.949 10.494 ( -0.224 3.880 -0.571) 3.928 10.557 ( -1.175 -2.578 -0.375) 2.858 13.215 ( 2.563 1.649 6.826) 7.476 13.249 ( 2.898 -1.882 7.287) 8.065 13.669 ( 5.810 3.004 5.965) 8.852 13.688 ( 3.950 0.994 6.940) 8.047 14.670 ( -2.921 8.091 -5.411) 10.163 14.843 ( -0.853 -9.189 -5.667) 10.830 18.169 ( -1.649 1.175 -3.603) 4.133 18.206 ( -1.983 -2.484 -1.854) 3.680 18.641 ( 0.374 0.636 0.207) 0.766 18.648 ( 1.641 -0.105 0.782) 1.820======================= Grid point 173 (89/312) =======================q-point: ( 0.20 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.529 ( 3.043 14.902 9.412) 17.886 2.705 ( 4.394 0.816 0.720) 4.527 2.964 ( 5.514 6.352 3.483) 9.103 3.179 ( 8.231 -12.275 1.388) 14.844 3.728 ( -4.717 7.720 11.661) 14.759 3.816 ( -4.735 -1.857 0.481) 5.109 4.082 ( 3.004 2.770 0.307) 4.098 4.116 ( 3.330 -0.630 0.986) 3.530 4.516 ( 1.254 9.119 -9.246) 13.046 4.642 ( 0.710 -5.192 -5.874) 7.872 4.716 ( -4.334 -2.751 4.244) 6.661 4.817 ( -2.346 -11.151 -3.444) 11.904 5.470 ( 0.403 1.780 0.399) 1.868 5.541 ( 0.518 -5.306 -0.491) 5.354 5.937 ( -5.757 3.330 4.713) 8.151 5.971 ( -2.961 -0.320 2.853) 4.124 7.557 ( -2.092 1.755 -1.333) 3.039 7.581 ( -2.989 -0.871 -2.140) 3.778 8.482 ( 4.459 3.513 12.206) 13.461 8.523 ( 6.043 -0.618 12.414) 13.820 9.147 ( -1.688 1.963 -5.282) 5.882 9.205 ( -1.041 -3.988 -4.415) 6.040 9.654 ( -3.609 2.534 -8.266) 9.369 9.696 ( -4.020 -1.698 -8.895) 9.908 10.481 ( -0.588 2.996 -0.541) 3.100 10.529 ( -1.500 -2.014 -0.063) 2.513 13.328 ( 2.616 2.150 5.848) 6.757 13.371 ( 3.146 -2.245 5.627) 6.826 13.817 ( 2.506 2.248 7.465) 8.189 13.835 ( 4.273 1.047 6.717) 8.030 14.556 ( -3.369 10.205 -5.342) 12.001 14.771 ( -0.620 -11.248 -5.856) 12.696 18.112 ( -0.540 1.897 -3.351) 3.889 18.159 ( -0.987 -2.791 -1.773) 3.451 18.636 ( -0.842 3.046 -0.107) 3.162 18.692 ( 2.077 -2.860 0.476) 3.566======================= Grid point 174 (90/312) =======================q-point: ( 0.30 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.698 ( 4.034 9.294 10.739) 14.764 2.787 ( 4.401 2.509 -1.149) 5.195 3.060 ( 3.249 7.593 -2.271) 8.565 3.305 ( 5.570 -14.032 -2.293) 15.270 3.663 ( -6.254 5.904 3.380) 9.241 3.717 ( -6.938 1.435 3.156) 7.756 4.130 ( -0.243 5.831 0.229) 5.841 4.188 ( 3.018 -0.274 1.332) 3.310 4.512 ( 5.546 7.176 -5.140) 10.425 4.620 ( 1.874 -3.438 -4.157) 5.711 4.688 ( -3.755 -6.431 4.322) 8.610 4.762 ( -1.542 -9.776 -1.023) 9.950 5.475 ( 0.153 1.594 -0.144) 1.608 5.545 ( 0.447 -5.517 -0.105) 5.536 5.856 ( -6.970 3.773 2.913) 8.444 5.915 ( -5.295 -2.461 1.618) 6.059 7.526 ( -0.324 0.981 -0.664) 1.228 7.535 ( -0.577 0.041 -0.939) 1.103 8.617 ( 0.227 3.518 5.873) 6.850 8.672 ( -0.307 -2.090 5.806) 6.179 9.138 ( 3.120 3.497 0.772) 4.750 9.206 ( 2.843 -3.570 1.370) 4.765 9.514 ( -2.711 1.449 -6.750) 7.417 9.537 ( -3.560 -0.783 -8.138) 8.917 10.463 ( -0.681 2.390 -0.501) 2.536 10.504 ( -1.269 -1.884 0.136) 2.276 13.411 ( 1.613 2.576 2.542) 3.962 13.460 ( 2.346 -2.429 1.705) 3.783 13.903 ( 0.105 2.852 4.631) 5.439 13.943 ( 1.629 -0.757 3.591) 4.015 14.459 ( -2.138 12.503 -3.205) 13.084 14.715 ( 0.208 -13.060 -4.324) 13.759 18.091 ( 0.793 2.331 -1.292) 2.781 18.141 ( 0.022 -2.706 0.027) 2.707 18.610 ( -1.340 6.056 -0.746) 6.248 18.727 ( 1.495 -6.036 -0.158) 6.220======================= Grid point 175 (91/312) =======================q-point: ( 0.40 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.769 ( -0.979 6.647 -5.634) 8.768 2.869 ( 1.238 -2.903 2.068) 3.773 3.064 ( 4.062 12.559 -2.643) 13.462 3.355 ( 3.931 -14.904 -2.810) 15.667 3.626 ( -3.304 6.593 5.026) 8.924 3.654 ( -5.384 5.270 6.408) 9.890 4.123 ( -0.521 7.237 1.731) 7.459 4.226 ( 1.385 -3.289 -1.093) 3.732 4.561 ( 1.430 -0.444 -1.545) 2.152 4.623 ( 0.416 2.494 -2.905) 3.852 4.655 ( -0.177 -7.962 1.833) 8.172 4.744 ( 0.935 -6.589 -1.190) 6.761 5.471 ( -0.012 1.972 -1.521) 2.490 5.551 ( 0.314 -6.230 -1.113) 6.337 5.751 ( -5.248 3.395 -0.245) 6.256 5.822 ( -4.985 -3.982 -0.496) 6.400 7.528 ( 0.447 0.758 0.563) 1.044 7.532 ( 0.207 0.363 0.444) 0.610 8.620 ( -1.332 1.833 -2.130) 3.109 8.648 ( -3.207 -0.980 -2.768) 4.348 9.195 ( 1.445 3.911 -1.642) 4.481 9.265 ( 0.935 -3.447 -1.782) 3.991 9.473 ( 1.040 1.181 4.436) 4.707 9.486 ( 1.452 -0.156 5.786) 5.968 10.448 ( -0.339 2.064 -0.497) 2.150 10.486 ( -0.802 -1.931 0.060) 2.092 13.429 ( 0.032 2.737 -1.927) 3.348 13.482 ( 0.780 -2.536 -3.300) 4.234 13.906 ( -1.826 3.063 -0.977) 3.698 13.958 ( -0.945 -2.006 -1.669) 2.776 14.427 ( 0.068 13.900 0.514) 13.909 14.700 ( 1.402 -13.740 -1.534) 13.897 18.112 ( 1.162 2.256 1.429) 2.913 18.159 ( 0.266 -2.515 2.764) 3.746 18.580 ( -0.718 8.580 -1.064) 8.675 18.744 ( 0.862 -8.278 -0.809) 8.362======================= Grid point 176 (92/312) =======================q-point: (-0.50 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.617 ( -4.261 9.960 -12.353) 16.430 2.793 ( -3.361 -8.651 -7.384) 11.860 3.194 ( 7.317 10.595 0.105) 12.877 3.405 ( 1.849 -7.680 -0.732) 7.933 3.595 ( -4.944 3.736 3.991) 7.371 3.615 ( -5.196 5.403 5.482) 9.287 4.160 ( 1.234 5.049 3.744) 6.406 4.229 ( 0.258 -1.853 -1.389) 2.330 4.531 ( -1.812 -2.333 -1.600) 3.359 4.590 ( 0.550 -6.712 0.108) 6.736 4.746 ( 5.320 -0.572 2.182) 5.779 4.766 ( 0.616 -1.687 2.390) 2.990 5.434 ( -0.314 1.828 -4.844) 5.187 5.506 ( -1.939 -5.199 -4.921) 7.416 5.690 ( -0.467 1.585 -1.249) 2.071 5.750 ( -0.726 -4.696 -2.290) 5.275 7.539 ( -0.244 0.801 0.757) 1.128 7.546 ( 0.106 0.018 1.295) 1.299 8.513 ( -3.736 1.726 -10.572) 11.345 8.536 ( -1.643 -0.592 -9.424) 9.584 9.196 ( 0.459 3.236 1.411) 3.559 9.254 ( 0.208 -2.878 1.371) 3.195 9.604 ( 2.778 1.758 10.682) 11.177 9.629 ( 2.871 -0.791 11.422) 11.804 10.443 ( 0.360 1.813 -0.497) 1.914 10.476 ( -0.202 -1.739 -0.146) 1.757 13.378 ( -1.247 2.461 -5.811) 6.433 13.427 ( -0.715 -2.536 -7.450) 7.903 13.825 ( -2.712 3.411 -6.169) 7.553 13.885 ( -2.232 -2.411 -6.666) 7.431 14.466 ( 1.847 13.944 3.322) 14.453 14.733 ( 2.401 -13.313 0.980) 13.563 18.153 ( 0.476 1.995 3.485) 4.044 18.197 ( -0.488 -2.467 4.809) 5.427 18.572 ( 0.858 9.223 -0.682) 9.288 18.744 ( 0.267 -8.547 -1.159) 8.629======================= Grid point 177 (93/312) =======================q-point: (-0.40 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.417 ( -3.634 13.362 -12.137) 18.414 2.658 ( -2.113 -11.829 -8.830) 14.912 3.194 ( -2.646 10.588 -13.802) 17.596 3.346 ( -5.104 -0.316 -3.430) 6.157 3.561 ( -3.119 3.669 5.959) 7.662 3.635 ( 2.314 -3.438 4.003) 5.762 4.197 ( -2.330 2.252 1.888) 3.750 4.211 ( -0.321 0.734 0.624) 1.016 4.525 ( 1.866 0.989 1.263) 2.461 4.636 ( 2.463 -8.452 2.437) 9.135 4.800 ( -1.656 2.263 6.255) 6.855 4.867 ( 2.516 -3.867 6.516) 7.984 5.396 ( 3.691 1.337 -8.176) 9.069 5.434 ( 0.695 -2.460 -4.556) 5.224 5.686 ( 1.339 1.219 -1.876) 2.607 5.753 ( 3.722 -5.540 -3.215) 7.408 7.529 ( -0.687 0.864 -0.990) 1.483 7.545 ( -0.817 -0.781 -0.685) 1.321 8.332 ( -2.383 4.056 -13.321) 14.128 8.394 ( -1.543 -2.279 -12.574) 12.872 9.256 ( 0.950 2.689 7.499) 8.023 9.308 ( 0.637 -2.950 7.120) 7.734 9.748 ( 1.741 2.116 9.561) 9.945 9.781 ( 1.954 -1.248 9.943) 10.210 10.454 ( 1.226 1.394 -0.251) 1.873 10.476 ( 0.471 -1.045 -0.382) 1.208 13.278 ( -2.123 1.804 -7.818) 8.300 13.317 ( -1.958 -2.305 -9.413) 9.887 13.702 ( -2.123 3.729 -9.050) 10.016 13.761 ( -2.244 -2.007 -9.396) 9.866 14.550 ( 2.973 13.156 4.336) 14.167 14.799 ( 2.817 -12.255 2.203) 12.766 18.193 ( -0.186 1.573 4.158) 4.449 18.230 ( -1.223 -2.072 5.137) 5.672 18.595 ( 1.668 7.237 0.195) 7.429 18.730 ( -0.532 -6.676 -1.173) 6.799======================= Grid point 178 (94/312) =======================q-point: (-0.30 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.267 ( -0.880 16.230 -9.225) 18.689 2.555 ( -0.330 -13.641 -7.222) 15.438 2.914 ( -7.434 15.206 -18.961) 25.417 3.158 ( -6.774 -7.269 -10.602) 14.530 3.571 ( -4.306 8.983 5.966) 11.611 3.713 ( 2.504 -6.266 0.626) 6.777 4.164 ( -2.523 2.339 3.108) 4.637 4.203 ( -2.728 -1.041 3.384) 4.469 4.604 ( 3.643 2.669 2.562) 5.192 4.720 ( 3.958 -4.997 2.904) 7.005 4.828 ( -2.504 1.428 7.006) 7.576 4.947 ( -0.459 -8.088 6.081) 10.130 5.400 ( 3.982 3.436 -5.991) 7.972 5.460 ( 4.422 -2.090 -1.995) 5.282 5.706 ( 3.729 3.807 -2.796) 6.018 5.813 ( 5.436 -6.208 -2.277) 8.560 7.502 ( 0.408 0.822 -3.724) 3.836 7.519 ( 1.559 -1.041 -3.614) 4.071 8.181 ( -1.307 4.482 -10.420) 11.418 8.247 ( -2.010 -2.267 -10.350) 10.784 9.358 ( 0.538 1.350 9.381) 9.493 9.395 ( -0.217 -2.626 8.596) 8.991 9.852 ( 0.897 2.590 6.738) 7.274 9.893 ( 1.340 -1.671 6.906) 7.230 10.478 ( 0.967 0.994 0.187) 1.400 10.490 ( 1.909 -0.239 -0.516) 1.992 13.161 ( -2.196 1.014 -7.147) 7.545 13.186 ( -2.334 -1.642 -8.479) 8.947 13.583 ( -0.759 3.736 -9.443) 10.183 13.632 ( -1.596 -1.024 -9.168) 9.362 14.651 ( 3.417 11.592 3.826) 12.677 14.871 ( 2.538 -10.801 2.066) 11.286 18.225 ( -0.369 1.189 3.268) 3.497 18.257 ( -1.030 -1.929 4.688) 5.173 18.625 ( 0.907 4.208 0.503) 4.333 18.702 ( -1.423 -3.679 -0.968) 4.062======================= Grid point 179 (95/312) =======================q-point: (-0.20 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.208 ( 1.223 17.428 -3.908) 17.902 2.495 ( 0.001 -6.776 -6.619) 9.472 2.635 ( -1.687 12.854 -15.194) 19.974 2.944 ( -4.215 -11.509 -10.167) 15.925 3.500 ( -9.287 14.005 6.339) 17.960 3.719 ( -1.085 -9.548 -1.497) 9.726 4.174 ( -0.612 0.197 3.471) 3.530 4.194 ( -2.483 -1.593 4.510) 5.389 4.681 ( 2.234 4.496 1.557) 5.256 4.818 ( 1.768 -8.185 1.911) 8.589 4.850 ( 0.278 5.663 4.764) 7.405 4.994 ( 1.457 -9.551 2.229) 9.916 5.409 ( 1.347 4.956 -2.319) 5.635 5.506 ( 2.123 -4.725 -1.528) 5.401 5.768 ( 5.421 6.563 -2.708) 8.933 5.889 ( 4.009 -5.319 -0.789) 6.707 7.507 ( 5.065 3.107 -3.405) 6.848 7.560 ( 6.411 -2.407 -2.183) 7.188 8.066 ( -2.363 3.645 -7.022) 8.257 8.117 ( -3.215 -1.609 -6.492) 7.421 9.438 ( -1.163 -0.427 7.269) 7.374 9.452 ( -1.884 -2.031 6.440) 7.011 9.916 ( 0.573 3.280 3.520) 4.845 9.966 ( 0.953 -1.946 3.521) 4.135 10.492 ( 0.697 2.455 -0.241) 2.564 10.530 ( 2.263 -1.377 0.077) 2.650 13.074 ( -1.049 0.494 -3.809) 3.981 13.085 ( -1.174 -0.773 -4.434) 4.652 13.496 ( 0.610 3.714 -7.508) 8.399 13.535 ( -0.361 -0.281 -6.163) 6.180 14.738 ( 2.788 9.530 1.849) 10.100 14.924 ( 1.576 -9.255 0.664) 9.411 18.244 ( -0.275 1.325 1.899) 2.332 18.283 ( -0.776 -2.502 3.588) 4.442 18.632 ( -0.351 2.033 -0.159) 2.069 18.664 ( -1.620 -1.253 -0.519) 2.113======================= Grid point 180 (96/312) =======================q-point: (-0.10 0.45 0.10)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.217 ( 0.038 18.493 2.829) 18.708 2.436 ( 5.664 14.200 -9.771) 18.144 2.601 ( 3.341 -6.634 0.250) 7.432 2.832 ( 0.634 -11.207 -5.510) 12.504 3.401 ( -8.609 16.244 9.241) 20.576 3.676 ( -1.655 -12.873 -0.083) 12.979 4.182 ( -1.670 -0.671 1.329) 2.237 4.190 ( -1.406 -1.581 1.393) 2.533 4.711 ( 0.652 4.708 -0.947) 4.846 4.816 ( -2.836 -4.526 2.743) 6.004 4.910 ( 2.274 3.194 -1.664) 4.260 5.030 ( 1.307 -9.562 -1.138) 9.718 5.410 ( 0.518 5.191 -0.566) 5.248 5.517 ( 0.954 -5.691 -1.323) 5.920 5.836 ( 4.397 6.503 -1.695) 8.031 5.938 ( 1.726 -3.782 0.417) 4.178 7.627 ( 8.101 4.978 1.706) 9.660 7.705 ( 8.625 -3.033 2.130) 9.388 7.956 ( -2.808 3.372 -4.546) 6.319 8.002 ( -3.518 -1.475 -3.742) 5.344 9.448 ( -3.445 -1.532 2.701) 4.638 9.452 ( -2.780 -1.817 2.761) 4.319 9.936 ( -0.416 3.707 -0.094) 3.731 9.991 ( -0.268 -1.967 -0.200) 1.995 10.499 ( 0.472 3.958 -0.450) 4.011 10.565 ( 1.331 -2.675 -0.025) 2.988 13.056 ( 0.654 0.567 1.068) 1.374 13.066 ( 0.769 -0.500 1.419) 1.690 13.467 ( 2.470 4.067 -3.442) 5.873 13.507 ( 1.606 -0.223 -1.572) 2.258 14.779 ( 1.104 7.727 -1.045) 7.875 14.937 ( 0.319 -8.129 -1.630) 8.297 18.251 ( -0.496 1.267 0.497) 1.448 18.289 ( -1.445 -2.591 1.513) 3.330 18.615 ( -0.578 1.689 -0.561) 1.871 18.640 ( -0.697 -0.856 -0.076) 1.106======================= Grid point 231 (97/312) =======================q-point: ( 0.00 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.011 ( 8.024 0.000 25.899) 27.114 1.131 ( -6.850 0.000 27.653) 28.489 2.022 ( 5.214 0.000 47.444) 47.729 2.500 ( -6.685 0.000 19.208) 20.338 3.636 ( 2.870 0.000 -7.140) 7.695 3.912 ( -1.989 0.000 -12.150) 12.312 4.107 ( -1.889 0.000 0.384) 1.928 4.196 ( -7.003 0.000 -8.625) 11.110 4.686 ( -0.014 0.000 -11.611) 11.611 4.840 ( 2.874 0.000 2.433) 3.765 4.926 ( 6.995 0.000 9.230) 11.581 5.131 ( -6.066 0.000 1.727) 6.307 5.437 ( 6.294 0.000 -2.810) 6.893 5.578 ( -2.439 0.000 -3.315) 4.116 5.967 ( -1.416 0.000 2.193) 2.610 6.153 ( 4.396 0.000 -1.496) 4.644 7.263 ( -1.567 0.000 2.745) 3.161 7.470 ( 0.110 0.000 0.502) 0.514 7.849 ( 5.936 0.000 13.783) 15.007 7.964 ( 5.872 0.000 13.145) 14.397 9.288 ( -7.152 0.000 -2.030) 7.435 9.495 ( -2.582 0.000 -9.029) 9.391 9.796 ( -4.808 0.000 -5.188) 7.073 10.062 ( -4.693 0.000 -7.735) 9.047 10.302 ( -2.012 0.000 -3.304) 3.868 10.418 ( 4.603 0.000 -1.422) 4.818 12.808 ( -5.412 0.000 17.710) 18.519 13.185 ( 1.749 0.000 6.113) 6.358 13.555 ( 1.586 0.000 7.424) 7.592 13.958 ( 26.941 0.000 -3.609) 27.182 14.694 ( -5.526 0.000 -0.611) 5.560 15.129 ( 2.183 0.000 -3.851) 4.427 18.218 ( -0.220 0.000 -4.630) 4.635 18.374 ( -2.133 0.000 -5.295) 5.709 18.645 ( -6.083 0.000 2.245) 6.484 18.793 ( 15.986 0.000 -1.309) 16.040======================= Grid point 232 (98/312) =======================q-point: ( 0.10 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.383 ( 4.064 0.000 26.678) 26.986 1.444 ( 10.075 0.000 26.001) 27.885 2.543 ( -1.089 0.000 23.410) 23.436 2.668 ( 8.996 0.000 31.765) 33.014 3.559 ( 0.914 0.000 -12.867) 12.899 3.791 ( 2.557 0.000 -14.419) 14.644 3.981 ( -7.478 0.000 -8.670) 11.449 3.993 ( -6.501 0.000 -4.850) 8.111 4.684 ( 4.911 0.000 -1.048) 5.021 4.931 ( 4.619 0.000 2.583) 5.292 4.997 ( -5.240 0.000 1.120) 5.358 5.217 ( 10.403 0.000 7.201) 12.652 5.458 ( -2.011 0.000 -3.037) 3.642 5.582 ( 6.794 0.000 -2.216) 7.146 5.961 ( -0.960 0.000 1.012) 1.395 6.204 ( 2.449 0.000 -1.042) 2.661 7.283 ( 0.823 0.000 1.437) 1.656 7.438 ( -1.448 0.000 -1.833) 2.336 8.153 ( 9.298 0.000 15.590) 18.152 8.208 ( 5.488 0.000 14.672) 15.665 9.124 ( -7.858 0.000 -2.528) 8.254 9.373 ( -1.017 0.000 -8.053) 8.117 9.625 ( -6.164 0.000 -8.649) 10.621 9.884 ( -5.471 0.000 -9.077) 10.599 10.245 ( -1.454 0.000 -1.810) 2.322 10.491 ( 5.008 0.000 -1.743) 5.303 12.879 ( -6.593 0.000 18.907) 20.024 13.272 ( 0.788 0.000 6.273) 6.323 13.653 ( 0.705 0.000 7.624) 7.656 14.310 ( 17.528 0.000 -12.507) 21.533 14.572 ( -1.769 0.000 -5.296) 5.584 15.146 ( 3.018 0.000 -2.471) 3.901 18.170 ( 0.254 0.000 -4.834) 4.841 18.274 ( -2.571 0.000 -5.454) 6.029 18.523 ( -8.453 0.000 0.608) 8.475 19.056 ( 14.763 0.000 -4.386) 15.401======================= Grid point 233 (99/312) =======================q-point: ( 0.20 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.764 ( 9.065 0.000 24.355) 25.987 1.871 ( 7.847 0.000 26.524) 27.661 2.635 ( -6.227 0.000 16.031) 17.198 3.125 ( 8.568 0.000 15.248) 17.490 3.446 ( 1.087 0.000 -13.066) 13.111 3.729 ( 6.255 0.000 -13.265) 14.666 3.730 ( -6.978 0.000 -12.806) 14.584 3.922 ( -1.242 0.000 7.087) 7.195 4.771 ( 5.467 0.000 -1.621) 5.702 4.901 ( -6.200 0.000 1.586) 6.400 5.021 ( -0.749 0.000 4.793) 4.851 5.399 ( 1.776 0.000 -6.083) 6.337 5.477 ( 11.034 0.000 3.381) 11.540 5.688 ( 5.865 0.000 -1.647) 6.092 5.954 ( 0.394 0.000 -1.317) 1.375 6.224 ( 1.121 0.000 -1.427) 1.815 7.315 ( 1.271 0.000 1.594) 2.039 7.409 ( -0.088 0.000 -0.589) 0.596 8.425 ( 3.701 0.000 10.492) 11.126 8.441 ( 7.234 0.000 9.894) 12.256 8.970 ( -7.632 0.000 0.626) 7.658 9.319 ( 1.361 0.000 -2.668) 2.995 9.425 ( -5.148 0.000 -8.806) 10.201 9.696 ( -4.982 0.000 -8.608) 9.946 10.211 ( -0.695 0.000 -1.235) 1.417 10.564 ( 5.065 0.000 -2.334) 5.577 12.933 ( -8.230 0.000 19.369) 21.044 13.329 ( -0.800 0.000 4.872) 4.937 13.719 ( -0.900 0.000 5.827) 5.896 14.283 ( -6.217 0.000 -3.932) 7.356 14.616 ( 16.418 0.000 -21.774) 27.270 15.189 ( 3.289 0.000 -0.733) 3.370 18.137 ( 0.646 0.000 -3.532) 3.590 18.186 ( -1.750 0.000 -3.878) 4.255 18.366 ( -8.218 0.000 -0.304) 8.223 19.227 ( 8.738 0.000 -4.824) 9.981======================= Grid point 234 (100/312) =======================q-point: ( 0.30 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.151 ( 7.320 0.000 21.088) 22.323 2.214 ( 0.268 0.000 24.832) 24.834 2.646 ( -7.312 0.000 11.987) 14.041 3.273 ( 3.268 0.000 0.426) 3.295 3.354 ( 0.131 0.000 -6.939) 6.940 3.512 ( -0.611 0.000 -15.771) 15.783 3.773 ( 9.396 0.000 -7.428) 11.978 4.040 ( 0.531 0.000 10.960) 10.973 4.812 ( -6.005 0.000 3.512) 6.956 4.846 ( 4.851 0.000 -3.499) 5.981 4.977 ( -6.460 0.000 2.894) 7.079 5.403 ( 5.700 0.000 -9.502) 11.081 5.660 ( 6.425 0.000 0.967) 6.497 5.748 ( 2.348 0.000 -1.746) 2.926 5.951 ( 3.021 0.000 -5.862) 6.595 6.221 ( 0.775 0.000 -2.621) 2.733 7.374 ( 2.282 0.000 4.244) 4.819 7.429 ( 1.492 0.000 1.887) 2.406 8.518 ( -0.030 0.000 1.042) 1.042 8.571 ( 1.573 0.000 -1.218) 1.990 8.842 ( -7.772 0.000 1.157) 7.857 9.331 ( 0.477 0.000 1.300) 1.385 9.378 ( 3.537 0.000 4.972) 6.101 9.563 ( -1.665 0.000 -4.141) 4.463 10.194 ( -0.064 0.000 -0.909) 0.911 10.624 ( 4.335 0.000 -3.286) 5.440 12.958 ( -9.869 0.000 19.371) 21.740 13.333 ( -2.609 0.000 2.326) 3.496 13.728 ( -2.727 0.000 2.675) 3.820 14.125 ( -6.407 0.000 -3.519) 7.310 14.642 ( 13.088 0.000 -28.540) 31.397 15.243 ( 2.536 0.000 0.481) 2.581 18.123 ( -0.492 0.000 -0.023) 0.493 18.145 ( 0.126 0.000 -1.041) 1.048 18.243 ( -3.679 0.000 -1.038) 3.822 19.283 ( 2.593 0.000 -4.698) 5.366======================= Grid point 235 (101/312) =======================q-point: ( 0.40 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.301 ( -14.224 0.000 17.589) 22.620 2.366 ( -4.819 0.000 14.009) 14.815 2.630 ( -6.057 0.000 11.203) 12.735 3.371 ( 5.656 0.000 2.837) 6.328 3.373 ( 7.499 0.000 0.055) 7.499 3.404 ( 5.879 0.000 -16.391) 17.413 3.900 ( 8.713 0.000 -3.429) 9.363 4.058 ( -5.838 0.000 3.673) 6.897 4.761 ( -4.801 0.000 6.495) 8.077 4.807 ( -5.553 0.000 -1.083) 5.658 4.961 ( 4.912 0.000 -3.508) 6.036 5.386 ( 4.070 0.000 -12.291) 12.947 5.734 ( 0.547 0.000 1.390) 1.494 5.740 ( -1.522 0.000 -1.289) 1.995 5.943 ( 5.519 0.000 -11.520) 12.774 6.200 ( 0.587 0.000 -4.151) 4.192 7.479 ( 3.452 0.000 5.526) 6.516 7.496 ( 2.360 0.000 4.363) 4.960 8.410 ( -7.611 0.000 -9.335) 12.045 8.472 ( -4.943 0.000 -11.264) 12.301 8.790 ( -0.242 0.000 7.322) 7.326 9.441 ( 3.895 0.000 9.374) 10.151 9.519 ( 4.417 0.000 7.567) 8.762 9.575 ( 2.797 0.000 3.769) 4.693 10.190 ( 0.388 0.000 -0.313) 0.499 10.652 ( 2.771 0.000 -4.490) 5.276 12.956 ( -10.923 0.000 19.023) 21.936 13.281 ( -3.927 0.000 -0.513) 3.961 13.674 ( -4.204 0.000 -0.508) 4.235 13.984 ( -4.177 0.000 -5.876) 7.209 14.541 ( 8.817 0.000 -31.484) 32.696 15.281 ( 0.933 0.000 0.434) 1.030 18.121 ( -0.988 0.000 3.661) 3.792 18.171 ( 2.242 0.000 1.773) 2.858 18.223 ( 1.856 0.000 -0.537) 1.932 19.234 ( -2.431 0.000 -5.314) 5.843======================= Grid point 236 (102/312) =======================q-point: (-0.50 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.094 ( -22.561 0.000 12.462) 25.774 2.258 ( -17.253 0.000 8.975) 19.448 2.640 ( -6.294 0.000 12.637) 14.118 3.353 ( 9.138 0.000 -21.473) 23.337 3.391 ( -7.265 0.000 -10.900) 13.099 3.636 ( 10.482 0.000 15.580) 18.778 3.903 ( -1.451 0.000 4.536) 4.762 4.121 ( 9.382 0.000 0.391) 9.390 4.706 ( -3.078 0.000 -2.509) 3.971 4.771 ( -2.702 0.000 9.580) 9.954 5.017 ( 6.086 0.000 -6.715) 9.063 5.332 ( 3.027 0.000 -9.936) 10.387 5.672 ( -4.216 0.000 -1.522) 4.483 5.702 ( -3.818 0.000 -2.185) 4.399 5.944 ( 6.715 0.000 -10.314) 12.307 6.160 ( -0.012 0.000 -4.986) 4.986 7.578 ( 2.839 0.000 0.893) 2.976 7.591 ( 2.072 0.000 6.056) 6.401 8.140 ( -10.153 0.000 -8.242) 13.077 8.206 ( -8.606 0.000 -16.011) 18.177 8.941 ( 4.913 0.000 11.785) 12.768 9.613 ( 3.961 0.000 9.756) 10.529 9.668 ( 2.458 0.000 7.951) 8.323 9.709 ( 6.025 0.000 6.620) 8.951 10.205 ( 0.970 0.000 1.140) 1.497 10.635 ( 0.867 0.000 -5.580) 5.647 12.932 ( -11.512 0.000 17.720) 21.131 13.190 ( -4.073 0.000 -2.551) 4.806 13.575 ( -4.646 0.000 -2.404) 5.232 13.832 ( -2.742 0.000 -14.386) 14.645 14.388 ( 6.344 0.000 -24.490) 25.298 15.284 ( -0.465 0.000 -0.674) 0.819 18.170 ( 2.079 0.000 3.419) 4.001 18.253 ( 3.642 0.000 3.226) 4.865 18.283 ( 2.976 0.000 3.351) 4.482 19.095 ( -6.272 0.000 -6.438) 8.988======================= Grid point 237 (103/312) =======================q-point: (-0.40 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.773 ( -25.248 0.000 13.095) 28.442 1.973 ( -22.842 0.000 9.561) 24.763 2.634 ( -8.753 0.000 13.645) 16.212 2.894 ( -27.328 0.000 -17.084) 32.228 3.309 ( 8.188 0.000 -19.111) 20.791 3.997 ( 10.504 0.000 16.756) 19.776 4.031 ( 6.174 0.000 6.184) 8.738 4.303 ( 10.328 0.000 -1.323) 10.412 4.634 ( -1.793 0.000 -4.809) 5.132 4.836 ( -0.893 0.000 8.559) 8.605 5.040 ( 6.873 0.000 -12.291) 14.083 5.339 ( 4.518 0.000 -1.503) 4.762 5.565 ( -5.277 0.000 -1.951) 5.626 5.567 ( -5.829 0.000 -5.833) 8.247 5.977 ( 5.345 0.000 -6.527) 8.436 6.110 ( -0.028 0.000 -4.569) 4.569 7.563 ( -0.926 0.000 -6.825) 6.887 7.670 ( -0.661 0.000 4.761) 4.806 7.880 ( -8.488 0.000 -15.104) 17.326 7.933 ( -7.240 0.000 -1.340) 7.363 9.158 ( 5.054 0.000 12.057) 13.073 9.757 ( 0.091 0.000 5.489) 5.489 9.764 ( 2.931 0.000 7.807) 8.339 9.897 ( 6.596 0.000 6.740) 9.431 10.256 ( 2.256 0.000 3.428) 4.104 10.577 ( -0.719 0.000 -6.281) 6.322 12.880 ( -11.834 0.000 14.817) 18.962 13.096 ( -2.898 0.000 -2.878) 4.084 13.473 ( -3.658 0.000 -2.314) 4.328 13.570 ( -4.528 0.000 -24.366) 24.783 14.350 ( 7.081 0.000 -7.659) 10.431 15.256 ( -0.921 0.000 -2.138) 2.328 18.240 ( 2.837 0.000 0.793) 2.946 18.354 ( 3.841 0.000 2.876) 4.798 18.398 ( 3.599 0.000 7.470) 8.292 18.888 ( -8.723 0.000 -6.976) 11.169======================= Grid point 238 (104/312) =======================q-point: (-0.30 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.459 ( -24.540 0.000 16.536) 29.591 1.637 ( -25.324 0.000 12.684) 28.323 2.156 ( -35.515 0.000 -10.958) 37.167 2.591 ( -11.361 0.000 14.537) 18.449 3.299 ( 8.385 0.000 -12.574) 15.113 4.192 ( 5.685 0.000 3.238) 6.543 4.323 ( 7.843 0.000 14.811) 16.759 4.462 ( 9.229 0.000 -2.842) 9.656 4.515 ( -4.722 0.000 -7.408) 8.785 4.842 ( -2.558 0.000 -5.334) 5.916 5.043 ( 8.005 0.000 -14.945) 16.954 5.412 ( -6.928 0.000 0.551) 6.950 5.432 ( 4.381 0.000 -10.662) 11.527 5.479 ( -2.477 0.000 12.347) 12.593 5.992 ( 2.221 0.000 -4.730) 5.226 6.074 ( 0.852 0.000 -4.272) 4.356 7.492 ( -0.479 0.000 -1.053) 1.157 7.518 ( -7.937 0.000 -11.034) 13.592 7.764 ( -1.567 0.000 3.408) 3.751 7.784 ( -7.164 0.000 -5.493) 9.028 9.338 ( 2.330 0.000 10.016) 10.284 9.778 ( -1.558 0.000 1.588) 2.225 9.869 ( 1.409 0.000 5.310) 5.493 10.067 ( 5.376 0.000 5.117) 7.422 10.351 ( 3.897 0.000 3.268) 5.086 10.491 ( -1.608 0.000 -6.661) 6.853 12.786 ( -11.580 0.000 9.653) 15.076 13.039 ( -0.913 0.000 -1.244) 1.543 13.267 ( -5.701 0.000 -12.430) 13.675 13.408 ( -1.718 0.000 -0.413) 1.767 14.470 ( 7.931 0.000 2.226) 8.237 15.214 ( -0.572 0.000 -3.449) 3.496 18.282 ( 1.701 0.000 -0.701) 1.840 18.438 ( 2.822 0.000 1.282) 3.100 18.541 ( 3.175 0.000 7.985) 8.593 18.661 ( -8.539 0.000 -5.503) 10.159======================= Grid point 239 (105/312) =======================q-point: (-0.20 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.152 ( -26.266 0.000 6.422) 27.040 1.320 ( -24.898 0.000 17.776) 30.592 1.546 ( -28.806 0.000 23.027) 36.879 2.520 ( -12.223 0.000 15.646) 19.854 3.384 ( 9.556 0.000 -3.399) 10.142 4.272 ( 2.387 0.000 -4.876) 5.429 4.330 ( -5.519 0.000 -9.359) 10.865 4.572 ( 4.323 0.000 12.875) 13.581 4.586 ( 5.229 0.000 -3.710) 6.412 4.621 ( -6.868 0.000 -11.219) 13.154 5.010 ( 4.009 0.000 -15.985) 16.481 5.333 ( -7.300 0.000 7.089) 10.176 5.364 ( 2.018 0.000 -7.802) 8.059 5.618 ( 1.902 0.000 7.904) 8.129 5.976 ( -0.148 0.000 -1.312) 1.320 6.056 ( 2.541 0.000 -5.268) 5.848 7.343 ( -2.115 0.000 -3.042) 3.705 7.522 ( -4.140 0.000 -2.844) 5.022 7.583 ( -2.216 0.000 2.006) 2.989 7.757 ( -3.110 0.000 3.495) 4.679 9.429 ( -1.436 0.000 6.328) 6.489 9.732 ( -2.731 0.000 -2.852) 3.949 9.916 ( -0.436 0.000 2.404) 2.443 10.187 ( 3.330 0.000 2.508) 4.169 10.395 ( -1.292 0.000 -6.688) 6.812 10.420 ( 2.402 0.000 -2.957) 3.810 12.695 ( -7.759 0.000 11.781) 14.106 13.041 ( 0.920 0.000 1.613) 1.857 13.199 ( 1.255 0.000 8.286) 8.381 13.405 ( 0.215 0.000 2.513) 2.522 14.641 ( 5.818 0.000 4.739) 7.504 15.171 ( 0.208 0.000 -4.298) 4.304 18.289 ( 0.503 0.000 -2.020) 2.082 18.474 ( -0.594 0.000 0.962) 1.131 18.510 ( -1.560 0.000 -3.391) 3.732 18.653 ( 0.882 0.000 6.497) 6.557======================= Grid point 240 (106/312) =======================q-point: (-0.10 0.00 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.797 ( -14.780 0.000 18.093) 23.362 1.114 ( -19.002 0.000 24.105) 30.694 1.583 ( -9.535 0.000 46.397) 47.367 2.473 ( -10.145 0.000 17.411) 20.151 3.554 ( 8.467 0.000 1.131) 8.542 4.122 ( -5.995 0.000 -14.298) 15.504 4.163 ( -3.387 0.000 -5.962) 6.857 4.383 ( -5.684 0.000 -6.176) 8.393 4.732 ( 5.419 0.000 6.443) 8.419 4.735 ( 1.680 0.000 8.815) 8.974 4.870 ( -0.443 0.000 -17.398) 17.404 5.243 ( -8.197 0.000 3.613) 8.958 5.368 ( 5.643 0.000 -6.209) 8.390 5.650 ( -2.678 0.000 0.565) 2.737 5.969 ( -1.008 0.000 1.785) 2.050 6.084 ( 5.173 0.000 -3.367) 6.172 7.326 ( -7.330 0.000 -0.886) 7.384 7.385 ( 3.893 0.000 5.241) 6.529 7.736 ( -2.343 0.000 4.760) 5.305 7.741 ( 5.716 0.000 10.415) 11.880 9.407 ( -5.019 0.000 1.483) 5.233 9.629 ( -3.143 0.000 -6.827) 7.516 9.896 ( -2.614 0.000 -1.152) 2.857 10.194 ( -2.497 0.000 -4.177) 4.866 10.359 ( 3.278 0.000 -2.649) 4.215 10.379 ( -1.261 0.000 -5.543) 5.684 12.733 ( -4.705 0.000 16.061) 16.736 13.098 ( 1.854 0.000 4.404) 4.778 13.461 ( 1.426 0.000 5.460) 5.643 13.482 ( 18.205 0.000 10.576) 21.054 14.738 ( 0.209 0.000 2.505) 2.513 15.140 ( 1.179 0.000 -4.473) 4.626 18.263 ( -0.193 0.000 -3.484) 3.490 18.445 ( -1.000 0.000 -3.057) 3.216 18.559 ( 7.997 0.000 0.905) 8.048 18.692 ( -2.556 0.000 4.361) 5.055======================= Grid point 241 (107/312) =======================q-point: ( 0.00 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.060 ( 2.651 3.557 24.615) 25.012 1.212 ( 3.048 10.644 25.650) 27.937 2.184 ( 1.811 15.323 42.957) 45.644 2.563 ( -6.206 6.633 18.846) 20.921 3.631 ( 2.655 -0.760 -5.612) 6.254 3.936 ( -1.933 2.259 -12.196) 12.553 4.089 ( -2.612 -0.963 -6.386) 6.966 4.231 ( -4.120 1.780 -5.152) 6.833 4.587 ( 2.283 -8.959 -8.776) 12.747 4.765 ( 2.142 -4.691 0.819) 5.221 4.992 ( 3.419 5.197 4.905) 7.922 5.230 ( -2.146 5.774 0.604) 6.189 5.453 ( 7.019 1.860 -1.717) 7.461 5.600 ( -4.207 3.110 -2.716) 5.894 5.945 ( -1.973 -2.244 2.419) 3.845 6.088 ( 4.220 -6.535 -0.955) 7.838 7.301 ( -1.753 3.771 2.138) 4.675 7.524 ( 0.226 5.063 -1.764) 5.366 7.853 ( 6.675 0.751 13.743) 15.297 7.998 ( 5.720 3.143 12.846) 14.409 9.310 ( -7.243 2.202 -2.895) 8.105 9.498 ( -2.726 0.227 -9.079) 9.482 9.805 ( -4.711 0.827 -5.006) 6.923 9.983 ( -4.121 -6.917 -5.425) 9.709 10.300 ( -0.348 -0.311 -4.324) 4.349 10.463 ( 2.338 3.880 -1.161) 4.676 12.844 ( -4.258 3.764 15.310) 16.331 13.193 ( 1.791 0.769 6.391) 6.681 13.559 ( 1.915 0.423 7.144) 7.408 13.857 ( 21.868 -9.036 2.532) 23.797 14.675 ( -4.881 -1.786 -0.903) 5.275 15.133 ( 1.822 0.124 -3.948) 4.350 18.220 ( -0.348 -0.062 -5.317) 5.329 18.367 ( -3.002 -0.627 -4.902) 5.783 18.653 ( -5.185 0.747 2.110) 5.647 18.717 ( 13.017 -6.453 1.710) 14.629======================= Grid point 242 (108/312) =======================q-point: ( 0.10 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.389 ( 6.658 2.690 24.327) 25.364 1.569 ( 8.080 10.764 24.107) 27.610 2.600 ( -2.030 5.737 21.737) 22.573 2.768 ( 8.484 10.195 31.669) 34.334 3.551 ( 0.074 -0.602 -12.481) 12.496 3.814 ( 2.351 2.110 -14.057) 14.407 3.939 ( -5.006 -0.975 -7.847) 9.359 4.064 ( -6.984 3.254 -7.660) 10.865 4.625 ( 4.165 -9.003 1.948) 10.110 4.795 ( 1.993 -3.535 -2.124) 4.580 5.095 ( 2.048 2.035 2.089) 3.563 5.280 ( 6.469 5.092 4.067) 9.182 5.472 ( -4.634 2.625 -0.902) 5.402 5.606 ( 7.901 2.601 -1.628) 8.476 5.930 ( -1.565 -3.206 1.117) 3.738 6.144 ( 2.505 -5.887 -0.221) 6.402 7.309 ( 0.411 2.565 1.220) 2.869 7.471 ( -1.763 3.058 -3.192) 4.760 8.179 ( 10.362 2.581 16.122) 19.337 8.230 ( 4.861 2.317 13.700) 14.720 9.138 ( -7.844 1.321 -3.101) 8.537 9.373 ( -1.169 -0.071 -8.118) 8.202 9.637 ( -6.015 1.163 -8.541) 10.511 9.833 ( -5.153 -4.755 -7.542) 10.298 10.256 ( -0.664 0.948 -2.465) 2.723 10.508 ( 3.747 1.638 -1.386) 4.317 12.915 ( -5.174 3.651 16.247) 17.437 13.283 ( 0.827 1.135 6.554) 6.703 13.660 ( 1.003 0.765 7.388) 7.495 14.202 ( 16.415 -10.186 -7.227) 20.626 14.555 ( -3.856 -1.433 -3.821) 5.614 15.142 ( 2.894 -0.594 -2.887) 4.131 18.165 ( 0.272 -0.913 -5.410) 5.493 18.257 ( -3.346 -1.167 -4.891) 6.040 18.545 ( -7.608 2.028 0.606) 7.897 18.971 ( 13.040 -7.645 -0.796) 15.137======================= Grid point 243 (109/312) =======================q-point: ( 0.20 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.764 ( 8.692 1.382 21.813) 23.522 1.961 ( 7.983 8.040 25.169) 27.602 2.696 ( -5.660 6.218 15.849) 17.941 3.187 ( 6.600 6.510 14.698) 17.377 3.430 ( 1.652 -1.458 -13.546) 13.724 3.726 ( -5.297 -0.076 -8.974) 10.421 3.773 ( 5.085 3.815 -14.894) 16.194 3.949 ( -1.415 2.662 5.168) 5.983 4.686 ( -1.291 -12.746 3.139) 13.190 4.813 ( 3.561 0.219 -3.574) 5.050 5.128 ( -1.598 4.272 2.679) 5.290 5.385 ( -0.296 -1.223 -4.147) 4.333 5.479 ( 8.188 1.292 3.760) 9.103 5.725 ( 6.258 3.320 -2.011) 7.364 5.911 ( -0.305 -4.408 -1.340) 4.618 6.176 ( 1.470 -4.657 -0.430) 4.902 7.334 ( 1.088 1.934 1.434) 2.642 7.427 ( -0.375 1.711 -1.124) 2.081 8.419 ( 2.853 0.284 8.756) 9.213 8.491 ( 7.881 4.123 10.839) 14.022 8.982 ( -7.336 1.190 0.245) 7.436 9.317 ( 1.342 -0.148 -2.603) 2.932 9.441 ( -4.991 1.578 -8.477) 9.963 9.661 ( -4.862 -3.413 -7.698) 9.724 10.228 ( -0.273 1.664 -1.543) 2.286 10.566 ( 4.224 0.197 -1.901) 4.636 12.968 ( -6.643 3.624 16.371) 18.035 13.343 ( -0.816 1.401 5.089) 5.341 13.730 ( -0.619 1.073 5.593) 5.729 14.246 ( -3.368 -4.277 -4.490) 7.057 14.542 ( 11.242 -6.370 -15.396) 20.099 15.180 ( 3.294 -1.200 -1.306) 3.741 18.125 ( 0.481 -2.535 -4.403) 5.104 18.164 ( -2.066 -0.189 -2.945) 3.603 18.404 ( -7.464 3.194 -0.224) 8.122 19.154 ( 8.362 -6.785 -2.207) 10.992======================= Grid point 244 (110/312) =======================q-point: ( 0.30 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.085 ( 3.333 -2.313 17.376) 17.843 2.339 ( 5.567 8.372 24.987) 26.934 2.712 ( -6.820 6.785 11.150) 14.726 3.265 ( -0.413 0.072 -3.610) 3.635 3.386 ( 3.448 2.698 -4.275) 6.119 3.518 ( -4.077 0.240 -10.157) 10.948 3.811 ( 10.298 3.923 -9.675) 14.664 4.058 ( 1.139 2.018 9.497) 9.776 4.660 ( -3.745 -12.210 2.812) 13.078 4.853 ( 4.696 0.303 -4.467) 6.488 5.062 ( -7.527 4.979 2.836) 9.460 5.374 ( 3.951 -2.609 -7.021) 8.469 5.626 ( 5.315 -2.409 0.210) 5.839 5.780 ( 1.212 1.988 -1.088) 2.570 5.897 ( 3.051 -5.122 -6.458) 8.789 6.192 ( 1.481 -2.994 -1.858) 3.822 7.386 ( 1.941 1.217 3.733) 4.380 7.440 ( 1.388 1.109 1.792) 2.524 8.489 ( 0.228 -1.536 -0.074) 1.554 8.624 ( -0.006 3.827 -1.217) 4.016 8.863 ( -6.432 2.148 1.106) 6.871 9.344 ( 0.552 1.278 1.914) 2.367 9.388 ( 3.519 0.945 4.861) 6.074 9.538 ( -1.506 -2.389 -3.304) 4.346 10.214 ( 0.183 2.019 -1.132) 2.322 10.617 ( 3.681 -0.696 -2.772) 4.661 12.992 ( -8.141 3.517 16.009) 18.301 13.348 ( -2.682 1.509 2.533) 3.986 13.741 ( -2.503 1.283 2.354) 3.668 14.111 ( -5.628 -1.589 -3.791) 6.969 14.557 ( 10.305 -7.814 -23.195) 26.557 15.230 ( 2.670 -1.646 -0.095) 3.138 18.096 ( -0.047 -3.532 -1.388) 3.795 18.135 ( 0.255 1.139 -0.307) 1.207 18.291 ( -4.039 3.582 -0.211) 5.403 19.230 ( 2.885 -5.070 -3.174) 6.641======================= Grid point 245 (111/312) =======================q-point: ( 0.40 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.161 ( -10.137 -5.835 9.888) 15.316 2.582 ( -6.147 13.013 19.354) 24.119 2.701 ( -5.074 7.664 10.647) 14.065 3.235 ( 4.322 -6.165 -6.223) 9.768 3.395 ( 0.554 -0.817 -3.237) 3.384 3.493 ( 8.367 4.468 -0.490) 9.498 3.926 ( 8.534 2.735 -5.475) 10.502 4.081 ( -3.366 2.588 1.102) 4.386 4.628 ( -2.633 -10.109 3.204) 10.927 4.858 ( -2.207 1.859 -1.538) 3.270 4.987 ( 0.122 1.918 -0.544) 1.997 5.352 ( 2.738 -3.255 -10.120) 10.977 5.683 ( 1.159 -3.210 -0.396) 3.436 5.752 ( -3.182 -1.308 -0.190) 3.446 5.888 ( 5.047 -4.457 -10.726) 12.665 6.191 ( 1.522 -1.609 -4.222) 4.768 7.475 ( 2.600 -0.104 5.125) 5.747 7.506 ( 2.465 0.799 4.075) 4.829 8.414 ( -5.584 0.332 -8.791) 10.420 8.465 ( -6.732 -0.470 -11.373) 13.225 8.832 ( 0.024 4.082 6.190) 7.415 9.440 ( 3.138 -0.079 8.149) 8.733 9.536 ( 3.864 0.957 8.962) 9.806 9.567 ( 3.843 0.019 4.446) 5.877 10.213 ( 0.559 2.145 -0.566) 2.288 10.640 ( 2.258 -1.221 -3.900) 4.669 12.988 ( -9.016 3.312 15.280) 18.049 13.297 ( -4.079 1.558 -0.170) 4.370 13.686 ( -4.071 1.233 -0.983) 4.366 13.975 ( -3.905 -1.112 -6.650) 7.792 14.465 ( 6.626 -7.035 -25.778) 27.530 15.266 ( 1.244 -1.738 -0.018) 2.138 18.106 ( 1.194 -1.783 1.414) 2.570 18.160 ( 1.345 0.439 2.664) 3.016 18.264 ( 0.506 2.881 0.931) 3.069 19.200 ( -1.927 -3.316 -4.439) 5.866======================= Grid point 246 (112/312) =======================q-point: (-0.50 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.952 ( -19.448 -7.050 5.900) 21.511 2.498 ( -18.441 16.887 12.966) 28.167 2.704 ( -6.166 6.842 10.849) 14.232 3.239 ( 3.399 -7.668 -13.639) 16.011 3.391 ( -1.600 -2.860 -8.445) 9.058 3.687 ( 8.130 4.232 10.400) 13.863 3.923 ( -0.734 1.928 3.379) 3.959 4.138 ( 9.959 1.845 -4.447) 11.062 4.632 ( 0.356 -6.546 1.546) 6.736 4.798 ( -3.795 1.969 3.796) 5.717 5.021 ( 4.539 -0.237 -3.995) 6.051 5.293 ( 1.770 -3.732 -8.751) 9.677 5.653 ( -3.229 -1.887 -1.777) 4.141 5.668 ( -4.079 -3.589 -3.248) 6.330 5.888 ( 5.335 -4.494 -7.722) 10.406 6.165 ( 1.067 -0.609 -5.720) 5.850 7.558 ( 1.782 -1.699 1.862) 3.086 7.596 ( 2.083 0.258 4.864) 5.297 8.114 ( -11.700 -1.061 -12.814) 17.385 8.252 ( -5.203 3.005 -11.837) 13.275 8.969 ( 4.402 2.912 11.317) 12.488 9.592 ( 3.863 -1.795 9.087) 10.036 9.673 ( 1.756 0.095 8.551) 8.730 9.730 ( 6.082 2.304 7.236) 9.729 10.228 ( 1.141 2.135 0.778) 2.543 10.621 ( 0.477 -1.422 -4.947) 5.169 12.963 ( -9.343 3.180 13.794) 16.961 13.205 ( -4.441 1.551 -2.006) 5.114 13.584 ( -4.555 0.940 -2.945) 5.505 13.810 ( -3.130 -2.499 -15.919) 16.415 14.340 ( 4.909 -4.163 -17.893) 19.015 15.272 ( -0.024 -1.362 -0.929) 1.649 18.163 ( 3.105 -0.702 1.627) 3.575 18.236 ( 2.768 -0.515 4.798) 5.563 18.316 ( 2.451 2.356 3.510) 4.887 19.078 ( -5.721 -1.698 -5.827) 8.341======================= Grid point 247 (113/312) =======================q-point: (-0.40 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.615 ( -23.520 -8.000 7.219) 25.871 2.219 ( -23.389 16.642 9.530) 30.247 2.686 ( -8.427 5.061 11.122) 14.844 2.906 ( -23.462 2.248 -12.486) 26.672 3.272 ( 5.387 -3.747 -15.203) 16.559 3.990 ( 8.737 -0.241 15.075) 17.425 4.050 ( 7.030 1.405 5.734) 9.180 4.271 ( 9.993 -3.452 -6.214) 12.263 4.643 ( 1.073 0.762 -4.322) 4.518 4.811 ( -1.201 -1.753 6.726) 7.054 5.050 ( 4.983 0.148 -7.941) 9.376 5.271 ( 2.017 -5.944 -2.568) 6.782 5.549 ( -6.132 -1.636 0.864) 6.405 5.560 ( -1.695 -1.252 -7.406) 7.700 5.922 ( 4.225 -4.363 -4.160) 7.361 6.123 ( 0.597 -0.036 -5.496) 5.529 7.554 ( -0.129 -1.161 -5.243) 5.371 7.631 ( -4.976 -3.503 0.136) 6.087 7.818 ( -5.763 -0.651 -6.909) 9.021 8.065 ( -4.732 7.220 -7.257) 11.277 9.176 ( 4.799 2.020 12.042) 13.119 9.743 ( 2.848 -2.149 8.083) 8.836 9.762 ( 0.234 0.607 5.854) 5.890 9.906 ( 5.502 0.942 6.473) 8.547 10.276 ( 2.361 2.003 2.895) 4.239 10.563 ( -1.000 -1.406 -5.686) 5.942 12.917 ( -9.559 3.685 11.669) 15.528 13.107 ( -3.487 1.164 -2.560) 4.480 13.477 ( -3.566 0.427 -3.444) 4.976 13.535 ( -5.056 -3.375 -22.530) 23.336 14.334 ( 6.348 -1.237 -4.274) 7.752 15.251 ( -0.475 -0.653 -2.178) 2.323 18.234 ( 3.432 -0.717 -0.112) 3.508 18.344 ( 3.246 -0.684 5.026) 6.022 18.414 ( 3.058 1.493 5.962) 6.865 18.888 ( -8.114 -0.123 -6.452) 10.367======================= Grid point 248 (114/312) =======================q-point: (-0.30 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.268 ( -24.382 -9.404 12.960) 29.170 1.816 ( -26.994 8.415 -0.307) 28.277 2.306 ( -29.641 15.494 2.243) 33.521 2.651 ( -11.138 6.461 13.521) 18.671 3.260 ( 7.411 -4.002 -10.514) 13.471 4.184 ( 4.664 -0.518 3.568) 5.895 4.310 ( 8.070 -1.533 12.356) 14.837 4.385 ( 9.061 -7.687 -5.863) 13.251 4.559 ( -3.169 4.083 -8.341) 9.813 4.806 ( -2.709 -3.087 -5.222) 6.643 5.060 ( 6.012 1.193 -10.017) 11.743 5.286 ( -0.430 -6.919 1.772) 7.155 5.451 ( -3.494 -0.295 -3.244) 4.776 5.536 ( 2.016 2.272 4.224) 5.203 5.944 ( 2.034 -3.898 -3.250) 5.468 6.082 ( 0.138 -0.260 -4.343) 4.353 7.397 ( -8.206 -5.408 -8.189) 12.793 7.527 ( 0.398 0.126 -0.929) 1.018 7.775 ( -2.006 1.406 1.503) 2.874 7.914 ( -4.454 8.961 -7.400) 12.446 9.356 ( 2.565 1.995 10.046) 10.558 9.786 ( -1.490 0.641 1.833) 2.448 9.855 ( 1.394 -1.510 5.944) 6.289 10.047 ( 3.957 -1.693 4.277) 6.068 10.364 ( 3.219 1.461 3.064) 4.678 10.481 ( -1.257 -1.013 -5.949) 6.164 12.836 ( -9.932 5.106 7.914) 13.687 13.042 ( -1.135 0.288 -1.441) 1.857 13.245 ( -5.265 -2.193 -11.181) 12.552 13.412 ( -1.675 0.464 -0.707) 1.877 14.462 ( 7.453 -0.723 2.834) 8.006 15.217 ( -0.252 0.140 -3.267) 3.280 18.281 ( 2.527 -0.514 -1.398) 2.933 18.432 ( 1.851 -0.357 2.575) 3.191 18.531 ( 2.242 -0.650 6.183) 6.609 18.680 ( -7.391 1.638 -4.465) 8.789======================= Grid point 249 (115/312) =======================q-point: (-0.20 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.020 ( -21.044 -10.741 23.163) 33.087 1.252 ( -28.793 4.904 -2.440) 29.310 1.939 ( -24.256 26.542 23.296) 42.843 2.578 ( -11.795 6.260 15.005) 20.086 3.350 ( 9.324 -3.576 -2.252) 10.237 4.252 ( 2.612 -1.638 -4.594) 5.533 4.370 ( -4.983 2.710 -10.769) 12.172 4.477 ( 3.888 -7.946 -2.927) 9.318 4.541 ( 2.926 -3.988 5.738) 7.576 4.630 ( -2.654 0.498 -7.279) 7.764 5.046 ( 2.370 3.207 -10.117) 10.875 5.298 ( -0.969 -2.877 2.730) 4.083 5.375 ( -0.466 0.496 -4.340) 4.393 5.651 ( 2.331 2.117 6.731) 7.431 5.941 ( 0.681 -3.347 -1.414) 3.697 6.041 ( 0.200 -1.491 -4.406) 4.656 7.253 ( -1.894 -3.847 0.093) 4.289 7.592 ( 2.534 1.290 5.363) 6.071 7.660 ( -5.672 6.696 -6.727) 11.057 7.806 ( -2.737 5.803 -0.799) 6.466 9.454 ( -0.837 2.600 5.981) 6.575 9.741 ( -2.817 0.826 -2.738) 4.014 9.910 ( -0.408 -0.931 3.199) 3.356 10.123 ( 1.120 -5.637 0.575) 5.776 10.377 ( -0.618 -0.652 -4.362) 4.453 10.458 ( 2.322 2.376 -2.124) 3.943 12.750 ( -6.864 5.521 9.386) 12.872 13.044 ( 1.096 0.291 1.656) 2.007 13.181 ( 0.799 -1.654 7.498) 7.720 13.408 ( 0.327 0.387 2.340) 2.395 14.625 ( 5.590 -1.527 4.105) 7.101 15.181 ( 0.241 0.747 -3.923) 4.000 18.301 ( 1.821 0.500 -2.894) 3.456 18.454 ( -1.147 -1.584 1.040) 2.214 18.511 ( -2.517 0.318 -2.414) 3.502 18.656 ( 0.594 0.269 5.608) 5.646======================= Grid point 250 (116/312) =======================q-point: (-0.10 0.09 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.893 ( -12.234 4.632 17.955) 22.215 1.005 ( -10.335 1.371 27.934) 29.816 1.884 ( -13.329 23.785 36.960) 45.929 2.534 ( -9.696 6.424 16.803) 20.436 3.530 ( 8.758 -2.576 2.203) 9.391 4.136 ( -5.560 1.459 -13.120) 14.324 4.191 ( -2.102 1.666 -8.345) 8.765 4.363 ( -3.771 -2.030 -7.272) 8.439 4.602 ( 3.012 -8.095 0.161) 8.639 4.708 ( 3.021 -3.766 2.562) 5.466 4.964 ( -0.662 6.866 -5.509) 8.828 5.280 ( -3.692 1.650 1.846) 4.446 5.369 ( 5.501 0.359 -5.471) 7.767 5.688 ( -2.962 3.659 0.923) 4.797 5.951 ( -0.876 -1.887 2.368) 3.152 6.027 ( 3.728 -5.528 -3.723) 7.636 7.303 ( 0.313 0.840 5.737) 5.806 7.491 ( -1.258 6.783 -1.745) 7.116 7.754 ( -2.116 1.872 3.953) 4.859 7.781 ( 5.416 3.854 8.031) 10.425 9.436 ( -4.681 2.934 0.727) 5.573 9.635 ( -3.324 0.547 -6.848) 7.631 9.898 ( -2.511 0.099 -0.478) 2.558 10.090 ( -2.646 -8.304 -3.379) 9.348 10.340 ( 1.114 -0.945 -4.796) 5.014 10.454 ( 0.560 4.832 -2.416) 5.431 12.775 ( -3.999 4.373 13.638) 14.870 13.103 ( 1.860 0.497 4.524) 4.917 13.422 ( 13.033 -4.821 11.047) 17.752 13.470 ( 2.911 0.373 6.409) 7.049 14.715 ( 0.527 -2.204 1.786) 2.885 15.150 ( 0.808 0.765 -4.173) 4.319 18.277 ( -0.259 0.965 -4.609) 4.716 18.453 ( -1.697 0.537 -3.332) 3.778 18.505 ( 6.139 -4.451 2.607) 8.019 18.693 ( -2.168 -0.007 4.137) 4.671======================= Grid point 251 (117/312) =======================q-point: ( 0.00 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.189 ( 5.176 10.995 19.202) 22.725 1.508 ( 6.446 18.633 19.709) 27.877 2.523 ( -2.416 17.574 32.613) 37.126 2.762 ( -4.929 14.679 20.849) 25.970 3.600 ( 2.771 -2.732 0.195) 3.896 3.985 ( -2.049 2.536 -12.351) 12.774 4.060 ( 0.700 -3.593 -11.824) 12.378 4.235 ( -2.257 -0.788 -5.213) 5.735 4.403 ( -0.969 -8.413 -8.079) 11.704 4.702 ( 4.560 -1.996 -0.638) 5.018 5.077 ( 0.415 2.815 -0.051) 2.846 5.256 ( -0.031 -2.519 0.262) 2.533 5.509 ( 8.350 3.848 0.038) 9.194 5.702 ( -3.062 5.312 -2.523) 6.630 5.882 ( -2.593 -5.719 1.310) 6.415 5.940 ( 1.864 -5.531 3.008) 6.566 7.393 ( -2.292 5.515 0.801) 6.026 7.633 ( -0.491 5.466 -5.443) 7.729 7.889 ( 8.830 3.108 13.872) 16.736 8.067 ( 5.977 3.786 12.488) 14.353 9.360 ( -7.648 2.427 -4.985) 9.446 9.497 ( -3.233 -0.501 -8.742) 9.334 9.815 ( -4.688 -2.077 -1.101) 5.244 9.852 ( -3.072 -3.717 -6.532) 8.119 10.297 ( 0.550 0.299 -3.394) 3.451 10.539 ( 0.656 3.599 -1.255) 3.868 12.947 ( -1.331 6.737 9.206) 11.486 13.214 ( 1.925 1.431 7.016) 7.415 13.565 ( 3.846 -0.314 6.629) 7.670 13.685 ( 12.541 -7.140 10.190) 17.666 14.634 ( -3.747 -2.297 -1.450) 4.628 15.121 ( 1.010 -1.646 -4.364) 4.772 18.206 ( -1.092 -1.477 -6.182) 6.449 18.352 ( -3.799 -0.874 -3.269) 5.087 18.606 ( 9.078 -4.122 3.214) 10.475 18.669 ( -3.998 0.689 2.039) 4.540======================= Grid point 252 (118/312) =======================q-point: ( 0.10 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.506 ( 8.552 9.557 18.499) 22.510 1.824 ( 6.947 15.298 19.432) 25.688 2.747 ( -2.411 9.116 18.892) 21.115 3.038 ( 5.978 17.266 30.171) 35.273 3.547 ( -1.897 0.356 -9.892) 10.079 3.862 ( 1.804 2.793 -12.492) 12.927 3.945 ( -2.472 1.001 -8.393) 8.807 4.086 ( -3.617 -1.169 -10.916) 11.558 4.381 ( 0.523 -13.655 2.000) 13.811 4.779 ( 4.968 -0.662 -2.876) 5.778 5.095 ( 1.471 -1.401 0.367) 2.065 5.285 ( 2.938 -3.873 -0.127) 4.863 5.609 ( -4.016 9.029 1.737) 10.034 5.673 ( 7.663 3.690 -1.263) 8.599 5.846 ( -3.318 -4.925 2.213) 6.337 6.007 ( 2.276 -7.246 2.280) 7.931 7.374 ( -0.403 4.004 0.426) 4.046 7.537 ( -2.556 3.390 -5.067) 6.611 8.245 ( 10.501 4.169 16.119) 19.685 8.295 ( 5.633 4.281 12.405) 14.281 9.165 ( -7.768 1.256 -4.438) 9.034 9.367 ( -1.444 -0.688 -7.958) 8.117 9.664 ( -6.040 1.370 -7.613) 9.814 9.729 ( -4.301 -5.312 -6.013) 9.104 10.279 ( 0.611 1.614 -2.380) 2.940 10.546 ( 1.433 2.057 -0.968) 2.687 13.015 ( -1.632 6.618 9.607) 11.780 13.313 ( 1.005 1.879 7.024) 7.340 13.681 ( 1.806 1.423 6.911) 7.283 13.986 ( 11.633 -10.829 2.365) 16.068 14.524 ( -5.179 -1.679 -2.398) 5.949 15.112 ( 2.437 -2.790 -3.810) 5.314 18.127 ( -0.937 -2.758 -5.970) 6.643 18.249 ( -3.088 0.177 -3.805) 4.904 18.587 ( -6.258 2.029 0.764) 6.623 18.821 ( 10.210 -6.956 2.781) 12.663======================= Grid point 253 (119/312) =======================q-point: ( 0.20 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.842 ( 8.846 6.963 15.960) 19.531 2.150 ( 7.153 11.288 21.021) 24.910 2.858 ( -4.059 9.991 15.773) 19.107 3.361 ( -1.212 8.868 8.641) 12.441 3.410 ( 4.627 2.256 -9.441) 10.753 3.727 ( -7.855 0.601 -6.018) 9.913 3.869 ( 7.637 6.057 -13.497) 16.649 4.002 ( 1.137 1.995 1.959) 3.018 4.400 ( -1.611 -15.855 3.054) 16.227 4.817 ( 4.081 -0.998 -5.493) 6.915 5.133 ( 0.754 -2.920 1.389) 3.321 5.323 ( 1.400 -5.053 -1.842) 5.558 5.580 ( -1.401 8.086 3.843) 9.062 5.777 ( 5.180 -3.348 -4.443) 7.602 5.805 ( -1.833 -1.476 0.736) 2.465 6.067 ( 1.887 -5.991 2.007) 6.594 7.383 ( 0.659 2.980 0.902) 3.182 7.467 ( -0.968 2.236 -1.968) 3.132 8.442 ( 1.599 2.143 7.105) 7.591 8.583 ( 8.361 5.171 10.513) 14.394 9.009 ( -6.333 1.421 -0.698) 6.528 9.313 ( 1.604 -0.320 -2.051) 2.623 9.478 ( -4.934 2.003 -7.547) 9.237 9.582 ( -4.425 -4.299 -6.306) 8.822 10.270 ( 0.509 2.623 -1.699) 3.166 10.571 ( 2.232 0.238 -1.029) 2.469 13.068 ( -2.732 6.582 8.922) 11.419 13.378 ( -0.676 2.196 5.237) 5.719 13.760 ( 0.019 2.061 5.178) 5.573 14.114 ( 2.575 -8.779 -3.507) 9.798 14.438 ( 0.361 -3.716 -5.147) 6.359 15.133 ( 3.151 -3.821 -2.500) 5.548 18.060 ( -0.567 -3.324 -4.282) 5.451 18.180 ( -0.896 1.207 -2.460) 2.883 18.467 ( -6.795 3.167 0.064) 7.498 19.007 ( 7.575 -7.716 1.159) 10.875======================= Grid point 254 (120/312) =======================q-point: ( 0.30 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.095 ( 3.046 3.507 10.299) 11.298 2.498 ( 7.682 8.063 21.478) 24.193 2.896 ( -5.670 12.011 10.129) 16.703 3.266 ( -0.834 -1.322 -7.584) 7.744 3.468 ( 3.492 6.778 -3.004) 8.196 3.528 ( -10.223 1.692 0.043) 10.362 3.913 ( 9.864 6.292 -10.201) 15.522 4.115 ( 3.700 3.490 4.425) 6.742 4.392 ( -1.668 -15.103 2.497) 15.399 4.835 ( 4.458 -2.593 -6.300) 8.141 5.107 ( -5.408 -0.890 1.832) 5.779 5.312 ( 0.174 -4.158 -2.659) 4.938 5.607 ( 1.526 1.318 -0.007) 2.016 5.738 ( -2.467 -7.563 -2.069) 8.219 5.831 ( 3.864 -0.524 -5.512) 6.752 6.110 ( 1.801 -5.175 -0.306) 5.488 7.418 ( 1.340 2.070 2.667) 3.633 7.467 ( 1.021 1.554 1.531) 2.409 8.477 ( -0.189 0.479 -1.411) 1.502 8.691 ( -3.005 2.816 -2.575) 4.857 8.921 ( -2.905 3.694 0.912) 4.787 9.377 ( 1.214 2.091 3.909) 4.597 9.403 ( 2.291 -0.006 2.384) 3.306 9.490 ( -0.226 -1.835 0.228) 1.863 10.264 ( 0.571 3.032 -1.398) 3.388 10.599 ( 2.067 -1.160 -1.612) 2.867 13.088 ( -3.978 6.301 7.700) 10.716 13.386 ( -2.597 2.263 2.423) 4.212 13.777 ( -2.014 2.474 1.799) 3.662 14.053 ( -2.849 -4.669 -5.222) 7.562 14.403 ( 3.133 -6.773 -10.915) 13.222 15.172 ( 2.896 -4.559 -1.291) 5.553 18.035 ( 1.191 -2.467 -1.523) 3.134 18.166 ( 0.426 1.953 0.107) 2.001 18.358 ( -4.909 3.255 0.472) 5.909 19.111 ( 3.445 -6.890 -0.834) 7.749======================= Grid point 255 (121/312) =======================q-point: ( 0.40 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.112 ( -8.139 0.699 2.481) 8.538 2.786 ( 0.560 8.088 12.006) 14.487 2.916 ( -0.923 12.753 14.107) 19.039 3.179 ( -3.516 0.865 -3.896) 5.319 3.356 ( -6.835 -2.199 -0.883) 7.234 3.566 ( 7.151 3.853 3.140) 8.708 3.999 ( 6.021 4.746 -6.091) 9.792 4.153 ( 2.858 3.910 -6.399) 8.025 4.407 ( 0.701 -11.942 3.332) 12.418 4.850 ( 2.648 -2.919 -5.183) 6.512 5.014 ( -5.512 0.460 2.689) 6.150 5.270 ( -0.715 -5.351 -4.887) 7.282 5.626 ( 1.242 -2.525 -1.669) 3.271 5.664 ( -2.658 -6.980 -3.646) 8.312 5.823 ( 1.997 -2.548 -6.409) 7.180 6.123 ( 1.811 -5.444 -3.714) 6.834 7.480 ( 1.503 0.747 3.952) 4.294 7.522 ( 1.998 0.855 3.639) 4.239 8.418 ( -1.464 0.222 -7.958) 8.094 8.465 ( -10.415 0.520 -12.600) 16.355 8.929 ( 0.828 5.656 4.762) 7.440 9.427 ( 1.754 -1.613 5.255) 5.770 9.538 ( 3.327 0.502 9.519) 10.097 9.604 ( 5.184 2.798 8.529) 10.366 10.264 ( 0.794 3.060 -1.021) 3.322 10.608 ( 1.040 -1.975 -2.508) 3.358 13.077 ( -4.594 5.704 6.208) 9.600 13.335 ( -4.029 2.171 -0.277) 4.585 13.722 ( -3.824 2.517 -1.831) 4.931 13.929 ( -3.024 -3.907 -9.554) 10.755 14.329 ( 1.702 -5.743 -11.863) 13.289 15.207 ( 1.972 -4.653 -0.907) 5.135 18.072 ( 3.235 -1.260 0.452) 3.501 18.192 ( 0.499 2.626 3.132) 4.118 18.314 ( -1.015 2.191 2.097) 3.198 19.117 ( -0.762 -5.223 -2.867) 6.007======================= Grid point 256 (122/312) =======================q-point: (-0.50 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.885 ( -15.981 0.162 -1.154) 16.023 2.797 ( -8.059 12.610 8.243) 17.085 2.912 ( -14.489 13.879 5.473) 20.797 3.114 ( 1.034 -3.903 -3.107) 5.095 3.300 ( -1.544 -5.306 -0.888) 5.597 3.757 ( 7.225 2.532 7.621) 10.802 3.976 ( -1.071 3.688 1.062) 3.985 4.168 ( 8.899 -0.417 -14.926) 17.383 4.509 ( 5.926 -4.221 5.236) 8.964 4.818 ( -2.153 -0.641 -0.482) 2.298 4.993 ( 0.610 -2.512 0.635) 2.662 5.205 ( -0.674 -5.270 -4.723) 7.108 5.566 ( -3.103 -6.714 -4.901) 8.873 5.606 ( -1.345 -2.906 -3.250) 4.562 5.807 ( 2.677 -3.760 -4.012) 6.115 6.109 ( 1.757 -5.323 -5.519) 7.867 7.527 ( 0.323 -1.257 1.134) 1.723 7.599 ( 1.408 0.058 4.304) 4.529 8.114 ( -11.277 0.869 -15.119) 18.881 8.295 ( -1.971 1.397 -10.347) 10.626 9.049 ( 3.671 5.148 10.245) 12.039 9.546 ( 3.167 -2.953 8.519) 9.557 9.683 ( 1.995 1.217 9.260) 9.551 9.783 ( 4.802 2.885 8.228) 9.954 10.278 ( 1.442 2.909 -0.003) 3.247 10.586 ( -0.361 -2.166 -3.415) 4.060 13.045 ( -4.481 5.026 4.448) 8.070 13.243 ( -4.642 2.104 -1.787) 5.401 13.614 ( -4.461 2.197 -3.894) 6.316 13.734 ( -4.082 -5.094 -17.571) 18.745 14.272 ( 2.276 -2.041 -5.197) 6.029 15.224 ( 1.081 -3.922 -1.339) 4.283 18.147 ( 3.977 -0.731 0.404) 4.064 18.248 ( 1.304 1.736 5.181) 5.618 18.358 ( 1.789 1.866 4.523) 5.210 19.032 ( -4.322 -3.137 -4.568) 7.028======================= Grid point 257 (123/312) =======================q-point: (-0.40 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.547 ( -19.269 1.212 -0.346) 19.310 2.487 ( -24.399 9.619 -3.653) 26.480 2.805 ( -5.908 7.644 3.962) 10.441 3.030 ( -11.765 9.233 3.717) 15.410 3.187 ( -3.132 -2.711 -5.507) 6.891 3.986 ( 7.679 -1.224 10.601) 13.147 4.074 ( 6.057 1.034 5.298) 8.113 4.166 ( 7.870 -6.737 -14.812) 18.075 4.673 ( 6.469 2.971 -0.658) 7.149 4.788 ( -2.067 -0.873 2.354) 3.251 5.011 ( 1.120 -4.643 -0.269) 4.784 5.168 ( 0.950 -3.952 -2.883) 4.983 5.484 ( -0.305 -5.446 -3.021) 6.236 5.527 ( -3.229 -1.939 -3.120) 4.891 5.836 ( 3.132 -4.457 -2.077) 5.830 6.083 ( 0.991 -4.161 -4.726) 6.374 7.517 ( -0.337 -2.202 -1.984) 2.983 7.576 ( -6.462 -2.046 -5.961) 9.027 7.847 ( -2.859 2.972 -5.659) 7.002 8.166 ( -2.199 3.301 -7.939) 8.874 9.237 ( 4.368 4.159 11.623) 13.095 9.686 ( 2.349 -3.585 8.628) 9.634 9.782 ( 0.281 1.434 6.323) 6.490 9.930 ( 3.392 1.470 6.202) 7.220 10.324 ( 2.739 2.718 1.771) 4.246 10.530 ( -1.547 -1.881 -4.213) 4.866 13.006 ( -3.920 4.997 3.432) 7.219 13.139 ( -4.527 2.107 -1.821) 5.315 13.448 ( -5.730 -4.187 -19.677) 20.917 13.501 ( -3.672 1.316 -3.696) 5.373 14.320 ( 4.776 0.145 1.261) 4.942 15.222 ( 0.650 -2.664 -2.131) 3.473 18.214 ( 3.331 -1.122 -0.577) 3.562 18.338 ( 2.345 0.087 5.748) 6.208 18.449 ( 2.314 1.984 5.417) 6.216 18.880 ( -6.589 -0.820 -5.291) 8.490======================= Grid point 258 (124/312) =======================q-point: (-0.30 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.206 ( -18.788 3.634 3.627) 19.477 1.933 ( -26.276 5.241 -11.234) 29.053 2.659 ( -18.686 18.188 12.130) 28.759 2.856 ( -13.315 15.533 12.443) 23.945 3.151 ( 5.043 -7.011 -6.236) 10.652 4.150 ( 9.226 -10.308 -15.557) 20.818 4.200 ( 5.131 -2.840 7.239) 9.316 4.283 ( 5.837 -1.926 9.447) 11.270 4.646 ( -1.969 4.241 -10.116) 11.144 4.752 ( -2.698 -1.815 -3.931) 5.101 5.067 ( 3.851 -0.906 1.337) 4.176 5.184 ( 2.296 -3.240 -0.113) 3.973 5.441 ( -1.964 -0.783 -4.210) 4.711 5.518 ( 3.332 -4.231 3.325) 6.329 5.862 ( 1.733 -4.685 -2.177) 5.449 6.055 ( -0.373 -2.246 -2.144) 3.127 7.335 ( -6.884 -1.247 -8.615) 11.098 7.524 ( 2.727 -0.479 -0.573) 2.827 7.814 ( -1.500 2.629 -0.182) 3.032 8.049 ( -2.554 4.794 -7.394) 9.175 9.414 ( 3.053 3.755 9.606) 10.757 9.783 ( -0.015 -2.448 5.145) 5.698 9.822 ( -0.822 -0.272 4.250) 4.337 10.021 ( 1.402 -0.723 3.004) 3.393 10.403 ( 2.204 2.311 2.235) 3.898 10.458 ( -0.317 -1.103 -4.301) 4.452 12.966 ( -4.999 7.757 3.411) 9.839 13.050 ( -2.280 0.800 -2.045) 3.166 13.194 ( -4.290 -2.837 -9.184) 10.526 13.427 ( -1.574 1.092 -1.375) 2.358 14.452 ( 6.181 -0.065 3.823) 7.269 15.208 ( 0.541 -1.401 -2.864) 3.234 18.256 ( 2.477 -1.774 -1.501) 3.397 18.427 ( 1.264 -0.460 4.188) 4.399 18.532 ( 1.081 0.839 3.879) 4.114 18.711 ( -5.897 1.406 -3.493) 6.997======================= Grid point 259 (125/312) =======================q-point: (-0.20 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.975 ( -13.070 7.181 11.067) 18.571 1.410 ( -20.828 10.934 -0.893) 23.540 2.443 ( -20.906 24.902 20.932) 38.669 2.764 ( -11.447 13.178 13.967) 22.355 3.249 ( 8.788 -6.964 0.168) 11.214 4.163 ( 8.052 -10.609 -14.562) 19.734 4.308 ( 0.791 -4.495 0.178) 4.568 4.411 ( -0.167 -1.843 -2.531) 3.136 4.501 ( -3.153 1.365 -0.428) 3.462 4.651 ( 0.023 2.140 -6.909) 7.233 5.111 ( 1.067 2.833 -2.527) 3.944 5.234 ( 2.103 -3.332 1.026) 4.072 5.381 ( 0.319 0.325 -4.356) 4.380 5.636 ( 4.428 -4.687 4.472) 7.847 5.861 ( 0.835 -4.741 -1.944) 5.192 6.018 ( -2.288 -0.355 -1.061) 2.547 7.237 ( 1.544 1.753 0.487) 2.386 7.617 ( 4.253 1.137 4.333) 6.177 7.743 ( -3.876 3.240 -2.476) 5.626 7.934 ( -2.449 5.713 -6.244) 8.810 9.520 ( 0.325 3.829 4.845) 6.184 9.760 ( -3.199 1.231 -2.127) 4.034 9.857 ( -1.315 -5.062 5.107) 7.309 10.034 ( -1.054 -2.452 -1.321) 2.978 10.368 ( -1.203 -0.204 -3.556) 3.759 10.503 ( 3.241 2.340 0.084) 3.998 12.891 ( -4.496 8.665 3.411) 10.341 13.051 ( 1.439 0.477 1.997) 2.507 13.145 ( 0.507 -1.931 5.928) 6.256 13.420 ( 0.596 0.878 1.878) 2.157 14.593 ( 4.866 -1.450 2.988) 5.892 15.186 ( 0.375 -0.633 -3.388) 3.467 18.282 ( 2.551 -2.216 -2.382) 4.134 18.438 ( -2.651 -0.250 0.462) 2.703 18.526 ( -2.053 1.279 -0.940) 2.595 18.663 ( -0.180 0.470 3.465) 3.501======================= Grid point 260 (126/312) =======================q-point: (-0.10 0.18 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.974 ( -2.629 10.335 17.503) 20.496 1.265 ( -3.364 18.581 16.942) 25.369 2.358 ( -14.110 24.084 29.188) 40.386 2.719 ( -9.144 12.967 15.989) 22.526 3.450 ( 8.899 -5.965 5.101) 11.866 4.140 ( 5.029 -7.131 -15.402) 17.702 4.174 ( -5.938 0.363 -9.014) 10.801 4.329 ( -1.922 -0.705 -7.353) 7.633 4.484 ( -0.902 -3.194 -0.868) 3.431 4.649 ( 2.527 -1.324 -1.996) 3.481 5.085 ( -0.471 4.836 -1.702) 5.148 5.262 ( -0.458 -2.989 0.956) 3.171 5.390 ( 5.695 1.996 -3.598) 7.026 5.731 ( 1.277 -2.026 1.939) 3.081 5.871 ( 2.843 -6.950 -2.093) 7.795 5.951 ( -4.458 0.574 1.064) 4.619 7.365 ( 4.463 5.105 7.016) 9.757 7.605 ( -0.476 5.154 -2.226) 5.634 7.799 ( 0.051 2.531 4.305) 4.994 7.864 ( 3.053 4.210 2.423) 5.737 9.506 ( -4.010 3.666 -1.259) 5.577 9.644 ( -4.358 0.409 -6.431) 7.779 9.863 ( -2.535 -5.514 3.141) 6.834 9.965 ( -2.691 -2.219 -4.843) 5.968 10.325 ( 0.142 -0.321 -3.653) 3.670 10.537 ( 1.238 3.615 -1.234) 4.016 12.892 ( -1.940 7.460 7.473) 10.736 13.117 ( 1.953 0.969 4.993) 5.449 13.327 ( 8.725 -4.428 12.122) 15.578 13.483 ( 2.289 0.988 5.604) 6.134 14.667 ( 0.945 -2.491 0.480) 2.707 15.154 ( 0.175 -0.746 -3.964) 4.037 18.278 ( 0.111 -1.189 -5.305) 5.437 18.412 ( -0.429 -2.971 1.510) 3.360 18.487 ( 0.483 1.615 -1.266) 2.108 18.691 ( -1.385 -0.234 3.465) 3.739======================= Grid point 261 (127/312) =======================q-point: ( 0.00 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.479 ( 8.043 18.790 10.025) 22.765 1.886 ( 5.935 20.323 15.516) 26.249 2.796 ( -3.897 10.966 18.870) 22.171 3.115 ( -3.693 20.250 25.677) 32.909 3.507 ( 4.133 -7.852 8.431) 12.240 3.911 ( 7.318 -9.849 -17.559) 21.421 4.034 ( -3.209 2.207 -8.794) 9.618 4.211 ( -2.512 -2.515 -2.433) 4.307 4.336 ( -5.480 1.925 -10.942) 12.388 4.680 ( 4.505 -0.477 -3.597) 5.784 5.073 ( -1.187 -3.586 -1.260) 3.982 5.181 ( -0.426 -4.512 -0.881) 4.617 5.571 ( 4.452 -0.569 1.271) 4.664 5.706 ( 5.096 -3.568 3.859) 7.321 5.735 ( 1.262 -4.141 -4.764) 6.438 5.970 ( -4.705 4.916 5.780) 8.928 7.501 ( -2.928 5.582 -0.690) 6.341 7.714 ( -2.355 2.864 -6.913) 7.844 7.969 ( 11.609 5.066 13.576) 18.567 8.137 ( 7.233 3.310 12.219) 14.580 9.380 ( -7.956 -0.713 -5.997) 9.988 9.473 ( -4.364 -2.174 -7.379) 8.845 9.736 ( -3.255 -2.266 -0.699) 4.027 9.857 ( -3.805 0.914 -6.626) 7.695 10.324 ( 0.677 2.676 -1.839) 3.317 10.591 ( 0.059 1.686 -1.215) 2.079 13.082 ( 1.822 6.677 3.313) 7.673 13.247 ( 2.237 1.965 6.856) 7.475 13.520 ( 8.430 -2.960 9.911) 13.343 13.635 ( 4.152 0.665 8.723) 9.684 14.597 ( -3.043 -1.244 -1.932) 3.813 15.062 ( 0.385 -4.595 -5.364) 7.073 18.173 ( -2.300 -1.512 -5.169) 5.857 18.330 ( -3.107 -1.603 -1.733) 3.902 18.567 ( 5.445 -0.266 1.437) 5.638 18.676 ( -2.439 0.019 1.708) 2.977======================= Grid point 262 (128/312) =======================q-point: ( 0.10 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.751 ( 9.689 15.809 11.153) 21.638 2.133 ( 5.184 16.581 14.619) 22.706 2.918 ( -1.634 7.795 15.182) 17.145 3.391 ( 2.910 18.274 27.178) 32.879 3.567 ( -2.836 1.326 -1.529) 3.484 3.864 ( 7.173 -10.634 -12.525) 17.928 3.922 ( -0.948 2.287 -8.046) 8.418 4.082 ( -3.651 3.747 -13.790) 14.749 4.195 ( -3.430 -4.832 2.220) 6.328 4.735 ( 5.246 -3.953 -5.057) 8.290 5.043 ( -0.189 -4.252 -1.416) 4.486 5.184 ( 0.464 -6.271 1.272) 6.415 5.628 ( 1.444 -6.685 -0.356) 6.848 5.714 ( 0.673 -2.247 -2.702) 3.578 5.831 ( 2.631 4.029 3.767) 6.111 5.949 ( -3.391 3.003 6.543) 7.958 7.453 ( -1.238 4.157 -0.696) 4.393 7.590 ( -3.335 2.061 -5.498) 6.752 8.334 ( 9.211 4.924 14.567) 17.925 8.384 ( 7.832 4.725 12.181) 15.233 9.175 ( -7.379 -0.331 -5.263) 9.070 9.341 ( -1.856 -2.215 -7.007) 7.579 9.637 ( -5.172 -2.702 -3.505) 6.807 9.699 ( -4.645 0.988 -9.209) 10.362 10.325 ( 1.032 3.224 -1.426) 3.673 10.577 ( -0.206 1.054 -0.767) 1.319 13.152 ( 2.034 7.114 3.052) 8.004 13.350 ( 1.572 1.863 6.413) 6.860 13.711 ( 3.828 1.369 6.565) 7.722 13.828 ( 6.337 -4.879 7.873) 11.223 14.498 ( -5.355 -0.896 -1.548) 5.646 15.030 ( 1.909 -5.817 -5.215) 8.042 18.080 ( -1.951 -1.680 -5.077) 5.692 18.249 ( -2.467 -0.488 -2.897) 3.836 18.618 ( -4.597 1.199 0.887) 4.832 18.720 ( 7.527 -3.577 2.529) 8.709======================= Grid point 263 (129/312) =======================q-point: ( 0.20 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.031 ( 9.247 12.606 8.975) 18.027 2.378 ( 5.371 12.107 15.943) 20.727 3.035 ( -1.435 6.826 14.172) 15.795 3.409 ( -4.109 4.044 -12.874) 14.106 3.634 ( 0.464 12.395 11.807) 17.125 3.759 ( -8.272 2.795 -6.198) 10.708 3.941 ( 5.501 -8.777 -3.649) 10.982 4.009 ( 9.091 6.849 -6.012) 12.872 4.167 ( -3.211 -4.897 4.401) 7.325 4.755 ( 3.882 -5.620 -7.466) 10.119 5.042 ( 0.671 -6.394 -0.623) 6.459 5.210 ( -0.145 -6.721 2.189) 7.070 5.624 ( -0.667 -8.142 -1.483) 8.303 5.703 ( -0.896 1.360 0.219) 1.643 5.838 ( -2.218 2.879 -0.107) 3.636 5.993 ( 0.603 -0.737 4.322) 4.426 7.442 ( 0.175 3.017 0.103) 3.023 7.505 ( -1.423 1.718 -2.246) 3.166 8.501 ( 0.851 3.938 5.567) 6.872 8.675 ( 7.349 4.065 9.544) 12.713 9.031 ( -4.354 0.904 -1.454) 4.678 9.297 ( 1.950 -1.736 -0.997) 2.795 9.502 ( -4.669 -0.722 -2.987) 5.589 9.525 ( -3.942 -0.107 -8.888) 9.724 10.328 ( 0.738 3.467 -1.299) 3.775 10.572 ( 0.248 -0.186 -0.386) 0.496 13.206 ( 1.198 7.285 1.390) 7.512 13.419 ( 0.109 1.843 3.950) 4.360 13.810 ( 0.973 3.238 4.839) 5.903 13.960 ( 2.776 -6.213 0.771) 6.849 14.394 ( -4.388 -1.049 -0.562) 4.546 15.029 ( 2.896 -7.097 -4.092) 8.689 18.015 ( -0.383 -1.109 -3.240) 3.446 18.198 ( -0.505 0.449 -1.535) 1.678 18.523 ( -5.915 2.682 0.089) 6.495 18.875 ( 6.449 -6.062 1.751) 9.022======================= Grid point 264 (130/312) =======================q-point: ( 0.30 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.218 ( 3.623 9.169 2.443) 10.157 2.648 ( 6.554 7.692 16.355) 19.226 3.130 ( -3.378 6.910 12.898) 15.017 3.221 ( -0.818 2.324 -14.214) 14.426 3.573 ( -6.372 4.369 -0.482) 7.741 3.669 ( -5.436 10.791 5.484) 13.269 4.006 ( 6.295 -3.184 -3.105) 7.708 4.104 ( 4.570 -2.524 -5.792) 7.798 4.211 ( 3.428 1.416 3.765) 5.285 4.749 ( 3.978 -6.373 -7.589) 10.679 5.032 ( -2.017 -6.415 0.538) 6.746 5.201 ( -2.560 -7.588 0.710) 8.039 5.583 ( -1.851 -7.432 -2.041) 7.926 5.672 ( -2.514 3.984 -0.378) 4.726 5.794 ( 0.301 -3.548 -4.333) 5.609 6.019 ( -0.548 -3.699 0.759) 3.815 7.460 ( 0.944 2.240 1.657) 2.942 7.496 ( 0.604 1.432 1.241) 1.988 8.507 ( -0.864 2.508 -2.824) 3.874 8.726 ( -5.475 0.790 -3.867) 6.750 8.996 ( 0.448 3.939 0.477) 3.993 9.365 ( 1.406 -3.224 -0.060) 3.518 9.423 ( 0.584 2.418 3.543) 4.328 9.489 ( 2.362 1.176 6.089) 6.636 10.326 ( 0.536 3.398 -1.318) 3.684 10.574 ( 0.320 -1.441 -0.571) 1.583 13.219 ( -0.063 6.898 -0.771) 6.941 13.426 ( -1.684 1.662 0.379) 2.396 13.838 ( -1.476 3.858 1.330) 4.340 13.950 ( -0.878 -5.037 -5.026) 7.170 14.324 ( -2.853 -1.664 -0.964) 3.440 15.052 ( 3.113 -7.991 -2.703) 8.992 18.011 ( 1.945 0.112 -0.463) 2.003 18.202 ( 1.102 1.545 1.101) 2.194 18.418 ( -5.442 3.150 0.369) 6.299 18.978 ( 3.680 -6.945 -0.044) 7.860======================= Grid point 265 (131/312) =======================q-point: ( 0.40 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.184 ( -5.748 6.611 -4.714) 9.949 2.882 ( 5.485 2.734 2.801) 6.738 3.145 ( 0.040 -6.205 0.936) 6.275 3.165 ( -1.625 13.939 7.600) 15.959 3.443 ( -16.125 10.721 9.618) 21.621 3.653 ( 3.030 4.919 0.957) 5.857 4.078 ( 3.228 -5.204 -2.823) 6.743 4.117 ( 4.564 0.685 -8.656) 9.810 4.314 ( 7.263 3.279 0.466) 7.983 4.753 ( 3.640 -6.838 -6.187) 9.914 4.985 ( -4.445 -3.682 3.127) 6.565 5.141 ( -3.899 -8.320 0.144) 9.190 5.517 ( -1.944 -6.675 -4.136) 8.090 5.615 ( -1.256 0.507 -3.959) 4.184 5.760 ( 0.362 -4.430 -3.920) 5.927 5.997 ( -0.209 -7.097 -3.000) 7.708 7.502 ( 0.699 1.407 2.539) 2.985 7.538 ( 1.422 0.780 3.293) 3.670 8.430 ( -0.986 1.067 -9.114) 9.229 8.478 ( -10.408 0.646 -12.960) 16.634 9.035 ( 1.785 5.197 4.140) 6.880 9.380 ( 1.414 -3.009 3.854) 5.090 9.567 ( 3.405 2.238 10.551) 11.310 9.654 ( 4.870 2.239 10.299) 11.610 10.324 ( 0.713 3.142 -1.256) 3.458 10.568 ( -0.173 -2.174 -1.125) 2.454 13.192 ( -0.913 5.831 -2.672) 6.479 13.370 ( -2.880 1.252 -2.949) 4.308 13.779 ( -3.914 2.902 -2.926) 5.683 13.845 ( -2.413 -3.522 -10.261) 11.114 14.272 ( -1.864 -0.181 0.087) 1.875 15.085 ( 2.869 -8.021 -1.775) 8.702 18.069 ( 3.392 0.991 1.505) 3.841 18.255 ( 1.813 3.578 3.394) 5.254 18.347 ( -3.029 1.617 2.181) 4.068 19.005 ( 0.432 -6.391 -1.984) 6.706======================= Grid point 266 (132/312) =======================q-point: (-0.50 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.955 ( -11.514 6.922 -7.365) 15.321 2.906 ( 4.917 -2.192 -12.115) 13.257 3.084 ( -15.196 -1.057 -6.390) 16.519 3.136 ( -9.162 9.174 11.252) 17.167 3.358 ( -2.511 14.025 16.614) 21.887 3.762 ( 5.548 -3.321 2.087) 6.794 4.061 ( -0.715 3.732 -1.808) 4.208 4.100 ( 5.315 -2.688 -11.760) 13.182 4.522 ( 11.460 4.379 5.048) 13.266 4.754 ( 2.073 -5.788 -3.805) 7.231 4.945 ( -4.799 -2.215 5.057) 7.315 5.087 ( -1.346 -7.356 0.154) 7.480 5.433 ( -1.836 -6.674 -6.138) 9.251 5.546 ( -1.175 -3.374 -4.971) 6.122 5.741 ( 0.882 -3.177 -1.810) 3.761 5.970 ( 1.796 -8.691 -4.781) 10.081 7.514 ( -0.754 -0.029 -0.115) 0.763 7.596 ( 0.277 -0.395 3.210) 3.246 8.143 ( -9.182 2.075 -15.702) 18.308 8.311 ( -0.726 0.463 -10.963) 10.997 9.151 ( 3.317 5.192 9.371) 11.215 9.485 ( 2.553 -3.350 8.473) 9.462 9.718 ( 1.990 2.267 9.456) 9.925 9.830 ( 3.592 1.938 9.035) 9.914 10.333 ( 1.534 2.820 -0.693) 3.284 10.544 ( -0.962 -2.122 -1.781) 2.933 13.139 ( -1.100 4.357 -3.918) 5.962 13.274 ( -3.119 0.872 -4.745) 5.745 13.635 ( -5.217 -2.806 -11.311) 12.769 13.676 ( -3.931 2.491 -8.819) 9.971 14.274 ( 0.526 2.311 3.129) 3.926 15.119 ( 2.489 -7.080 -1.582) 7.670 18.147 ( 3.043 0.906 1.627) 3.568 18.301 ( -0.027 3.599 3.045) 4.714 18.383 ( 2.016 0.889 6.036) 6.426 18.957 ( -2.562 -4.675 -3.499) 6.376======================= Grid point 267 (133/312) =======================q-point: (-0.40 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.657 ( -12.563 9.873 -6.767) 17.353 2.595 ( -20.879 3.704 -15.287) 26.141 2.915 ( 5.057 -3.983 -9.607) 11.564 3.079 ( -10.371 7.756 11.618) 17.398 3.384 ( -11.568 16.283 12.814) 23.731 3.851 ( 7.885 -12.419 -10.312) 17.965 4.101 ( 3.363 2.292 4.913) 6.380 4.114 ( 5.088 1.480 -1.816) 5.602 4.747 ( 0.045 -0.513 7.214) 7.233 4.768 ( 6.667 2.617 -7.259) 10.197 4.912 ( -0.598 -3.732 4.866) 6.162 5.102 ( 1.918 -3.857 0.514) 4.338 5.350 ( 0.325 -7.993 -5.358) 9.628 5.487 ( -1.865 -2.305 -1.424) 3.290 5.751 ( 1.827 -4.414 -1.814) 5.110 5.973 ( 2.801 -7.009 -3.258) 8.221 7.484 ( -0.718 -1.170 -2.560) 2.905 7.541 ( -5.278 -1.818 -6.704) 8.724 7.917 ( -1.518 4.210 -7.102) 8.394 8.201 ( -0.812 0.604 -8.733) 8.792 9.321 ( 3.759 4.283 10.984) 12.374 9.614 ( 1.453 -3.784 9.308) 10.152 9.816 ( 0.115 2.100 6.301) 6.642 9.955 ( 1.761 0.963 6.243) 6.558 10.374 ( 3.059 2.425 0.607) 3.950 10.498 ( -1.695 -1.304 -2.453) 3.254 13.082 ( -0.727 2.696 -3.814) 4.727 13.175 ( -2.645 0.872 -4.111) 4.966 13.393 ( -5.885 -0.617 -14.589) 15.743 13.541 ( -3.442 2.505 -5.362) 6.847 14.350 ( 3.185 3.241 4.875) 6.665 15.143 ( 2.089 -5.611 -1.959) 6.299 18.203 ( 1.911 0.210 0.551) 2.000 18.347 ( 1.034 0.652 4.409) 4.575 18.487 ( 2.263 2.018 5.631) 6.396 18.852 ( -4.613 -2.212 -4.066) 6.535======================= Grid point 268 (134/312) =======================q-point: (-0.30 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.395 ( -9.065 15.130 -4.753) 18.268 2.052 ( -20.967 7.771 -13.456) 26.097 2.937 ( 2.848 1.528 -2.187) 3.902 2.985 ( -10.179 2.552 9.839) 14.385 3.241 ( -15.587 18.871 12.129) 27.316 3.869 ( 10.556 -15.273 -18.309) 26.075 4.202 ( 2.988 0.162 4.429) 5.345 4.263 ( 3.821 0.208 9.093) 9.865 4.692 ( -4.410 0.670 -6.806) 8.137 4.747 ( 0.501 0.243 -3.659) 3.701 5.039 ( 3.436 -0.927 4.296) 5.579 5.158 ( 4.406 -0.237 -0.555) 4.447 5.364 ( 4.553 -8.829 -2.312) 10.200 5.449 ( -1.985 -0.328 1.770) 2.680 5.762 ( 1.404 -5.686 -2.204) 6.258 6.001 ( 1.841 -3.512 -0.315) 3.978 7.334 ( -3.811 0.854 -8.580) 9.427 7.507 ( 4.210 -1.344 -1.304) 4.608 7.873 ( -0.806 3.484 -2.410) 4.312 8.104 ( -1.575 1.307 -6.733) 7.038 9.483 ( 2.673 3.063 8.952) 9.832 9.707 ( -0.732 -4.464 7.870) 9.078 9.844 ( -1.828 1.908 2.515) 3.648 10.017 ( 0.259 0.001 2.612) 2.624 10.435 ( -1.969 0.637 -1.617) 2.626 10.456 ( 4.237 1.260 0.259) 4.428 13.045 ( -0.201 0.622 -1.827) 1.940 13.108 ( -1.535 1.257 -1.002) 2.223 13.173 ( -4.160 4.114 -9.541) 11.193 13.454 ( -1.383 1.621 -2.820) 3.534 14.471 ( 4.508 2.378 4.423) 6.748 15.155 ( 1.554 -4.275 -2.606) 5.242 18.230 ( 1.102 -0.614 -0.367) 1.313 18.411 ( 0.846 -1.156 3.974) 4.224 18.559 ( 0.515 1.775 3.094) 3.604 18.728 ( -4.442 0.215 -2.787) 5.249======================= Grid point 269 (135/312) =======================q-point: (-0.20 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.259 ( -1.979 20.650 -1.803) 20.823 1.656 ( -12.869 14.579 0.957) 19.470 2.839 ( -15.084 15.255 14.382) 25.828 3.044 ( -2.023 4.056 9.978) 10.959 3.122 ( -3.465 4.930 7.404) 9.546 3.890 ( 11.065 -15.092 -17.898) 25.895 4.265 ( -0.254 -1.530 1.320) 2.037 4.357 ( -1.445 -2.708 2.672) 4.070 4.558 ( -2.884 3.521 -3.964) 6.035 4.709 ( 1.408 3.492 -6.763) 7.740 5.095 ( 0.428 -4.333 1.447) 4.588 5.217 ( 2.491 0.608 -1.886) 3.183 5.399 ( 2.943 1.545 -3.905) 5.128 5.493 ( 2.930 -8.116 4.282) 9.633 5.761 ( 0.899 -5.661 -2.054) 6.089 6.018 ( -0.541 -0.430 0.689) 0.976 7.298 ( 5.093 4.174 0.181) 6.587 7.627 ( 6.997 -0.187 3.638) 7.888 7.807 ( -3.044 3.569 -2.992) 5.564 8.008 ( -2.308 2.192 -5.812) 6.627 9.573 ( -0.122 1.199 3.584) 3.781 9.740 ( -3.352 -6.237 5.656) 9.063 9.799 ( -3.130 3.030 -1.308) 4.549 10.018 ( -0.908 0.011 -1.104) 1.429 10.378 ( -1.396 1.380 -2.486) 3.168 10.541 ( 3.647 1.375 0.525) 3.932 13.026 ( -0.899 2.632 -0.363) 2.805 13.091 ( 0.612 3.914 -0.214) 3.967 13.119 ( 1.559 1.372 4.494) 4.951 13.441 ( 1.043 1.128 0.801) 1.733 14.582 ( 3.642 0.610 2.088) 4.242 15.146 ( 0.692 -3.615 -3.414) 5.020 18.243 ( 1.109 -1.282 -0.775) 1.864 18.426 ( -2.111 -1.204 0.540) 2.489 18.557 ( -1.668 1.814 -0.201) 2.473 18.671 ( -0.905 0.268 1.308) 1.613======================= Grid point 270 (136/312) =======================q-point: (-0.10 0.27 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.290 ( 3.898 21.225 4.682) 22.082 1.645 ( 1.461 20.602 14.842) 25.433 2.745 ( -11.552 15.209 18.389) 26.512 3.029 ( -9.640 18.558 18.635) 28.011 3.299 ( 8.277 -9.773 8.255) 15.237 3.914 ( 9.874 -13.435 -16.470) 23.437 4.189 ( -4.388 0.361 -6.471) 7.827 4.297 ( -2.893 -2.932 -3.739) 5.563 4.491 ( -2.682 3.085 -3.855) 5.619 4.670 ( 1.616 3.043 -6.040) 6.954 5.098 ( -0.633 -4.040 -0.113) 4.091 5.209 ( -0.678 -2.093 -1.913) 2.916 5.458 ( 6.102 4.787 -0.537) 7.774 5.593 ( 3.821 -9.237 3.116) 10.471 5.755 ( 1.092 -5.457 -3.312) 6.476 5.999 ( -2.866 2.626 2.530) 4.638 7.479 ( 6.749 6.447 6.559) 11.408 7.695 ( 1.363 4.365 -2.306) 5.121 7.841 ( 2.158 1.682 4.634) 5.381 7.928 ( 1.786 2.389 0.357) 3.004 9.539 ( -4.058 -0.666 -2.655) 4.895 9.639 ( -6.866 -2.660 -4.065) 8.411 9.771 ( -1.650 -0.666 2.000) 2.677 9.964 ( -2.265 0.611 -3.936) 4.582 10.340 ( -0.279 2.034 -2.199) 3.008 10.588 ( 1.631 1.598 -0.809) 2.422 13.031 ( 0.682 5.919 1.946) 6.268 13.146 ( 2.090 2.273 4.951) 5.835 13.268 ( 6.469 -1.199 10.374) 12.284 13.505 ( 2.859 1.182 4.791) 5.703 14.632 ( 0.795 -0.848 -0.594) 1.305 15.112 ( -0.138 -3.786 -4.491) 5.875 18.243 ( -0.260 -1.712 -2.730) 3.233 18.377 ( -2.109 -1.271 0.022) 2.463 18.523 ( -0.370 2.013 -1.437) 2.501 18.683 ( -0.670 -0.627 2.421) 2.589======================= Grid point 271 (137/312) =======================q-point: ( 0.00 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.883 ( 8.878 22.837 2.857) 24.668 2.266 ( 4.437 18.827 12.710) 23.145 2.931 ( -2.013 2.225 10.597) 11.013 3.245 ( 5.198 -16.457 8.252) 19.130 3.489 ( -0.859 14.820 22.052) 26.583 3.777 ( 7.390 -2.972 -8.783) 11.856 4.076 ( -3.685 2.224 -5.150) 6.711 4.159 ( -2.876 -2.351 -1.504) 4.007 4.421 ( -4.366 6.045 -10.786) 13.113 4.682 ( 1.169 0.658 -7.482) 7.601 4.967 ( -2.830 -6.366 2.234) 7.316 5.065 ( -0.229 -8.384 -5.212) 9.874 5.475 ( 0.747 -4.822 2.952) 5.703 5.600 ( 2.150 -6.063 -2.327) 6.841 5.808 ( 6.220 7.115 2.775) 9.850 6.041 ( -1.787 1.757 4.654) 5.286 7.601 ( -3.404 4.750 -2.157) 6.229 7.743 ( -3.519 0.324 -6.234) 7.166 8.070 ( 12.870 5.085 12.687) 18.774 8.186 ( 9.219 1.684 11.961) 15.195 9.346 ( -7.598 -2.085 -4.866) 9.261 9.412 ( -5.441 -3.809 -4.914) 8.261 9.744 ( -3.673 2.372 -3.639) 5.689 9.865 ( -3.866 -0.184 -6.354) 7.440 10.396 ( 0.553 4.589 -0.912) 4.711 10.600 ( -0.085 -0.756 -0.993) 1.251 13.180 ( 2.929 3.464 3.451) 5.700 13.276 ( 2.806 0.462 5.449) 6.147 13.512 ( 8.325 2.474 7.870) 11.720 13.655 ( 4.793 0.787 6.681) 8.260 14.598 ( -2.755 1.658 -2.736) 4.222 14.948 ( -0.154 -7.176 -6.256) 9.521 18.160 ( -3.155 0.339 -3.458) 4.694 18.290 ( -2.819 -2.529 -1.480) 4.066 18.581 ( 3.110 1.473 0.245) 3.450 18.669 ( -1.021 -0.800 1.186) 1.758======================= Grid point 272 (138/312) =======================q-point: ( 0.10 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.096 ( 9.680 19.750 4.805) 22.513 2.439 ( 2.831 14.857 10.514) 18.420 3.012 ( -0.702 1.455 9.720) 9.853 3.415 ( 4.974 -17.025 7.117) 19.112 3.706 ( 0.121 9.836 4.410) 10.780 3.776 ( 2.445 7.007 4.194) 8.525 3.980 ( -1.368 3.522 -5.226) 6.449 4.124 ( -1.065 -1.338 1.810) 2.490 4.229 ( -3.155 8.681 -10.923) 14.305 4.644 ( 2.600 -4.702 -7.604) 9.311 4.927 ( -1.138 -7.644 -2.696) 8.185 5.040 ( -0.890 -8.966 2.662) 9.395 5.504 ( -0.101 -4.664 1.503) 4.901 5.615 ( 1.958 -6.104 -2.066) 6.735 5.930 ( 2.759 5.456 3.323) 6.958 6.034 ( -4.441 3.715 5.533) 8.008 7.527 ( -2.077 3.430 -1.853) 4.417 7.615 ( -3.714 0.533 -4.905) 6.176 8.424 ( 8.742 4.312 13.154) 16.372 8.464 ( 9.020 3.402 12.255) 15.592 9.160 ( -6.397 -0.782 -4.946) 8.124 9.279 ( -2.758 -3.990 -5.379) 7.242 9.621 ( -4.727 0.933 -5.258) 7.132 9.709 ( -4.925 -0.073 -8.447) 9.778 10.399 ( 0.586 4.384 -0.694) 4.477 10.581 ( -0.895 -0.722 -0.597) 1.296 13.265 ( 3.281 4.459 1.880) 5.846 13.375 ( 2.490 0.448 4.357) 5.038 13.730 ( 6.965 1.502 6.227) 9.463 13.805 ( 3.435 1.112 7.400) 8.234 14.502 ( -5.002 1.717 -1.629) 5.534 14.892 ( 1.015 -8.381 -6.265) 10.513 18.071 ( -2.275 0.778 -3.616) 4.343 18.224 ( -2.035 -2.211 -2.014) 3.618 18.634 ( -1.946 0.621 0.639) 2.141 18.677 ( 4.114 -1.297 1.102) 4.452======================= Grid point 273 (139/312) =======================q-point: ( 0.20 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.312 ( 9.164 16.328 2.622) 18.906 2.598 ( 3.102 10.400 11.356) 15.708 3.083 ( -0.650 -1.003 5.968) 6.087 3.545 ( 4.283 -12.775 -9.822) 16.673 3.572 ( -5.048 6.046 5.281) 9.483 3.820 ( -7.480 3.263 -1.849) 8.367 3.982 ( 2.697 12.351 4.626) 13.461 4.140 ( -0.343 0.555 2.500) 2.584 4.179 ( 5.315 9.080 -2.318) 10.774 4.621 ( 3.338 -7.123 -8.192) 11.358 4.889 ( 0.394 -9.481 -3.148) 9.998 5.057 ( -2.540 -9.398 5.017) 10.952 5.502 ( -0.839 -4.048 0.059) 4.135 5.630 ( 1.700 -6.051 -1.644) 6.497 5.929 ( -5.655 4.931 1.521) 7.656 6.013 ( -2.785 1.679 3.748) 4.962 7.493 ( -0.317 2.280 -0.685) 2.402 7.530 ( -1.482 0.881 -2.029) 2.663 8.584 ( 0.463 4.518 4.640) 6.493 8.728 ( 4.735 1.302 8.006) 9.392 9.051 ( -1.342 1.459 -1.265) 2.351 9.242 ( 2.125 -3.752 0.002) 4.311 9.493 ( -3.277 0.558 -3.498) 4.826 9.538 ( -4.383 0.463 -7.120) 8.373 10.400 ( 0.174 3.884 -0.759) 3.961 10.560 ( -0.931 -1.131 -0.143) 1.472 13.326 ( 2.524 4.913 -0.935) 5.602 13.441 ( 1.356 0.314 1.338) 1.931 13.871 ( 3.893 2.184 2.103) 4.934 13.902 ( 0.623 0.661 3.727) 3.836 14.401 ( -5.269 2.066 0.886) 5.728 14.865 ( 2.123 -9.854 -5.091) 11.293 18.021 ( -0.055 1.726 -1.659) 2.395 18.190 ( -0.189 -1.462 -0.313) 1.507 18.573 ( -4.141 2.693 -0.317) 4.950 18.773 ( 4.535 -4.638 0.717) 6.526======================= Grid point 274 (140/312) =======================q-point: ( 0.30 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.431 ( 3.734 12.580 -4.755) 13.958 2.792 ( 4.746 7.214 13.593) 16.104 3.062 ( -2.388 -5.836 -5.346) 8.266 3.451 ( -0.612 11.765 -2.602) 12.065 3.605 ( -3.780 -8.174 2.858) 9.448 3.718 ( -2.861 2.391 6.252) 7.280 4.018 ( -2.662 11.104 3.442) 11.926 4.176 ( 3.051 2.395 -1.025) 4.012 4.276 ( 7.519 5.953 -3.399) 10.175 4.608 ( 3.764 -7.281 -7.642) 11.206 4.876 ( 0.144 -9.719 -1.084) 9.780 5.023 ( -5.075 -10.766 2.682) 12.201 5.478 ( -1.193 -3.200 -1.291) 3.651 5.645 ( 1.793 -6.399 -1.857) 6.900 5.798 ( -7.722 4.108 -1.767) 8.924 5.970 ( -4.338 -1.927 0.378) 4.761 7.499 ( 0.783 1.729 0.989) 2.140 7.519 ( 0.439 0.985 0.945) 1.433 8.566 ( -1.937 3.455 -3.756) 5.458 8.722 ( -5.990 -1.089 -4.432) 7.531 9.069 ( 2.158 3.812 -0.132) 4.383 9.296 ( 1.420 -3.832 -1.215) 4.263 9.468 ( 1.378 2.191 5.361) 5.954 9.512 ( 2.582 0.949 7.395) 7.890 10.392 ( -0.039 3.381 -0.940) 3.509 10.544 ( -0.829 -1.791 -0.098) 1.976 13.333 ( 1.011 4.719 -4.147) 6.363 13.444 ( -0.315 0.106 -2.865) 2.884 13.891 ( -1.784 -0.406 -3.055) 3.561 13.915 ( 0.306 3.134 -1.546) 3.508 14.335 ( -4.041 3.038 3.194) 5.980 14.870 ( 2.920 -10.778 -3.293) 11.642 18.040 ( 2.113 2.766 1.272) 3.706 18.213 ( 1.418 -0.636 2.664) 3.085 18.488 ( -4.363 4.422 -0.644) 6.246 18.845 ( 3.054 -6.955 -0.572) 7.618======================= Grid point 275 (141/312) =======================q-point: ( 0.40 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.350 ( -3.810 10.226 -10.186) 14.928 2.910 ( -0.769 -2.399 -9.267) 9.603 3.026 ( 3.181 -1.975 7.812) 8.663 3.445 ( -1.365 14.032 3.509) 14.529 3.566 ( -3.701 -4.144 4.057) 6.880 3.714 ( -7.652 4.346 6.610) 11.006 4.015 ( 3.433 5.528 -1.409) 6.658 4.203 ( 0.657 3.560 -0.856) 3.720 4.404 ( 10.309 5.839 -2.688) 12.149 4.607 ( 3.375 -7.545 -5.875) 10.140 4.876 ( -0.399 -7.537 2.451) 7.935 4.954 ( -4.682 -10.906 2.813) 12.197 5.423 ( -2.184 -2.837 -3.967) 5.343 5.615 ( -4.401 -4.219 -6.561) 8.957 5.676 ( 0.202 -0.557 -0.952) 1.121 5.876 ( -3.971 -5.258 -2.638) 7.098 7.530 ( 0.305 1.376 1.618) 2.146 7.551 ( 0.961 0.545 2.729) 2.944 8.456 ( -2.186 1.476 -10.730) 11.049 8.488 ( -8.751 0.331 -12.768) 15.483 9.124 ( 2.405 4.093 3.938) 6.169 9.319 ( 1.663 -3.268 3.484) 5.058 9.614 ( 3.376 2.508 10.757) 11.549 9.684 ( 4.322 0.810 11.097) 11.936 10.383 ( 0.249 2.955 -1.090) 3.160 10.526 ( -0.816 -2.165 -0.360) 2.342 13.285 ( -0.354 3.745 -6.415) 7.436 13.378 ( -1.451 -0.289 -6.612) 6.775 13.784 ( -4.031 -0.008 -7.339) 8.373 13.855 ( -2.083 1.812 -6.914) 7.444 14.321 ( -1.779 5.369 4.957) 7.521 14.904 ( 3.430 -10.705 -1.771) 11.380 18.110 ( 2.540 3.137 3.368) 5.257 18.289 ( 2.033 -0.605 5.623) 6.010 18.414 ( -2.739 5.893 -0.380) 6.510 18.871 ( 1.148 -7.620 -1.887) 7.934======================= Grid point 276 (142/312) =======================q-point: (-0.50 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.133 ( -7.216 11.165 -11.270) 17.428 2.800 ( 0.990 -8.616 -11.225) 14.185 3.036 ( -6.972 0.717 -5.733) 9.055 3.387 ( -9.365 12.440 5.437) 16.493 3.599 ( 5.366 -6.446 -1.967) 8.615 3.631 ( -5.879 7.064 7.229) 11.693 4.088 ( 5.175 4.028 -2.096) 6.885 4.187 ( -2.482 6.177 1.690) 6.868 4.584 ( 4.253 -2.949 2.911) 5.938 4.656 ( 11.107 0.512 -1.022) 11.166 4.899 ( -5.688 -3.837 6.290) 9.308 4.929 ( 1.630 -7.577 3.222) 8.393 5.327 ( -2.312 -3.927 -6.718) 8.118 5.472 ( -2.119 -4.551 -6.956) 8.578 5.687 ( 0.771 -2.342 -0.915) 2.630 5.804 ( 0.564 -7.832 -4.145) 8.879 7.523 ( -1.491 0.840 -0.928) 1.947 7.584 ( -0.889 -0.851 1.516) 1.952 8.190 ( -6.479 2.829 -15.450) 16.991 8.312 ( -0.900 -0.462 -12.360) 12.401 9.239 ( 2.980 3.995 8.924) 10.221 9.421 ( 2.256 -3.223 8.581) 9.440 9.765 ( 1.937 2.544 9.371) 9.902 9.853 ( 2.689 0.354 9.479) 9.859 10.385 ( 1.219 2.557 -0.901) 2.973 10.506 ( -0.872 -1.850 -0.737) 2.174 13.203 ( -1.145 2.310 -7.056) 7.512 13.273 ( -1.615 -0.797 -8.473) 8.663 13.613 ( -4.631 0.933 -10.584) 11.590 13.722 ( -3.254 1.157 -9.141) 9.772 14.365 ( 0.666 7.207 5.804) 9.277 14.956 ( 3.577 -9.792 -1.107) 10.483 18.182 ( 1.387 2.726 3.579) 4.708 18.344 ( -1.996 -0.437 3.822) 4.334 18.431 ( 3.351 5.383 3.804) 7.394 18.851 ( -0.801 -6.434 -2.707) 7.026======================= Grid point 277 (143/312) =======================q-point: (-0.40 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.899 ( -6.149 14.675 -9.921) 18.751 2.688 ( -15.188 6.640 -17.093) 23.810 2.735 ( 2.325 -11.809 -8.093) 14.504 3.272 ( -8.687 5.529 2.981) 10.721 3.559 ( 0.765 -3.680 -7.457) 8.351 3.709 ( -0.989 5.916 7.845) 9.875 4.168 ( -0.680 4.684 4.288) 6.387 4.177 ( 2.938 4.987 3.443) 6.734 4.645 ( 2.821 -6.807 0.347) 7.376 4.821 ( -6.780 -0.736 2.796) 7.371 4.921 ( 8.717 2.159 7.657) 11.802 5.023 ( 6.402 -1.701 1.955) 6.906 5.207 ( -2.430 -5.964 -7.199) 9.659 5.435 ( 1.779 -3.414 -1.472) 4.122 5.673 ( 0.163 -3.351 -2.664) 4.284 5.828 ( 5.012 -7.673 -2.314) 9.452 7.471 ( -0.939 -0.308 -3.871) 3.996 7.508 ( -4.375 -1.551 -6.427) 7.928 8.003 ( -0.597 4.604 -8.778) 9.930 8.195 ( -0.083 -1.138 -9.749) 9.815 9.392 ( 2.667 3.030 10.545) 11.292 9.545 ( 0.769 -3.323 9.935) 10.504 9.860 ( 0.095 2.492 6.099) 6.589 9.963 ( 0.850 -0.241 6.326) 6.387 10.415 ( 2.760 1.908 -0.168) 3.360 10.480 ( -0.952 -0.664 -1.078) 1.584 13.114 ( -1.346 0.926 -5.824) 6.048 13.164 ( -1.447 -1.395 -7.478) 7.743 13.427 ( -3.215 3.475 -11.242) 12.198 13.578 ( -2.575 0.817 -8.367) 8.793 14.452 ( 2.509 7.435 5.475) 9.568 15.008 ( 3.262 -8.484 -1.331) 9.186 18.225 ( 0.179 2.025 2.215) 3.007 18.352 ( -0.768 -0.405 3.689) 3.790 18.534 ( 2.551 3.198 4.475) 6.063 18.793 ( -2.418 -3.866 -2.768) 5.335======================= Grid point 278 (144/312) =======================q-point: (-0.30 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.740 ( -1.161 19.882 -7.651) 21.335 2.241 ( -14.602 12.129 -14.233) 23.726 2.737 ( 3.938 -12.950 -2.569) 13.777 3.128 ( -7.714 -1.977 -0.380) 7.972 3.489 ( -4.478 5.836 -0.662) 7.386 3.722 ( -0.977 4.433 0.504) 4.567 4.207 ( 0.474 1.148 4.323) 4.498 4.289 ( 1.046 2.030 7.747) 8.077 4.666 ( -0.569 -3.509 -3.008) 4.656 4.756 ( 0.043 1.545 -0.365) 1.588 5.021 ( -1.558 -2.760 3.486) 4.711 5.125 ( 4.870 -6.690 -8.626) 11.954 5.237 ( 5.850 0.985 7.659) 9.688 5.463 ( 1.540 1.029 -0.154) 1.859 5.658 ( 1.277 -4.390 -2.932) 5.431 5.913 ( 4.901 -5.863 -0.366) 7.650 7.359 ( -0.735 1.607 -7.577) 7.780 7.474 ( 4.609 -1.970 -2.406) 5.560 7.945 ( -0.220 3.897 -4.593) 6.027 8.108 ( -0.768 -0.759 -6.834) 6.919 9.523 ( 0.837 1.229 8.528) 8.656 9.628 ( -2.034 -3.603 8.668) 9.605 9.891 ( -1.204 2.866 2.441) 3.953 10.013 ( -0.032 -0.595 2.634) 2.701 10.450 ( -0.705 1.100 -1.655) 2.109 10.480 ( 3.563 0.887 0.808) 3.759 13.051 ( -0.701 0.151 -2.765) 2.856 13.085 ( -0.913 -1.495 -3.206) 3.654 13.294 ( -0.178 6.178 -8.999) 10.917 13.478 ( -0.579 0.443 -5.547) 5.594 14.552 ( 3.154 6.223 3.720) 7.906 15.043 ( 2.399 -7.306 -2.231) 8.007 18.238 ( -0.327 1.425 1.091) 1.824 18.382 ( -0.237 -1.963 3.385) 3.920 18.596 ( 0.343 2.153 2.357) 3.211 18.718 ( -2.844 -1.166 -1.895) 3.611======================= Grid point 279 (145/312) =======================q-point: (-0.20 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.708 ( 4.758 25.173 -7.633) 26.732 1.958 ( -7.053 16.699 1.596) 18.198 2.832 ( 4.023 -12.555 5.808) 14.407 3.012 ( -4.511 -4.514 1.283) 6.509 3.392 ( -8.848 12.472 7.600) 17.076 3.712 ( 3.071 -0.248 -6.020) 6.762 4.239 ( -0.953 -0.946 1.758) 2.213 4.318 ( -4.076 -1.589 3.088) 5.354 4.618 ( -0.514 2.557 -2.972) 3.954 4.770 ( 2.734 2.860 -4.647) 6.103 5.006 ( -1.889 -4.357 1.856) 5.099 5.147 ( 3.495 -8.844 -5.285) 10.880 5.363 ( 1.041 -0.901 5.653) 5.819 5.496 ( 3.905 4.171 -2.121) 6.095 5.662 ( 2.042 -3.337 -2.414) 4.597 5.980 ( 2.490 -3.737 0.182) 4.494 7.386 ( 7.794 4.757 0.491) 9.145 7.606 ( 9.027 -1.995 2.901) 9.690 7.878 ( -2.193 3.840 -4.084) 6.020 8.025 ( -1.913 -0.212 -5.351) 5.687 9.569 ( -2.499 -1.090 3.319) 4.295 9.636 ( -4.926 -4.462 5.600) 8.691 9.872 ( -1.632 4.194 -0.515) 4.530 10.016 ( -0.667 -0.438 -0.747) 1.093 10.421 ( -0.602 2.948 -1.528) 3.375 10.552 ( 3.275 -0.267 0.300) 3.300 13.044 ( 0.813 0.465 1.407) 1.690 13.084 ( 1.086 -1.009 2.856) 3.217 13.249 ( 2.762 7.117 -4.761) 8.997 13.455 ( 1.982 0.078 -1.453) 2.459 14.627 ( 2.269 4.282 0.869) 4.923 15.047 ( 1.039 -6.678 -3.593) 7.654 18.241 ( -0.299 1.006 0.683) 1.252 18.391 ( -1.705 -2.450 1.238) 3.231 18.592 ( -1.487 1.857 -0.198) 2.387 18.670 ( -1.195 -0.403 -0.027) 1.261======================= Grid point 280 (146/312) =======================q-point: (-0.10 0.36 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.741 ( 6.147 25.190 -3.241) 26.131 2.037 ( 4.379 20.096 13.633) 24.676 2.900 ( -4.766 -0.609 9.115) 10.304 3.068 ( 5.579 -14.843 6.815) 17.260 3.362 ( -6.039 14.801 15.861) 22.519 3.724 ( 6.411 -4.038 -8.448) 11.348 4.191 ( -3.740 0.042 -2.768) 4.653 4.240 ( -3.894 -2.574 -1.637) 4.946 4.562 ( -1.987 4.013 -5.508) 7.098 4.743 ( 0.904 4.006 -7.479) 8.532 4.991 ( -2.569 -5.797 2.944) 6.991 5.125 ( 0.762 -7.801 -6.640) 10.273 5.424 ( 0.911 -4.021 4.097) 5.812 5.563 ( 4.072 -0.473 -0.813) 4.179 5.694 ( 4.401 2.567 -1.443) 5.295 6.017 ( 0.538 -1.117 2.109) 2.446 7.600 ( 7.590 5.988 5.597) 11.171 7.765 ( 3.941 2.465 -2.221) 5.152 7.865 ( 2.749 1.164 4.467) 5.373 7.955 ( 2.063 0.446 0.072) 2.112 9.502 ( -5.429 -2.390 -1.693) 6.169 9.554 ( -6.674 -4.529 -0.189) 8.068 9.825 ( -2.245 4.215 -2.042) 5.194 9.970 ( -2.151 -0.211 -3.642) 4.235 10.401 ( -0.017 4.145 -1.270) 4.335 10.596 ( 1.606 -0.797 -0.649) 1.907 13.098 ( 2.005 1.856 3.650) 4.560 13.170 ( 2.666 -0.474 5.939) 6.528 13.316 ( 6.270 5.639 2.507) 8.797 13.521 ( 4.145 0.124 3.080) 5.165 14.645 ( 0.134 2.527 -1.744) 3.074 15.010 ( -0.203 -6.648 -5.146) 8.409 18.230 ( -1.524 0.381 -0.814) 1.769 18.348 ( -2.695 -1.958 -0.514) 3.371 18.563 ( -0.382 2.110 -1.144) 2.430 18.666 ( -0.248 -1.139 1.163) 1.647======================= Grid point 281 (147/312) =======================q-point: ( 0.00 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.329 ( 8.215 22.934 -1.007) 24.382 2.568 ( 2.137 8.922 8.292) 12.366 2.845 ( 8.324 -11.077 1.310) 13.918 2.913 ( 1.132 -12.646 12.285) 17.668 3.701 ( 2.894 6.870 12.535) 14.584 3.765 ( 4.257 -0.401 3.510) 5.532 4.112 ( -3.923 1.228 -1.015) 4.235 4.128 ( -3.303 -0.919 -0.389) 3.451 4.564 ( -2.790 8.768 -7.897) 12.125 4.688 ( -2.398 -1.664 -7.963) 8.481 4.862 ( -3.407 -3.799 1.190) 5.240 4.887 ( -1.116 -7.720 -5.519) 9.555 5.440 ( 1.145 0.904 1.015) 1.777 5.495 ( 1.551 -4.525 -1.329) 4.964 5.941 ( 4.294 6.210 3.317) 8.246 6.030 ( 1.448 -2.806 3.859) 4.986 7.680 ( -3.718 3.409 -3.589) 6.191 7.730 ( -3.834 -1.712 -4.978) 6.512 8.153 ( 12.568 3.434 12.096) 17.778 8.195 ( 11.209 -0.854 11.886) 16.360 9.322 ( -7.097 -0.078 -3.837) 8.068 9.347 ( -6.344 -2.613 -3.766) 7.827 9.800 ( -4.029 2.976 -5.389) 7.357 9.847 ( -3.994 -1.768 -6.070) 7.478 10.487 ( 0.287 4.616 -0.625) 4.667 10.562 ( 0.030 -3.084 -0.727) 3.169 13.229 ( 2.835 2.028 5.419) 6.443 13.263 ( 2.858 -1.467 5.899) 6.717 13.587 ( 8.315 4.247 4.269) 10.267 13.648 ( 6.883 -1.791 4.748) 8.551 14.668 ( -2.177 5.572 -4.329) 7.385 14.800 ( -1.072 -7.808 -5.936) 9.867 18.186 ( -3.417 2.171 -2.270) 4.641 18.236 ( -3.156 -2.917 -1.700) 4.621 18.614 ( 1.631 1.825 0.127) 2.451 18.647 ( 0.328 -1.484 0.557) 1.619======================= Grid point 282 (148/312) =======================q-point: ( 0.10 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.482 ( 8.093 19.312 0.684) 20.950 2.661 ( 1.406 5.356 5.542) 7.834 2.980 ( 2.051 -3.493 5.975) 7.219 3.061 ( 5.684 -15.704 5.834) 17.690 3.844 ( 0.686 5.510 -0.278) 5.559 3.889 ( 2.177 1.476 6.760) 7.254 4.056 ( -0.325 3.532 1.098) 3.713 4.101 ( -0.462 -1.338 4.133) 4.369 4.425 ( -1.972 10.798 -9.306) 14.391 4.577 ( -1.108 -3.579 -6.411) 7.426 4.787 ( -1.915 -4.147 -4.005) 6.075 4.857 ( -2.236 -8.968 4.277) 10.184 5.466 ( 0.585 0.516 0.686) 1.039 5.513 ( 1.410 -4.168 -0.892) 4.490 6.022 ( 0.258 3.850 3.611) 5.284 6.066 ( -2.355 -0.451 4.363) 4.978 7.582 ( -2.908 2.226 -2.944) 4.699 7.611 ( -3.540 -0.871 -3.972) 5.391 8.489 ( 8.911 2.264 12.519) 15.533 8.505 ( 9.220 0.712 12.367) 15.442 9.160 ( -5.127 1.063 -4.454) 6.874 9.204 ( -3.848 -3.413 -4.471) 6.815 9.656 ( -4.816 2.244 -6.807) 8.635 9.694 ( -4.935 -1.515 -7.770) 9.329 10.483 ( -0.196 4.093 -0.409) 4.118 10.549 ( -0.808 -2.645 -0.436) 2.800 13.328 ( 2.875 2.400 3.602) 5.196 13.364 ( 2.720 -1.400 3.984) 5.023 13.779 ( 7.084 2.968 4.483) 8.893 13.817 ( 5.397 -0.586 5.342) 7.617 14.575 ( -3.454 6.051 -3.392) 7.749 14.723 ( -0.888 -8.852 -5.659) 10.544 18.107 ( -2.154 2.807 -2.361) 4.253 18.169 ( -1.940 -3.321 -1.763) 4.231 18.646 ( 0.181 0.666 0.231) 0.728 18.659 ( 1.527 -0.729 0.328) 1.723======================= Grid point 283 (149/312) =======================q-point: ( 0.20 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.625 ( 7.413 14.683 -1.714) 16.537 2.746 ( 2.266 3.312 5.630) 6.914 3.051 ( 0.268 -0.147 3.126) 3.141 3.203 ( 4.667 -15.937 2.648) 16.816 3.774 ( -4.780 8.851 -0.393) 10.067 3.860 ( -5.104 -0.155 -0.151) 5.109 4.132 ( 4.596 2.166 -0.551) 5.110 4.164 ( -0.098 0.668 5.346) 5.388 4.358 ( 3.447 10.291 -5.755) 12.284 4.534 ( 1.737 -4.298 -3.669) 5.911 4.730 ( -1.321 -2.366 -2.026) 3.384 4.858 ( -3.768 -10.752 5.235) 12.538 5.473 ( -0.096 0.845 -0.058) 0.853 5.525 ( 0.883 -4.404 -0.922) 4.585 6.003 ( -5.558 2.722 1.851) 6.460 6.031 ( -5.058 -0.171 2.742) 5.756 7.527 ( -0.797 1.176 -1.267) 1.904 7.538 ( -1.208 -0.071 -1.672) 2.064 8.665 ( 0.583 3.785 4.759) 6.109 8.722 ( 1.873 -1.870 6.042) 6.597 9.095 ( 1.422 3.124 -0.232) 3.440 9.165 ( 2.340 -4.064 0.372) 4.704 9.514 ( -3.361 1.373 -4.400) 5.704 9.536 ( -3.937 -0.716 -5.650) 6.924 10.471 ( -0.664 3.439 -0.364) 3.521 10.527 ( -1.169 -2.355 -0.162) 2.634 13.394 ( 2.020 2.528 0.235) 3.244 13.430 ( 1.791 -1.314 0.518) 2.281 13.907 ( 3.477 2.034 0.804) 4.108 13.928 ( 2.473 0.314 2.175) 3.309 14.489 ( -3.297 7.302 -0.842) 8.056 14.666 ( 0.053 -10.471 -4.004) 11.210 18.074 ( 0.150 3.522 -0.252) 3.535 18.143 ( 0.076 -3.304 0.298) 3.318 18.629 ( -1.417 3.126 -0.652) 3.494 18.694 ( 1.721 -3.737 -0.329) 4.127======================= Grid point 284 (150/312) =======================q-point: ( 0.30 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.672 ( 2.426 11.659 -8.437) 14.595 2.845 ( 2.830 -5.114 -0.220) 5.849 3.044 ( -1.229 7.911 1.947) 8.239 3.286 ( 2.226 -15.409 2.293) 15.737 3.723 ( -2.916 9.840 4.213) 11.094 3.801 ( -2.843 2.084 4.419) 5.653 4.175 ( -2.112 1.543 2.615) 3.698 4.177 ( 2.335 -0.427 -2.739) 3.624 4.421 ( 7.620 9.126 -3.725) 12.459 4.556 ( 2.556 1.406 -1.499) 3.280 4.686 ( -0.633 -6.875 -2.668) 7.401 4.803 ( -6.146 -11.672 2.692) 13.463 5.462 ( -0.574 1.430 -1.237) 1.976 5.527 ( 0.544 -5.168 -1.663) 5.456 5.875 ( -8.236 3.539 -0.946) 9.014 5.931 ( -7.020 -2.371 -0.297) 7.416 7.524 ( 0.675 0.849 0.703) 1.292 7.531 ( 0.530 0.158 0.707) 0.898 8.632 ( -3.412 3.277 -4.130) 6.280 8.688 ( -4.991 -2.464 -4.365) 7.074 9.144 ( 2.457 3.986 -0.853) 4.759 9.221 ( 2.021 -4.025 -1.300) 4.688 9.504 ( 1.875 1.417 6.529) 6.940 9.520 ( 2.267 -0.229 7.283) 7.631 10.453 ( -0.762 2.973 -0.480) 3.106 10.504 ( -1.141 -2.346 -0.138) 2.612 13.399 ( 0.362 2.367 -3.842) 4.527 13.432 ( 0.133 -1.208 -3.891) 4.076 13.913 ( -0.931 2.127 -3.805) 4.457 13.944 ( -0.300 -0.404 -3.344) 3.382 14.450 ( -1.441 8.873 1.984) 9.205 14.652 ( 1.559 -11.563 -1.675) 11.787 18.107 ( 1.780 3.938 2.853) 5.178 18.177 ( 1.416 -3.026 3.457) 4.807 18.588 ( -1.624 5.988 -1.427) 6.366 18.712 ( 1.212 -6.824 -1.318) 7.055======================= Grid point 285 (151/312) =======================q-point: ( 0.40 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.557 ( -2.883 11.068 -12.269) 16.773 2.762 ( -2.753 -10.089 -11.307) 15.402 3.123 ( 2.806 9.261 4.839) 10.819 3.342 ( 2.035 -12.907 0.630) 13.082 3.709 ( -3.876 10.530 3.509) 11.757 3.801 ( -5.100 1.393 6.077) 8.055 4.147 ( 1.479 5.030 -2.452) 5.788 4.218 ( 1.181 -2.335 3.127) 4.077 4.533 ( 4.876 5.147 -0.130) 7.090 4.551 ( 0.975 6.256 -2.891) 6.960 4.706 ( 1.951 -9.635 2.966) 10.268 4.743 ( 0.301 -10.403 1.611) 10.531 5.414 ( -2.266 1.932 -4.150) 5.107 5.493 ( -1.819 -6.053 -4.707) 7.881 5.721 ( -5.237 3.325 -2.416) 6.657 5.790 ( -5.887 -3.944 -2.545) 7.529 7.551 ( 0.299 0.743 1.478) 1.681 7.557 ( 0.579 0.025 1.987) 2.070 8.480 ( -4.149 0.919 -11.804) 12.545 8.490 ( -6.500 -0.148 -12.383) 13.986 9.195 ( 2.454 3.378 3.706) 5.583 9.257 ( 2.089 -3.235 3.458) 5.175 9.657 ( 3.512 1.945 10.961) 11.673 9.684 ( 3.830 -0.759 11.186) 11.848 10.437 ( -0.360 2.647 -0.656) 2.750 10.484 ( -0.805 -2.319 -0.293) 2.472 13.337 ( -1.106 1.834 -6.945) 7.268 13.364 ( -1.199 -1.116 -7.504) 7.681 13.813 ( -3.269 2.556 -7.876) 8.902 13.858 ( -2.644 -1.505 -7.918) 8.482 14.473 ( 0.807 10.112 3.498) 10.730 14.687 ( 2.901 -11.697 0.079) 12.052 18.180 ( 1.425 3.919 5.065) 6.561 18.249 ( 0.970 -3.118 5.892) 6.737 18.553 ( -0.245 8.209 -1.508) 8.350 18.716 ( 1.005 -8.519 -1.926) 8.791======================= Grid point 286 (152/312) =======================q-point: (-0.50 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.364 ( -4.118 12.540 -12.240) 18.001 2.599 ( -2.103 -11.752 -11.190) 16.363 3.125 ( -3.134 8.055 -7.720) 11.588 3.325 ( -1.445 -12.058 -8.521) 14.836 3.657 ( -3.799 9.298 2.750) 10.414 3.747 ( -4.393 0.828 5.798) 7.321 4.189 ( 2.993 5.543 0.792) 6.349 4.265 ( -0.941 -0.416 5.397) 5.495 4.525 ( 0.273 2.201 0.605) 2.298 4.648 ( 1.054 -6.461 6.917) 9.524 4.810 ( 8.183 0.698 3.692) 9.005 4.860 ( 4.318 -2.897 7.236) 8.911 5.299 ( -2.920 1.270 -8.144) 8.744 5.371 ( -2.301 -5.483 -8.456) 10.337 5.662 ( -0.074 0.013 -1.559) 1.561 5.694 ( -1.235 -3.526 -3.002) 4.793 7.543 ( -1.832 1.156 -0.945) 2.363 7.565 ( -1.644 -1.113 -0.078) 1.987 8.246 ( -3.970 2.790 -14.738) 15.517 8.291 ( -2.047 -1.793 -13.696) 13.964 9.306 ( 2.566 3.078 8.737) 9.612 9.362 ( 2.278 -2.960 8.661) 9.432 9.811 ( 1.979 2.181 9.384) 9.835 9.844 ( 2.185 -1.170 9.511) 9.829 10.431 ( 0.562 2.242 -0.674) 2.408 10.470 ( -0.230 -1.911 -0.464) 1.980 13.234 ( -1.794 1.117 -7.987) 8.262 13.253 ( -1.678 -1.060 -8.913) 9.131 13.657 ( -3.467 3.130 -10.366) 11.369 13.711 ( -3.045 -2.053 -10.238) 10.877 14.540 ( 2.331 10.595 3.794) 11.493 14.752 ( 3.612 -11.205 0.740) 11.796 18.244 ( -0.114 3.492 5.138) 6.213 18.307 ( -1.089 -2.884 5.533) 6.334 18.563 ( 2.003 7.768 0.165) 8.024 18.714 ( 0.748 -7.768 -1.686) 7.984======================= Grid point 287 (153/312) =======================q-point: (-0.40 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.194 ( -1.933 15.614 -9.880) 18.579 2.482 ( 0.119 -14.265 -8.347) 16.528 2.867 ( -8.928 11.881 -17.778) 23.172 3.127 ( -5.124 -14.252 -16.219) 22.191 3.651 ( -0.953 9.143 3.522) 9.844 3.770 ( -1.638 -1.961 7.323) 7.756 4.253 ( 0.140 4.219 4.969) 6.520 4.288 ( -2.918 3.038 7.235) 8.372 4.565 ( 2.922 1.414 1.079) 3.421 4.706 ( -0.098 -9.760 4.003) 10.549 4.948 ( -2.596 3.161 7.377) 8.435 5.023 ( 2.128 -3.341 8.440) 9.324 5.200 ( 5.793 6.351 -9.814) 13.047 5.340 ( 6.306 -6.664 -4.098) 10.049 5.643 ( 0.630 0.596 -2.562) 2.705 5.700 ( 3.937 -5.199 -1.996) 6.820 7.471 ( -1.859 0.326 -5.045) 5.387 7.483 ( -3.172 -0.951 -5.916) 6.780 8.088 ( -0.025 4.175 -9.931) 10.773 8.157 ( 0.162 -2.862 -10.267) 10.659 9.441 ( 1.447 2.350 10.349) 10.711 9.488 ( 0.733 -2.670 10.251) 10.618 9.908 ( 0.254 2.349 6.107) 6.549 9.946 ( 0.457 -1.511 6.256) 6.452 10.447 ( 1.765 1.366 -0.382) 2.264 10.467 ( 0.403 -0.793 -0.492) 1.016 13.126 ( -1.697 0.515 -6.650) 6.883 13.140 ( -1.612 -0.980 -7.422) 7.658 13.502 ( -1.711 3.883 -10.730) 11.539 13.563 ( -1.732 -2.232 -10.160) 10.545 14.625 ( 3.026 10.223 3.138) 11.113 14.825 ( 3.584 -10.322 0.354) 10.932 18.274 ( -1.137 2.894 3.565) 4.730 18.326 ( -1.574 -2.229 3.981) 4.826 18.612 ( 1.712 4.760 1.638) 5.318 18.707 ( -0.181 -4.969 -0.967) 5.065======================= Grid point 288 (154/312) =======================q-point: (-0.30 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.120 ( 2.585 18.996 -5.639) 19.984 2.441 ( 0.549 -10.773 -4.488) 11.683 2.542 ( -5.421 11.915 -14.629) 19.631 2.880 ( -3.524 -18.445 -15.539) 24.374 3.658 ( -2.229 10.053 2.627) 10.627 3.788 ( -4.017 -1.917 5.896) 7.387 4.263 ( -4.081 4.024 6.473) 8.646 4.315 ( -3.498 -0.458 7.272) 8.083 4.637 ( 3.836 2.803 0.019) 4.751 4.749 ( 3.177 -4.935 -0.218) 5.873 4.945 ( -2.615 -0.881 3.968) 4.833 5.003 ( -2.205 -5.004 -1.894) 5.787 5.329 ( 6.342 6.135 1.111) 8.893 5.436 ( 4.418 -4.385 -0.127) 6.226 5.654 ( 3.711 4.558 -2.628) 6.439 5.781 ( 6.141 -7.480 -1.304) 9.765 7.394 ( 1.887 2.005 -5.866) 6.480 7.434 ( 3.764 -2.159 -3.990) 5.894 8.018 ( 0.018 3.605 -6.187) 7.161 8.077 ( -0.182 -2.449 -6.894) 7.319 9.542 ( -1.175 1.048 8.555) 8.699 9.572 ( -2.230 -2.233 8.814) 9.362 9.947 ( -0.461 2.758 2.595) 3.815 9.991 ( -0.135 -1.752 2.674) 3.200 10.473 ( 0.902 1.098 -0.707) 1.587 10.486 ( 2.357 -0.236 0.114) 2.371 13.054 ( -0.625 0.282 -3.040) 3.116 13.064 ( -0.604 -0.772 -3.083) 3.235 13.396 ( 0.921 4.436 -8.997) 10.074 13.461 ( 0.517 -2.235 -7.912) 8.238 14.702 ( 2.723 9.075 1.388) 9.576 14.882 ( 2.734 -9.270 -0.980) 9.714 18.280 ( -1.202 2.761 2.284) 3.780 18.335 ( -1.158 -2.803 2.969) 4.244 18.641 ( -0.144 2.434 0.962) 2.621 18.686 ( -1.282 -2.153 -0.611) 2.580======================= Grid point 289 (155/312) =======================q-point: (-0.20 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.180 ( 7.893 22.579 -3.405) 24.160 2.294 ( -3.591 18.431 -3.474) 19.096 2.560 ( 5.496 -14.922 4.650) 16.568 2.725 ( 1.107 -21.190 -10.527) 23.687 3.619 ( -5.020 10.731 3.989) 12.500 3.747 ( -5.255 -1.378 4.188) 6.860 4.244 ( -3.548 1.602 3.365) 5.146 4.284 ( -5.434 -2.123 3.744) 6.933 4.685 ( 1.519 5.658 -1.269) 5.995 4.800 ( 3.312 -2.296 -3.157) 5.119 4.930 ( -2.867 -2.346 2.914) 4.713 4.976 ( 1.839 -6.121 -3.573) 7.323 5.397 ( 0.864 3.599 0.923) 3.815 5.480 ( 1.458 -4.489 -1.116) 4.851 5.722 ( 5.738 7.786 -1.952) 9.867 5.874 ( 4.974 -7.209 -0.909) 8.805 7.475 ( 9.405 4.475 1.257) 10.491 7.553 ( 9.839 -3.529 2.114) 10.665 7.949 ( -1.616 3.394 -4.894) 6.171 8.003 ( -1.553 -2.093 -5.244) 5.856 9.553 ( -4.397 -0.122 4.153) 6.049 9.572 ( -5.212 -2.154 5.095) 7.600 9.946 ( -0.865 3.332 -0.391) 3.464 9.996 ( -0.620 -1.807 -0.513) 1.978 10.481 ( 0.784 3.059 -0.763) 3.249 10.530 ( 2.223 -1.940 -0.152) 2.954 13.054 ( 1.226 0.583 1.920) 2.352 13.067 ( 1.338 -0.768 2.403) 2.855 13.364 ( 3.581 4.882 -5.532) 8.202 13.434 ( 3.142 -2.390 -4.039) 5.647 14.743 ( 1.444 7.553 -1.137) 7.774 14.900 ( 1.218 -8.355 -2.943) 8.941 18.278 ( -1.229 2.697 1.600) 3.368 18.336 ( -1.598 -3.137 1.734) 3.924 18.627 ( -1.297 1.696 -0.470) 2.187 18.655 ( -1.226 -1.180 -0.529) 1.782======================= Grid point 290 (156/312) =======================q-point: (-0.10 0.45 0.20)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.227 ( 5.961 24.792 -5.926) 26.179 2.398 ( 5.038 16.265 11.528) 20.563 2.717 ( 6.106 -19.661 -4.542) 21.083 2.743 ( 4.448 -13.886 11.611) 18.640 3.595 ( -2.801 9.686 8.091) 12.928 3.708 ( -2.090 -1.703 3.485) 4.406 4.193 ( -3.825 0.221 0.010) 3.832 4.205 ( -4.777 -1.111 0.018) 4.905 4.661 ( -1.191 6.958 -4.086) 8.157 4.786 ( -0.125 -2.089 -5.948) 6.306 4.903 ( -2.822 -1.986 1.810) 3.897 4.958 ( 0.524 -6.933 -5.828) 9.073 5.413 ( 0.726 2.240 0.602) 2.430 5.486 ( 1.095 -4.905 -1.697) 5.304 5.823 ( 5.925 7.874 0.715) 9.880 5.954 ( 3.689 -5.352 1.397) 6.649 7.702 ( 7.343 4.552 4.086) 9.557 7.768 ( 6.392 -2.055 1.464) 6.872 7.903 ( 2.522 2.584 1.465) 3.897 7.945 ( 2.595 -1.516 0.183) 3.011 9.470 ( -6.436 -0.527 -0.385) 6.469 9.487 ( -6.640 -2.286 0.196) 7.025 9.901 ( -2.345 3.432 -3.092) 5.181 9.951 ( -2.216 -1.786 -3.454) 4.476 10.486 ( 0.586 4.380 -0.802) 4.492 10.558 ( 1.206 -3.012 -0.628) 3.305 13.126 ( 2.407 1.299 5.198) 5.874 13.151 ( 2.690 -1.228 6.046) 6.730 13.426 ( 6.549 5.122 -0.440) 8.326 13.500 ( 5.742 -2.478 0.769) 6.301 14.730 ( -0.341 6.193 -3.405) 7.076 14.869 ( -0.317 -7.771 -4.861) 9.172 18.255 ( -2.481 2.129 -0.041) 3.269 18.303 ( -2.843 -2.616 -0.150) 3.866 18.603 ( -0.186 2.046 -0.728) 2.180 18.639 ( -0.104 -1.677 0.025) 1.680======================= Grid point 341 (157/312) =======================q-point: ( 0.00 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.531 ( 7.537 0.000 26.241) 27.302 1.670 ( -5.056 0.000 26.374) 26.854 2.847 ( -3.682 0.000 27.522) 27.767 2.965 ( -3.034 0.000 33.619) 33.756 3.406 ( -0.573 0.000 -15.323) 15.334 3.592 ( 0.126 0.000 -18.494) 18.495 4.036 ( -7.224 0.000 -8.231) 10.952 4.122 ( -8.203 0.000 0.609) 8.225 4.555 ( 9.499 0.000 -1.746) 9.658 4.793 ( 5.085 0.000 -7.863) 9.364 5.084 ( -0.744 0.000 4.501) 4.563 5.175 ( 1.049 0.000 4.917) 5.028 5.397 ( 8.940 0.000 -3.024) 9.437 5.499 ( -3.360 0.000 -2.181) 4.005 6.013 ( -2.304 0.000 2.207) 3.191 6.130 ( 4.381 0.000 -1.081) 4.513 7.313 ( -1.750 0.000 2.370) 2.946 7.457 ( -2.137 0.000 -1.319) 2.511 8.152 ( 7.792 0.000 15.317) 17.185 8.248 ( 6.145 0.000 14.320) 15.583 9.246 ( -7.635 0.000 -1.738) 7.831 9.317 ( -1.511 0.000 -7.824) 7.968 9.661 ( -6.991 0.000 -8.233) 10.801 9.878 ( -4.731 0.000 -10.563) 11.574 10.255 ( -1.374 0.000 -1.182) 1.812 10.382 ( 4.537 0.000 -2.147) 5.019 13.185 ( -4.882 0.000 19.036) 19.652 13.317 ( 1.447 0.000 6.847) 6.999 13.706 ( 1.810 0.000 7.250) 7.473 13.873 ( 15.445 0.000 -4.713) 16.148 14.687 ( -8.557 0.000 0.040) 8.557 15.035 ( 4.932 0.000 -5.628) 7.483 18.124 ( -0.423 0.000 -4.430) 4.450 18.255 ( -1.928 0.000 -6.309) 6.597 18.691 ( -8.172 0.000 2.230) 8.471 18.771 ( 13.130 0.000 -0.824) 13.156======================= Grid point 342 (158/312) =======================q-point: ( 0.10 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.915 ( 2.752 0.000 26.491) 26.634 1.961 ( 10.551 0.000 25.755) 27.833 2.925 ( -7.410 0.000 14.118) 15.944 3.233 ( 1.343 0.000 -20.153) 20.197 3.275 ( -1.488 0.000 25.755) 25.798 3.484 ( 5.432 0.000 -11.807) 12.997 3.794 ( -9.060 0.000 -7.998) 12.085 4.040 ( -3.667 0.000 7.544) 8.388 4.655 ( 4.391 0.000 -3.863) 5.849 4.888 ( 11.593 0.000 -7.560) 13.840 5.016 ( -5.134 0.000 1.142) 5.259 5.355 ( 7.497 0.000 6.375) 9.841 5.404 ( -4.245 0.000 -2.648) 5.003 5.526 ( 7.846 0.000 -3.195) 8.471 5.981 ( -2.771 0.000 0.896) 2.912 6.179 ( 2.362 0.000 -1.405) 2.749 7.323 ( 0.174 0.000 2.571) 2.577 7.413 ( -0.977 0.000 -0.657) 1.177 8.418 ( 6.215 0.000 10.100) 11.859 8.460 ( 3.388 0.000 9.190) 9.795 9.120 ( -6.477 0.000 2.834) 7.070 9.271 ( 1.825 0.000 -1.107) 2.135 9.442 ( -6.530 0.000 -8.990) 11.112 9.686 ( -4.446 0.000 -10.492) 11.395 10.221 ( -1.387 0.000 -0.478) 1.467 10.445 ( 4.925 0.000 -2.797) 5.664 13.273 ( -6.306 0.000 19.320) 20.323 13.390 ( -0.262 0.000 5.352) 5.358 13.786 ( -0.067 0.000 5.209) 5.209 14.052 ( 12.944 0.000 -12.622) 18.080 14.507 ( -9.415 0.000 -1.719) 9.571 15.090 ( 5.692 0.000 -3.213) 6.536 18.088 ( 0.721 0.000 -3.025) 3.110 18.167 ( -1.242 0.000 -5.002) 5.154 18.536 ( -9.863 0.000 0.643) 9.884 18.992 ( 11.929 0.000 -2.379) 12.164======================= Grid point 343 (159/312) =======================q-point: ( 0.20 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.259 ( 6.121 0.000 24.882) 25.624 2.396 ( 8.445 0.000 25.786) 27.134 2.882 ( -6.441 0.000 5.142) 8.241 3.080 ( 5.410 0.000 -22.655) 23.292 3.354 ( -7.007 0.000 9.019) 11.421 3.554 ( 7.574 0.000 -0.375) 7.583 3.573 ( -8.441 0.000 -3.409) 9.103 4.132 ( 1.172 0.000 11.024) 11.086 4.693 ( 5.724 0.000 -6.244) 8.471 4.943 ( -4.800 0.000 2.755) 5.535 4.969 ( 6.184 0.000 -12.005) 13.504 5.290 ( -3.894 0.000 -3.928) 5.531 5.534 ( 7.104 0.000 2.109) 7.410 5.629 ( 7.178 0.000 -3.869) 8.154 5.929 ( -2.895 0.000 -1.103) 3.098 6.188 ( 0.502 0.000 -1.992) 2.054 7.374 ( 2.013 0.000 3.882) 4.373 7.419 ( 1.294 0.000 1.348) 1.869 8.530 ( -0.578 0.000 0.082) 0.584 8.541 ( 1.096 0.000 0.328) 1.144 9.012 ( -9.062 0.000 1.189) 9.139 9.342 ( 0.887 0.000 3.271) 3.389 9.360 ( 4.362 0.000 5.918) 7.352 9.541 ( -1.321 0.000 -6.027) 6.170 10.197 ( -0.877 0.000 -0.065) 0.879 10.503 ( 4.783 0.000 -3.720) 6.059 13.330 ( -8.090 0.000 19.008) 20.658 13.407 ( -2.431 0.000 2.819) 3.723 13.800 ( -2.250 0.000 1.889) 2.938 14.083 ( 5.925 0.000 -16.726) 17.744 14.334 ( -5.442 0.000 -4.794) 7.253 15.171 ( 5.267 0.000 -1.293) 5.423 18.095 ( 2.014 0.000 -0.463) 2.067 18.121 ( 0.421 0.000 -2.407) 2.444 18.363 ( -8.871 0.000 0.002) 8.871 19.141 ( 7.457 0.000 -3.774) 8.358======================= Grid point 344 (160/312) =======================q-point: ( 0.30 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.569 ( 1.451 0.000 19.704) 19.758 2.716 ( -3.613 0.000 25.086) 25.345 2.823 ( -4.973 0.000 4.571) 6.754 2.993 ( 9.175 0.000 -22.501) 24.300 3.300 ( -1.131 0.000 1.402) 1.801 3.455 ( -2.829 0.000 3.971) 4.876 3.716 ( 7.881 0.000 2.980) 8.426 4.199 ( -3.910 0.000 5.194) 6.501 4.743 ( 6.646 0.000 -7.049) 9.688 4.868 ( -0.885 0.000 -15.821) 15.845 4.901 ( -3.861 0.000 5.123) 6.415 5.207 ( 0.869 0.000 -7.874) 7.922 5.656 ( 6.463 0.000 -1.877) 6.730 5.705 ( 4.142 0.000 -2.218) 4.698 5.851 ( -3.380 0.000 -3.150) 4.620 6.162 ( -0.546 0.000 -3.043) 3.091 7.466 ( 3.149 0.000 4.287) 5.319 7.484 ( 3.146 0.000 3.320) 4.574 8.437 ( -5.325 0.000 -8.527) 10.053 8.459 ( -4.987 0.000 -9.170) 10.438 8.902 ( -3.967 0.000 6.358) 7.494 9.476 ( 3.681 0.000 11.183) 11.773 9.486 ( 4.426 0.000 3.059) 5.380 9.575 ( 3.872 0.000 7.012) 8.010 10.188 ( -0.189 0.000 0.371) 0.417 10.540 ( 3.874 0.000 -5.023) 6.343 13.350 ( -9.740 0.000 18.100) 20.555 13.357 ( -4.428 0.000 -0.014) 4.428 13.744 ( -4.007 0.000 -1.169) 4.174 13.953 ( -1.155 0.000 -16.927) 16.966 14.217 ( -0.504 0.000 -8.427) 8.442 15.242 ( 3.367 0.000 -1.103) 3.543 18.138 ( 2.413 0.000 0.274) 2.428 18.153 ( 2.975 0.000 2.725) 4.035 18.233 ( -5.092 0.000 0.326) 5.102 19.185 ( 2.002 0.000 -4.869) 5.264======================= Grid point 345 (161/312) =======================q-point: (-0.60 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.638 ( -11.024 0.000 12.751) 16.856 2.660 ( -21.563 0.000 17.337) 27.669 2.839 ( -2.063 0.000 8.738) 8.979 2.950 ( 9.888 0.000 -21.813) 23.949 3.358 ( 2.708 0.000 -1.876) 3.294 3.605 ( 8.878 0.000 13.319) 16.006 3.866 ( 5.478 0.000 0.513) 5.502 4.128 ( -5.519 0.000 4.866) 7.358 4.685 ( -0.635 0.000 -15.441) 15.454 4.789 ( 6.750 0.000 -9.785) 11.887 4.904 ( -2.408 0.000 6.857) 7.268 5.155 ( 3.231 0.000 -9.958) 10.469 5.723 ( 2.227 0.000 -9.286) 9.549 5.728 ( -0.671 0.000 0.300) 0.735 5.768 ( -0.095 0.000 1.959) 1.961 6.115 ( -0.575 0.000 -4.175) 4.214 7.546 ( 1.828 0.000 0.919) 2.046 7.592 ( 3.931 0.000 4.856) 6.248 8.208 ( -8.729 0.000 -14.652) 17.055 8.213 ( -7.520 0.000 -9.436) 12.066 8.998 ( 2.634 0.000 13.021) 13.284 9.633 ( 6.671 0.000 5.600) 8.710 9.655 ( 3.234 0.000 11.395) 11.845 9.722 ( 2.967 0.000 8.376) 8.886 10.199 ( 0.733 0.000 0.971) 1.216 10.542 ( 2.439 0.000 -6.423) 6.870 13.254 ( -5.310 0.000 -2.135) 5.724 13.328 ( -11.045 0.000 16.062) 19.494 13.640 ( -4.897 0.000 -2.765) 5.623 13.726 ( -3.776 0.000 -19.700) 20.059 14.160 ( 1.612 0.000 -3.947) 4.263 15.263 ( 1.059 0.000 -2.777) 2.972 18.187 ( -1.035 0.000 1.684) 1.976 18.207 ( 3.840 0.000 1.725) 4.209 18.257 ( 4.074 0.000 5.085) 6.516 19.122 ( -3.046 0.000 -5.732) 6.491======================= Grid point 346 (162/312) =======================q-point: (-0.50 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.378 ( -24.934 0.000 14.118) 28.654 2.469 ( -19.117 0.000 11.819) 22.476 2.888 ( -3.396 0.000 10.689) 11.216 2.938 ( 10.972 0.000 -19.097) 22.025 3.176 ( -17.315 0.000 -7.800) 18.991 3.953 ( 11.879 0.000 15.012) 19.144 3.961 ( 5.886 0.000 1.714) 6.130 4.183 ( 3.477 0.000 6.466) 7.341 4.567 ( 3.302 0.000 -13.270) 13.675 4.782 ( 4.182 0.000 -12.340) 13.030 4.924 ( -2.112 0.000 3.237) 3.865 5.144 ( 6.834 0.000 -10.670) 12.671 5.616 ( -3.899 0.000 -3.035) 4.942 5.694 ( -4.684 0.000 3.567) 5.887 5.843 ( 4.765 0.000 -0.398) 4.781 6.066 ( -0.073 0.000 -4.335) 4.336 7.533 ( -1.111 0.000 -3.777) 3.937 7.708 ( 2.452 0.000 5.259) 5.802 7.884 ( -9.249 0.000 -15.657) 18.185 8.021 ( -5.859 0.000 -4.930) 7.657 9.206 ( 4.324 0.000 14.330) 14.968 9.784 ( 2.708 0.000 3.732) 4.611 9.808 ( 2.028 0.000 9.695) 9.905 9.862 ( 4.721 0.000 8.114) 9.388 10.236 ( 2.110 0.000 1.262) 2.458 10.504 ( 0.957 0.000 -7.459) 7.521 13.137 ( -4.466 0.000 -2.564) 5.150 13.257 ( -12.557 0.000 12.484) 17.707 13.452 ( -4.572 0.000 -17.724) 18.304 13.526 ( -4.439 0.000 -2.438) 5.065 14.214 ( 4.505 0.000 3.416) 5.654 15.230 ( -0.139 0.000 -5.202) 5.204 18.211 ( 1.410 0.000 1.437) 2.013 18.300 ( 4.226 0.000 1.401) 4.452 18.399 ( 4.528 0.000 7.503) 8.763 18.970 ( -6.853 0.000 -6.144) 9.204======================= Grid point 347 (163/312) =======================q-point: (-0.40 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.047 ( -24.300 0.000 10.135) 26.329 2.208 ( -22.405 0.000 13.327) 26.069 2.685 ( -27.894 0.000 0.890) 27.908 2.922 ( -7.369 0.000 13.695) 15.551 2.988 ( 11.756 0.000 -12.138) 16.898 4.091 ( 6.476 0.000 -0.669) 6.511 4.274 ( 9.043 0.000 7.028) 11.453 4.328 ( 5.624 0.000 5.431) 7.818 4.533 ( 1.589 0.000 -2.617) 3.061 4.723 ( 6.377 0.000 -16.755) 17.927 4.845 ( -4.809 0.000 -7.217) 8.673 5.178 ( 8.705 0.000 -13.144) 15.765 5.554 ( -4.431 0.000 5.743) 7.253 5.653 ( -4.697 0.000 7.163) 8.565 5.916 ( 3.395 0.000 -0.247) 3.404 6.027 ( 0.133 0.000 -3.885) 3.887 7.485 ( 0.052 0.000 -1.308) 1.309 7.555 ( -8.698 0.000 -11.664) 14.550 7.808 ( 1.030 0.000 4.014) 4.144 7.867 ( -6.840 0.000 -4.407) 8.136 9.408 ( 2.632 0.000 12.492) 12.767 9.811 ( -1.076 0.000 -0.184) 1.091 9.915 ( 0.479 0.000 7.269) 7.284 10.028 ( 4.879 0.000 6.164) 7.861 10.294 ( 3.377 0.000 -0.368) 3.397 10.434 ( -0.261 0.000 -7.962) 7.966 13.056 ( -2.153 0.000 -0.887) 2.329 13.091 ( -12.028 0.000 2.500) 12.285 13.285 ( -3.891 0.000 -0.359) 3.908 13.445 ( -2.580 0.000 -0.429) 2.616 14.380 ( 6.747 0.000 8.251) 10.659 15.166 ( 0.061 0.000 -7.250) 7.250 18.249 ( 1.431 0.000 0.302) 1.463 18.379 ( 3.662 0.000 -0.347) 3.679 18.560 ( 4.102 0.000 8.405) 9.352 18.767 ( -8.476 0.000 -5.628) 10.174======================= Grid point 348 (164/312) =======================q-point: (-0.30 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.669 ( -24.674 0.000 3.491) 24.920 1.932 ( -23.081 0.000 16.213) 28.207 2.291 ( -25.956 0.000 24.981) 36.024 2.901 ( -10.545 0.000 15.592) 18.823 3.142 ( 13.201 0.000 -2.901) 13.516 4.151 ( 3.479 0.000 -7.378) 8.157 4.300 ( -1.794 0.000 -10.365) 10.519 4.481 ( 4.884 0.000 2.529) 5.500 4.634 ( 2.628 0.000 9.088) 9.460 4.650 ( -5.610 0.000 -6.278) 8.419 4.717 ( 9.769 0.000 -14.186) 17.224 5.175 ( 6.109 0.000 -14.694) 15.913 5.531 ( -6.298 0.000 7.062) 9.462 5.680 ( -0.479 0.000 6.674) 6.691 5.963 ( 1.530 0.000 0.959) 1.806 5.984 ( -0.125 0.000 -4.959) 4.961 7.360 ( -3.344 0.000 -3.355) 4.738 7.531 ( 2.665 0.000 3.335) 4.269 7.684 ( -7.799 0.000 -2.415) 8.165 7.840 ( -1.709 0.000 3.591) 3.977 9.528 ( -1.108 0.000 8.418) 8.491 9.749 ( -3.030 0.000 -4.594) 5.504 9.965 ( -1.313 0.000 4.065) 4.272 10.152 ( 3.515 0.000 3.324) 4.838 10.334 ( 2.948 0.000 -3.981) 4.954 10.341 ( -1.042 0.000 -8.251) 8.316 12.958 ( -7.563 0.000 8.941) 11.710 13.047 ( 0.455 0.000 2.196) 2.242 13.267 ( -1.312 0.000 6.282) 6.417 13.430 ( -0.125 0.000 2.490) 2.493 14.594 ( 6.344 0.000 9.279) 11.240 15.098 ( 1.059 0.000 -8.387) 8.453 18.261 ( 0.391 0.000 -1.415) 1.468 18.423 ( 2.723 0.000 -2.534) 3.720 18.574 ( -6.777 0.000 -4.013) 7.876 18.700 ( 2.152 0.000 7.848) 8.138======================= Grid point 349 (165/312) =======================q-point: (-0.20 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.293 ( -21.120 0.000 12.109) 24.345 1.704 ( -20.663 0.000 20.083) 28.815 2.252 ( -14.775 0.000 40.961) 43.544 2.859 ( -11.343 0.000 17.684) 21.009 3.384 ( 11.771 0.000 2.133) 11.963 4.042 ( -2.739 0.000 -15.421) 15.662 4.148 ( -2.417 0.000 -8.350) 8.692 4.413 ( -3.988 0.000 -6.037) 7.236 4.645 ( 4.713 0.000 -17.881) 18.491 4.717 ( 4.980 0.000 9.523) 10.747 4.802 ( 0.388 0.000 5.981) 5.993 5.162 ( 7.705 0.000 -10.454) 12.986 5.436 ( -9.231 0.000 2.610) 9.593 5.694 ( -2.571 0.000 -1.425) 2.939 5.965 ( 3.781 0.000 -2.805) 4.708 5.998 ( 0.380 0.000 2.610) 2.637 7.376 ( 2.868 0.000 5.342) 6.063 7.457 ( -7.741 0.000 -0.865) 7.789 7.743 ( 5.833 0.000 10.500) 12.011 7.831 ( -2.608 0.000 4.500) 5.201 9.525 ( -5.272 0.000 2.898) 6.016 9.619 ( -3.946 0.000 -8.319) 9.208 9.942 ( -3.269 0.000 -0.245) 3.278 10.189 ( -1.717 0.000 -4.555) 4.868 10.271 ( 2.722 0.000 -3.425) 4.375 10.325 ( 1.115 0.000 -4.868) 4.994 12.984 ( -3.977 0.000 15.697) 16.193 13.109 ( 2.098 0.000 5.163) 5.573 13.373 ( 5.629 0.000 7.617) 9.471 13.486 ( 1.838 0.000 5.356) 5.663 14.759 ( 2.242 0.000 6.876) 7.232 15.045 ( 2.348 0.000 -8.465) 8.785 18.235 ( -0.605 0.000 -3.196) 3.252 18.429 ( 0.167 0.000 -4.806) 4.809 18.468 ( 0.629 0.000 -1.403) 1.537 18.782 ( -1.077 0.000 6.305) 6.396======================= Grid point 350 (166/312) =======================q-point: (-0.10 0.00 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.233 ( -4.662 0.000 24.287) 24.730 1.597 ( -14.200 0.000 24.042) 27.922 2.507 ( -5.132 0.000 44.952) 45.244 2.855 ( -9.252 0.000 20.454) 22.450 3.512 ( 2.847 0.000 -6.582) 7.171 3.808 ( -3.582 0.000 -17.763) 18.121 4.116 ( 2.039 0.000 0.519) 2.104 4.278 ( -6.484 0.000 -3.194) 7.228 4.514 ( 2.936 0.000 -17.267) 17.515 4.813 ( 0.042 0.000 -2.746) 2.747 4.914 ( 5.655 0.000 10.133) 11.604 5.258 ( 9.209 0.000 -3.501) 9.852 5.274 ( -8.849 0.000 0.213) 8.852 5.594 ( -3.439 0.000 -4.585) 5.731 6.020 ( -1.117 0.000 2.848) 3.060 6.045 ( 5.652 0.000 -0.935) 5.729 7.347 ( -4.698 0.000 2.032) 5.119 7.476 ( 1.003 0.000 2.502) 2.695 7.899 ( 3.043 0.000 11.929) 12.311 7.985 ( 6.881 0.000 13.872) 15.485 9.408 ( -7.660 0.000 -1.374) 7.782 9.456 ( -3.501 0.000 -9.898) 10.499 9.839 ( -5.259 0.000 -4.759) 7.093 10.056 ( -3.937 0.000 -9.146) 9.957 10.291 ( -0.498 0.000 -2.739) 2.784 10.322 ( 4.062 0.000 -1.524) 4.339 13.082 ( -3.950 0.000 18.016) 18.444 13.212 ( 2.349 0.000 6.838) 7.231 13.591 ( 2.560 0.000 7.212) 7.652 13.609 ( 13.095 0.000 3.454) 13.543 14.792 ( -3.976 0.000 2.988) 4.974 15.021 ( 3.691 0.000 -7.507) 8.365 18.182 ( -0.939 0.000 -4.400) 4.500 18.351 ( -1.772 0.000 -5.942) 6.201 18.563 ( 9.230 0.000 -0.284) 9.235 18.780 ( -4.850 0.000 4.279) 6.468======================= Grid point 351 (167/312) =======================q-point: ( 0.00 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.555 ( 4.512 2.109 25.083) 25.573 1.735 ( -1.054 7.223 26.243) 27.239 2.898 ( -4.727 4.888 23.434) 24.400 3.060 ( -2.443 9.709 33.771) 35.224 3.420 ( -1.252 1.471 -14.113) 14.245 3.612 ( 0.482 1.913 -18.816) 18.919 4.016 ( -7.863 -1.178 -4.319) 9.048 4.102 ( -3.957 -2.984 -5.260) 7.227 4.534 ( 8.430 -3.605 2.056) 9.396 4.709 ( 2.093 -5.338 -6.674) 8.799 5.081 ( 2.397 -0.869 2.288) 3.425 5.214 ( 1.419 2.215 -1.311) 2.940 5.440 ( 8.186 4.196 -0.430) 9.209 5.552 ( -3.736 5.366 -0.404) 6.551 5.994 ( -2.750 -1.993 2.260) 4.079 6.079 ( 4.175 -4.828 -0.229) 6.387 7.340 ( -1.924 2.604 1.837) 3.723 7.483 ( -2.209 2.480 -2.142) 3.952 8.157 ( 9.156 0.737 15.335) 17.875 8.273 ( 5.669 2.372 13.681) 14.998 9.254 ( -7.693 0.819 -2.204) 8.045 9.320 ( -1.731 0.199 -7.922) 8.111 9.666 ( -6.574 0.484 -8.570) 10.812 9.845 ( -4.951 -3.235 -8.692) 10.513 10.243 ( -0.118 -0.533 -1.102) 1.230 10.424 ( 3.079 3.589 -2.559) 5.377 13.173 ( -3.961 -0.979 16.641) 17.134 13.332 ( 1.351 1.403 7.418) 7.669 13.700 ( 2.739 -0.569 6.287) 6.881 13.857 ( 13.027 -1.550 -1.341) 13.187 14.662 ( -7.304 -2.362 -0.279) 7.682 15.031 ( 4.332 -0.603 -6.248) 7.627 18.119 ( -0.813 -0.512 -4.368) 4.472 18.258 ( -2.608 0.322 -5.811) 6.378 18.693 ( -5.955 0.023 1.792) 6.219 18.736 ( 10.753 -3.165 0.512) 11.221======================= Grid point 352 (168/312) =======================q-point: ( 0.10 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.890 ( 4.657 -0.336 25.523) 25.946 2.056 ( 7.805 7.649 24.557) 26.879 2.971 ( -6.670 4.745 12.641) 15.060 3.240 ( 0.981 0.656 -14.579) 14.626 3.345 ( -2.852 6.895 21.204) 22.478 3.495 ( 5.606 1.640 -14.534) 15.664 3.806 ( -8.046 1.494 -5.407) 9.808 4.039 ( -2.107 -0.445 5.856) 6.239 4.674 ( 3.862 -0.078 -1.509) 4.147 4.703 ( 4.500 -11.723 -5.300) 13.629 5.102 ( 1.804 2.990 -1.837) 3.946 5.292 ( 5.615 -4.185 -1.996) 7.282 5.492 ( -2.896 7.345 2.200) 8.196 5.576 ( 6.907 4.340 -1.208) 8.247 5.953 ( -3.393 -2.806 1.029) 4.522 6.136 ( 2.505 -4.157 -0.585) 4.889 7.343 ( 0.048 1.931 2.229) 2.950 7.431 ( -1.139 1.685 -1.041) 2.284 8.443 ( 5.478 2.375 8.997) 10.798 8.468 ( 4.432 1.000 9.261) 10.316 9.125 ( -6.445 0.455 2.418) 6.899 9.270 ( 1.841 -0.119 -1.052) 2.124 9.454 ( -6.042 1.224 -8.936) 10.856 9.662 ( -4.666 -2.356 -9.410) 10.764 10.227 ( -0.784 0.736 -0.372) 1.138 10.464 ( 4.100 1.875 -2.861) 5.340 13.254 ( -5.249 -1.597 16.528) 17.415 13.408 ( -0.419 1.597 5.917) 6.143 13.785 ( 0.520 0.031 4.572) 4.602 14.027 ( 10.711 -2.439 -9.269) 14.373 14.501 ( -8.538 -0.629 -1.611) 8.712 15.073 ( 5.625 -1.845 -4.078) 7.188 18.077 ( 0.259 -1.324 -3.066) 3.350 18.165 ( -1.751 0.123 -4.106) 4.465 18.555 ( -8.831 1.725 0.263) 9.001 18.950 ( 11.215 -4.018 -1.097) 11.963======================= Grid point 353 (169/312) =======================q-point: ( 0.20 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.221 ( 4.316 -2.425 23.507) 24.022 2.456 ( 8.915 4.950 24.104) 26.172 2.898 ( -4.412 2.253 -3.824) 6.258 3.139 ( 1.873 5.291 -10.948) 12.303 3.390 ( -5.259 3.277 6.948) 9.310 3.542 ( 8.500 0.360 -4.234) 9.502 3.630 ( -8.745 5.016 0.203) 10.084 4.134 ( 1.359 0.092 10.003) 10.095 4.698 ( 4.068 -0.851 -5.699) 7.054 4.711 ( 0.920 -13.109 -4.153) 13.782 5.114 ( 1.925 5.040 -5.018) 7.368 5.294 ( -2.028 -0.782 -3.288) 3.941 5.518 ( 4.442 0.993 -0.539) 4.584 5.675 ( 5.682 3.231 -2.169) 6.887 5.891 ( -3.532 -3.756 -0.797) 5.217 6.157 ( 0.809 -3.044 -1.351) 3.427 7.387 ( 1.773 1.303 3.537) 4.166 7.432 ( 1.183 1.253 1.286) 2.150 8.493 ( -1.266 -1.523 -0.965) 2.203 8.602 ( 1.575 3.920 0.183) 4.228 9.017 ( -8.497 0.434 1.061) 8.574 9.358 ( 1.162 1.583 3.933) 4.396 9.367 ( 4.403 0.667 5.540) 7.108 9.522 ( -1.404 -1.727 -5.355) 5.799 10.211 ( -0.611 1.443 -0.098) 1.570 10.511 ( 4.237 0.788 -3.548) 5.583 13.301 ( -6.804 -2.351 15.211) 16.828 13.428 ( -2.680 1.632 3.858) 4.973 13.803 ( -1.844 0.387 1.331) 2.307 14.051 ( 4.384 -3.028 -14.071) 15.046 14.343 ( -5.284 0.904 -3.823) 6.585 15.147 ( 5.418 -2.611 -2.163) 6.391 18.067 ( 0.910 -2.680 -1.183) 3.067 18.128 ( 0.492 1.009 -0.545) 1.248 18.397 ( -7.706 3.026 -0.502) 8.294 19.103 ( 7.214 -3.837 -2.753) 8.622======================= Grid point 354 (170/312) =======================q-point: ( 0.30 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.445 ( -4.481 -7.748 18.024) 20.124 2.779 ( 1.714 -2.836 -2.459) 4.126 2.847 ( 3.867 8.065 18.556) 20.599 3.068 ( 0.800 7.239 -8.413) 11.128 3.389 ( -1.368 7.977 1.701) 8.271 3.493 ( -4.148 3.895 4.996) 7.572 3.695 ( 8.791 -1.561 0.325) 8.934 4.191 ( -3.766 -0.803 3.949) 5.516 4.653 ( -0.556 -13.138 -6.259) 14.563 4.738 ( 6.265 -0.881 -7.059) 9.479 5.050 ( -3.321 6.234 -3.685) 7.967 5.221 ( -0.299 1.369 -6.008) 6.170 5.600 ( 5.975 -3.730 -2.969) 7.644 5.733 ( 3.286 0.646 -3.490) 4.837 5.809 ( -3.743 -3.642 -1.615) 5.467 6.141 ( -0.255 -2.265 -2.917) 3.702 7.471 ( 2.761 0.511 4.162) 5.021 7.494 ( 2.939 0.930 3.183) 4.431 8.402 ( -3.629 -2.066 -8.086) 9.100 8.494 ( -7.346 2.063 -10.585) 13.048 8.925 ( -2.970 2.309 6.338) 7.371 9.468 ( 2.829 -0.487 6.952) 7.521 9.518 ( 5.271 2.601 6.511) 8.771 9.567 ( 4.038 -0.491 8.267) 9.214 10.205 ( -0.049 1.657 0.188) 1.669 10.542 ( 3.442 0.158 -4.682) 5.813 13.299 ( -7.620 -2.998 10.739) 13.505 13.392 ( -5.241 1.411 4.153) 6.834 13.747 ( -3.766 0.411 -1.861) 4.221 13.925 ( -1.400 -2.724 -15.889) 16.181 14.234 ( -1.617 1.745 -5.630) 6.112 15.214 ( 3.728 -2.960 -1.866) 5.113 18.089 ( 1.591 -3.158 0.953) 3.662 18.168 ( 2.027 1.289 3.301) 4.083 18.286 ( -3.396 4.019 -0.267) 5.268 19.154 ( 2.144 -3.155 -4.206) 5.678======================= Grid point 355 (171/312) =======================q-point: (-0.60 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.388 ( -16.745 -11.581 12.736) 24.015 2.758 ( 3.962 -4.300 -7.415) 9.444 2.966 ( -12.232 16.076 9.638) 22.382 3.061 ( 0.433 8.907 3.123) 9.449 3.347 ( 1.467 -0.973 -2.317) 2.909 3.655 ( 8.132 4.604 11.909) 15.138 3.842 ( 7.050 -2.169 -1.610) 7.550 4.108 ( -5.774 -1.790 2.833) 6.676 4.576 ( 1.852 -8.916 -10.542) 13.931 4.782 ( 5.764 -0.843 -7.015) 9.119 4.974 ( -3.064 4.824 1.497) 5.907 5.162 ( 1.620 0.790 -8.325) 8.518 5.664 ( 3.471 -4.951 -5.635) 8.265 5.685 ( -2.881 -4.463 -2.141) 5.727 5.776 ( 0.437 0.113 0.632) 0.777 6.098 ( -0.141 -1.977 -4.568) 4.980 7.538 ( 1.255 -0.632 0.569) 1.516 7.597 ( 3.673 0.527 5.038) 6.257 8.189 ( -11.178 -0.965 -14.396) 18.252 8.227 ( -4.439 0.398 -10.196) 11.127 9.026 ( 2.631 2.788 12.522) 13.096 9.613 ( 4.599 -1.524 8.709) 9.966 9.691 ( 4.885 2.655 7.168) 9.072 9.725 ( 3.138 0.701 9.641) 10.163 10.215 ( 0.832 1.593 0.672) 1.919 10.541 ( 2.088 -0.142 -5.941) 6.299 13.229 ( -6.643 -2.112 2.285) 7.335 13.333 ( -8.017 0.007 8.520) 11.699 13.638 ( -4.673 -0.007 -4.103) 6.219 13.704 ( -4.197 -2.085 -17.934) 18.536 14.185 ( 0.584 2.398 -1.622) 2.953 15.238 ( 1.651 -2.723 -3.333) 4.609 18.137 ( 1.786 -2.495 2.064) 3.698 18.246 ( 1.332 1.421 4.809) 5.188 18.290 ( 3.298 3.349 2.158) 5.172 19.101 ( -2.635 -2.164 -5.361) 6.353======================= Grid point 356 (172/312) =======================q-point: (-0.50 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.145 ( -22.396 -12.386 13.001) 28.706 2.708 ( -21.397 12.158 4.505) 25.018 2.783 ( 5.799 -5.734 -8.159) 11.536 3.067 ( -1.404 8.605 1.918) 8.927 3.231 ( -13.372 5.928 -2.209) 14.792 3.936 ( 7.330 -2.881 -1.199) 7.967 3.969 ( 10.335 1.360 12.985) 16.651 4.126 ( 2.482 -4.799 5.092) 7.424 4.538 ( 4.815 -2.339 -9.463) 10.872 4.797 ( 3.954 0.857 -8.497) 9.411 4.947 ( -2.293 2.060 0.223) 3.090 5.131 ( 4.963 -1.100 -9.479) 10.756 5.569 ( -3.687 -4.502 -2.268) 6.245 5.673 ( -3.413 -2.404 3.092) 5.195 5.821 ( 3.721 -2.085 -0.145) 4.268 6.055 ( 0.749 -1.475 -4.960) 5.228 7.520 ( -0.870 -1.303 -3.860) 4.165 7.700 ( 0.156 -1.184 3.872) 4.052 7.845 ( -8.781 -1.941 -13.105) 15.893 8.070 ( -3.602 3.267 -6.947) 8.480 9.227 ( 4.124 2.165 13.978) 14.733 9.781 ( 3.192 -1.890 9.653) 10.342 9.801 ( 1.376 1.086 3.689) 4.085 9.884 ( 4.261 1.895 8.206) 9.438 10.251 ( 2.222 1.446 0.987) 2.829 10.502 ( 0.624 -0.214 -6.909) 6.941 13.125 ( -4.918 -1.089 -0.891) 5.115 13.258 ( -10.065 -0.194 9.229) 13.657 13.426 ( -5.058 -2.235 -17.057) 17.931 13.527 ( -4.225 0.121 -3.216) 5.311 14.235 ( 3.535 2.171 4.270) 5.954 15.213 ( 0.585 -1.916 -5.530) 5.881 18.191 ( 1.997 -1.401 1.731) 2.991 18.323 ( 3.184 1.660 2.588) 4.426 18.410 ( 4.192 1.279 6.408) 7.764 18.961 ( -6.258 -0.970 -5.964) 8.699======================= Grid point 357 (173/312) =======================q-point: (-0.40 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.862 ( -23.539 -12.265 16.565) 31.288 2.268 ( -25.254 1.863 -4.995) 25.811 2.795 ( -7.868 3.988 5.054) 10.166 2.955 ( -11.800 10.858 7.459) 17.686 3.066 ( -0.012 5.663 0.271) 5.670 4.029 ( 7.874 -7.530 -7.341) 13.137 4.253 ( 4.790 -4.561 6.354) 9.172 4.275 ( 8.527 -0.220 8.192) 11.827 4.539 ( 1.345 0.543 -2.625) 3.000 4.769 ( 2.988 2.427 -10.287) 10.983 4.857 ( -1.667 2.223 -9.223) 9.633 5.152 ( 7.643 -2.542 -11.327) 13.899 5.516 ( -4.270 -3.354 5.291) 7.581 5.648 ( -3.415 -1.146 6.648) 7.561 5.883 ( 2.809 -3.050 -0.193) 4.151 6.029 ( 1.078 -0.343 -4.074) 4.229 7.452 ( -5.319 -3.205 -6.272) 8.826 7.516 ( -3.101 -2.730 -5.345) 6.756 7.814 ( 0.452 0.749 3.032) 3.156 7.934 ( -4.696 5.160 -5.851) 9.105 9.422 ( 2.592 1.604 12.174) 12.550 9.820 ( -1.090 0.779 -0.061) 1.341 9.905 ( 0.844 -1.033 7.782) 7.896 10.026 ( 3.536 -0.134 5.415) 6.469 10.311 ( 3.592 1.636 -0.126) 3.949 10.431 ( -0.555 -0.261 -7.444) 7.469 13.050 ( -2.658 -0.383 0.358) 2.710 13.107 ( -10.330 1.415 0.160) 10.427 13.259 ( -3.402 -2.628 -0.396) 4.317 13.444 ( -2.412 0.009 -0.753) 2.527 14.386 ( 5.823 0.724 7.909) 9.849 15.160 ( 0.796 -0.784 -7.343) 7.428 18.236 ( 1.578 -1.027 0.493) 1.946 18.399 ( 3.086 1.711 0.455) 3.557 18.552 ( 3.375 -0.552 7.563) 8.301 18.772 ( -7.596 0.425 -5.425) 9.344======================= Grid point 358 (174/312) =======================q-point: (-0.30 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.640 ( -20.831 -8.522 21.080) 30.838 1.744 ( -26.916 -4.210 0.023) 27.243 2.597 ( -21.990 21.713 21.911) 37.883 2.939 ( -8.346 4.391 14.117) 16.978 3.140 ( 9.962 -0.260 -0.950) 10.011 4.076 ( 6.595 -8.805 -10.991) 15.551 4.322 ( -1.348 2.010 -10.030) 10.317 4.376 ( 3.212 -6.101 -0.107) 6.896 4.618 ( 1.391 -1.727 10.979) 11.200 4.636 ( -4.684 -0.950 -5.360) 7.182 4.833 ( 8.148 8.356 -10.507) 15.704 5.157 ( 6.227 -1.794 -13.399) 14.884 5.485 ( -5.772 -3.581 5.791) 8.927 5.692 ( 0.468 -0.205 6.517) 6.537 5.911 ( 0.800 -3.795 -1.105) 4.033 6.006 ( 0.312 0.887 -3.019) 3.162 7.289 ( -3.090 -4.584 -1.445) 5.714 7.567 ( 5.149 1.151 4.397) 6.868 7.731 ( -7.674 4.177 -4.768) 9.954 7.860 ( -1.789 2.401 1.852) 3.520 9.541 ( -0.866 1.374 7.905) 8.070 9.761 ( -2.953 1.189 -4.264) 5.321 9.964 ( -1.174 -0.213 4.615) 4.767 10.109 ( 1.431 -3.815 1.730) 4.427 10.333 ( -0.617 0.446 -6.571) 6.615 10.374 ( 3.308 2.415 -3.484) 5.377 12.973 ( -6.714 1.542 7.090) 9.885 13.049 ( 0.561 0.184 2.391) 2.463 13.248 ( -1.056 -1.952 6.267) 6.648 13.430 ( -0.004 0.019 2.382) 2.382 14.577 ( 5.607 -1.529 7.989) 9.880 15.105 ( 1.672 0.475 -8.082) 8.267 18.255 ( 0.787 -0.652 -1.141) 1.531 18.436 ( 1.693 1.315 -1.979) 2.917 18.570 ( -5.952 -0.309 -3.021) 6.682 18.698 ( 1.515 -0.137 6.282) 6.464======================= Grid point 359 (175/312) =======================q-point: (-0.20 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.341 ( -19.431 3.523 11.189) 22.697 1.553 ( -16.684 -8.400 27.864) 33.546 2.507 ( -15.918 20.351 32.276) 41.344 2.908 ( -10.922 5.414 17.463) 21.297 3.369 ( 11.587 -1.653 3.043) 12.094 4.020 ( 0.735 -3.603 -15.716) 16.140 4.167 ( -2.907 1.489 -9.255) 9.815 4.316 ( -0.943 -6.975 -9.178) 11.566 4.587 ( -1.317 -2.889 -1.568) 3.541 4.707 ( 1.338 -3.215 2.621) 4.359 4.899 ( 3.713 8.032 0.239) 8.852 5.158 ( 7.892 -0.358 -9.693) 12.504 5.404 ( -6.550 -2.566 1.211) 7.138 5.733 ( -1.721 2.477 -0.149) 3.020 5.912 ( 3.139 -4.965 -2.158) 6.258 6.000 ( -0.152 0.051 1.528) 1.537 7.331 ( 3.076 -1.717 6.893) 7.741 7.547 ( -6.604 6.006 -2.645) 9.310 7.760 ( 7.028 1.694 9.946) 12.296 7.839 ( -2.652 0.835 3.440) 4.423 9.538 ( -4.679 1.330 1.885) 5.217 9.633 ( -4.401 1.460 -7.637) 8.934 9.947 ( -3.151 0.483 -0.233) 3.196 10.100 ( -1.948 -7.096 -2.659) 7.824 10.269 ( 0.877 0.397 -5.254) 5.341 10.394 ( 2.414 4.646 -3.490) 6.292 12.990 ( -3.402 0.715 13.398) 13.842 13.116 ( 2.133 0.622 5.540) 5.968 13.354 ( 5.133 -1.837 8.040) 9.715 13.489 ( 2.071 0.267 5.513) 5.895 14.718 ( 2.356 -3.646 4.870) 6.524 15.065 ( 2.305 1.425 -7.611) 8.079 18.241 ( -0.334 0.352 -2.980) 3.019 18.434 ( 1.167 -0.076 -3.500) 3.691 18.462 ( -1.793 0.098 -2.093) 2.758 18.772 ( -0.807 -1.009 5.835) 5.977======================= Grid point 360 (176/312) =======================q-point: (-0.10 0.09 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.295 ( -4.114 5.143 22.351) 23.301 1.578 ( -10.412 0.665 27.809) 29.702 2.657 ( -6.651 13.523 38.344) 41.199 2.911 ( -8.915 6.235 21.107) 23.746 3.517 ( 3.353 0.295 -5.151) 6.153 3.820 ( -2.510 0.869 -18.283) 18.475 4.101 ( 0.349 -2.504 -1.028) 2.730 4.224 ( -1.212 -4.245 -6.936) 8.222 4.481 ( -1.052 -2.643 -8.778) 9.227 4.736 ( 0.427 -6.212 -1.691) 6.452 4.977 ( 3.684 4.503 3.683) 6.886 5.243 ( 3.641 0.014 -2.981) 4.706 5.317 ( 0.967 2.436 -0.627) 2.695 5.644 ( -3.975 4.451 -3.629) 6.984 5.988 ( 4.918 -5.712 -0.595) 7.561 6.012 ( -1.117 -0.656 3.200) 3.452 7.377 ( -3.858 3.038 2.096) 5.339 7.511 ( 0.974 3.339 1.179) 3.672 7.887 ( 3.394 -0.606 11.150) 11.671 8.016 ( 7.137 2.610 13.625) 15.601 9.422 ( -7.324 1.404 -2.105) 7.749 9.464 ( -4.071 0.771 -9.733) 10.578 9.843 ( -5.041 0.347 -5.322) 7.339 10.000 ( -3.965 -5.194 -5.954) 8.840 10.252 ( 1.094 -1.063 -2.840) 3.224 10.403 ( 2.090 5.066 -2.653) 6.089 13.078 ( -3.201 -0.302 15.738) 16.063 13.223 ( 2.313 1.046 7.381) 7.805 13.561 ( 7.405 -2.337 5.317) 9.411 13.621 ( 7.154 0.587 6.922) 9.972 14.749 ( -2.506 -3.915 1.580) 4.910 15.036 ( 2.620 0.984 -7.165) 7.692 18.185 ( -1.370 0.235 -4.395) 4.609 18.361 ( -2.258 0.959 -5.637) 6.147 18.533 ( 8.180 -2.688 0.564) 8.629 18.775 ( -4.211 -0.573 3.956) 5.807======================= Grid point 361 (177/312) =======================q-point: ( 0.00 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.618 ( 3.315 5.076 23.012) 23.797 1.942 ( 1.797 13.864 23.151) 27.044 3.018 ( -4.805 7.129 19.785) 21.573 3.307 ( -2.662 14.622 24.608) 28.748 3.467 ( -1.806 3.973 -8.547) 9.597 3.654 ( 2.534 1.801 -18.120) 18.384 3.968 ( 0.774 -7.043 -1.014) 7.157 4.042 ( -6.740 0.680 -9.287) 11.496 4.403 ( 0.738 -8.070 3.465) 8.813 4.649 ( 4.891 -2.358 -4.287) 6.918 5.050 ( 2.692 -2.418 -2.702) 4.516 5.220 ( 1.699 -1.357 -3.887) 4.453 5.544 ( 6.473 6.022 2.996) 9.335 5.657 ( -1.211 3.619 -1.054) 3.959 5.911 ( 1.317 -7.285 1.969) 7.660 6.012 ( -1.430 0.149 2.931) 3.264 7.404 ( -2.326 3.916 0.553) 4.588 7.540 ( -2.492 3.210 -3.783) 5.552 8.189 ( 11.477 2.635 14.892) 18.985 8.328 ( 5.633 3.132 12.670) 14.215 9.272 ( -8.007 0.769 -3.274) 8.684 9.321 ( -2.315 -0.125 -8.060) 8.387 9.675 ( -5.093 0.128 -9.349) 10.647 9.774 ( -5.877 -3.437 -5.019) 8.458 10.251 ( 0.507 1.522 -0.629) 1.723 10.496 ( 1.826 3.598 -2.890) 4.963 13.159 ( -1.874 -0.233 11.474) 11.629 13.363 ( 1.497 1.526 7.444) 7.744 13.687 ( 4.830 -0.764 5.165) 7.113 13.823 ( 8.156 -1.656 4.528) 9.474 14.609 ( -4.923 -2.809 -0.836) 5.729 15.001 ( 3.248 -2.776 -7.587) 8.707 18.106 ( -2.268 -0.758 -3.616) 4.335 18.266 ( -3.331 0.409 -4.972) 5.999 18.656 ( 9.462 -3.474 1.878) 10.253 18.705 ( -4.987 -0.055 1.427) 5.187======================= Grid point 362 (178/312) =======================q-point: ( 0.10 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.920 ( 4.596 3.553 22.367) 23.109 2.235 ( 6.043 10.876 21.450) 24.798 3.102 ( -4.870 8.683 10.098) 14.180 3.245 ( -1.226 -0.321 -10.455) 10.531 3.508 ( -2.870 8.452 4.467) 9.982 3.574 ( 5.362 7.428 -9.702) 13.344 3.862 ( -6.874 4.517 1.269) 8.323 4.005 ( 1.996 -3.391 4.983) 6.349 4.440 ( 0.508 -12.701 0.746) 12.733 4.685 ( 3.513 -1.646 -5.743) 6.931 5.090 ( 3.766 -3.909 -0.873) 5.498 5.231 ( 3.818 -1.866 -5.070) 6.616 5.634 ( -1.138 4.961 0.334) 5.101 5.659 ( 4.130 3.844 0.145) 5.644 5.893 ( -4.774 -2.251 2.167) 5.706 6.048 ( 2.155 -3.864 1.534) 4.683 7.391 ( -0.260 2.888 1.347) 3.197 7.471 ( -1.461 2.295 -1.819) 3.273 8.485 ( 0.858 2.151 5.939) 6.374 8.519 ( 9.634 4.096 9.989) 14.470 9.131 ( -6.341 0.008 1.165) 6.447 9.266 ( 2.048 -0.381 -0.775) 2.222 9.484 ( -4.926 1.750 -8.772) 10.212 9.607 ( -5.251 -3.080 -6.863) 9.174 10.254 ( 0.018 2.227 0.016) 2.228 10.508 ( 2.519 2.406 -2.786) 4.460 13.227 ( -3.038 -0.897 11.043) 11.489 13.439 ( -0.160 1.338 5.209) 5.381 13.792 ( 1.773 0.687 3.652) 4.117 13.970 ( 6.178 -3.179 -2.798) 7.490 14.488 ( -6.654 -0.575 -1.020) 6.756 15.014 ( 5.287 -4.421 -5.891) 9.066 18.043 ( -1.401 -1.834 -2.180) 3.175 18.177 ( -1.557 0.972 -3.103) 3.605 18.592 ( -6.945 1.929 -0.269) 7.213 18.856 ( 9.563 -5.301 0.926) 10.973======================= Grid point 363 (179/312) =======================q-point: ( 0.20 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.198 ( 2.359 0.406 19.249) 19.398 2.568 ( 7.168 6.730 20.038) 22.320 2.969 ( -0.711 4.468 -15.652) 16.293 3.249 ( -3.052 5.470 8.059) 10.207 3.454 ( -1.393 3.769 0.062) 4.018 3.599 ( 8.439 5.468 -9.671) 13.951 3.772 ( -8.935 9.888 6.326) 14.752 4.127 ( 2.207 -1.302 7.378) 7.810 4.432 ( -1.174 -13.975 -0.847) 14.050 4.679 ( 4.147 -2.770 -7.932) 9.369 5.140 ( 1.590 -3.061 -1.079) 3.615 5.245 ( 3.252 -2.575 -5.641) 7.002 5.600 ( -1.562 5.557 -1.788) 6.043 5.708 ( 1.916 -0.904 -2.132) 3.006 5.813 ( -4.236 -2.839 -0.189) 5.103 6.088 ( 0.838 -3.513 0.271) 3.622 7.420 ( 1.302 2.010 2.704) 3.612 7.463 ( 0.914 1.812 1.154) 2.334 8.480 ( -2.332 0.348 -2.551) 3.474 8.680 ( 1.581 3.965 -1.165) 4.425 9.026 ( -6.703 0.456 0.914) 6.781 9.373 ( 4.794 -0.583 5.146) 7.057 9.399 ( 0.814 2.437 3.414) 4.272 9.490 ( -0.757 -0.957 -2.188) 2.505 10.251 ( -0.213 2.774 -0.044) 2.783 10.530 ( 2.852 1.086 -3.018) 4.292 13.259 ( -4.584 -1.643 9.587) 10.753 13.454 ( -2.154 0.826 2.050) 3.086 13.819 ( -1.046 1.416 0.530) 1.839 13.981 ( 1.319 -3.887 -8.697) 9.618 14.366 ( -5.000 1.465 -1.492) 5.419 15.068 ( 5.594 -5.630 -3.995) 8.885 18.017 ( -0.148 -2.076 0.188) 2.090 18.157 ( 0.835 1.808 0.185) 2.000 18.460 ( -6.395 3.227 -0.894) 7.219 19.007 ( 6.594 -5.836 -0.994) 8.862======================= Grid point 364 (180/312) =======================q-point: ( 0.30 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.328 ( -6.586 -4.052 12.709) 14.877 2.747 ( 3.032 0.039 -10.053) 10.500 2.983 ( 7.882 5.729 12.830) 16.111 3.234 ( -2.443 8.966 2.906) 9.737 3.525 ( 1.735 4.271 8.726) 9.869 3.611 ( -10.415 8.054 6.023) 14.478 3.715 ( 9.161 6.347 -7.762) 13.581 4.163 ( -2.818 -2.847 0.383) 4.024 4.399 ( 0.298 -12.207 -2.917) 12.554 4.696 ( 5.865 -3.718 -7.328) 10.096 5.112 ( -2.473 -0.024 -2.049) 3.211 5.234 ( 0.273 -1.079 -3.456) 3.631 5.561 ( 1.341 0.754 -4.577) 4.828 5.664 ( -2.779 -6.847 -4.113) 8.457 5.771 ( 0.070 -1.268 -1.338) 1.845 6.079 ( -0.668 -3.924 -2.268) 4.582 7.486 ( 1.988 1.075 3.656) 4.298 7.516 ( 2.401 1.326 3.044) 4.097 8.372 ( -3.061 -0.889 -8.708) 9.273 8.527 ( -9.394 1.259 -12.210) 15.457 8.984 ( -0.704 3.600 6.198) 7.202 9.443 ( 2.272 -2.271 4.767) 5.748 9.566 ( 5.173 1.659 9.368) 10.829 9.584 ( 5.099 3.097 8.575) 10.446 10.249 ( 0.071 2.835 -0.103) 2.838 10.545 ( 2.302 0.122 -3.742) 4.395 13.246 ( -5.859 -2.238 7.159) 9.517 13.404 ( -3.774 -0.121 -0.605) 3.824 13.766 ( -3.346 1.591 -2.906) 4.709 13.862 ( -2.604 -3.547 -12.420) 13.177 14.279 ( -3.069 2.795 -1.015) 4.273 15.127 ( 4.473 -6.148 -3.397) 8.327 18.043 ( 1.462 -1.268 2.491) 3.154 18.203 ( 1.954 2.318 3.462) 4.602 18.361 ( -3.228 3.573 -0.284) 4.823 19.071 ( 2.489 -5.374 -2.978) 6.629======================= Grid point 365 (181/312) =======================q-point: (-0.60 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.215 ( -15.638 -6.297 8.072) 18.691 2.695 ( 6.240 -2.072 -14.449) 15.874 3.184 ( -3.798 7.129 2.566) 8.475 3.307 ( 4.175 5.941 13.803) 15.597 3.343 ( -16.804 9.792 3.892) 19.835 3.740 ( 4.975 2.029 11.654) 12.832 3.811 ( 10.081 0.862 -10.200) 14.367 4.074 ( -4.870 -1.360 -0.121) 5.058 4.412 ( 5.234 -6.877 -3.528) 9.335 4.739 ( 5.788 -3.825 -6.054) 9.208 5.045 ( -3.304 2.132 0.476) 3.961 5.182 ( -1.955 0.853 -3.642) 4.221 5.543 ( -0.305 -7.326 -6.920) 10.082 5.585 ( 0.419 -5.380 -1.535) 5.610 5.762 ( 0.085 -1.681 -0.715) 1.829 6.032 ( -0.235 -4.909 -4.671) 6.781 7.528 ( -0.057 -0.317 0.012) 0.322 7.609 ( 2.962 0.579 4.933) 5.783 8.174 ( -11.626 -0.638 -15.855) 19.671 8.228 ( -2.773 -0.178 -10.093) 10.469 9.098 ( 2.942 4.529 11.434) 12.645 9.574 ( 3.823 -2.566 9.094) 10.194 9.732 ( 3.238 1.794 7.892) 8.717 9.769 ( 5.038 3.482 8.740) 10.672 10.256 ( 0.828 2.511 0.111) 2.646 10.537 ( 1.211 -0.305 -4.632) 4.798 13.187 ( -6.084 -1.986 3.348) 7.223 13.318 ( -4.532 -1.560 -0.798) 4.859 13.641 ( -4.922 -0.724 -11.182) 12.239 13.664 ( -4.768 -0.695 -8.497) 9.768 14.245 ( -0.982 3.783 2.227) 4.498 15.158 ( 3.010 -5.663 -4.316) 7.730 18.108 ( 2.137 -0.321 3.271) 3.920 18.277 ( 1.075 2.161 4.962) 5.518 18.356 ( 2.035 3.082 2.074) 4.236 19.041 ( -1.556 -4.092 -4.599) 6.349======================= Grid point 366 (182/312) =======================q-point: (-0.50 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.960 ( -20.348 -6.584 8.723) 23.098 2.691 ( 5.636 -3.725 -12.795) 14.469 2.858 ( -19.230 3.552 -8.858) 21.468 3.231 ( -5.638 7.640 6.129) 11.301 3.420 ( -9.065 13.624 13.326) 21.104 3.809 ( 6.578 -10.421 -13.326) 18.151 4.009 ( 7.880 2.754 12.562) 15.082 4.067 ( 1.612 -0.314 6.321) 6.531 4.509 ( 8.100 0.033 -4.398) 9.217 4.786 ( 4.839 -2.448 -4.440) 7.008 4.987 ( -3.725 1.846 -1.228) 4.335 5.115 ( 0.929 -0.432 -6.343) 6.425 5.458 ( -2.518 -6.891 -1.484) 7.485 5.601 ( -0.825 -4.923 2.255) 5.477 5.772 ( 1.841 -2.922 -0.430) 3.480 5.996 ( 1.956 -4.888 -5.310) 7.478 7.490 ( -0.945 -1.625 -4.097) 4.508 7.659 ( -5.227 -2.750 -1.706) 6.147 7.841 ( -4.771 1.258 -8.832) 10.117 8.112 ( -0.919 1.010 -7.853) 7.970 9.287 ( 3.837 3.992 12.967) 14.099 9.733 ( 2.760 -2.784 9.809) 10.563 9.832 ( 0.968 1.942 4.749) 5.221 9.927 ( 3.674 2.497 6.833) 8.150 10.286 ( 2.292 2.066 0.449) 3.119 10.498 ( -0.113 -0.216 -5.351) 5.356 13.103 ( -4.534 -1.008 0.243) 4.651 13.234 ( -4.856 -2.446 1.584) 5.663 13.389 ( -6.749 -1.309 -14.099) 15.686 13.533 ( -3.885 0.577 -4.293) 5.819 14.292 ( 1.714 3.644 5.747) 7.017 15.154 ( 2.260 -4.287 -5.969) 7.689 18.175 ( 1.812 0.001 2.668) 3.225 18.348 ( 2.069 1.017 4.074) 4.681 18.449 ( 3.397 2.548 4.816) 6.421 18.931 ( -4.699 -2.201 -5.491) 7.555======================= Grid point 367 (183/312) =======================q-point: (-0.40 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.675 ( -21.718 -6.383 13.016) 26.112 2.282 ( -24.022 0.420 -11.241) 26.526 2.800 ( 7.944 -1.202 -3.933) 8.946 3.180 ( -6.902 6.451 6.618) 11.535 3.296 ( -17.151 20.114 14.809) 30.299 3.798 ( 8.195 -15.237 -15.172) 23.011 4.200 ( 4.043 -1.184 6.994) 8.165 4.276 ( 6.754 0.247 11.562) 13.392 4.560 ( 2.472 1.818 -5.658) 6.436 4.780 ( -3.382 -0.370 -5.123) 6.150 4.921 ( 4.819 2.612 -7.720) 9.469 5.101 ( 4.748 -1.949 -7.899) 9.420 5.439 ( -2.272 -4.737 4.751) 7.083 5.598 ( -2.631 -3.812 5.375) 7.095 5.810 ( 2.325 -4.515 -0.622) 5.117 5.999 ( 2.918 -2.940 -3.684) 5.544 7.388 ( -8.971 -2.975 -9.728) 13.563 7.468 ( 2.002 -2.416 -2.160) 3.809 7.835 ( 0.272 1.311 1.744) 2.199 8.017 ( -1.881 2.994 -6.780) 7.647 9.469 ( 2.517 3.189 11.207) 11.920 9.829 ( -0.479 -0.418 2.534) 2.613 9.886 ( 0.117 -0.447 6.657) 6.673 10.028 ( 1.395 0.413 3.665) 3.943 10.348 ( 4.046 1.934 0.087) 4.486 10.429 ( -1.287 0.243 -5.753) 5.900 13.045 ( -1.835 -0.129 0.605) 1.937 13.139 ( -8.022 1.786 -2.893) 8.713 13.194 ( -2.204 -3.832 -0.921) 4.515 13.446 ( -2.011 0.104 -1.919) 2.782 14.410 ( 3.794 1.902 7.176) 8.337 15.129 ( 2.399 -2.567 -7.351) 8.147 18.221 ( 0.967 -0.276 1.443) 1.759 18.425 ( 2.489 0.641 2.276) 3.433 18.552 ( 1.961 0.821 5.267) 5.680 18.778 ( -5.736 0.010 -5.007) 7.614======================= Grid point 368 (184/312) =======================q-point: (-0.30 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.450 ( -19.704 -6.327 19.137) 28.187 1.791 ( -20.977 5.395 -0.249) 21.661 2.913 ( -2.375 7.362 10.204) 12.805 3.124 ( -3.649 7.486 6.732) 10.709 3.163 ( -11.841 12.789 15.551) 23.358 3.815 ( 10.168 -17.046 -15.906) 25.436 4.305 ( 1.257 -2.001 1.414) 2.754 4.365 ( -0.972 2.151 -7.858) 8.204 4.582 ( -0.166 -1.521 8.346) 8.485 4.629 ( -3.825 0.496 -4.971) 6.292 4.975 ( 7.332 5.479 -6.973) 11.507 5.115 ( 6.136 -1.849 -9.691) 11.619 5.420 ( -4.530 -3.071 3.331) 6.407 5.639 ( 1.016 -5.209 5.512) 7.652 5.829 ( 0.685 -4.861 -1.567) 5.153 6.012 ( 1.345 -0.428 -2.309) 2.706 7.230 ( -1.031 -1.465 -0.689) 1.920 7.563 ( 6.644 -1.269 4.302) 8.016 7.795 ( -4.588 2.360 -2.483) 5.726 7.928 ( -1.870 3.815 -3.338) 5.403 9.580 ( -0.460 2.554 6.556) 7.051 9.790 ( -2.686 1.724 -3.223) 4.536 9.943 ( -1.534 -2.437 6.503) 7.112 10.042 ( -1.365 -2.224 -1.083) 2.825 10.347 ( -1.302 0.946 -5.408) 5.643 10.423 ( 4.433 2.546 -1.352) 5.288 13.012 ( -4.412 2.272 2.165) 5.414 13.055 ( 0.778 0.550 3.286) 3.421 13.199 ( -0.284 -2.938 5.907) 6.603 13.429 ( 0.484 -0.139 1.571) 1.650 14.550 ( 3.952 -0.883 5.639) 6.942 15.102 ( 2.774 -1.119 -7.722) 8.281 18.241 ( 0.479 -0.530 0.180) 0.737 18.461 ( 0.179 0.828 -1.011) 1.319 18.569 ( -3.816 0.426 -1.079) 3.989 18.697 ( 0.111 -0.058 2.778) 2.781======================= Grid point 369 (185/312) =======================q-point: (-0.20 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.327 ( -13.455 -1.512 18.929) 23.273 1.599 ( -10.992 10.784 20.885) 25.948 2.882 ( -13.522 16.215 21.382) 30.049 3.097 ( -11.790 15.346 19.599) 27.543 3.314 ( 11.036 -4.244 5.487) 13.035 3.837 ( 9.090 -15.008 -16.904) 24.364 4.186 ( -5.596 1.042 -10.058) 11.557 4.267 ( -0.907 0.983 -8.497) 8.602 4.547 ( -3.243 -1.173 0.219) 3.456 4.636 ( -1.818 -3.179 2.083) 4.213 5.024 ( 3.699 3.361 -4.952) 7.036 5.167 ( 8.266 2.227 -4.617) 9.726 5.356 ( -3.363 -2.111 0.217) 3.977 5.719 ( 2.271 -5.183 2.775) 6.302 5.804 ( 0.369 -5.231 -4.193) 6.714 6.011 ( -0.336 1.074 1.063) 1.548 7.333 ( 6.515 1.803 8.102) 10.551 7.641 ( -5.264 3.594 -2.548) 6.864 7.796 ( 8.414 1.646 8.950) 12.394 7.867 ( -2.763 2.167 -0.422) 3.537 9.570 ( -3.753 1.719 -0.576) 4.168 9.672 ( -5.352 2.576 -5.902) 8.373 9.952 ( -3.184 -4.190 3.887) 6.543 9.965 ( -2.982 -2.340 -5.273) 6.495 10.286 ( -0.230 1.368 -4.129) 4.356 10.474 ( 3.225 3.511 -2.698) 5.478 13.012 ( -1.763 1.541 7.912) 8.251 13.132 ( 2.269 1.119 6.273) 6.764 13.309 ( 4.537 -2.673 8.665) 10.140 13.493 ( 2.701 0.080 5.259) 5.913 14.647 ( 2.172 -3.280 2.146) 4.481 15.076 ( 2.312 -0.630 -7.381) 7.760 18.243 ( -0.195 -0.008 -1.199) 1.214 18.420 ( -0.982 -0.872 -2.248) 2.603 18.488 ( -2.279 2.171 -2.933) 4.302 18.745 ( -0.209 -1.680 4.474) 4.783======================= Grid point 370 (186/312) =======================q-point: (-0.10 0.18 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.380 ( -2.546 4.628 21.529) 22.167 1.716 ( -3.796 13.345 26.365) 29.793 2.912 ( -7.717 11.169 23.645) 27.265 3.128 ( -8.319 16.585 26.037) 31.972 3.515 ( 5.215 -0.776 -0.682) 5.316 3.787 ( 4.554 -7.189 -19.243) 21.041 4.010 ( -2.592 -3.209 -7.037) 8.157 4.192 ( -0.216 0.466 -5.952) 5.974 4.428 ( -5.956 -2.675 -2.559) 7.013 4.626 ( 1.389 -4.489 -2.475) 5.311 5.032 ( 2.913 0.710 -4.218) 5.175 5.240 ( 0.987 -1.297 -2.859) 3.291 5.383 ( 6.124 5.385 3.234) 8.773 5.707 ( -1.562 0.800 -3.408) 3.833 5.838 ( 4.312 -9.409 0.366) 10.357 6.017 ( -1.931 1.593 3.653) 4.429 7.455 ( -2.694 4.819 1.527) 5.728 7.588 ( 1.458 4.350 -0.940) 4.683 7.889 ( 4.224 0.831 9.664) 10.580 8.067 ( 8.262 2.463 13.058) 15.648 9.451 ( -5.847 1.135 -4.671) 7.569 9.485 ( -6.548 1.522 -8.371) 10.736 9.840 ( -3.805 -1.892 -7.525) 8.642 9.900 ( -4.715 -3.429 -0.355) 5.840 10.255 ( 0.440 1.291 -2.437) 2.793 10.492 ( 2.015 4.024 -2.989) 5.402 13.078 ( -1.364 0.496 10.554) 10.653 13.248 ( 2.414 1.459 7.887) 8.376 13.511 ( 7.811 -2.718 6.860) 10.745 13.629 ( 5.048 0.275 8.064) 9.517 14.668 ( -0.847 -3.991 -0.277) 4.089 15.037 ( 1.590 -1.298 -7.641) 7.912 18.189 ( -2.612 0.248 -3.556) 4.419 18.376 ( -2.827 0.077 -4.538) 5.347 18.488 ( 5.796 -1.264 0.953) 6.008 18.757 ( -2.754 -1.222 3.129) 4.343======================= Grid point 371 (187/312) =======================q-point: ( 0.00 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.765 ( 5.001 10.445 17.753) 21.196 2.240 ( 1.052 16.653 19.140) 25.393 3.137 ( -4.460 4.051 16.174) 17.259 3.482 ( 1.228 1.936 -15.457) 15.626 3.596 ( 6.110 -3.918 -0.497) 7.275 3.663 ( 1.194 10.213 13.973) 17.348 3.878 ( -2.411 1.925 -4.846) 5.745 4.100 ( -6.800 4.647 -4.180) 9.236 4.276 ( -2.820 -4.727 2.596) 6.086 4.588 ( 4.575 -3.783 -5.402) 8.026 4.983 ( 2.070 -4.827 -6.028) 7.995 5.173 ( 1.143 -3.521 -1.220) 3.898 5.608 ( 1.216 -1.929 1.717) 2.854 5.659 ( 1.824 -3.300 -2.401) 4.470 5.803 ( 5.727 0.165 6.047) 8.330 6.067 ( -2.712 4.128 3.525) 6.068 7.481 ( -2.687 3.936 -1.016) 4.873 7.595 ( -2.863 2.326 -4.971) 6.190 8.255 ( 13.092 4.169 14.071) 19.666 8.388 ( 6.807 2.965 12.091) 14.189 9.273 ( -8.246 -0.772 -4.193) 9.283 9.313 ( -3.366 -0.801 -7.869) 8.596 9.662 ( -3.872 -1.063 -7.225) 8.265 9.738 ( -6.836 -0.408 -4.919) 8.431 10.302 ( 0.474 3.791 0.138) 3.823 10.553 ( 1.082 2.133 -2.553) 3.498 13.172 ( 0.661 1.715 5.764) 6.050 13.383 ( 1.872 0.482 6.127) 6.424 13.671 ( 6.604 -0.869 5.922) 8.913 13.801 ( 5.197 -0.748 6.773) 8.569 14.565 ( -3.144 -1.515 -1.054) 3.646 14.923 ( 1.978 -5.205 -8.208) 9.919 18.097 ( -3.953 -0.025 -2.363) 4.606 18.266 ( -3.067 -0.600 -4.166) 5.208 18.605 ( 7.135 -1.558 2.114) 7.603 18.701 ( -3.363 -0.482 0.733) 3.476======================= Grid point 372 (188/312) =======================q-point: ( 0.10 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.032 ( 5.077 8.239 16.542) 19.165 2.460 ( 3.621 12.212 17.519) 21.660 3.209 ( -2.873 -1.975 4.570) 5.748 3.298 ( -1.982 9.296 -9.817) 13.665 3.653 ( 5.216 6.351 -9.655) 12.679 3.723 ( -0.994 5.247 -5.420) 7.608 3.864 ( 1.149 -4.962 3.274) 6.055 4.043 ( -4.052 10.473 15.996) 19.544 4.258 ( -2.396 -5.458 2.023) 6.295 4.604 ( 3.555 -6.507 -7.447) 10.509 4.980 ( 3.041 -7.162 -3.646) 8.593 5.198 ( 2.165 -2.417 -1.095) 3.425 5.618 ( -0.416 -4.841 -0.653) 4.903 5.678 ( 1.752 -3.103 -1.140) 3.741 5.912 ( -1.275 3.824 3.924) 5.625 6.043 ( -2.006 3.358 2.839) 4.833 7.447 ( -0.610 2.861 0.176) 2.931 7.511 ( -1.703 1.805 -2.442) 3.481 8.540 ( 0.861 3.528 4.941) 6.132 8.603 ( 9.948 4.438 8.904) 14.069 9.121 ( -5.896 -1.045 -0.404) 6.001 9.250 ( 2.088 -1.553 -0.782) 2.717 9.511 ( -3.764 0.721 -7.762) 8.657 9.564 ( -5.928 -0.877 -4.458) 7.469 10.313 ( 0.186 3.904 0.461) 3.935 10.548 ( 1.059 1.578 -2.254) 2.948 13.229 ( -0.356 1.293 4.819) 5.003 13.452 ( 0.381 -0.033 3.319) 3.341 13.808 ( 3.421 0.694 2.974) 4.586 13.920 ( 2.656 -1.713 1.611) 3.548 14.483 ( -5.007 0.146 0.169) 5.012 14.906 ( 4.234 -6.693 -6.921) 10.518 18.020 ( -2.446 -0.346 -0.871) 2.619 18.193 ( -0.935 0.434 -2.381) 2.595 18.623 ( -5.148 1.202 -0.475) 5.308 18.762 ( 7.418 -4.333 1.553) 8.730======================= Grid point 373 (189/312) =======================q-point: ( 0.20 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.246 ( 1.710 4.686 12.356) 13.325 2.713 ( 4.682 8.135 16.872) 19.307 3.024 ( 0.320 0.305 -21.196) 21.200 3.350 ( -3.539 5.873 15.501) 16.950 3.568 ( -0.227 8.086 -7.522) 11.046 3.726 ( 6.989 7.009 -7.486) 12.410 3.929 ( -0.634 -1.151 6.483) 6.615 4.101 ( -5.471 5.524 7.901) 11.085 4.241 ( -1.002 -4.854 2.318) 5.472 4.585 ( 3.992 -7.032 -8.989) 12.091 5.014 ( 2.962 -8.775 -1.615) 9.401 5.205 ( 0.631 -2.880 -3.121) 4.294 5.587 ( -1.384 -5.595 -1.916) 6.074 5.692 ( 0.815 -2.496 -1.130) 2.858 5.826 ( -7.380 4.571 -1.596) 8.826 6.050 ( -1.262 -0.217 1.496) 1.969 7.460 ( 0.941 2.026 1.745) 2.834 7.496 ( 0.684 1.528 0.989) 1.945 8.509 ( -3.205 2.675 -3.948) 5.746 8.744 ( -0.243 2.527 -3.035) 3.957 9.034 ( -3.554 0.425 1.130) 3.754 9.330 ( 2.891 -3.533 0.901) 4.653 9.448 ( 1.413 2.539 4.751) 5.570 9.500 ( 1.515 1.620 3.189) 3.884 10.315 ( -0.234 3.840 0.126) 3.849 10.547 ( 1.187 0.580 -2.163) 2.535 13.248 ( -1.861 0.631 3.031) 3.613 13.456 ( -1.560 -0.580 -0.455) 1.725 13.851 ( 0.211 1.377 -0.947) 1.684 13.919 ( -1.194 -2.034 -4.186) 4.804 14.398 ( -4.718 1.898 1.101) 5.204 14.935 ( 5.135 -8.048 -5.078) 10.814 17.999 ( -0.082 0.381 1.696) 1.740 18.190 ( 1.378 1.488 0.855) 2.201 18.515 ( -5.464 2.559 -0.950) 6.108 18.890 ( 5.554 -6.208 -0.215) 8.333======================= Grid point 374 (190/312) =======================q-point: ( 0.30 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.298 ( -6.112 0.919 5.529) 8.293 2.778 ( 0.655 2.546 -14.096) 14.339 3.043 ( 8.483 0.308 8.589) 12.076 3.390 ( -5.531 7.583 10.974) 14.441 3.600 ( 4.747 5.098 2.048) 7.261 3.759 ( -0.414 6.917 -0.937) 6.992 3.938 ( -5.322 14.220 -0.412) 15.189 4.031 ( -0.305 -9.315 0.633) 9.342 4.263 ( 1.762 -1.881 0.475) 2.621 4.593 ( 5.651 -6.963 -7.186) 11.491 5.042 ( 0.355 -6.983 0.698) 7.027 5.174 ( 0.173 -4.960 -3.008) 5.804 5.527 ( -3.012 -6.297 -2.997) 7.597 5.630 ( -6.198 5.157 -4.645) 9.305 5.714 ( 0.606 -4.974 -3.100) 5.892 6.006 ( -3.277 -3.289 -1.539) 4.891 7.510 ( 1.426 1.374 2.970) 3.570 7.541 ( 1.812 1.134 2.936) 3.632 8.373 ( -3.619 0.983 -10.219) 10.885 8.540 ( -10.424 0.139 -13.115) 16.753 9.055 ( 1.604 3.691 6.050) 7.266 9.386 ( 2.634 -3.474 4.456) 6.234 9.605 ( 4.483 2.351 10.364) 11.534 9.648 ( 5.835 3.128 8.758) 10.979 10.310 ( -0.198 3.515 -0.219) 3.528 10.544 ( 0.868 -0.330 -2.485) 2.653 13.222 ( -3.163 -0.158 1.165) 3.374 13.390 ( -3.102 -1.287 -3.923) 5.164 13.793 ( -2.656 -0.820 -7.720) 8.205 13.812 ( -3.855 0.358 -5.895) 7.052 14.338 ( -3.547 3.388 2.483) 5.498 14.983 ( 4.831 -8.597 -4.082) 10.673 18.047 ( 1.900 1.665 3.927) 4.670 18.252 ( 2.565 2.596 3.832) 5.292 18.420 ( -3.804 2.727 -0.195) 4.684 18.954 ( 2.728 -6.745 -2.265) 7.621======================= Grid point 375 (191/312) =======================q-point: (-0.60 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.151 ( -12.736 -0.366 1.770) 12.864 2.672 ( 4.861 -0.897 -16.141) 16.880 3.196 ( -2.911 -4.450 -1.665) 5.572 3.395 ( -5.712 8.034 10.336) 14.283 3.610 ( -3.071 8.166 1.343) 8.827 3.705 ( -5.806 -1.332 0.542) 5.981 3.886 ( 6.563 4.843 0.368) 8.165 4.093 ( 0.545 4.905 3.571) 6.092 4.356 ( 8.863 1.269 0.936) 9.002 4.638 ( 5.345 -6.650 -4.752) 9.766 5.044 ( -1.269 -2.504 2.447) 3.724 5.160 ( -2.851 -4.092 2.171) 5.440 5.407 ( -3.336 -6.186 -6.362) 9.480 5.503 ( -1.005 -2.756 -6.396) 7.037 5.712 ( 1.094 -3.478 -1.427) 3.915 5.921 ( -2.430 -6.208 -3.924) 7.736 7.530 ( -1.263 0.548 -0.430) 1.442 7.616 ( 1.857 0.122 4.187) 4.582 8.164 ( -9.689 -0.262 -16.270) 18.938 8.225 ( -3.614 -0.063 -11.550) 12.102 9.188 ( 3.551 4.655 10.494) 12.017 9.518 ( 3.736 -3.129 9.236) 10.443 9.771 ( 2.860 2.248 8.824) 9.544 9.834 ( 4.976 3.005 7.773) 9.706 10.308 ( 0.434 2.958 -0.247) 3.000 10.528 ( 0.223 -0.702 -2.965) 3.055 13.161 ( -3.697 -0.609 -0.355) 3.764 13.280 ( -3.293 -2.147 -5.562) 6.811 13.608 ( -5.693 -1.571 -11.842) 13.233 13.682 ( -4.047 1.211 -6.772) 7.981 14.326 ( -1.602 4.658 4.816) 6.889 15.025 ( 4.184 -7.997 -4.350) 10.019 18.128 ( 2.069 2.451 4.350) 5.405 18.333 ( 0.540 3.661 4.013) 5.458 18.400 ( 1.339 1.422 3.100) 3.664 18.946 ( -0.212 -5.850 -3.919) 7.044======================= Grid point 376 (192/312) =======================q-point: (-0.50 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.902 ( -15.996 0.549 2.331) 16.174 2.634 ( 5.113 -2.677 -13.227) 14.431 2.865 ( -16.699 -2.068 -13.856) 21.798 3.374 ( -6.350 7.906 7.911) 12.861 3.545 ( 1.623 -11.850 -16.220) 20.153 3.713 ( -3.784 10.567 15.216) 18.908 4.069 ( 5.564 3.564 10.976) 12.811 4.119 ( -0.248 6.022 4.687) 7.635 4.550 ( 10.276 3.867 -3.530) 11.533 4.708 ( 6.668 -4.978 -1.505) 8.456 5.016 ( -6.751 1.244 0.610) 6.892 5.096 ( -0.765 -2.410 -0.702) 2.624 5.321 ( -1.856 -6.746 -1.917) 7.254 5.489 ( 2.460 -6.751 0.080) 7.185 5.713 ( 0.248 -3.073 -1.277) 3.337 5.872 ( 2.436 -7.644 -4.549) 9.223 7.465 ( -1.905 -0.854 -4.762) 5.200 7.605 ( -7.113 -2.828 -5.081) 9.187 7.879 ( -2.515 2.484 -7.582) 8.366 8.113 ( 0.442 -0.716 -8.473) 8.515 9.369 ( 3.666 4.353 11.849) 13.145 9.678 ( 2.592 -2.914 10.476) 11.178 9.871 ( 0.539 2.126 5.091) 5.543 9.972 ( 2.804 1.983 5.486) 6.473 10.328 ( 1.950 2.320 0.095) 3.032 10.493 ( -0.641 -0.345 -3.343) 3.421 13.090 ( -2.957 -0.384 -1.237) 3.228 13.178 ( -2.304 -2.979 -4.061) 5.539 13.377 ( -6.523 0.008 -11.194) 12.956 13.544 ( -3.346 0.300 -6.713) 7.507 14.373 ( 0.531 4.890 6.497) 8.149 15.050 ( 3.798 -6.509 -5.460) 9.306 18.196 ( 0.972 2.155 3.454) 4.186 18.370 ( 0.665 1.387 3.352) 3.688 18.496 ( 2.952 2.210 5.143) 6.328 18.875 ( -2.650 -3.725 -4.706) 6.561======================= Grid point 377 (193/312) =======================q-point: (-0.40 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.639 ( -16.160 2.819 5.368) 17.260 2.308 ( -19.936 2.646 -10.959) 22.903 2.746 ( 9.128 -5.056 -6.538) 12.313 3.324 ( -7.843 8.823 8.216) 14.383 3.430 ( 3.569 -16.050 -15.659) 22.706 3.711 ( -10.968 15.436 12.700) 22.800 4.196 ( 2.963 1.052 4.883) 5.807 4.291 ( 4.854 1.459 12.449) 13.441 4.603 ( 2.688 1.965 -7.866) 8.542 4.771 ( -2.354 -0.335 -3.968) 4.626 4.927 ( 4.767 -0.899 -4.951) 6.931 5.096 ( 2.275 0.707 -3.423) 4.171 5.333 ( 0.267 -6.042 6.457) 8.847 5.520 ( -1.998 -4.014 3.300) 5.567 5.712 ( 1.710 -5.675 -1.833) 6.204 5.915 ( 5.307 -5.730 -2.749) 8.280 7.345 ( -7.670 -1.567 -10.079) 12.762 7.422 ( 2.728 -2.337 -3.041) 4.707 7.864 ( 0.454 1.785 -0.079) 1.844 8.047 ( 0.035 0.277 -6.665) 6.671 9.536 ( 2.199 3.493 10.112) 10.922 9.799 ( -0.073 -2.302 8.390) 8.701 9.896 ( -1.193 1.330 1.950) 2.645 10.038 ( 0.159 0.453 2.140) 2.193 10.381 ( 3.550 1.587 -0.298) 3.900 10.442 ( -1.139 0.924 -3.046) 3.381 13.044 ( -0.966 -0.124 -0.227) 1.000 13.123 ( -1.022 -3.309 -0.980) 3.599 13.176 ( -5.064 2.221 -6.286) 8.372 13.443 ( -1.270 -0.522 -4.447) 4.654 14.463 ( 1.999 3.674 6.246) 7.517 15.058 ( 3.706 -4.849 -6.624) 9.007 18.231 ( -0.202 1.363 2.493) 2.848 18.424 ( 1.524 -0.567 2.778) 3.219 18.581 ( 1.100 1.910 3.814) 4.405 18.768 ( -3.691 -1.029 -4.201) 5.686======================= Grid point 378 (194/312) =======================q-point: (-0.30 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.445 ( -12.470 5.945 9.905) 16.998 1.929 ( -14.655 8.947 2.431) 17.342 2.916 ( 11.451 -5.330 2.383) 12.853 3.239 ( -12.740 8.038 13.065) 19.941 3.378 ( 4.682 -12.019 -10.819) 16.835 3.619 ( -7.836 12.423 6.301) 15.983 4.275 ( 1.225 -1.259 1.107) 2.076 4.400 ( -2.334 1.519 -2.018) 3.439 4.571 ( 0.140 0.344 2.114) 2.146 4.657 ( -2.479 2.301 -4.668) 5.764 4.989 ( 6.699 -3.053 -7.412) 10.447 5.133 ( 5.103 2.227 -2.795) 6.230 5.375 ( -2.066 -1.192 1.946) 3.078 5.520 ( -0.413 -6.291 4.220) 7.587 5.722 ( 1.001 -6.164 -1.989) 6.554 5.980 ( 3.830 -3.139 -2.048) 5.359 7.228 ( 1.976 1.137 -0.622) 2.363 7.526 ( 8.101 -2.508 3.402) 9.137 7.835 ( -2.708 2.004 -1.856) 3.847 7.980 ( -0.947 1.511 -5.125) 5.426 9.628 ( -0.952 2.119 5.074) 5.580 9.826 ( -1.672 1.738 0.136) 2.415 9.878 ( -4.300 -3.369 4.382) 7.003 10.025 ( -1.373 -0.118 -1.459) 2.007 10.372 ( -1.137 1.783 -3.359) 3.970 10.466 ( 4.164 1.812 -0.532) 4.573 13.041 ( -0.684 0.547 0.293) 0.923 13.084 ( 0.298 2.400 0.985) 2.611 13.146 ( 0.697 -2.205 4.725) 5.260 13.419 ( 1.523 -1.051 -0.670) 1.968 14.554 ( 2.187 1.470 3.747) 4.581 15.055 ( 3.356 -3.786 -7.208) 8.806 18.243 ( -0.600 0.829 1.775) 2.049 18.456 ( -0.476 -1.255 0.126) 1.348 18.591 ( -2.228 1.720 -0.139) 2.818 18.695 ( -0.931 -0.173 -0.041) 0.948======================= Grid point 379 (195/312) =======================q-point: (-0.20 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.399 ( -5.187 9.415 14.105) 17.734 1.856 ( -5.128 15.285 18.336) 24.416 3.126 ( -10.668 9.377 14.097) 20.011 3.201 ( 9.650 -7.663 8.827) 15.157 3.376 ( -1.980 1.130 6.043) 6.459 3.580 ( 2.988 0.404 -5.452) 6.231 4.212 ( -5.205 1.294 -6.961) 8.788 4.284 ( -1.624 0.469 -7.360) 7.552 4.544 ( -4.151 0.616 -0.775) 4.268 4.614 ( -1.310 1.239 -1.927) 2.639 5.018 ( 4.273 -2.758 -7.282) 8.882 5.200 ( 2.124 -1.573 -1.098) 2.862 5.366 ( 3.317 4.562 1.258) 5.779 5.573 ( 1.654 -8.248 3.208) 9.003 5.704 ( 0.323 -5.681 -3.970) 6.938 6.021 ( 2.014 -0.612 0.350) 2.134 7.391 ( 9.721 3.939 8.138) 13.275 7.687 ( -0.435 1.266 -0.453) 1.413 7.819 ( 6.512 0.995 6.936) 9.566 7.909 ( -1.840 1.776 -3.390) 4.246 9.591 ( -4.243 0.339 -2.183) 4.784 9.724 ( -6.896 1.900 -4.960) 8.705 9.839 ( -3.234 -3.997 2.057) 5.537 9.974 ( -2.415 0.541 -2.047) 3.212 10.325 ( -0.737 2.831 -2.404) 3.786 10.526 ( 3.425 1.847 -1.943) 4.350 13.048 ( 0.317 2.170 2.917) 3.650 13.157 ( 2.623 1.375 5.899) 6.601 13.260 ( 4.645 -2.203 8.478) 9.915 13.486 ( 4.014 -1.001 3.655) 5.520 14.607 ( 1.314 -0.646 0.397) 1.517 15.034 ( 2.082 -3.712 -7.500) 8.623 18.248 ( -0.975 0.655 1.293) 1.747 18.405 ( -2.381 -0.802 -2.520) 3.558 18.533 ( -2.350 2.303 -2.367) 4.053 18.711 ( 0.242 -1.880 2.494) 3.133======================= Grid point 380 (196/312) =======================q-point: (-0.10 0.27 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.526 ( 1.728 11.130 16.862) 20.278 2.029 ( -0.327 18.211 22.495) 28.944 3.087 ( -8.246 6.473 16.357) 19.428 3.426 ( 2.699 -0.921 9.493) 9.912 3.473 ( 3.259 3.346 11.416) 12.335 3.595 ( 5.950 -3.185 -9.851) 11.941 4.027 ( -5.399 3.289 -8.815) 10.848 4.201 ( -0.554 -0.095 -4.751) 4.784 4.397 ( -8.394 -0.008 -3.938) 9.272 4.577 ( 1.558 -0.464 -4.503) 4.788 5.007 ( 2.773 -3.117 -7.352) 8.453 5.185 ( -0.556 -4.297 -1.747) 4.671 5.513 ( 5.751 6.905 5.357) 10.462 5.650 ( 4.269 -9.203 2.309) 10.404 5.670 ( 0.896 -3.602 -3.583) 5.159 6.059 ( -0.055 1.929 3.067) 3.624 7.551 ( -2.441 4.874 -0.090) 5.451 7.665 ( 2.003 3.401 -2.532) 4.690 7.920 ( 6.288 2.406 9.234) 11.428 8.104 ( 9.938 1.352 12.548) 16.064 9.455 ( -5.589 -0.606 -5.982) 8.209 9.510 ( -8.779 0.335 -7.444) 11.515 9.779 ( -3.140 -2.193 -3.071) 4.909 9.886 ( -4.803 0.252 -3.025) 5.681 10.301 ( 0.020 3.451 -1.110) 3.625 10.552 ( 1.984 2.125 -2.608) 3.905 13.102 ( 0.887 2.008 5.191) 5.636 13.273 ( 2.680 1.010 7.158) 7.709 13.464 ( 7.552 -2.029 8.566) 11.598 13.628 ( 5.373 -0.475 7.130) 8.941 14.610 ( -0.371 -1.815 -1.430) 2.340 14.983 ( 0.855 -4.251 -8.073) 9.164 18.197 ( -4.142 0.637 -1.798) 4.560 18.356 ( -1.856 -1.749 -2.692) 3.708 18.496 ( 2.298 1.757 -0.618) 2.958 18.728 ( -1.142 -1.801 2.052) 2.959======================= Grid point 381 (197/312) =======================q-point: ( 0.00 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.015 ( 6.866 15.504 10.342) 19.862 2.554 ( -1.073 15.272 14.999) 21.433 3.101 ( 2.687 -9.432 3.646) 10.463 3.331 ( 3.305 -9.789 2.201) 10.564 3.634 ( 3.456 5.979 -3.941) 7.952 3.824 ( 2.286 4.030 3.811) 5.999 3.998 ( -3.817 7.412 -1.310) 8.439 4.196 ( -1.125 2.461 6.824) 7.341 4.247 ( -5.942 4.019 -3.913) 8.172 4.545 ( -0.126 0.954 -5.556) 5.639 4.857 ( 1.192 -8.212 -8.020) 11.541 5.080 ( 0.390 -6.373 1.964) 6.680 5.520 ( 0.123 -4.887 1.587) 5.139 5.559 ( 2.112 -5.371 -1.474) 5.957 5.901 ( 5.596 6.945 6.033) 10.768 6.125 ( -0.319 1.317 3.413) 3.673 7.550 ( -2.868 3.197 -2.583) 5.012 7.626 ( -3.071 0.847 -5.294) 6.179 8.339 ( 13.458 4.352 13.380) 19.470 8.434 ( 8.895 1.720 12.142) 15.150 9.249 ( -7.882 -1.388 -4.535) 9.199 9.287 ( -4.940 -1.944 -7.003) 8.787 9.659 ( -4.903 0.932 -5.260) 7.251 9.736 ( -6.185 -0.214 -6.147) 8.723 10.389 ( 0.335 4.954 0.451) 4.986 10.573 ( 0.569 -0.086 -1.676) 1.772 13.223 ( 2.761 3.338 1.627) 4.627 13.379 ( 2.339 -0.954 4.121) 4.834 13.662 ( 7.204 0.233 6.550) 9.739 13.783 ( 5.995 -1.462 5.422) 8.214 14.559 ( -2.536 0.990 -0.984) 2.894 14.811 ( 0.285 -6.225 -6.853) 9.262 18.108 ( -4.615 1.257 -1.681) 5.070 18.240 ( -2.609 -2.048 -3.292) 4.673 18.597 ( 4.205 0.651 1.310) 4.452 18.685 ( -1.452 -1.229 0.365) 1.937======================= Grid point 382 (198/312) =======================q-point: ( 0.10 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.233 ( 5.808 12.585 9.036) 16.545 2.680 ( 0.982 9.730 12.265) 15.687 3.135 ( -0.804 -5.296 -2.719) 6.007 3.389 ( 2.857 -4.599 -2.174) 5.834 3.650 ( 2.253 2.865 1.493) 3.939 3.863 ( 2.788 8.757 -8.794) 12.720 3.889 ( -4.106 3.729 -1.230) 5.681 4.174 ( -0.808 2.328 2.426) 3.458 4.290 ( -2.551 4.068 13.379) 14.215 4.490 ( 0.612 -0.481 -6.555) 6.601 4.817 ( 1.889 -9.832 -5.343) 11.348 5.117 ( 0.438 -6.370 2.129) 6.730 5.521 ( -0.958 -4.115 0.341) 4.239 5.584 ( 1.776 -5.395 -1.100) 5.785 6.004 ( -0.483 5.131 3.745) 6.370 6.115 ( -3.553 2.894 2.325) 5.139 7.496 ( -0.958 2.217 -1.019) 2.622 7.537 ( -1.764 0.851 -2.701) 3.336 8.614 ( 1.663 4.059 4.869) 6.553 8.679 ( 8.973 3.183 8.268) 12.610 9.098 ( -4.868 -1.035 -1.666) 5.248 9.202 ( 1.277 -3.274 -1.399) 3.783 9.521 ( -3.933 0.841 -4.480) 6.020 9.566 ( -5.156 0.397 -4.662) 6.962 10.397 ( -0.122 4.629 0.574) 4.666 10.562 ( -0.008 -0.135 -1.362) 1.369 13.275 ( 1.838 3.247 -0.038) 3.732 13.438 ( 1.021 -1.370 1.305) 2.150 13.814 ( 4.278 0.328 2.354) 4.894 13.902 ( 2.704 -0.695 1.759) 3.300 14.499 ( -4.016 1.642 1.212) 4.505 14.770 ( 1.982 -7.173 -5.570) 9.296 18.033 ( -2.237 1.734 -0.146) 2.834 18.186 ( -0.313 -1.328 -1.516) 2.039 18.638 ( -3.186 0.491 -0.394) 3.248 18.696 ( 4.553 -2.509 0.852) 5.268======================= Grid point 383 (199/312) =======================q-point: ( 0.20 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.376 ( 1.856 8.700 4.100) 9.795 2.842 ( 4.589 2.703 9.508) 10.898 3.006 ( -3.648 0.731 -11.928) 12.495 3.444 ( 1.567 0.496 5.476) 5.717 3.720 ( -1.394 0.213 -0.628) 1.544 3.746 ( 0.781 4.593 -0.023) 4.659 3.938 ( 5.229 7.478 -1.535) 9.253 4.200 ( 1.478 0.415 1.337) 2.036 4.311 ( -7.648 6.009 8.686) 13.040 4.447 ( 2.925 -1.714 -8.200) 8.874 4.823 ( 2.821 -11.100 -2.594) 11.743 5.108 ( -2.462 -7.409 -0.407) 7.818 5.495 ( -1.687 -3.289 -0.709) 3.764 5.598 ( 1.292 -5.782 -1.655) 6.151 5.931 ( -8.059 5.274 -1.318) 9.721 6.061 ( -4.499 0.645 0.822) 4.619 7.495 ( 0.755 1.554 0.965) 1.979 7.518 ( 0.633 0.811 0.749) 1.272 8.578 ( -4.058 4.258 -4.680) 7.517 8.768 ( -3.322 -0.234 -4.446) 5.555 9.050 ( 0.303 1.525 1.358) 2.064 9.253 ( 2.529 -4.330 -0.147) 5.016 9.494 ( 1.951 2.275 5.730) 6.467 9.532 ( 2.210 1.376 5.248) 5.859 10.393 ( -0.667 4.149 0.199) 4.207 10.548 ( -0.216 -0.617 -1.210) 1.375 13.283 ( 0.244 2.760 -2.347) 3.631 13.435 ( -0.954 -1.588 -2.341) 2.986 13.855 ( 0.423 -0.193 -3.075) 3.110 13.913 ( -0.676 0.324 -2.936) 3.031 14.443 ( -4.159 2.856 2.914) 5.826 14.773 ( 3.325 -8.476 -3.826) 9.876 18.032 ( 0.807 2.927 2.623) 4.012 18.204 ( 2.067 -0.325 1.772) 2.742 18.560 ( -4.232 2.320 -1.021) 4.933 18.775 ( 3.686 -5.601 -0.517) 6.725======================= Grid point 384 (200/312) =======================q-point: ( 0.30 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.360 ( -4.464 5.459 -2.111) 7.361 2.789 ( -0.530 -3.182 -18.149) 18.433 3.051 ( 3.440 3.024 11.464) 12.345 3.503 ( -1.632 0.841 5.465) 5.765 3.678 ( -2.584 1.658 -0.678) 3.144 3.818 ( 3.883 3.709 4.440) 6.968 3.983 ( -1.001 3.946 -3.963) 5.682 4.200 ( -1.410 10.092 0.374) 10.197 4.293 ( 0.833 5.545 7.518) 9.379 4.447 ( 5.730 -6.161 -7.851) 11.508 4.867 ( 3.179 -10.879 0.821) 11.364 5.041 ( -3.286 -8.866 -0.586) 9.473 5.439 ( -2.993 -2.686 -2.578) 4.777 5.594 ( 0.161 -6.799 -3.451) 7.627 5.735 ( -8.581 5.329 -4.137) 10.915 5.953 ( -6.445 -2.589 -1.903) 7.202 7.536 ( 1.262 1.226 2.427) 2.998 7.557 ( 1.419 0.594 2.677) 3.088 8.407 ( -5.115 2.428 -11.783) 13.073 8.532 ( -10.280 -0.990 -13.357) 16.884 9.122 ( 3.203 3.328 5.955) 7.536 9.317 ( 3.176 -3.686 4.680) 6.751 9.651 ( 4.421 2.354 10.188) 11.353 9.695 ( 5.584 1.650 9.423) 11.077 10.379 ( -0.737 3.639 -0.218) 3.719 10.530 ( -0.367 -1.198 -1.341) 1.836 13.240 ( -1.224 1.851 -4.204) 4.753 13.360 ( -2.708 -1.694 -5.487) 6.349 13.770 ( -3.403 -0.404 -8.018) 8.720 13.832 ( -2.580 0.378 -6.994) 7.464 14.412 ( -2.865 4.393 4.260) 6.757 14.810 ( 4.007 -9.164 -2.646) 10.346 18.104 ( 2.552 4.178 4.889) 6.919 18.288 ( 3.425 0.709 4.709) 5.865 18.475 ( -3.920 3.308 -0.709) 5.178 18.817 ( 2.311 -7.425 -2.180) 8.077======================= Grid point 385 (201/312) =======================q-point: (-0.60 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.197 ( -8.782 4.960 -4.723) 11.137 2.631 ( 2.062 -4.215 -16.032) 16.705 3.120 ( -4.977 -1.837 -1.138) 5.426 3.478 ( -1.077 -7.255 -9.978) 12.384 3.592 ( -6.543 6.389 4.545) 10.212 3.816 ( -6.221 4.741 3.365) 8.515 3.993 ( 6.048 6.718 3.974) 9.875 4.269 ( 0.306 11.976 7.694) 14.237 4.439 ( 10.281 6.784 2.690) 12.608 4.493 ( 5.188 -7.945 -3.021) 9.958 4.951 ( 1.709 -6.907 4.593) 8.469 5.019 ( -0.106 -10.100 4.478) 11.049 5.324 ( -4.750 -2.390 -5.849) 7.905 5.458 ( -5.909 -3.295 -8.767) 11.074 5.653 ( 1.052 -1.488 -1.381) 2.286 5.812 ( -5.322 -4.901 -3.325) 7.963 7.547 ( -1.831 1.186 -0.506) 2.240 7.612 ( 0.481 -0.568 2.849) 2.945 8.168 ( -7.809 0.661 -16.281) 18.069 8.222 ( -4.603 -0.349 -13.255) 14.036 9.271 ( 4.011 3.879 9.986) 11.439 9.457 ( 3.914 -3.190 9.476) 10.737 9.815 ( 2.875 2.340 8.675) 9.434 9.876 ( 4.314 1.279 7.871) 9.066 10.367 ( -0.143 3.108 -0.364) 3.132 10.508 ( -0.477 -1.404 -1.579) 2.166 13.164 ( -1.878 0.809 -4.825) 5.241 13.242 ( -3.108 -1.745 -6.821) 7.696 13.594 ( -5.207 0.238 -10.696) 11.899 13.691 ( -3.501 -0.517 -9.616) 10.246 14.425 ( -0.909 5.769 5.439) 7.981 14.861 ( 4.264 -8.838 -2.544) 10.137 18.198 ( 1.732 4.610 5.030) 7.040 18.407 ( 0.751 -0.787 4.266) 4.403 18.418 ( 0.591 5.213 2.425) 5.780 18.819 ( 0.915 -7.288 -3.246) 8.030======================= Grid point 386 (202/312) =======================q-point: (-0.50 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.976 ( -10.007 6.932 -4.069) 12.835 2.556 ( 4.905 -6.665 -12.236) 14.772 2.829 ( -15.543 -0.017 -13.431) 20.542 3.285 ( -0.762 -13.109 -20.803) 24.600 3.548 ( -6.141 9.425 8.433) 14.059 3.854 ( 0.221 2.917 9.722) 10.153 4.153 ( 4.795 5.155 8.588) 11.105 4.304 ( -4.586 12.494 8.207) 15.636 4.545 ( 4.882 -6.126 -2.753) 8.303 4.712 ( 13.471 7.115 -0.051) 15.235 4.990 ( -3.907 -7.614 4.950) 9.887 5.044 ( -3.682 0.839 4.824) 6.126 5.219 ( -2.129 -4.246 -2.796) 5.512 5.344 ( 4.503 -8.363 -4.043) 10.323 5.659 ( -0.650 -2.482 -1.986) 3.245 5.727 ( 1.495 -6.717 -3.297) 7.630 7.459 ( -3.318 0.274 -5.691) 6.594 7.552 ( -7.013 -2.629 -6.370) 9.832 7.933 ( -1.245 3.061 -8.132) 8.778 8.090 ( 0.740 -1.693 -9.159) 9.344 9.447 ( 3.367 3.634 11.184) 12.232 9.622 ( 2.580 -2.950 11.009) 11.685 9.914 ( 0.432 2.324 4.926) 5.464 9.997 ( 1.850 0.507 4.945) 5.304 10.374 ( 1.314 2.481 -0.034) 2.808 10.482 ( -0.584 -0.882 -1.726) 2.025 13.087 ( -1.619 0.075 -3.863) 4.189 13.131 ( -2.001 -1.871 -5.490) 6.135 13.390 ( -4.854 1.497 -10.795) 11.930 13.535 ( -2.663 -1.369 -9.678) 10.130 14.480 ( 0.654 6.249 5.749) 8.517 14.911 ( 4.262 -7.774 -3.386) 9.490 18.255 ( -0.104 3.843 3.531) 5.220 18.395 ( -0.931 0.872 1.991) 2.365 18.536 ( 3.033 2.249 5.523) 6.691 18.790 ( -0.522 -5.075 -3.273) 6.061======================= Grid point 387 (203/312) =======================q-point: (-0.40 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.775 ( -8.090 10.954 -1.961) 13.758 2.394 ( -14.931 6.483 -10.259) 19.241 2.594 ( 7.302 -10.840 -5.572) 14.208 3.091 ( 1.701 -17.429 -19.117) 25.926 3.516 ( -5.626 10.945 6.668) 13.997 3.925 ( -4.339 3.776 9.801) 11.364 4.288 ( -3.998 9.281 6.214) 11.863 4.336 ( 3.893 3.657 10.967) 12.198 4.594 ( 2.603 -3.188 -3.214) 5.222 4.776 ( -1.574 0.424 -6.720) 6.915 4.934 ( 2.129 1.938 -6.605) 7.205 5.081 ( 0.529 -2.801 2.184) 3.591 5.239 ( 3.149 -2.720 9.386) 10.267 5.445 ( 2.458 -4.221 2.280) 5.390 5.609 ( 0.065 -4.164 -3.328) 5.331 5.788 ( 6.540 -7.170 -2.216) 9.955 7.326 ( -5.146 -0.425 -9.415) 10.738 7.380 ( 1.808 -2.005 -4.612) 5.344 7.904 ( 0.828 2.339 -2.205) 3.320 8.035 ( 0.995 -1.336 -6.366) 6.581 9.596 ( 1.272 2.757 9.561) 10.031 9.749 ( -0.494 -2.797 10.088) 10.480 9.932 ( -1.242 2.304 0.781) 2.731 10.039 ( -0.460 -0.405 1.357) 1.489 10.412 ( 2.442 1.651 -0.282) 2.961 10.457 ( -0.133 0.494 -1.215) 1.319 13.040 ( -0.556 -0.255 -1.247) 1.389 13.072 ( -0.379 -1.963 -1.612) 2.569 13.227 ( -2.198 3.107 -8.291) 9.123 13.419 ( -0.347 -2.079 -7.537) 7.826 14.552 ( 1.354 5.625 4.590) 7.385 14.947 ( 3.946 -6.593 -4.644) 8.978 18.272 ( -1.153 2.728 2.693) 4.003 18.408 ( 0.105 -1.058 1.816) 2.105 18.618 ( 0.779 1.858 3.429) 3.977 18.739 ( -1.759 -2.000 -2.593) 3.717======================= Grid point 388 (204/312) =======================q-point: (-0.30 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.661 ( -3.449 15.861 0.851) 16.254 2.128 ( -8.579 11.716 3.505) 14.938 2.750 ( 10.185 -11.966 4.168) 16.257 2.983 ( 3.924 -20.824 -13.253) 24.994 3.472 ( -4.933 12.394 4.080) 13.949 3.881 ( -9.857 8.256 9.432) 15.946 4.282 ( -1.658 3.373 1.816) 4.174 4.428 ( -4.604 1.516 2.296) 5.363 4.581 ( 1.706 0.454 -1.337) 2.215 4.707 ( -0.530 2.477 -2.978) 3.910 4.924 ( 5.035 -2.953 -7.545) 9.539 5.111 ( 0.814 -4.685 1.155) 4.894 5.393 ( 3.149 1.624 6.649) 7.534 5.439 ( -1.196 -0.503 -2.119) 2.485 5.605 ( 1.492 -5.409 -2.427) 6.113 5.888 ( 6.201 -6.363 -2.253) 9.166 7.267 ( 4.901 2.735 -0.263) 5.619 7.469 ( 8.871 -3.366 2.424) 9.793 7.876 ( -1.367 2.307 -2.640) 3.763 7.988 ( -0.156 -0.591 -5.175) 5.211 9.658 ( -2.698 1.187 4.571) 5.439 9.789 ( -4.617 -3.655 6.677) 8.903 9.895 ( -1.842 3.238 -1.722) 4.104 10.022 ( -1.010 -0.511 -1.340) 1.754 10.414 ( -0.362 2.398 -1.731) 2.979 10.489 ( 3.357 0.541 -0.189) 3.406 13.046 ( 0.739 0.166 1.878) 2.025 13.090 ( 1.530 -1.463 3.079) 3.737 13.163 ( 1.772 3.545 -3.335) 5.179 13.384 ( 2.782 -2.661 -3.786) 5.399 14.609 ( 1.078 4.232 1.979) 4.795 14.961 ( 3.013 -5.922 -5.774) 8.803 18.273 ( -1.337 2.209 2.480) 3.580 18.422 ( -0.554 -2.178 0.664) 2.343 18.625 ( -1.877 1.626 0.169) 2.489 18.688 ( -1.322 -0.564 -1.060) 1.786======================= Grid point 389 (205/312) =======================q-point: (-0.20 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.670 ( 1.434 18.142 4.824) 18.828 2.164 ( 0.033 16.538 17.347) 23.967 2.966 ( 4.722 -21.418 -6.670) 22.924 3.021 ( 8.578 -11.352 12.627) 19.023 3.437 ( -0.615 11.735 1.687) 11.872 3.790 ( -9.037 9.094 8.859) 15.583 4.235 ( -3.456 1.838 -2.758) 4.789 4.297 ( -5.272 1.013 -4.669) 7.115 4.567 ( -3.036 2.032 -2.063) 4.195 4.673 ( -0.364 4.279 -3.875) 5.785 4.945 ( 3.710 -4.505 -6.656) 8.852 5.111 ( -1.505 -6.898 -0.302) 7.067 5.435 ( 2.187 -3.285 0.374) 3.964 5.493 ( 3.175 3.312 3.283) 5.642 5.607 ( 2.604 -2.118 -3.010) 4.508 5.976 ( 4.941 -4.218 -0.019) 6.496 7.475 ( 11.760 4.721 7.702) 14.829 7.687 ( 6.481 -1.296 2.872) 7.207 7.844 ( 2.660 1.710 2.765) 4.201 7.927 ( -0.979 0.093 -3.832) 3.956 9.589 ( -5.793 -0.203 -1.580) 6.008 9.691 ( -8.433 -3.797 -1.471) 9.364 9.851 ( -2.084 3.447 -0.722) 4.092 9.978 ( -2.125 -0.264 -2.346) 3.177 10.391 ( -0.313 3.877 -1.213) 4.075 10.542 ( 2.979 -0.127 -1.249) 3.233 13.090 ( 1.880 2.101 1.899) 3.399 13.175 ( 2.867 -0.115 4.928) 5.702 13.242 ( 5.705 1.055 5.400) 7.926 13.449 ( 5.773 -2.868 0.985) 6.521 14.626 ( 0.242 2.674 -0.791) 2.799 14.940 ( 1.349 -5.883 -6.642) 8.975 18.271 ( -1.902 1.763 2.345) 3.497 18.385 ( -2.619 -1.349 -1.737) 3.420 18.573 ( -2.235 1.951 -1.831) 3.486 18.675 ( 0.109 -1.809 0.541) 1.891======================= Grid point 390 (206/312) =======================q-point: (-0.10 0.36 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.803 ( 5.360 17.485 8.757) 20.277 2.384 ( 1.361 18.317 19.862) 27.053 3.014 ( 4.113 -16.620 -0.270) 17.123 3.231 ( 1.632 -7.818 10.306) 13.039 3.533 ( 8.400 5.076 0.744) 9.842 3.753 ( -4.180 7.101 9.713) 12.738 4.110 ( -5.017 5.278 -4.461) 8.540 4.195 ( -2.262 -0.067 -1.618) 2.782 4.434 ( -6.505 3.806 -6.358) 9.860 4.610 ( -1.032 3.734 -5.383) 6.632 4.916 ( 1.864 -6.277 -8.807) 10.975 5.079 ( -1.371 -6.748 0.411) 6.898 5.486 ( 1.368 -5.618 2.250) 6.204 5.542 ( 1.583 -4.970 -1.661) 5.474 5.715 ( 7.842 7.981 4.309) 11.990 6.066 ( 3.075 -1.497 2.738) 4.381 7.634 ( -2.418 3.784 -2.128) 4.969 7.712 ( 1.109 1.506 -3.953) 4.373 7.977 ( 9.566 3.441 10.420) 14.558 8.116 ( 11.662 -0.216 12.287) 16.941 9.436 ( -6.929 -1.063 -4.990) 8.605 9.487 ( -8.885 -2.294 -6.089) 11.013 9.782 ( -3.816 1.985 -2.830) 5.149 9.887 ( -4.442 -0.299 -4.190) 6.113 10.382 ( 0.165 4.770 -0.321) 4.784 10.570 ( 1.718 -0.250 -1.784) 2.490 13.152 ( 2.723 3.078 2.004) 4.572 13.281 ( 2.929 -0.338 5.430) 6.179 13.443 ( 7.906 0.194 8.343) 11.496 13.603 ( 7.190 -2.286 5.080) 9.096 14.606 ( -0.880 1.429 -1.993) 2.605 14.882 ( -0.064 -5.992 -7.139) 9.320 18.216 ( -5.053 1.320 -0.724) 5.272 18.320 ( -2.442 -1.940 -2.367) 3.915 18.539 ( 1.029 2.548 -0.789) 2.859 18.689 ( 0.063 -2.287 1.043) 2.514======================= Grid point 391 (207/312) =======================q-point: ( 0.00 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.345 ( 7.787 18.392 3.186) 20.225 2.669 ( 3.856 -11.110 1.136) 11.815 2.971 ( 2.527 6.129 10.944) 12.795 3.161 ( -2.904 -9.741 11.946) 15.685 3.749 ( 5.935 5.575 -3.128) 8.722 3.831 ( 5.367 -2.560 -1.339) 6.095 4.110 ( -4.222 4.516 -1.240) 6.305 4.180 ( -1.482 -2.751 3.420) 4.632 4.397 ( -3.826 9.982 -6.986) 12.770 4.580 ( -3.359 -5.185 -0.922) 6.246 4.753 ( -0.029 4.157 -4.701) 6.276 4.925 ( -0.610 -9.666 2.723) 10.061 5.462 ( 0.949 -1.043 1.101) 1.790 5.479 ( 1.608 -2.708 -0.255) 3.160 6.027 ( 3.996 5.809 4.927) 8.601 6.111 ( 2.070 -2.747 3.919) 5.214 7.601 ( -2.970 2.055 -3.931) 5.338 7.627 ( -3.068 -0.670 -4.886) 5.808 8.412 ( 12.741 2.987 12.957) 18.416 8.447 ( 11.121 -0.569 12.561) 16.786 9.233 ( -7.375 -0.076 -4.915) 8.863 9.249 ( -6.371 -1.661 -5.820) 8.787 9.690 ( -5.588 1.935 -5.487) 8.067 9.722 ( -5.849 -1.264 -6.048) 8.508 10.481 ( 0.238 4.389 0.138) 4.398 10.548 ( 0.286 -2.499 -0.653) 2.599 13.290 ( 3.465 3.446 0.690) 4.936 13.347 ( 2.984 -2.363 2.124) 4.359 13.686 ( 7.721 2.280 5.167) 9.566 13.740 ( 7.577 -2.911 4.151) 9.117 14.605 ( -2.329 3.730 -1.679) 4.707 14.696 ( -1.403 -5.592 -4.005) 7.021 18.143 ( -4.076 2.335 -1.862) 5.053 18.193 ( -3.063 -2.694 -2.508) 4.789 18.622 ( 1.956 1.691 0.620) 2.659 18.656 ( 0.228 -1.743 0.321) 1.787======================= Grid point 392 (208/312) =======================q-point: ( 0.10 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.499 ( 5.821 14.584 1.637) 15.788 2.735 ( 2.704 -6.948 0.260) 7.461 3.084 ( 0.367 3.391 6.235) 7.107 3.223 ( -0.440 -9.183 8.761) 12.699 3.789 ( 1.897 8.018 -3.075) 8.794 3.900 ( 1.824 -2.939 -1.371) 3.721 4.015 ( 0.275 7.569 -6.729) 10.131 4.180 ( 1.344 -9.327 -3.225) 9.960 4.311 ( -1.984 11.415 0.240) 11.588 4.541 ( -2.203 -9.113 2.580) 9.724 4.730 ( -0.509 9.462 -0.159) 9.477 4.951 ( -1.041 -10.819 3.589) 11.446 5.477 ( -0.079 -0.480 0.398) 0.628 5.501 ( 0.977 -2.926 -0.351) 3.105 6.092 ( -1.675 3.710 3.036) 5.078 6.136 ( -2.890 -0.723 2.410) 3.832 7.530 ( -1.315 1.249 -1.979) 2.684 7.543 ( -1.618 -0.187 -2.553) 3.028 8.684 ( 3.487 2.899 5.949) 7.480 8.713 ( 6.462 0.131 7.474) 9.881 9.095 ( -2.797 0.989 -2.294) 3.750 9.137 ( -0.298 -3.175 -1.925) 3.725 9.544 ( -4.178 1.377 -3.583) 5.674 9.565 ( -4.546 -0.623 -4.080) 6.140 10.481 ( -0.489 3.916 0.254) 3.955 10.540 ( -0.526 -2.178 -0.438) 2.283 13.342 ( 2.514 3.513 -1.652) 4.625 13.401 ( 1.864 -2.525 -0.562) 3.189 13.834 ( 4.649 1.834 1.050) 5.107 13.876 ( 4.393 -2.112 0.421) 4.892 14.550 ( -3.006 3.794 0.695) 4.890 14.643 ( -0.918 -5.850 -2.141) 6.296 18.082 ( -1.209 3.130 -0.156) 3.359 18.143 ( -0.317 -2.986 -0.679) 3.079 18.647 ( -0.908 0.536 -0.251) 1.084 18.662 ( 1.451 -1.169 0.030) 1.864======================= Grid point 393 (209/312) =======================q-point: ( 0.20 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.566 ( 1.920 10.650 -3.479) 11.367 2.759 ( 2.149 -8.752 -6.481) 11.100 3.120 ( -1.925 9.003 6.487) 11.262 3.311 ( 0.813 -10.498 7.102) 12.701 3.794 ( -0.132 7.158 1.471) 7.308 3.863 ( -1.926 2.366 1.876) 3.582 4.038 ( 6.649 3.612 -7.601) 10.726 4.176 ( 2.896 -10.054 -5.672) 11.901 4.313 ( 1.167 11.342 2.052) 11.585 4.547 ( -0.291 -9.018 3.976) 9.860 4.693 ( -3.187 9.569 -1.500) 10.197 4.925 ( -4.382 -11.498 1.103) 12.354 5.467 ( -0.933 0.299 -0.631) 1.165 5.505 ( 0.220 -3.595 -1.193) 3.794 6.014 ( -7.660 3.391 -0.839) 8.419 6.058 ( -6.684 -1.154 -0.170) 6.785 7.518 ( 0.691 0.839 0.552) 1.219 7.526 ( 0.669 -0.019 0.528) 0.852 8.663 ( -4.820 4.358 -4.783) 8.069 8.735 ( -4.989 -2.995 -4.772) 7.525 9.097 ( 2.473 3.297 0.769) 4.192 9.170 ( 2.747 -4.226 0.036) 5.040 9.531 ( 2.171 1.442 6.139) 6.669 9.546 ( 2.261 -0.039 6.010) 6.422 10.468 ( -1.071 3.465 0.030) 3.627 10.522 ( -0.995 -2.117 -0.438) 2.380 13.342 ( 0.736 3.182 -4.521) 5.577 13.397 ( -0.057 -2.402 -3.875) 4.559 13.868 ( 0.663 1.516 -4.155) 4.472 13.902 ( 0.654 -1.533 -4.499) 4.798 14.513 ( -2.605 4.676 2.561) 5.934 14.624 ( 0.254 -6.879 -0.396) 6.895 18.102 ( 1.893 4.066 2.907) 5.345 18.173 ( 2.395 -2.901 2.606) 4.577 18.610 ( -2.067 3.020 -1.167) 3.841 18.680 ( 0.877 -4.321 -1.043) 4.531======================= Grid point 394 (210/312) =======================q-point: ( 0.30 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.496 ( -2.577 8.364 -8.635) 12.295 2.664 ( -0.930 -8.583 -13.629) 16.133 3.174 ( -0.839 8.852 7.592) 11.692 3.366 ( -1.507 -10.648 4.053) 11.492 3.792 ( -1.781 8.077 0.171) 8.273 3.897 ( -0.749 -0.474 4.097) 4.192 4.050 ( 4.158 5.287 -7.012) 9.717 4.203 ( 4.153 -9.080 -0.083) 9.985 4.396 ( 5.862 11.186 1.759) 12.751 4.585 ( -3.673 12.780 3.321) 13.706 4.638 ( 3.897 -11.824 -0.149) 12.450 4.840 ( -4.981 -12.021 1.336) 13.080 5.424 ( -2.380 1.055 -2.596) 3.676 5.479 ( -1.141 -4.686 -3.067) 5.716 5.827 ( -9.203 4.296 -3.564) 10.763 5.899 ( -8.470 -3.200 -2.773) 9.469 7.555 ( 1.268 0.726 2.207) 2.646 7.563 ( 1.283 -0.066 2.340) 2.669 8.458 ( -7.134 2.675 -12.789) 14.886 8.503 ( -9.060 -2.003 -13.234) 16.163 9.184 ( 3.825 3.230 5.661) 7.558 9.248 ( 3.668 -3.475 5.139) 7.206 9.690 ( 4.622 1.644 10.023) 11.159 9.709 ( 5.060 -0.203 9.837) 11.064 10.445 ( -1.137 3.147 -0.290) 3.358 10.497 ( -1.061 -2.232 -0.612) 2.546 13.283 ( -1.014 2.396 -6.652) 7.142 13.325 ( -1.913 -1.993 -6.489) 7.052 13.783 ( -2.760 1.598 -8.559) 9.134 13.818 ( -2.293 -1.687 -8.778) 9.228 14.511 ( -0.909 6.042 3.547) 7.066 14.644 ( 1.791 -7.922 0.600) 8.144 18.194 ( 3.017 4.742 5.432) 7.816 18.269 ( 3.289 -2.717 5.438) 6.911 18.557 ( -1.908 5.368 -1.576) 5.911 18.677 ( 0.701 -6.997 -2.126) 7.347======================= Grid point 395 (211/312) =======================q-point: (-0.60 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.330 ( -4.741 8.491 -10.011) 13.956 2.502 ( -1.151 -8.729 -13.739) 16.318 3.154 ( -5.744 5.205 -3.497) 8.504 3.298 ( -5.079 -9.241 -7.491) 12.935 3.744 ( -2.831 7.327 0.915) 7.908 3.840 ( -2.851 -2.138 -1.123) 3.736 4.138 ( 4.838 8.224 3.750) 10.252 4.303 ( 3.387 -8.589 3.998) 10.061 4.542 ( 1.908 12.881 3.315) 13.437 4.601 ( 7.637 9.404 6.195) 13.607 4.793 ( 8.121 -9.683 5.724) 13.873 4.799 ( -1.796 -11.871 3.924) 12.631 5.314 ( -5.433 1.274 -5.611) 7.914 5.372 ( -5.626 -4.546 -6.896) 9.993 5.669 ( -3.563 2.528 -2.662) 5.115 5.731 ( -5.781 -3.769 -3.192) 7.604 7.572 ( -1.656 1.330 0.045) 2.125 7.596 ( -0.816 -1.096 1.273) 1.867 8.187 ( -6.450 1.232 -15.786) 17.097 8.210 ( -5.414 -0.974 -14.702) 15.698 9.338 ( 4.160 3.213 9.789) 11.111 9.397 ( 4.091 -3.075 9.674) 10.944 9.857 ( 3.117 1.881 8.426) 9.178 9.882 ( 3.611 -0.613 8.178) 8.961 10.425 ( -0.581 2.842 -0.466) 2.938 10.473 ( -0.726 -2.203 -0.788) 2.449 13.186 ( -1.800 1.333 -7.077) 7.423 13.213 ( -2.592 -1.409 -7.245) 7.823 13.617 ( -4.144 2.071 -11.131) 12.056 13.662 ( -3.433 -2.259 -11.248) 11.975 14.548 ( 0.884 7.092 3.840) 8.113 14.696 ( 2.960 -8.290 0.687) 8.829 18.292 ( 1.119 4.803 5.486) 7.377 18.369 ( 0.698 -3.098 5.309) 6.186 18.532 ( 1.039 6.772 -0.000) 6.851 18.673 ( 1.387 -7.734 -2.076) 8.127======================= Grid point 396 (212/312) =======================q-point: (-0.50 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.152 ( -4.033 10.994 -8.623) 14.542 2.374 ( 0.955 -11.454 -10.939) 15.867 2.892 ( -11.151 6.319 -14.291) 19.197 3.056 ( -6.346 -10.498 -17.127) 21.067 3.723 ( -2.324 8.251 4.152) 9.525 3.842 ( 0.232 -3.742 4.213) 5.640 4.264 ( 3.721 6.448 6.580) 9.936 4.397 ( 2.233 -7.075 5.402) 9.177 4.567 ( -2.838 12.701 5.384) 14.084 4.793 ( -2.698 -9.369 2.511) 10.068 4.898 ( 13.937 8.224 6.831) 17.565 5.045 ( 5.790 -3.226 10.786) 12.660 5.146 ( -3.266 -2.018 -7.237) 8.192 5.192 ( -2.938 -6.004 -6.928) 9.627 5.625 ( -0.708 -0.838 -2.358) 2.601 5.638 ( -0.279 -2.485 -2.678) 3.664 7.474 ( -4.797 1.256 -6.426) 8.117 7.506 ( -6.108 -2.064 -6.698) 9.297 7.993 ( -0.290 3.137 -8.992) 9.528 8.049 ( 0.412 -2.574 -9.422) 9.776 9.510 ( 2.958 3.038 11.034) 11.821 9.566 ( 2.681 -2.929 11.117) 11.805 9.958 ( 0.627 2.147 4.872) 5.361 9.990 ( 1.092 -1.128 4.875) 5.121 10.420 ( 0.620 2.249 -0.260) 2.348 10.458 ( -0.066 -1.622 -0.767) 1.796 13.092 ( -1.474 0.428 -5.424) 5.637 13.105 ( -1.861 -0.953 -5.645) 6.020 13.434 ( -3.203 2.905 -11.426) 12.217 13.492 ( -2.449 -2.908 -11.396) 12.014 14.611 ( 1.906 7.384 3.323) 8.319 14.759 ( 3.437 -7.969 -0.101) 8.679 18.332 ( -1.159 3.852 3.134) 5.099 18.388 ( -1.658 -1.766 2.305) 3.344 18.595 ( 2.706 4.061 3.069) 5.764 18.688 ( 1.383 -5.372 -0.667) 5.588======================= Grid point 397 (213/312) =======================q-point: (-0.40 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.035 ( -0.492 15.484 -5.902) 16.578 2.338 ( 4.659 -15.400 -6.060) 17.193 2.555 ( -9.665 10.345 -11.582) 18.291 2.788 ( -4.166 -13.991 -15.532) 21.315 3.725 ( -2.280 10.254 3.915) 11.210 3.887 ( -0.694 -6.095 4.305) 7.495 4.398 ( 1.028 4.323 9.061) 10.092 4.475 ( -3.920 -0.580 10.312) 11.047 4.558 ( 1.505 7.469 -1.307) 7.731 4.729 ( -2.696 -6.444 -3.165) 7.669 4.982 ( -2.023 2.489 -6.665) 7.396 5.027 ( -1.815 -2.239 -1.628) 3.310 5.243 ( 8.028 3.205 10.225) 13.389 5.343 ( 8.013 -6.175 4.678) 11.146 5.584 ( 0.549 1.612 -3.617) 3.998 5.659 ( 4.494 -5.828 -2.639) 7.818 7.328 ( -2.455 0.580 -8.070) 8.455 7.347 ( -0.033 -1.409 -6.365) 6.519 7.952 ( 1.170 2.620 -4.209) 5.094 8.000 ( 1.291 -2.275 -5.652) 6.228 9.645 ( 0.152 2.498 9.661) 9.980 9.695 ( -0.487 -2.772 10.050) 10.437 9.979 ( -0.990 2.477 0.876) 2.808 10.020 ( -0.768 -1.632 1.074) 2.099 10.441 ( 1.601 1.272 -0.186) 2.053 10.458 ( 0.800 -0.418 -0.431) 1.000 13.037 ( -0.317 0.107 -1.803) 1.833 13.046 ( -0.248 -0.863 -1.817) 2.027 13.294 ( -0.391 3.774 -9.629) 10.350 13.365 ( 0.127 -3.464 -9.504) 10.116 14.674 ( 1.961 6.979 1.822) 7.475 14.813 ( 3.138 -7.321 -1.568) 8.118 18.329 ( -1.542 3.004 2.019) 3.934 18.379 ( -1.125 -2.107 1.408) 2.773 18.654 ( 0.515 2.036 2.189) 3.034 18.696 ( -0.260 -2.312 -0.186) 2.334======================= Grid point 398 (214/312) =======================q-point: (-0.30 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.021 ( 3.764 20.891 -4.318) 21.662 2.361 ( -2.578 9.020 1.733) 9.540 2.442 ( 7.872 -16.432 -2.190) 18.352 2.638 ( 0.003 -14.903 -4.246) 15.496 3.707 ( -3.174 11.515 2.464) 12.196 3.885 ( -3.695 -6.113 3.184) 7.820 4.387 ( -7.107 5.071 4.151) 9.667 4.444 ( -7.536 -0.808 3.239) 8.242 4.619 ( 4.241 4.745 0.036) 6.364 4.716 ( 3.111 -2.908 -1.470) 4.505 4.906 ( 0.455 2.058 -5.361) 5.760 4.995 ( -1.751 -6.318 0.704) 6.594 5.401 ( 0.951 1.263 3.142) 3.517 5.447 ( 1.723 -2.584 0.468) 3.141 5.596 ( 5.077 5.972 -2.838) 8.336 5.745 ( 7.036 -8.248 -2.314) 11.085 7.328 ( 7.205 3.593 0.487) 8.066 7.400 ( 8.579 -3.771 1.434) 9.481 7.922 ( -0.402 2.384 -3.733) 4.448 7.963 ( 0.040 -1.852 -4.666) 5.020 9.683 ( -4.333 1.670 5.090) 6.890 9.726 ( -5.110 -2.837 5.843) 8.265 9.956 ( -0.978 2.917 -1.206) 3.304 10.001 ( -0.839 -1.695 -1.229) 2.256 10.458 ( 0.871 2.019 -0.738) 2.319 10.486 ( 2.211 -0.866 -0.241) 2.387 13.051 ( 1.440 0.477 2.562) 2.978 13.065 ( 1.731 -1.006 2.958) 3.572 13.240 ( 3.123 4.262 -6.175) 8.127 13.320 ( 3.473 -3.952 -6.056) 8.023 14.710 ( 1.114 6.198 -0.424) 6.311 14.837 ( 2.019 -6.782 -3.290) 7.803 18.322 ( -1.372 2.803 2.076) 3.749 18.375 ( -0.943 -2.662 1.224) 3.078 18.652 ( -1.692 1.263 -0.105) 2.114 18.673 ( -1.489 -0.952 -0.778) 1.931======================= Grid point 399 (215/312) =======================q-point: (-0.20 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.066 ( 5.306 22.538 -2.636) 23.304 2.457 ( 3.797 4.498 9.814) 11.444 2.544 ( 7.185 -12.365 -0.737) 14.319 2.776 ( 6.972 -14.097 14.471) 21.372 3.666 ( -2.643 11.026 1.160) 11.397 3.825 ( -4.951 -4.610 2.082) 7.078 4.288 ( -5.703 2.611 0.345) 6.282 4.313 ( -6.732 0.086 -1.124) 6.826 4.642 ( -0.833 5.964 -2.828) 6.653 4.735 ( -0.011 -0.496 -2.107) 2.164 4.876 ( 1.271 -0.249 -6.047) 6.184 4.965 ( -2.078 -7.402 0.412) 7.699 5.405 ( 0.430 0.724 -0.640) 1.057 5.454 ( 0.537 -3.935 -1.760) 4.344 5.707 ( 7.434 8.436 1.030) 11.291 5.863 ( 6.985 -7.359 0.367) 10.153 7.565 ( 12.247 4.487 6.897) 14.754 7.641 ( 10.811 -3.356 5.483) 12.578 7.881 ( 0.511 2.024 -0.795) 2.234 7.915 ( -0.280 -1.330 -2.889) 3.193 9.594 ( -7.245 0.871 -0.646) 7.326 9.627 ( -8.102 -2.621 -0.392) 8.524 9.917 ( -2.121 3.013 -1.943) 4.166 9.961 ( -2.047 -1.581 -2.346) 3.491 10.465 ( 0.770 3.575 -0.725) 3.728 10.521 ( 2.003 -2.112 -0.781) 3.014 13.126 ( 2.680 1.660 3.801) 4.938 13.156 ( 3.033 -1.418 5.190) 6.177 13.297 ( 6.703 4.022 0.138) 7.818 13.379 ( 6.884 -4.263 -0.917) 8.149 14.705 ( -0.150 5.300 -2.417) 5.828 14.820 ( 0.387 -6.433 -4.657) 7.951 18.311 ( -2.402 2.246 1.650) 3.679 18.352 ( -2.560 -1.997 -0.065) 3.248 18.608 ( -1.590 1.741 -1.414) 2.749 18.641 ( -0.636 -1.725 -0.773) 1.995======================= Grid point 400 (216/312) =======================q-point: (-0.10 0.45 0.30)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.177 ( 7.371 21.083 1.432) 22.380 2.574 ( 5.586 -15.987 -0.093) 16.935 2.770 ( 5.461 10.650 15.279) 19.408 3.036 ( 2.396 -12.898 16.412) 21.011 3.669 ( 3.143 7.472 -0.219) 8.109 3.779 ( -0.635 -3.277 0.970) 3.476 4.194 ( -4.857 2.398 -0.198) 5.421 4.204 ( -3.924 0.657 0.653) 4.032 4.546 ( -3.641 7.673 -7.203) 11.136 4.672 ( -3.114 -1.586 -3.853) 5.202 4.817 ( 0.084 0.307 -7.489) 7.496 4.933 ( -1.850 -8.104 0.739) 8.345 5.426 ( 1.523 -0.596 0.804) 1.822 5.456 ( 1.368 -3.412 -1.055) 3.825 5.872 ( 7.267 7.806 4.135) 11.439 6.000 ( 5.645 -5.268 3.188) 8.354 7.693 ( -1.780 2.316 -3.753) 4.756 7.721 ( -0.532 -0.559 -4.478) 4.544 8.044 ( 12.060 3.270 11.627) 17.068 8.095 ( 12.632 -1.952 12.122) 17.616 9.425 ( -8.047 0.113 -4.298) 9.124 9.444 ( -8.560 -1.825 -4.651) 9.911 9.830 ( -4.307 2.582 -3.832) 6.317 9.870 ( -4.354 -1.511 -4.322) 6.318 10.473 ( 0.657 4.412 -0.327) 4.473 10.542 ( 1.232 -2.655 -0.902) 3.063 13.211 ( 3.401 2.923 2.170) 4.982 13.259 ( 3.247 -1.925 3.862) 5.400 13.475 ( 8.655 2.950 5.653) 10.750 13.543 ( 8.671 -3.737 3.941) 10.232 14.663 ( -1.322 4.378 -2.987) 5.462 14.765 ( -0.976 -5.996 -5.003) 7.870 18.246 ( -4.851 1.813 -1.003) 5.275 18.283 ( -3.758 -1.971 -1.866) 4.636 18.590 ( 0.831 2.724 -0.345) 2.868 18.642 ( 0.665 -2.619 0.259) 2.715======================= Grid point 451 (217/312) =======================q-point: ( 0.00 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.053 ( 6.746 0.000 26.108) 26.966 2.180 ( -2.891 0.000 24.862) 25.030 3.035 ( -3.256 0.000 -21.637) 21.880 3.067 ( -3.621 0.000 -13.100) 13.591 3.385 ( -0.097 0.000 9.611) 9.611 3.661 ( -6.903 0.000 31.184) 31.939 3.852 ( -6.033 0.000 -9.351) 11.128 4.195 ( -5.111 0.000 6.356) 8.156 4.495 ( 13.368 0.000 -7.419) 15.289 4.563 ( 4.949 0.000 -13.134) 14.035 5.131 ( -6.032 0.000 2.318) 6.462 5.297 ( 7.543 0.000 -5.518) 9.346 5.313 ( 5.046 0.000 7.217) 8.806 5.493 ( -2.670 0.000 -0.674) 2.753 6.052 ( -3.069 0.000 1.692) 3.504 6.107 ( 4.066 0.000 -1.210) 4.242 7.357 ( -1.259 0.000 2.034) 2.392 7.427 ( -1.678 0.000 -1.600) 2.319 8.416 ( 5.312 0.000 10.266) 11.559 8.483 ( 3.681 0.000 7.964) 8.774 9.225 ( 2.590 0.000 -0.603) 2.659 9.253 ( -4.467 0.000 3.585) 5.728 9.480 ( -7.765 0.000 -9.550) 12.308 9.648 ( -3.975 0.000 -12.321) 12.946 10.255 ( -2.101 0.000 1.027) 2.338 10.336 ( 3.965 0.000 -2.451) 4.662 13.449 ( -0.009 0.000 6.228) 6.228 13.506 ( -1.030 0.000 10.987) 11.035 13.794 ( 6.372 0.000 -1.966) 6.668 13.821 ( 1.252 0.000 3.639) 3.849 14.704 ( -11.188 0.000 2.013) 11.368 14.908 ( 8.689 0.000 -6.893) 11.091 18.058 ( -0.258 0.000 -1.780) 1.799 18.136 ( -1.222 0.000 -5.202) 5.344 18.729 ( -9.741 0.000 1.472) 9.852 18.759 ( 11.843 0.000 -0.439) 11.851======================= Grid point 452 (218/312) =======================q-point: ( 0.10 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.430 ( 2.652 0.000 24.874) 25.015 2.463 ( 10.138 0.000 24.447) 26.465 2.778 ( 0.915 0.000 -24.486) 24.503 2.881 ( 0.178 0.000 -15.907) 15.908 3.517 ( 0.311 0.000 13.599) 13.602 3.667 ( -5.915 0.000 -5.776) 8.268 3.729 ( -12.152 0.000 19.293) 22.801 4.232 ( -0.529 0.000 10.249) 10.263 4.521 ( 4.553 0.000 -8.812) 9.919 4.622 ( 12.060 0.000 -19.143) 22.625 5.055 ( -4.917 0.000 2.849) 5.683 5.338 ( -1.340 0.000 -4.133) 4.345 5.450 ( 4.579 0.000 -4.551) 6.456 5.465 ( 4.492 0.000 4.434) 6.312 5.997 ( -4.182 0.000 0.707) 4.241 6.149 ( 2.010 0.000 -1.602) 2.570 7.381 ( 1.103 0.000 3.088) 3.280 7.408 ( 0.658 0.000 -0.030) 0.659 8.536 ( 0.819 0.000 1.736) 1.919 8.539 ( -0.934 0.000 -1.153) 1.483 9.182 ( -9.146 0.000 -1.347) 9.244 9.339 ( 5.097 0.000 6.806) 8.503 9.364 ( 1.832 0.000 6.057) 6.328 9.487 ( -0.815 0.000 -8.514) 8.553 10.227 ( -1.916 0.000 0.984) 2.154 10.384 ( 4.228 0.000 -3.256) 5.336 13.478 ( -2.086 0.000 3.350) 3.946 13.574 ( -1.812 0.000 7.704) 7.914 13.840 ( -1.013 0.000 -0.243) 1.042 13.843 ( 3.404 0.000 -6.513) 7.349 14.511 ( -11.905 0.000 2.833) 12.237 15.017 ( 8.702 0.000 -4.037) 9.593 18.063 ( 1.393 0.000 0.671) 1.546 18.087 ( 0.297 0.000 -2.804) 2.820 18.546 ( -10.657 0.000 0.308) 10.661 18.953 ( 9.884 0.000 -1.762) 10.040======================= Grid point 453 (219/312) =======================q-point: ( 0.20 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.572 ( 5.479 0.000 -21.079) 21.779 2.767 ( 4.859 0.000 19.284) 19.886 2.772 ( 4.060 0.000 -10.565) 11.319 2.890 ( 10.055 0.000 20.265) 22.622 3.537 ( -4.800 0.000 -0.021) 4.800 3.537 ( -13.220 0.000 9.673) 16.381 3.741 ( -1.157 0.000 14.260) 14.307 4.311 ( -1.736 0.000 7.412) 7.613 4.520 ( 6.088 0.000 -15.617) 16.761 4.586 ( 7.541 0.000 -20.027) 21.400 5.009 ( -3.554 0.000 3.583) 5.046 5.209 ( -5.346 0.000 -4.942) 7.281 5.549 ( 8.735 0.000 -3.897) 9.565 5.556 ( 3.241 0.000 0.207) 3.248 5.917 ( -4.766 0.000 -0.041) 4.766 6.148 ( -0.184 0.000 -2.051) 2.059 7.451 ( 3.101 0.000 1.532) 3.459 7.453 ( 2.691 0.000 3.629) 4.518 8.438 ( -4.541 0.000 -8.980) 10.063 8.469 ( -5.038 0.000 -7.442) 8.987 9.042 ( -5.003 0.000 4.135) 6.491 9.428 ( 3.716 0.000 0.265) 3.725 9.528 ( 3.809 0.000 12.608) 13.170 9.563 ( 5.915 0.000 8.345) 10.229 10.207 ( -1.203 0.000 0.981) 1.552 10.420 ( 3.773 0.000 -4.462) 5.843 13.437 ( -4.242 0.000 0.194) 4.246 13.586 ( -2.095 0.000 1.686) 2.689 13.785 ( -2.716 0.000 -3.510) 4.438 13.789 ( -1.083 0.000 -8.344) 8.413 14.345 ( -10.599 0.000 6.073) 12.216 15.128 ( 6.767 0.000 -3.262) 7.512 18.095 ( 2.127 0.000 -0.192) 2.135 18.121 ( 2.877 0.000 2.963) 4.130 18.369 ( -8.565 0.000 0.676) 8.592 19.071 ( 5.670 0.000 -3.466) 6.646======================= Grid point 454 (220/312) =======================q-point: ( 0.30 0.00 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.501 ( 10.746 0.000 -22.355) 24.804 2.782 ( 7.083 0.000 -7.481) 10.302 2.965 ( -5.077 0.000 15.329) 16.148 3.221 ( -4.925 0.000 24.498) 24.988 3.316 ( -9.272 0.000 0.048) 9.272 3.575 ( 6.308 0.000 7.447) 9.759 3.868 ( 0.239 0.000 10.115) 10.118 4.302 ( -6.166 0.000 7.075) 9.384 4.370 ( 5.730 0.000 -30.316) 30.853 4.597 ( 6.832 0.000 -8.628) 11.006 4.995 ( -2.030 0.000 3.515) 4.059 5.074 ( -3.105 0.000 -6.704) 7.388 5.602 ( 3.092 0.000 -2.122) 3.750 5.666 ( 6.585 0.000 -1.638) 6.786 5.834 ( -4.030 0.000 0.746) 4.099 6.106 ( -1.785 0.000 -2.591) 3.146 7.525 ( 1.716 0.000 1.199) 2.093 7.547 ( 4.986 0.000 2.725) 5.682 8.229 ( -5.832 0.000 -11.273) 12.692 8.230 ( -8.946 0.000 -13.281) 16.013 9.096 ( 1.105 0.000 12.300) 12.349 9.560 ( 7.113 0.000 4.858) 8.614 9.718 ( 3.131 0.000 12.370) 12.760 9.743 ( 4.122 0.000 8.479) 9.428 10.203 ( -0.246 0.000 0.881) 0.915 10.429 ( 2.738 0.000 -6.028) 6.621 13.333 ( -5.679 0.000 -2.302) 6.128 13.521 ( -1.639 0.000 -8.403) 8.561 13.656 ( -6.086 0.000 -3.875) 7.215 13.683 ( -3.572 0.000 -4.882) 6.049 14.261 ( -7.435 0.000 11.035) 13.306 15.182 ( 3.474 0.000 -5.160) 6.221 18.154 ( 3.475 0.000 1.340) 3.725 18.208 ( 1.750 0.000 2.581) 3.119 18.278 ( -2.019 0.000 4.356) 4.802 19.088 ( 0.770 0.000 -5.026) 5.084======================= Grid point 455 (221/312) =======================q-point: ( 0.40 0.00 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.522 ( 13.228 0.000 -18.189) 22.491 2.860 ( 1.820 0.000 -0.358) 1.855 2.900 ( -14.085 0.000 10.953) 17.842 2.959 ( -17.046 0.000 1.654) 17.126 3.393 ( -6.686 0.000 10.106) 12.117 3.866 ( 12.310 0.000 11.538) 16.872 3.941 ( -0.081 0.000 7.271) 7.271 4.210 ( 9.549 0.000 -28.201) 29.774 4.288 ( -4.120 0.000 11.186) 11.920 4.632 ( 5.229 0.000 -7.543) 9.179 4.963 ( 0.026 0.000 -9.762) 9.762 4.978 ( -2.413 0.000 -0.594) 2.485 5.631 ( 0.997 0.000 0.979) 1.397 5.748 ( 2.381 0.000 1.398) 2.761 5.810 ( 0.114 0.000 2.245) 2.248 6.041 ( -1.849 0.000 -3.230) 3.722 7.517 ( -1.052 0.000 -3.664) 3.812 7.677 ( 5.542 0.000 3.352) 6.477 7.912 ( -10.236 0.000 -14.349) 17.626 8.049 ( -3.793 0.000 -6.742) 7.736 9.282 ( 3.670 0.000 14.684) 15.136 9.737 ( 5.979 0.000 3.754) 7.060 9.878 ( 1.816 0.000 10.793) 10.945 9.881 ( 2.781 0.000 7.874) 8.350 10.215 ( 0.858 0.000 0.238) 0.890 10.402 ( 1.636 0.000 -7.479) 7.656 13.201 ( -5.411 0.000 -3.046) 6.210 13.363 ( -3.003 0.000 -13.747) 14.071 13.521 ( -7.398 0.000 1.897) 7.638 13.570 ( -3.571 0.000 -4.120) 5.452 14.293 ( -3.149 0.000 14.852) 15.182 15.153 ( 0.942 0.000 -8.574) 8.626 18.221 ( -0.442 0.000 2.310) 2.352 18.237 ( 3.867 0.000 1.153) 4.035 18.387 ( 4.682 0.000 7.139) 8.537 19.005 ( -3.649 0.000 -6.132) 7.136======================= Grid point 456 (222/312) =======================q-point: (-0.50 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.531 ( -22.873 0.000 0.066) 22.873 2.630 ( 14.586 0.000 -10.999) 18.268 2.710 ( -18.219 0.000 11.747) 21.678 2.995 ( 4.480 0.000 0.642) 4.525 3.242 ( -19.444 0.000 14.635) 24.336 4.030 ( 1.331 0.000 6.210) 6.351 4.103 ( 10.960 0.000 -13.567) 17.441 4.253 ( 13.942 0.000 -3.964) 14.495 4.361 ( -0.199 0.000 10.858) 10.860 4.629 ( 0.805 0.000 -3.057) 3.161 4.868 ( -5.338 0.000 -7.093) 8.877 4.897 ( 5.366 0.000 -13.428) 14.460 5.671 ( -1.063 0.000 6.800) 6.882 5.775 ( -2.026 0.000 3.349) 3.914 5.866 ( 2.907 0.000 2.018) 3.539 5.987 ( -0.226 0.000 -3.680) 3.687 7.461 ( 0.158 0.000 -2.966) 2.970 7.601 ( -8.859 0.000 -11.477) 14.498 7.803 ( 3.840 0.000 3.757) 5.372 7.931 ( -4.460 0.000 -3.823) 5.874 9.487 ( 3.067 0.000 13.184) 13.536 9.807 ( 0.642 0.000 -1.760) 1.873 9.993 ( 0.091 0.000 8.747) 8.747 10.019 ( 3.579 0.000 7.326) 8.154 10.234 ( 1.822 0.000 -1.755) 2.530 10.345 ( 0.734 0.000 -8.304) 8.337 13.096 ( -3.229 0.000 -1.318) 3.487 13.183 ( -3.992 0.000 -7.829) 8.788 13.425 ( -5.737 0.000 3.405) 6.672 13.484 ( -2.458 0.000 -1.671) 2.972 14.428 ( 0.915 0.000 16.095) 16.121 15.063 ( 0.596 0.000 -11.693) 11.708 18.244 ( 0.218 0.000 1.932) 1.945 18.308 ( 3.386 0.000 -0.504) 3.423 18.556 ( 5.333 0.000 7.931) 9.558 18.845 ( -6.618 0.000 -6.505) 9.280======================= Grid point 457 (223/312) =======================q-point: (-0.40 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.121 ( -22.092 0.000 1.588) 22.149 2.481 ( -20.100 0.000 13.623) 24.282 2.849 ( 16.245 0.000 -1.759) 16.340 2.969 ( -17.798 0.000 20.636) 27.251 3.145 ( -3.825 0.000 10.003) 10.709 4.068 ( -1.219 0.000 -0.300) 1.255 4.133 ( 8.741 0.000 -16.966) 19.085 4.372 ( 6.669 0.000 -13.245) 14.829 4.470 ( 0.860 0.000 6.150) 6.210 4.693 ( -4.620 0.000 -4.272) 6.293 4.698 ( 3.926 0.000 10.109) 10.844 4.879 ( 7.822 0.000 -16.112) 17.910 5.696 ( -4.126 0.000 6.117) 7.378 5.756 ( -2.468 0.000 2.213) 3.315 5.938 ( 2.712 0.000 1.972) 3.354 5.944 ( -0.506 0.000 -4.664) 4.691 7.399 ( -4.364 0.000 -3.157) 5.386 7.501 ( 4.147 0.000 3.387) 5.354 7.795 ( -6.729 0.000 -2.650) 7.232 7.882 ( 0.981 0.000 3.279) 3.423 9.630 ( -0.036 0.000 9.147) 9.147 9.745 ( -2.542 0.000 -6.558) 7.033 10.045 ( -2.210 0.000 5.099) 5.557 10.133 ( 2.565 0.000 4.219) 4.938 10.244 ( 2.373 0.000 -3.636) 4.342 10.266 ( -0.215 0.000 -8.715) 8.717 13.069 ( -0.215 0.000 2.322) 2.332 13.092 ( -1.877 0.000 1.097) 2.174 13.384 ( -3.550 0.000 5.579) 6.612 13.456 ( -0.353 0.000 1.564) 1.604 14.624 ( 3.179 0.000 14.984) 15.317 14.959 ( 1.916 0.000 -13.479) 13.614 18.254 ( -0.465 0.000 0.149) 0.488 18.346 ( 2.504 0.000 -2.752) 3.721 18.653 ( -7.146 0.000 -5.951) 9.299 18.724 ( 4.105 0.000 7.985) 8.978======================= Grid point 458 (224/312) =======================q-point: (-0.30 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.785 ( -20.076 0.000 10.293) 22.561 2.260 ( -19.660 0.000 16.239) 25.499 2.918 ( -15.232 0.000 32.941) 36.292 3.167 ( 15.659 0.000 4.395) 16.264 3.177 ( -5.233 0.000 12.335) 13.400 3.958 ( -4.777 0.000 -10.915) 11.914 4.058 ( 1.233 0.000 -14.633) 14.685 4.345 ( 7.041 0.000 -16.737) 18.158 4.429 ( -3.652 0.000 -2.800) 4.601 4.737 ( 3.585 0.000 9.350) 10.013 4.821 ( 2.112 0.000 -7.721) 8.005 4.908 ( 8.667 0.000 0.092) 8.668 5.623 ( -8.223 0.000 2.181) 8.507 5.717 ( -2.555 0.000 -3.194) 4.091 5.895 ( 1.001 0.000 -3.000) 3.163 6.004 ( 1.964 0.000 2.684) 3.326 7.390 ( 1.496 0.000 5.213) 5.424 7.580 ( -5.050 0.000 1.268) 5.207 7.737 ( 4.632 0.000 7.743) 9.023 7.911 ( -1.142 0.000 4.027) 4.186 9.599 ( -3.976 0.000 -10.216) 10.962 9.649 ( -4.662 0.000 3.223) 5.667 10.004 ( -3.968 0.000 -1.422) 4.215 10.156 ( -1.471 0.000 -8.529) 8.655 10.206 ( 2.053 0.000 0.355) 2.084 10.259 ( 1.933 0.000 -1.328) 2.345 13.128 ( 1.950 0.000 5.999) 6.308 13.136 ( 1.230 0.000 8.107) 8.200 13.409 ( -0.583 0.000 7.492) 7.514 13.502 ( 1.908 0.000 4.566) 4.949 14.811 ( 2.032 0.000 11.763) 11.938 14.877 ( 3.836 0.000 -13.713) 14.239 18.227 ( -1.444 0.000 -1.917) 2.400 18.351 ( 2.112 0.000 -4.227) 4.726 18.487 ( -4.705 0.000 -4.829) 6.742 18.850 ( 1.217 0.000 7.088) 7.192======================= Grid point 459 (225/312) =======================q-point: (-0.20 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 312Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.630 ( -12.663 0.000 20.741) 24.301 2.101 ( -16.317 0.000 19.476) 25.408 3.044 ( -7.556 0.000 31.286) 32.186 3.220 ( -7.464 0.000 23.043) 24.222 3.401 ( 4.709 0.000 -2.233) 5.211 3.710 ( -6.110 0.000 -17.049) 18.111 4.006 ( 8.152 0.000 -6.539) 10.450 4.265 ( 2.802 0.000 -18.323) 18.536 4.348 ( -3.881 0.000 -0.446) 3.907 4.743 ( 1.223 0.000 -12.075) 12.137 4.916 ( 5.143 0.000 9.699) 10.978 5.074 ( 7.804 0.000 1.094) 7.880 5.458 ( -10.444 0.000 0.522) 10.457 5.609 ( -3.326 0.000 -4.772) 5.817 5.940 ( 4.845 0.000 -0.664) 4.890 6.056 ( 0.497 0.000 2.813) 2.857 7.465 ( -6.272 0.000 0.857) 6.330 7.484 ( 1.503 0.000 3.773) 4.061 7.968 ( 1.669 0.000 9.881) 10.021 7.986 ( 8.262 0.000 13.590) 15.904 9.417 ( -3.731 0.000 -11.396) 11.991 9.534 ( -7.801 0.000 -1.869) 8.021 9.885 ( -5.127 0.000 -5.616) 7.604 10.019 ( -2.916 0.000 -10.637) 11.030 10.249 ( 2.561 0.000 -0.676) 2.648 10.279 ( 0.280 0.000 0.679) 0.735 13.242 ( 2.475 0.000 8.066) 8.437 13.266 ( 1.682 0.000 11.324) 11.449 13.510 ( 3.643 0.000 7.019) 7.908 13.606 ( 3.259 0.000 6.382) 7.166 14.835 ( 5.748 0.000 -12.529) 13.785 14.904 ( -2.592 0.000 7.297) 7.744 18.169 ( -1.936 0.000 -3.292) 3.819 18.320 ( -1.223 0.000 -5.893) 6.019 18.431 ( 3.905 0.000 -2.127) 4.446 18.900 ( -2.662 0.000 5.440) 6.057======================= Grid point 460 (226/312) =======================q-point: (-0.10 0.00 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.738 ( -1.371 0.000 26.028) 26.064 2.064 ( -10.162 0.000 22.720) 24.889 3.156 ( -4.664 0.000 12.929) 13.744 3.292 ( -3.964 0.000 -15.172) 15.681 3.412 ( -4.979 0.000 30.905) 31.303 3.447 ( -4.796 0.000 -7.809) 9.164 4.056 ( -4.316 0.000 -10.016) 10.907 4.258 ( 17.442 0.000 -7.112) 18.837 4.265 ( -5.875 0.000 1.894) 6.173 4.642 ( 1.067 0.000 -12.008) 12.055 5.103 ( 4.987 0.000 8.388) 9.758 5.204 ( 7.638 0.000 -3.336) 8.335 5.285 ( -8.529 0.000 1.590) 8.675 5.534 ( -1.881 0.000 -0.866) 2.071 6.029 ( 5.319 0.000 -0.835) 5.384 6.073 ( -1.421 0.000 2.409) 2.797 7.385 ( -3.708 0.000 1.530) 4.011 7.483 ( -2.044 0.000 -1.281) 2.412 8.175 ( 6.280 0.000 14.454) 15.759 8.268 ( 7.198 0.000 13.622) 15.407 9.264 ( -1.459 0.000 -8.503) 8.627 9.364 ( -7.494 0.000 -2.340) 7.851 9.707 ( -6.873 0.000 -8.212) 10.708 9.844 ( -3.955 0.000 -11.985) 12.621 10.277 ( -1.349 0.000 1.083) 1.730 10.290 ( 3.288 0.000 -1.729) 3.714 13.362 ( 1.637 0.000 8.031) 8.196 13.400 ( 0.130 0.000 12.165) 12.166 13.662 ( 6.748 0.000 3.223) 7.478 13.730 ( 3.009 0.000 6.184) 6.877 14.843 ( 7.452 0.000 -10.129) 12.575 14.858 ( -7.945 0.000 3.557) 8.705 18.102 ( -1.525 0.000 -3.296) 3.631 18.225 ( -1.964 0.000 -6.324) 6.622 18.556 ( 10.038 0.000 -0.365) 10.044 18.857 ( -6.671 0.000 3.405) 7.490======================= Grid point 461 (227/312) =======================q-point: ( 0.00 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.057 ( 4.956 0.737 25.228) 25.721 2.246 ( -1.527 6.287 24.930) 25.756 3.010 ( -3.965 0.005 -19.275) 19.678 3.157 ( -1.539 6.567 -16.890) 18.187 3.388 ( -0.831 0.358 11.219) 11.256 3.686 ( -8.294 2.041 20.997) 22.668 3.883 ( -4.413 3.541 -2.256) 6.091 4.129 ( -0.610 -5.436 5.023) 7.427 4.501 ( 7.541 -4.125 -9.504) 12.814 4.556 ( 4.921 2.839 -5.123) 7.650 5.089 ( -0.553 -3.856 0.065) 3.896 5.176 ( 3.156 -5.297 -2.937) 6.829 5.463 ( 5.663 8.303 3.122) 10.524 5.563 ( -2.613 5.896 0.079) 6.450 6.031 ( -2.909 -2.153 1.534) 3.931 6.071 ( 3.570 -3.143 -0.567) 4.790 7.375 ( -1.317 1.759 1.716) 2.788 7.443 ( -1.692 1.529 -1.852) 2.937 8.421 ( 6.861 0.569 10.239) 12.338 8.494 ( 2.620 1.162 7.292) 7.835 9.223 ( 2.346 -0.171 -0.848) 2.501 9.257 ( -4.550 0.298 3.416) 5.697 9.480 ( -6.975 0.073 -9.593) 11.860 9.641 ( -4.483 -0.676 -11.422) 12.288 10.253 ( -1.271 0.251 1.802) 2.219 10.366 ( 3.052 2.756 -3.156) 5.183 13.434 ( -0.387 -2.044 8.002) 8.268 13.495 ( -0.584 -0.630 8.163) 8.208 13.775 ( 3.960 -0.788 1.740) 4.397 13.852 ( 3.291 2.008 1.102) 4.010 14.674 ( -9.327 -2.839 1.854) 9.925 14.890 ( 7.581 -1.975 -7.646) 10.947 18.060 ( -0.858 0.203 -1.311) 1.580 18.147 ( -1.418 0.975 -5.000) 5.287 18.722 ( -5.015 -0.830 1.140) 5.210 18.742 ( 7.315 -1.490 0.106) 7.466======================= Grid point 462 (228/312) =======================q-point: ( 0.10 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.391 ( 4.114 -1.731 24.201) 24.609 2.537 ( 6.538 5.482 23.492) 24.993 2.751 ( -0.452 -0.715 -22.663) 22.679 2.992 ( 2.965 8.933 -17.670) 20.021 3.515 ( -0.551 -0.032 12.660) 12.672 3.608 ( -7.407 -2.871 3.699) 8.763 3.825 ( -8.923 6.941 8.817) 14.337 4.213 ( 1.011 -1.765 9.240) 9.461 4.513 ( 6.141 -3.630 -9.897) 12.200 4.586 ( 4.575 -1.090 -11.263) 12.206 5.049 ( -1.225 0.105 -1.982) 2.333 5.247 ( 5.198 -7.628 -2.208) 9.491 5.493 ( -3.053 6.689 -2.789) 7.864 5.579 ( 4.291 6.341 1.606) 7.823 5.968 ( -4.625 -2.748 0.515) 5.404 6.121 ( 2.178 -2.667 -0.913) 3.563 7.395 ( 0.958 1.343 2.860) 3.302 7.422 ( 0.627 1.357 -0.022) 1.495 8.514 ( -2.244 -0.830 -1.351) 2.748 8.574 ( 2.221 2.319 1.153) 3.412 9.176 ( -8.560 -0.601 -1.125) 8.654 9.340 ( 5.197 0.029 6.259) 8.135 9.380 ( 2.044 1.563 6.209) 6.721 9.479 ( -1.242 -0.703 -8.051) 8.177 10.239 ( -1.773 1.289 1.378) 2.589 10.399 ( 3.902 1.559 -3.536) 5.491 13.472 ( -2.244 -1.000 4.246) 4.905 13.542 ( -1.796 -2.771 5.716) 6.601 13.820 ( 0.320 -0.280 -0.667) 0.791 13.878 ( 1.392 1.700 -4.834) 5.310 14.503 ( -10.742 -0.680 2.498) 11.049 14.983 ( 8.584 -3.421 -4.702) 10.368 18.053 ( 0.224 -0.665 0.696) 0.989 18.104 ( 0.793 1.415 -1.755) 2.390 18.555 ( -9.723 0.858 -0.278) 9.765 18.928 ( 9.452 -2.522 -1.252) 9.863======================= Grid point 463 (229/312) =======================q-point: ( 0.20 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.532 ( 3.660 -2.380 -20.076) 20.545 2.684 ( 1.824 -4.197 16.917) 17.525 2.894 ( 7.149 5.486 5.967) 10.808 2.953 ( 7.903 7.287 2.730) 11.091 3.480 ( -4.348 -0.103 3.630) 5.665 3.667 ( -4.681 6.324 7.597) 10.937 3.733 ( -6.324 1.007 12.304) 13.870 4.289 ( -1.708 -2.113 5.363) 6.012 4.494 ( 3.222 -6.532 -19.552) 20.864 4.543 ( 6.113 -0.299 -7.701) 9.837 5.011 ( -0.192 1.016 -3.221) 3.382 5.257 ( -3.301 1.297 -0.845) 3.646 5.455 ( 4.397 -1.714 -5.152) 6.987 5.650 ( 3.193 3.678 -0.708) 4.922 5.881 ( -4.853 -3.507 -0.102) 5.988 6.128 ( -0.174 -1.937 -1.555) 2.490 7.460 ( 2.795 0.904 3.121) 4.286 7.465 ( 2.632 1.273 2.069) 3.582 8.396 ( -4.832 -2.531 -8.574) 10.162 8.512 ( -5.293 2.660 -8.781) 10.592 9.050 ( -4.261 0.830 4.403) 6.183 9.438 ( 3.648 0.777 0.268) 3.740 9.520 ( 4.917 -0.653 10.236) 11.375 9.574 ( 5.258 1.151 10.644) 11.927 10.222 ( -1.226 1.555 1.071) 2.251 10.430 ( 3.539 0.984 -4.413) 5.742 13.433 ( -4.339 -0.566 0.212) 4.381 13.540 ( -2.393 -4.347 1.433) 5.165 13.777 ( -2.806 0.221 -2.969) 4.091 13.808 ( -1.828 0.690 -8.277) 8.504 14.354 ( -9.225 1.068 5.282) 10.684 15.088 ( 6.845 -4.033 -3.772) 8.795 18.078 ( 1.208 -1.045 2.018) 2.574 18.146 ( 3.065 1.913 2.343) 4.306 18.387 ( -7.602 1.842 -0.310) 7.828 19.045 ( 5.524 -2.677 -3.115) 6.883======================= Grid point 464 (230/312) =======================q-point: ( 0.30 0.09 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.442 ( 8.533 -4.025 -19.612) 21.763 2.802 ( -6.810 -8.496 13.415) 17.278 2.912 ( 4.313 7.144 -8.719) 12.069 3.266 ( 7.585 0.881 13.197) 15.247 3.433 ( -14.337 11.612 7.788) 20.026 3.618 ( 5.121 4.137 6.791) 9.458 3.839 ( -0.505 -2.413 10.747) 11.026 4.248 ( -4.304 -4.429 -1.271) 6.306 4.350 ( 3.061 -3.138 -17.675) 18.210 4.592 ( 6.321 -0.281 -6.619) 9.157 4.980 ( 0.479 0.292 -3.779) 3.820 5.158 ( -5.346 6.227 -1.302) 8.310 5.516 ( 6.337 -6.471 -4.253) 10.006 5.687 ( 1.548 -0.378 -0.715) 1.747 5.807 ( -2.861 -2.462 0.649) 3.830 6.087 ( -1.979 -1.896 -2.390) 3.637 7.523 ( 1.191 0.042 0.599) 1.333 7.561 ( 4.743 1.222 3.375) 5.948 8.198 ( -5.201 -1.982 -11.641) 12.903 8.247 ( -9.725 0.604 -13.331) 16.512 9.115 ( 1.465 1.974 12.036) 12.284 9.574 ( 7.043 1.045 5.476) 8.982 9.700 ( 3.784 -1.007 9.249) 10.044 9.764 ( 3.807 1.638 10.634) 11.413 10.217 ( -0.325 1.462 0.840) 1.717 10.436 ( 2.545 0.737 -5.771) 6.350 13.327 ( -5.652 -0.723 -2.554) 6.245 13.478 ( -2.317 -4.234 -5.343) 7.200 13.655 ( -6.262 -0.355 -5.267) 8.190 13.679 ( -3.735 -0.188 -5.532) 6.677 14.285 ( -6.238 2.330 9.636) 11.713 15.143 ( 3.812 -4.059 -5.464) 7.801 18.136 ( 1.745 -0.983 3.632) 4.148 18.245 ( 4.005 2.661 3.017) 5.676 18.293 ( -2.664 1.786 2.192) 3.884 19.065 ( 0.918 -2.433 -4.840) 5.495======================= Grid point 465 (231/312) =======================q-point: ( 0.40 0.09 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.459 ( 11.632 -4.848 -14.656) 19.328 2.676 ( -18.761 -12.653 13.531) 26.366 2.952 ( 6.237 6.502 -7.608) 11.792 3.098 ( -14.927 5.062 -8.306) 17.817 3.483 ( -5.751 9.273 16.592) 19.858 3.880 ( 5.858 -3.206 8.669) 10.943 3.899 ( 4.635 0.841 6.740) 8.223 4.166 ( 2.442 -2.458 -7.983) 8.703 4.309 ( 2.902 0.262 -1.655) 3.350 4.634 ( 5.176 0.260 -6.505) 8.317 4.942 ( 1.216 0.085 -7.555) 7.652 5.042 ( -4.983 4.278 -3.769) 7.573 5.582 ( 2.653 -4.897 0.693) 5.612 5.713 ( 1.034 -3.650 2.848) 4.744 5.799 ( 0.444 -1.289 1.174) 1.799 6.019 ( -1.958 -2.270 -3.300) 4.458 7.499 ( -1.324 -1.486 -4.342) 4.777 7.691 ( 4.999 1.077 4.104) 6.557 7.890 ( -11.350 -1.765 -14.671) 18.632 8.055 ( -2.413 0.244 -6.962) 7.373 9.300 ( 3.649 1.893 14.238) 14.820 9.757 ( 6.029 1.868 3.967) 7.455 9.835 ( 2.124 -2.347 8.534) 9.102 9.920 ( 2.379 1.945 9.484) 9.969 10.227 ( 0.808 1.249 0.170) 1.497 10.409 ( 1.458 0.757 -7.058) 7.246 13.194 ( -5.230 -0.743 -3.227) 6.190 13.346 ( -2.869 -1.833 -11.539) 12.031 13.497 ( -7.903 -2.598 1.009) 8.380 13.560 ( -3.490 -0.616 -4.594) 5.802 14.317 ( -2.675 2.391 13.301) 13.777 15.120 ( 1.519 -3.381 -8.668) 9.428 18.198 ( 0.653 -0.681 4.025) 4.135 18.285 ( 2.268 3.142 0.226) 3.881 18.394 ( 4.623 0.856 6.796) 8.264 18.988 ( -3.248 -1.795 -6.065) 7.110======================= Grid point 466 (232/312) =======================q-point: (-0.50 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.436 ( -21.505 -9.765 13.939) 27.425 2.570 ( 8.369 -5.050 -7.223) 12.154 2.663 ( -15.981 -1.889 -5.700) 17.072 3.046 ( 7.292 3.727 -6.446) 10.422 3.417 ( -16.674 14.950 15.888) 27.459 3.911 ( 0.674 -8.481 0.221) 8.510 4.166 ( 8.509 2.801 0.294) 8.963 4.213 ( 7.527 -1.424 -0.485) 7.676 4.412 ( 6.457 2.512 5.752) 9.005 4.645 ( 1.811 1.759 -4.316) 5.000 4.870 ( -4.281 0.345 -7.795) 8.900 4.902 ( 2.506 0.678 -12.437) 12.705 5.639 ( -1.012 -3.284 7.334) 8.099 5.751 ( -1.590 -2.443 3.588) 4.623 5.839 ( 2.610 -2.704 1.560) 4.069 5.967 ( 0.455 -2.120 -4.003) 4.552 7.440 ( 0.504 -2.003 -3.508) 4.071 7.559 ( -9.821 -3.763 -10.809) 15.082 7.813 ( 3.518 0.979 3.683) 5.186 7.956 ( -3.179 1.919 -4.567) 5.886 9.499 ( 2.968 1.361 12.790) 13.200 9.817 ( 0.382 0.988 -2.097) 2.349 9.970 ( 1.799 -1.512 9.074) 9.373 10.038 ( 1.691 1.098 6.847) 7.137 10.247 ( 2.105 1.393 -1.537) 2.955 10.353 ( 0.433 0.857 -7.799) 7.858 13.092 ( -2.971 -0.376 -1.262) 3.250 13.179 ( -3.878 -0.383 -7.628) 8.566 13.394 ( -5.874 -3.283 3.689) 7.674 13.474 ( -2.020 -0.887 -2.156) 3.085 14.439 ( 0.581 1.165 14.741) 14.798 15.042 ( 1.329 -2.202 -11.662) 11.942 18.239 ( 0.045 -0.042 3.002) 3.003 18.338 ( 3.167 2.501 -0.800) 4.114 18.554 ( 4.844 -0.103 7.558) 8.977 18.838 ( -6.013 -0.812 -6.498) 8.890======================= Grid point 467 (233/312) =======================q-point: (-0.40 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.131 ( -21.169 1.077 2.184) 21.309 2.289 ( -21.753 -14.695 17.083) 31.321 2.814 ( 14.904 -2.572 0.665) 15.139 3.099 ( 0.279 4.639 1.408) 4.856 3.271 ( -15.364 15.394 17.939) 28.193 3.914 ( 0.727 -11.123 -2.623) 11.451 4.205 ( 2.945 3.813 -10.784) 11.812 4.315 ( 3.117 -2.641 -3.872) 5.628 4.596 ( 5.863 8.794 -2.248) 10.806 4.683 ( -4.439 -0.697 -4.422) 6.304 4.687 ( 3.299 -1.186 9.247) 9.889 4.876 ( 7.321 -0.229 -14.675) 16.402 5.648 ( -5.571 -3.988 4.973) 8.466 5.751 ( -1.056 -1.489 3.155) 3.645 5.890 ( 0.679 -3.616 -0.467) 3.709 5.953 ( 2.216 -0.368 -2.797) 3.587 7.343 ( -4.722 -4.316 -1.912) 6.676 7.502 ( 5.785 -0.823 2.839) 6.497 7.821 ( -6.002 2.181 -2.989) 7.051 7.894 ( 0.596 1.196 2.269) 2.633 9.636 ( -0.233 0.762 8.529) 8.566 9.756 ( -2.119 1.142 -6.136) 6.591 10.043 ( -1.885 -0.195 5.140) 5.479 10.111 ( 0.890 -2.099 2.871) 3.666 10.268 ( 0.968 2.179 -5.232) 5.750 10.280 ( 1.808 1.529 -5.182) 5.697 13.067 ( -0.523 -0.172 1.801) 1.884 13.091 ( -1.371 -0.085 1.272) 1.872 13.356 ( -3.212 -2.742 5.624) 7.033 13.451 ( 0.059 -0.688 1.347) 1.514 14.608 ( 2.108 -1.399 13.196) 13.436 14.955 ( 2.915 -0.532 -12.862) 13.199 18.254 ( -0.708 0.211 1.159) 1.374 18.371 ( 2.337 2.284 -3.035) 4.460 18.647 ( -6.133 -0.639 -4.250) 7.489 18.719 ( 3.149 -0.481 5.989) 6.784======================= Grid point 468 (234/312) =======================q-point: (-0.30 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.799 ( -19.119 0.833 9.064) 21.175 2.139 ( -18.083 -8.692 24.131) 31.382 3.049 ( -6.520 6.867 17.774) 20.139 3.165 ( 10.510 1.975 7.179) 12.880 3.242 ( -6.264 7.897 14.510) 17.667 3.865 ( -1.047 -9.381 -8.598) 12.768 4.091 ( -0.917 2.801 -13.301) 13.623 4.241 ( -1.161 -4.134 -10.189) 11.057 4.549 ( -0.199 5.070 -8.681) 10.055 4.695 ( 2.367 -1.755 2.953) 4.172 4.857 ( 4.243 2.007 -5.995) 7.613 4.917 ( 8.462 1.394 4.822) 9.838 5.543 ( -7.823 -5.706 -0.449) 9.693 5.755 ( -1.364 1.208 -0.632) 1.929 5.854 ( 0.354 -3.931 -3.239) 5.106 5.999 ( 2.230 -0.472 1.857) 2.940 7.349 ( 2.060 -2.828 6.530) 7.408 7.644 ( -4.369 5.118 -0.338) 6.738 7.725 ( 5.776 -1.188 7.764) 9.749 7.911 ( -1.363 0.088 3.365) 3.631 9.599 ( -4.046 0.230 -7.917) 8.893 9.672 ( -4.358 2.170 1.051) 4.981 9.999 ( -3.716 -0.642 -2.748) 4.667 10.111 ( -1.920 -3.845 -2.746) 5.100 10.211 ( 0.514 1.509 -2.709) 3.143 10.312 ( 3.001 3.696 -2.027) 5.175 13.108 ( 1.276 -1.348 6.141) 6.416 13.150 ( 1.882 0.764 7.316) 7.592 13.390 ( -0.025 -1.907 7.443) 7.683 13.502 ( 2.194 -0.172 4.626) 5.123 14.737 ( 1.379 -5.213 4.428) 6.978 14.917 ( 4.321 1.871 -7.522) 8.874 18.237 ( -1.390 0.995 -0.692) 1.843 18.365 ( 1.565 1.332 -4.670) 5.102 18.490 ( -4.703 0.431 -4.736) 6.688 18.833 ( 1.187 -1.698 6.717) 7.029======================= Grid point 469 (235/312) =======================q-point: (-0.20 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.655 ( -11.287 2.087 19.356) 22.503 2.081 ( -14.609 -0.712 24.648) 28.661 3.110 ( -5.981 4.956 19.608) 21.090 3.298 ( -7.824 8.996 27.175) 29.675 3.406 ( 5.887 0.313 -1.137) 6.004 3.687 ( -4.276 -3.102 -16.154) 16.996 3.998 ( 5.363 -1.284 -8.351) 10.007 4.148 ( 0.402 -5.486 -7.870) 9.602 4.441 ( -2.515 4.105 -7.477) 8.893 4.695 ( 0.278 -3.893 -7.820) 8.740 4.916 ( 5.220 -0.143 0.933) 5.305 5.122 ( 7.129 4.086 6.475) 10.462 5.382 ( -7.052 -4.723 -2.786) 8.933 5.675 ( -3.431 3.831 -3.297) 6.109 5.893 ( 4.521 -4.716 -0.281) 6.539 6.050 ( 0.593 -0.407 2.624) 2.721 7.458 ( -0.356 0.446 4.056) 4.096 7.529 ( -3.294 3.337 0.074) 4.690 7.943 ( 2.370 -1.516 9.378) 9.791 8.010 ( 8.118 1.398 13.183) 15.545 9.425 ( -3.810 0.867 -11.033) 11.705 9.549 ( -8.000 1.526 -2.280) 8.457 9.874 ( -4.670 -1.272 -6.657) 8.230 10.001 ( -3.546 -1.659 -7.932) 8.845 10.222 ( 0.780 -0.403 0.904) 1.261 10.340 ( 1.988 4.037 -1.711) 4.814 13.218 ( 2.033 -2.042 8.883) 9.339 13.276 ( 2.091 0.708 9.816) 10.061 13.499 ( 3.799 -1.107 7.241) 8.252 13.613 ( 3.665 0.545 6.510) 7.490 14.759 ( 2.694 -5.693 -4.962) 8.018 14.933 ( 0.569 1.129 -1.342) 1.844 18.185 ( -2.469 1.616 -2.676) 3.983 18.335 ( -0.916 1.314 -5.798) 6.016 18.422 ( 3.046 -0.749 -1.980) 3.709 18.882 ( -2.362 -1.774 5.167) 5.952======================= Grid point 470 (236/312) =======================q-point: (-0.10 0.09 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.764 ( -1.065 2.513 24.488) 24.639 2.101 ( -9.187 4.302 24.757) 26.755 3.170 ( -3.879 1.676 7.495) 8.604 3.331 ( -4.259 3.801 -9.356) 10.961 3.441 ( -3.339 0.129 -14.416) 14.798 3.502 ( -5.247 7.748 33.140) 34.435 4.035 ( -1.111 -4.596 -11.311) 12.259 4.099 ( 3.085 -5.267 -0.390) 6.116 4.394 ( 4.454 4.878 -0.867) 6.663 4.601 ( 0.434 -3.947 -10.272) 11.013 5.025 ( 5.079 -4.565 0.994) 6.901 5.230 ( -4.342 -3.996 -0.461) 5.919 5.319 ( 6.122 8.117 2.543) 10.480 5.602 ( -2.423 5.052 -0.322) 5.612 5.982 ( 5.056 -4.762 -0.237) 6.949 6.066 ( -1.459 -0.473 2.190) 2.674 7.408 ( -3.696 2.252 1.058) 4.456 7.501 ( -1.893 1.796 -1.772) 3.154 8.156 ( 7.274 -1.339 14.227) 16.035 8.294 ( 7.138 2.144 13.435) 15.364 9.270 ( -1.770 0.556 -8.648) 8.844 9.372 ( -7.709 0.798 -2.490) 8.140 9.698 ( -6.281 -0.942 -8.731) 10.797 9.835 ( -4.533 -0.787 -10.471) 11.437 10.245 ( 0.200 -0.767 1.563) 1.753 10.352 ( 1.695 3.893 -2.346) 4.851 13.339 ( 1.039 -2.332 9.499) 9.836 13.403 ( 0.886 0.377 9.867) 9.914 13.651 ( 5.717 -0.877 4.594) 7.386 13.748 ( 4.033 1.431 5.624) 7.068 14.758 ( 0.703 -5.608 -2.619) 6.229 14.892 ( -0.714 0.566 -4.913) 4.997 18.110 ( -2.182 0.883 -2.902) 3.737 18.239 ( -2.182 1.309 -6.309) 6.803 18.539 ( 9.435 -1.508 0.250) 9.558 18.846 ( -6.065 -1.212 3.095) 6.916======================= Grid point 471 (237/312) =======================q-point: ( 0.00 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.088 ( 3.169 2.531 23.951) 24.292 2.405 ( -0.765 10.053 22.718) 24.855 3.043 ( -3.717 2.965 -20.627) 21.168 3.282 ( 3.230 5.239 -19.489) 20.438 3.412 ( -3.703 3.127 15.604) 16.339 3.721 ( -7.802 1.415 2.874) 8.434 3.941 ( 0.905 -1.494 4.216) 4.564 4.081 ( -0.746 4.991 9.775) 11.001 4.390 ( 0.958 -6.499 -3.970) 7.676 4.587 ( 4.085 -0.988 -2.009) 4.658 5.000 ( 3.733 -5.080 -1.471) 6.474 5.114 ( 1.691 -1.183 -6.085) 6.425 5.605 ( 3.390 5.773 2.787) 7.251 5.655 ( -0.637 2.157 0.174) 2.256 5.960 ( 2.449 -4.421 2.848) 5.801 6.042 ( -2.090 0.988 -0.024) 2.312 7.418 ( -1.473 2.580 0.882) 3.099 7.479 ( -1.735 2.080 -2.429) 3.639 8.443 ( 9.326 1.936 9.888) 13.729 8.527 ( 1.444 2.237 6.266) 6.808 9.216 ( 1.503 -0.685 -1.579) 2.285 9.258 ( -4.694 -0.426 2.305) 5.247 9.486 ( -5.133 0.655 -8.859) 10.260 9.626 ( -5.633 -0.673 -9.293) 10.888 10.275 ( -0.787 2.190 2.775) 3.622 10.428 ( 2.302 3.433 -3.899) 5.682 13.373 ( -1.027 -3.811 9.125) 9.942 13.487 ( 0.346 -0.565 4.187) 4.239 13.770 ( 3.529 0.109 3.803) 5.189 13.881 ( 3.303 0.842 1.023) 3.559 14.612 ( -5.659 -3.203 1.494) 6.672 14.833 ( 5.356 -3.727 -8.661) 10.843 18.067 ( -2.321 0.506 -0.258) 2.390 18.168 ( -1.602 1.042 -4.602) 4.983 18.688 ( 8.222 -2.429 1.418) 8.690 18.721 ( -5.576 -0.837 0.126) 5.640======================= Grid point 472 (238/312) =======================q-point: ( 0.10 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.374 ( 2.253 -0.131 22.617) 22.729 2.663 ( 4.700 7.366 21.054) 22.795 2.767 ( -1.728 2.268 -23.031) 23.207 3.177 ( 6.019 9.760 -18.453) 21.725 3.522 ( -1.850 0.989 13.360) 13.524 3.589 ( -5.781 1.130 2.647) 6.458 3.958 ( -3.943 5.561 4.225) 8.020 4.180 ( 1.791 -0.678 6.562) 6.836 4.393 ( 1.072 -6.643 -2.519) 7.185 4.573 ( -0.256 -2.085 -6.081) 6.433 5.059 ( 3.731 -1.859 -2.925) 5.093 5.107 ( 4.397 -4.098 -5.552) 8.183 5.617 ( -2.290 4.026 -1.692) 4.931 5.672 ( 1.594 2.749 0.491) 3.215 5.916 ( -6.270 -1.385 -0.138) 6.423 6.070 ( 2.219 -1.821 0.866) 2.999 7.427 ( 0.640 1.924 2.255) 3.033 7.455 ( 0.618 1.915 0.036) 2.013 8.511 ( -3.939 0.704 -2.822) 4.897 8.627 ( 3.785 3.131 0.798) 4.977 9.158 ( -7.116 -1.367 -0.652) 7.275 9.329 ( 5.224 -1.510 4.301) 6.933 9.419 ( 1.992 2.420 5.606) 6.423 9.472 ( -1.344 0.403 -5.116) 5.304 10.277 ( -1.552 2.780 2.081) 3.803 10.439 ( 3.089 2.500 -3.889) 5.560 13.419 ( -2.849 -4.286 7.226) 8.871 13.500 ( -1.355 -1.489 0.332) 2.041 13.827 ( 0.151 0.732 0.679) 1.010 13.898 ( 0.363 0.320 -4.595) 4.620 14.494 ( -7.948 -0.070 1.939) 8.181 14.893 ( 7.878 -5.775 -5.703) 11.311 18.043 ( -1.263 -0.348 2.021) 2.408 18.135 ( 1.223 1.734 -0.949) 2.324 18.576 ( -7.607 1.257 -1.333) 7.825 18.863 ( 8.195 -4.047 -0.238) 9.143======================= Grid point 473 (239/312) =======================q-point: ( 0.20 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.514 ( 0.542 0.225 -15.088) 15.099 2.605 ( -2.160 -3.560 12.592) 13.263 2.972 ( 8.153 3.489 14.133) 16.685 3.134 ( 6.586 10.273 -12.974) 17.811 3.530 ( 1.721 4.613 1.921) 5.285 3.681 ( -1.248 -0.506 16.427) 16.483 3.886 ( -7.945 10.855 3.313) 13.854 4.231 ( -2.617 -4.235 2.191) 5.439 4.340 ( -0.580 -7.558 -8.118) 11.107 4.528 ( 3.783 -2.200 -6.074) 7.486 5.049 ( 2.057 2.377 -7.460) 8.095 5.171 ( 4.648 -7.902 -0.786) 9.201 5.532 ( -3.419 6.454 -4.554) 8.607 5.677 ( -0.901 -0.924 -1.352) 1.869 5.799 ( -4.640 -4.437 -0.891) 6.482 6.086 ( -0.847 -1.920 -0.296) 2.119 7.483 ( 2.339 1.387 3.365) 4.326 7.497 ( 2.319 1.879 1.921) 3.550 8.359 ( -5.502 -1.048 -9.327) 10.880 8.557 ( -6.380 2.010 -10.320) 12.298 9.071 ( -2.220 1.297 5.130) 5.738 9.430 ( 3.569 -2.158 2.533) 4.880 9.529 ( 6.154 2.055 6.965) 9.519 9.606 ( 4.994 2.065 11.465) 12.674 10.266 ( -1.342 2.965 1.287) 3.500 10.456 ( 2.837 1.646 -4.175) 5.310 13.404 ( -4.787 -3.254 3.262) 6.644 13.450 ( -2.645 -3.773 -2.219) 5.115 13.789 ( -3.070 0.635 -2.816) 4.213 13.809 ( -2.799 -0.448 -8.306) 8.777 14.387 ( -6.452 2.288 3.811) 7.835 14.981 ( 6.700 -6.792 -4.408) 10.510 18.065 ( 0.288 -0.214 4.289) 4.304 18.187 ( 3.172 2.393 2.788) 4.854 18.433 ( -5.858 2.692 -1.697) 6.667 18.973 ( 5.040 -4.765 -2.390) 7.336======================= Grid point 474 (240/312) =======================q-point: ( 0.30 0.18 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.389 ( 5.585 -1.287 -17.899) 18.794 2.615 ( -12.413 -9.185 13.493) 20.507 3.086 ( 8.556 8.458 -15.578) 19.683 3.277 ( 5.213 0.961 6.804) 8.625 3.645 ( 3.738 6.747 5.290) 9.353 3.708 ( -10.503 5.571 8.284) 14.491 3.838 ( -0.639 5.138 11.946) 13.020 4.154 ( -3.337 -5.038 -1.658) 6.266 4.265 ( 2.645 -4.722 -8.653) 10.206 4.578 ( 5.027 -1.427 -2.871) 5.962 5.011 ( 1.733 2.294 -7.001) 7.568 5.237 ( -0.746 -1.077 3.436) 3.678 5.420 ( 0.698 -0.666 -9.479) 9.528 5.622 ( -3.105 -5.970 0.241) 6.734 5.755 ( -0.225 -3.206 -0.486) 3.250 6.037 ( -3.118 -3.104 -1.765) 4.740 7.530 ( -0.126 0.763 0.120) 0.782 7.587 ( 4.232 1.359 3.953) 5.949 8.159 ( -4.286 -1.928 -11.823) 12.723 8.254 ( -11.235 0.130 -14.344) 18.221 9.166 ( 2.461 3.184 11.475) 12.160 9.575 ( 6.005 -1.438 7.880) 10.011 9.705 ( 5.297 1.832 5.749) 8.029 9.800 ( 3.903 2.003 10.794) 11.651 10.258 ( -0.621 2.731 0.845) 2.925 10.455 ( 1.995 1.190 -5.050) 5.559 13.305 ( -5.640 -1.525 -2.637) 6.410 13.376 ( -3.349 -5.919 -1.895) 7.060 13.637 ( -6.008 -1.403 -8.567) 10.557 13.681 ( -4.181 0.254 -5.596) 6.990 14.343 ( -4.106 3.641 7.193) 9.047 15.036 ( 4.382 -6.783 -5.583) 9.817 18.130 ( 0.939 0.442 5.901) 5.991 18.294 ( 3.859 2.574 5.151) 6.932 18.346 ( -1.807 3.301 -1.067) 3.912 18.997 ( 1.274 -4.609 -4.408) 6.504======================= Grid point 475 (241/312) =======================q-point: ( 0.40 0.18 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.371 ( 4.904 -4.749 -7.908) 10.447 2.460 ( -13.381 -8.882 7.860) 17.880 3.036 ( -2.444 0.934 -15.140) 15.365 3.160 ( -4.320 2.345 -17.326) 18.009 3.687 ( -4.455 8.569 16.070) 18.749 3.794 ( -1.719 -1.402 11.347) 11.562 3.973 ( 6.330 5.392 5.773) 10.122 4.139 ( 0.275 -0.393 5.787) 5.806 4.294 ( 7.891 -0.880 -5.343) 9.570 4.633 ( 4.195 -0.605 -2.972) 5.176 4.971 ( 1.646 2.591 -7.983) 8.552 5.126 ( -8.413 4.188 -4.655) 10.488 5.456 ( 5.286 -7.986 0.596) 9.595 5.612 ( 0.215 -6.741 4.241) 7.967 5.758 ( 0.621 -2.947 -0.133) 3.014 5.954 ( -2.810 -4.500 -3.140) 6.165 7.473 ( -2.481 -1.072 -5.527) 6.152 7.701 ( 2.197 -0.389 3.550) 4.192 7.864 ( -10.720 -0.682 -14.146) 17.762 8.050 ( -0.706 -0.791 -7.116) 7.194 9.351 ( 3.757 3.346 13.195) 14.121 9.772 ( 5.076 -1.896 10.179) 11.531 9.819 ( 2.933 2.098 1.763) 4.013 9.954 ( 2.423 1.681 8.678) 9.165 10.262 ( 0.500 2.358 0.290) 2.428 10.429 ( 1.063 1.248 -5.916) 6.139 13.174 ( -4.779 -1.270 -3.519) 6.069 13.286 ( -3.035 -4.432 -4.734) 7.160 13.440 ( -7.673 -2.702 -4.342) 9.222 13.549 ( -3.606 -0.705 -5.861) 6.918 14.377 ( -1.797 3.715 10.390) 11.180 15.031 ( 2.710 -5.627 -8.280) 10.371 18.201 ( 0.306 0.961 5.780) 5.867 18.341 ( 1.388 2.591 0.540) 2.988 18.426 ( 4.489 2.465 5.491) 7.508 18.937 ( -2.156 -3.529 -5.795) 7.119======================= Grid point 476 (242/312) =======================q-point: (-0.50 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.222 ( -20.685 -10.926 17.137) 28.999 2.488 ( 6.209 -3.399 -6.023) 9.294 2.634 ( -14.300 -1.589 -11.318) 18.306 3.081 ( 10.619 -1.211 -20.119) 22.782 3.701 ( -9.850 7.500 13.712) 18.474 3.797 ( -9.038 3.838 10.912) 14.680 4.151 ( 7.493 -1.893 1.688) 7.910 4.266 ( 5.079 4.546 4.145) 7.978 4.430 ( 8.640 0.080 3.155) 9.199 4.679 ( 4.405 1.067 -3.583) 5.777 4.888 ( -5.612 1.513 -8.567) 10.352 4.928 ( 0.434 2.293 -11.268) 11.507 5.551 ( -0.289 -5.707 8.480) 10.225 5.681 ( -0.332 -4.951 4.694) 6.830 5.769 ( 1.478 -4.386 -0.120) 4.630 5.902 ( 1.806 -4.734 -4.318) 6.657 7.394 ( 0.961 -2.586 -4.646) 5.403 7.480 ( -10.943 -4.063 -10.325) 15.584 7.834 ( 2.639 1.108 3.132) 4.243 7.983 ( -1.014 0.666 -5.111) 5.253 9.539 ( 2.781 2.744 11.808) 12.437 9.841 ( -0.158 1.442 -1.849) 2.350 9.942 ( 2.581 -1.520 8.903) 9.393 10.053 ( 0.645 0.489 5.051) 5.115 10.284 ( 2.176 2.304 -0.717) 3.249 10.379 ( 0.009 1.761 -6.275) 6.517 13.082 ( -2.357 -0.664 -1.110) 2.688 13.167 ( -3.351 -0.996 -6.515) 7.394 13.310 ( -5.554 -5.008 3.181) 8.127 13.450 ( -1.557 -1.646 -3.937) 4.543 14.472 ( -0.089 2.303 11.786) 12.009 14.983 ( 2.826 -3.759 -10.996) 11.959 18.250 ( -0.584 1.217 4.574) 4.769 18.385 ( 2.795 2.035 -0.439) 3.485 18.560 ( 3.636 0.904 6.176) 7.223 18.814 ( -4.407 -1.656 -6.232) 7.810======================= Grid point 477 (243/312) =======================q-point: (-0.40 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.022 ( -21.370 -12.103 17.229) 30.000 2.165 ( -18.409 2.543 3.956) 19.000 2.761 ( 15.088 -3.074 1.559) 15.477 3.111 ( 10.944 -3.405 -14.587) 18.551 3.618 ( -14.556 16.347 16.278) 27.278 3.721 ( -8.663 -5.174 7.667) 12.672 4.243 ( 3.513 -1.166 -5.959) 7.015 4.310 ( 0.827 3.213 -5.412) 6.348 4.654 ( 3.775 -2.130 11.353) 12.152 4.668 ( -5.325 -0.015 -5.030) 7.325 4.753 ( 7.937 5.609 -5.478) 11.156 4.884 ( 5.644 2.046 -11.621) 13.081 5.564 ( -6.383 -4.542 4.064) 8.825 5.686 ( -0.662 -5.070 3.378) 6.128 5.804 ( 0.714 -5.366 -0.733) 5.462 5.926 ( 4.488 -2.657 -3.537) 6.302 7.267 ( -4.162 -3.302 -1.265) 5.461 7.465 ( 7.519 -2.830 2.563) 8.433 7.854 ( -3.652 1.096 -1.153) 3.984 7.924 ( -0.105 1.618 -1.357) 2.114 9.662 ( -0.625 1.906 7.230) 7.503 9.786 ( -1.411 1.992 -5.073) 5.630 10.034 ( -0.902 -1.047 6.209) 6.361 10.065 ( -1.842 -2.261 -0.294) 2.931 10.307 ( -0.312 2.092 -5.031) 5.457 10.331 ( 3.239 3.277 -1.987) 5.018 13.062 ( -1.013 -0.265 0.751) 1.289 13.089 ( -0.252 -0.072 1.500) 1.522 13.285 ( -2.284 -4.415 5.902) 7.716 13.425 ( 1.100 -2.162 -0.221) 2.435 14.585 ( 0.196 -0.653 9.609) 9.633 14.935 ( 4.460 -1.702 -11.519) 12.469 18.267 ( -1.448 1.168 2.818) 3.377 18.417 ( 2.112 2.117 -2.890) 4.158 18.633 ( -3.985 -0.536 -0.900) 4.121 18.709 ( 1.173 -0.528 1.743) 2.166======================= Grid point 478 (244/312) =======================q-point: (-0.30 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.772 ( -17.068 -3.914 11.599) 21.004 2.062 ( -13.084 2.066 26.572) 29.691 3.079 ( 11.706 -0.977 8.157) 14.301 3.180 ( 8.835 -2.180 -6.399) 11.124 3.528 ( -13.029 18.314 18.867) 29.345 3.645 ( -5.220 -11.387 2.855) 12.847 4.156 ( -2.072 3.866 -11.656) 12.454 4.207 ( -2.867 -0.463 -9.675) 10.102 4.557 ( -0.721 -1.841 -6.360) 6.660 4.709 ( -1.755 1.037 0.937) 2.243 4.876 ( 5.032 0.288 -6.874) 8.524 4.979 ( 9.931 4.863 5.861) 12.515 5.441 ( -6.594 -4.669 -2.120) 8.353 5.716 ( 0.637 -5.368 2.349) 5.894 5.767 ( -0.923 -4.690 -4.901) 6.846 5.985 ( 3.580 -1.209 0.209) 3.784 7.311 ( 4.374 -0.894 7.849) 9.030 7.692 ( 6.885 -2.226 6.861) 9.972 7.738 ( -2.190 4.153 -0.744) 4.753 7.914 ( -1.539 0.208 1.438) 2.116 9.612 ( -4.182 1.192 -6.260) 7.622 9.724 ( -3.863 3.137 -0.264) 4.984 9.969 ( -3.639 -2.819 -6.077) 7.624 10.047 ( -3.146 -2.215 2.323) 4.494 10.256 ( -0.485 2.989 -2.459) 3.900 10.380 ( 3.682 3.353 -2.278) 5.476 13.083 ( 0.898 -1.112 4.875) 5.080 13.162 ( 2.411 0.490 6.809) 7.240 13.340 ( 1.071 -3.185 7.545) 8.260 13.486 ( 3.414 -1.776 3.910) 5.486 14.647 ( 0.162 -3.661 2.239) 4.295 14.928 ( 4.742 -0.686 -7.581) 8.968 18.262 ( -1.374 1.575 1.785) 2.749 18.393 ( -0.136 1.331 -5.362) 5.527 18.510 ( -4.042 1.703 -4.220) 6.087 18.788 ( 1.035 -2.855 5.479) 6.264======================= Grid point 479 (245/312) =======================q-point: (-0.20 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.689 ( -8.286 1.433 18.825) 20.618 2.134 ( -10.072 6.871 28.826) 31.299 3.195 ( -0.469 3.809 5.479) 6.690 3.389 ( 10.096 -3.368 -1.154) 10.705 3.539 ( -5.820 10.997 17.158) 21.194 3.568 ( -5.752 -4.608 1.829) 7.594 3.982 ( -3.570 1.159 -9.590) 10.298 4.111 ( 2.418 0.357 -6.527) 6.970 4.470 ( -1.251 -0.583 -7.295) 7.424 4.628 ( -4.786 -2.777 -4.101) 6.888 4.908 ( 4.362 -0.673 -3.779) 5.810 5.178 ( 3.643 0.376 3.012) 4.742 5.350 ( 0.983 2.566 0.457) 2.786 5.699 ( -1.174 -1.806 -3.457) 4.074 5.770 ( 3.432 -7.613 0.846) 8.393 6.047 ( 1.623 0.058 1.919) 2.514 7.487 ( 3.410 2.476 5.261) 6.740 7.595 ( -4.203 3.214 -2.090) 5.689 7.920 ( 1.997 -0.775 7.168) 7.481 8.030 ( 10.012 0.682 13.309) 16.668 9.447 ( -4.208 1.354 -10.229) 11.144 9.588 ( -8.564 2.262 -3.416) 9.493 9.834 ( -3.780 -2.691 -7.447) 8.774 9.970 ( -4.548 -1.288 -3.493) 5.877 10.243 ( -0.238 2.383 0.819) 2.531 10.415 ( 2.765 3.643 -2.805) 5.365 13.175 ( 1.564 -2.200 8.147) 8.582 13.288 ( 2.684 0.453 8.366) 8.798 13.469 ( 4.434 -2.008 7.730) 9.135 13.616 ( 4.830 -0.626 6.446) 8.080 14.653 ( 1.385 -4.782 -2.856) 5.739 14.929 ( 1.626 -1.551 -5.450) 5.895 18.226 ( -3.727 2.592 -1.208) 4.698 18.351 ( 0.641 -0.143 -4.443) 4.491 18.423 ( 0.130 1.516 -2.807) 3.193 18.834 ( -1.537 -3.187 4.319) 5.583======================= Grid point 480 (246/312) =======================q-point: (-0.10 0.18 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.822 ( -0.374 3.509 22.884) 23.154 2.243 ( -6.913 10.483 25.485) 28.410 3.221 ( -0.759 3.259 -1.780) 3.790 3.410 ( -3.031 -3.761 -9.417) 10.583 3.421 ( -1.075 4.668 -6.715) 8.248 3.688 ( -4.669 10.379 25.250) 27.696 3.897 ( 1.576 -5.298 -3.515) 6.551 4.091 ( -1.661 1.933 -3.880) 4.643 4.431 ( -0.886 -1.368 1.413) 2.157 4.518 ( 2.688 -3.860 -7.331) 8.710 4.953 ( 3.688 -3.150 -2.298) 5.367 5.161 ( -0.686 -2.960 -4.604) 5.516 5.481 ( 5.663 8.446 5.367) 11.498 5.663 ( -0.567 0.319 -0.616) 0.896 5.859 ( 4.875 -7.555 1.429) 9.104 6.071 ( -1.105 1.277 1.660) 2.368 7.464 ( -3.705 3.346 -0.130) 4.994 7.545 ( -1.654 2.554 -2.931) 4.225 8.142 ( 9.227 0.137 13.774) 16.580 8.335 ( 7.823 2.011 13.126) 15.412 9.283 ( -2.644 0.702 -8.931) 9.340 9.390 ( -8.333 0.785 -3.167) 8.949 9.674 ( -5.014 -1.277 -8.855) 10.255 9.819 ( -5.704 -0.754 -7.641) 9.565 10.257 ( -0.184 1.946 2.377) 3.077 10.427 ( 1.971 3.780 -3.378) 5.439 13.284 ( 0.533 -3.112 9.486) 9.997 13.409 ( 1.815 0.065 7.256) 7.480 13.634 ( 5.468 -0.900 6.231) 8.339 13.769 ( 4.909 0.491 5.520) 7.404 14.651 ( 0.764 -5.093 -1.945) 5.505 14.876 ( -0.086 -2.153 -7.185) 7.501 18.134 ( -3.636 1.529 -2.121) 4.478 18.265 ( -2.705 1.150 -6.086) 6.759 18.510 ( 7.821 -1.110 1.389) 8.021 18.812 ( -4.466 -2.255 2.301) 5.506======================= Grid point 481 (247/312) =======================q-point: ( 0.00 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.156 ( 2.624 4.734 20.967) 21.654 2.617 ( -1.523 11.482 17.235) 20.765 3.081 ( -0.279 -0.405 -19.574) 19.580 3.344 ( 3.405 2.913 -7.285) 8.553 3.511 ( -1.302 5.295 5.913) 8.043 3.735 ( -3.688 0.536 -3.181) 4.900 3.906 ( -1.285 0.659 3.498) 3.785 4.261 ( -0.543 4.487 -3.441) 5.680 4.275 ( -1.353 1.476 12.362) 12.523 4.511 ( 1.813 -6.306 -1.106) 6.654 4.901 ( 1.393 -5.349 -0.776) 5.581 5.108 ( 3.673 -0.275 -5.356) 6.500 5.627 ( -0.322 -3.995 0.288) 4.019 5.636 ( 1.673 -3.221 -0.256) 3.639 5.936 ( 4.542 2.873 6.710) 8.597 6.100 ( -2.205 4.091 -0.413) 4.666 7.468 ( -1.635 2.430 -0.250) 2.939 7.516 ( -1.788 1.638 -2.987) 3.848 8.496 ( 10.646 3.502 9.393) 14.623 8.578 ( 1.912 3.045 6.088) 7.070 9.194 ( -0.171 -1.575 -2.672) 3.107 9.235 ( -4.363 -1.989 -0.162) 4.797 9.509 ( -4.072 1.781 -6.515) 7.887 9.619 ( -6.327 -0.076 -7.181) 9.571 10.335 ( -0.647 3.943 3.009) 5.001 10.490 ( 1.758 2.906 -3.700) 5.022 13.305 ( -0.747 -2.957 7.105) 7.731 13.464 ( 1.260 -1.951 1.404) 2.714 13.772 ( 3.897 0.016 4.563) 6.000 13.881 ( 3.357 -0.888 1.105) 3.644 14.566 ( -2.619 -1.330 1.408) 3.257 14.758 ( 2.685 -3.851 -7.814) 9.116 18.079 ( -3.696 0.702 0.465) 3.791 18.180 ( -1.266 0.149 -4.111) 4.304 18.646 ( 6.903 -1.663 2.001) 7.377 18.704 ( -4.361 -1.002 -0.516) 4.504======================= Grid point 482 (248/312) =======================q-point: ( 0.10 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.387 ( 0.556 1.595 18.534) 18.611 2.763 ( 4.205 1.766 -4.312) 6.277 2.870 ( -3.972 9.002 -1.110) 9.902 3.341 ( 7.964 7.026 -15.098) 18.459 3.563 ( -3.021 3.229 10.745) 11.619 3.643 ( -1.269 3.806 -0.883) 4.108 3.977 ( 1.708 -1.930 7.296) 7.738 4.208 ( 2.241 -0.539 -7.246) 7.604 4.336 ( -6.215 3.816 8.334) 11.075 4.493 ( -1.322 -5.579 -2.072) 6.097 4.934 ( 2.809 -7.438 -0.115) 7.952 5.118 ( 3.271 0.745 -6.937) 7.706 5.604 ( -1.788 -4.098 -0.680) 4.523 5.661 ( 1.251 -3.838 -0.713) 4.099 5.956 ( -6.994 4.789 -0.614) 8.499 6.077 ( 0.434 2.406 1.436) 2.835 7.464 ( 0.396 1.784 1.503) 2.366 7.489 ( 0.654 1.526 0.093) 1.663 8.546 ( -4.980 2.987 -3.658) 6.863 8.691 ( 3.789 3.423 -0.272) 5.113 9.124 ( -5.225 -2.082 -0.129) 5.626 9.279 ( 4.109 -3.564 1.560) 5.658 9.467 ( 1.430 2.506 4.329) 5.203 9.498 ( 0.372 2.050 -0.243) 2.097 10.343 ( -1.447 3.981 2.349) 4.843 10.488 ( 1.992 2.414 -3.592) 4.764 13.337 ( -2.601 -3.749 5.508) 7.153 13.467 ( -0.681 -2.225 -2.006) 3.072 13.837 ( 0.341 0.052 0.285) 0.447 13.894 ( -0.273 -0.593 -4.105) 4.157 14.505 ( -5.170 1.253 1.969) 5.672 14.778 ( 5.871 -5.793 -5.217) 9.759 18.043 ( -1.825 0.439 2.958) 3.503 18.164 ( 1.900 1.131 -0.383) 2.244 18.599 ( -5.401 1.127 -1.847) 5.818 18.781 ( 6.122 -4.218 0.435) 7.447======================= Grid point 483 (249/312) =======================q-point: ( 0.20 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.497 ( -4.840 -2.172 7.740) 9.384 2.587 ( -0.528 1.260 -16.266) 16.323 3.039 ( 4.957 3.937 13.309) 14.738 3.330 ( 7.785 10.110 -15.387) 19.990 3.614 ( 0.474 3.166 6.709) 7.434 3.703 ( 1.745 2.576 8.189) 8.760 4.050 ( -0.471 2.320 4.300) 4.908 4.184 ( -2.124 3.096 -1.671) 4.109 4.238 ( -7.121 -2.050 -1.158) 7.500 4.456 ( 2.165 -4.921 -2.004) 5.738 4.998 ( 3.709 -8.615 0.639) 9.401 5.089 ( 2.221 -0.050 -8.007) 8.310 5.555 ( -2.474 -4.362 -1.124) 5.139 5.667 ( 0.498 -2.982 -1.293) 3.288 5.758 ( -10.258 3.623 -5.256) 12.083 6.064 ( -3.160 -0.485 0.189) 3.202 7.510 ( 1.995 1.389 3.195) 4.015 7.531 ( 2.049 1.529 2.171) 3.354 8.362 ( -6.728 1.439 -10.453) 12.514 8.585 ( -8.044 0.813 -11.776) 14.284 9.098 ( 0.552 1.472 6.077) 6.277 9.370 ( 4.087 -3.714 4.237) 6.961 9.583 ( 6.215 3.194 6.116) 9.286 9.648 ( 5.270 2.242 10.505) 11.964 10.332 ( -1.573 3.864 1.395) 4.399 10.488 ( 1.710 1.592 -3.533) 4.236 13.318 ( -4.188 -4.448 3.353) 6.969 13.401 ( -2.754 -2.323 -4.825) 6.021 13.781 ( -3.606 -1.221 -6.357) 7.410 13.809 ( -2.650 0.205 -5.948) 6.515 14.440 ( -4.277 3.150 3.037) 6.119 14.844 ( 5.580 -7.161 -3.621) 9.774 18.074 ( 0.564 1.264 5.400) 5.575 18.232 ( 3.668 2.097 3.200) 5.300 18.484 ( -4.594 2.631 -2.065) 5.683 18.869 ( 4.025 -5.913 -1.806) 7.377======================= Grid point 484 (250/312) =======================q-point: ( 0.30 0.27 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.380 ( -0.062 -0.579 -12.644) 12.658 2.474 ( -8.558 -4.974 2.858) 10.302 3.170 ( 3.484 0.519 -9.024) 9.687 3.337 ( 4.079 4.884 -7.572) 9.891 3.691 ( -1.956 1.956 10.133) 10.503 3.809 ( 0.960 2.592 2.713) 3.873 4.012 ( -9.235 6.960 8.548) 14.380 4.092 ( 1.472 2.101 2.786) 3.787 4.212 ( 5.362 0.725 -5.032) 7.389 4.535 ( 3.762 -2.893 2.972) 5.600 5.037 ( 1.371 -0.705 -3.962) 4.251 5.118 ( 6.922 -8.139 0.107) 10.685 5.481 ( -10.332 -1.687 -5.380) 11.771 5.500 ( -3.830 -0.233 -3.025) 4.886 5.674 ( 1.083 -4.840 -1.358) 5.142 5.975 ( -5.481 -3.356 -1.471) 6.593 7.551 ( -1.041 1.266 0.285) 1.663 7.610 ( 3.292 0.895 3.887) 5.172 8.132 ( -4.959 -0.685 -12.839) 13.780 8.251 ( -11.778 -0.425 -15.068) 19.130 9.231 ( 3.742 3.423 10.955) 12.071 9.527 ( 5.525 -3.103 8.956) 10.971 9.757 ( 5.818 3.130 4.884) 8.216 9.839 ( 4.303 1.973 9.552) 10.661 10.318 ( -1.111 3.469 0.920) 3.757 10.478 ( 1.134 1.029 -3.944) 4.231 13.255 ( -5.279 -4.262 1.606) 6.972 13.283 ( -3.486 -2.788 -6.208) 7.646 13.609 ( -5.838 -1.349 -9.486) 11.220 13.679 ( -4.024 -0.632 -7.855) 8.849 14.419 ( -2.519 4.155 5.535) 7.366 14.898 ( 4.320 -7.282 -4.230) 9.465 18.155 ( 1.311 2.251 6.545) 7.045 18.347 ( 3.845 2.888 5.360) 7.201 18.406 ( -1.739 2.906 -1.214) 3.598 18.892 ( 1.565 -6.273 -3.860) 7.530======================= Grid point 485 (251/312) =======================q-point: ( 0.40 0.27 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.253 ( -12.888 -6.197 6.307) 15.630 2.368 ( 4.925 -2.341 -11.326) 12.570 3.002 ( -7.984 -3.320 -16.542) 18.666 3.171 ( -2.153 -1.581 -23.176) 23.330 3.726 ( -7.216 1.012 13.915) 15.707 3.872 ( 2.725 3.063 10.145) 10.942 4.114 ( 3.218 7.541 10.178) 13.069 4.153 ( 1.643 3.582 4.595) 6.053 4.323 ( 10.547 4.741 -3.563) 12.100 4.614 ( 1.399 -1.144 3.561) 3.993 5.021 ( 1.959 2.041 -6.018) 6.649 5.191 ( -11.204 2.134 -6.538) 13.146 5.290 ( 7.963 -8.974 2.022) 12.167 5.467 ( -1.063 -7.968 4.107) 9.027 5.689 ( 1.707 -4.086 -1.177) 4.582 5.855 ( -4.807 -5.539 -2.672) 7.805 7.463 ( -4.174 0.163 -6.467) 7.699 7.673 ( -2.919 -2.296 -0.772) 3.793 7.867 ( -6.642 0.898 -10.644) 12.578 8.028 ( -0.236 -1.384 -7.436) 7.567 9.421 ( 4.067 3.774 12.138) 13.346 9.722 ( 4.570 -2.862 10.691) 11.973 9.871 ( 3.107 2.892 1.342) 4.452 9.984 ( 2.571 1.345 6.810) 7.402 10.314 ( -0.077 3.010 0.708) 3.093 10.452 ( 0.570 1.049 -4.336) 4.497 13.147 ( -4.265 -1.537 -3.405) 5.670 13.192 ( -3.140 -4.861 -1.058) 5.883 13.401 ( -6.694 -1.415 -8.452) 10.874 13.527 ( -3.338 -1.772 -8.511) 9.313 14.454 ( -1.027 4.265 7.925) 9.058 14.916 ( 3.446 -6.107 -6.362) 9.469 18.233 ( 0.356 2.393 5.816) 6.299 18.388 ( 0.079 2.401 1.129) 2.654 18.479 ( 4.223 2.777 4.799) 6.969 18.854 ( -0.662 -4.992 -5.044) 7.127======================= Grid point 486 (252/312) =======================q-point: (-0.50 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.051 ( -18.078 -6.539 12.235) 22.787 2.432 ( 9.246 -3.056 -6.299) 11.597 2.598 ( -15.110 -1.918 -11.400) 19.024 2.991 ( 8.634 -7.337 -26.011) 28.371 3.702 ( -10.565 0.563 14.361) 17.837 4.012 ( -2.790 5.591 13.052) 14.471 4.158 ( 2.529 6.869 -2.616) 7.773 4.344 ( 3.969 2.743 14.114) 14.916 4.459 ( 7.743 4.250 -4.464) 9.897 4.678 ( 3.440 -0.805 1.262) 3.752 4.916 ( -7.777 1.158 -10.069) 12.775 4.989 ( 1.889 3.487 -8.729) 9.588 5.431 ( 0.564 -6.530 9.890) 11.865 5.561 ( 3.004 -7.554 6.083) 10.153 5.682 ( -1.162 -4.415 -2.187) 5.062 5.790 ( 2.752 -6.654 -4.010) 8.242 7.347 ( 0.272 -2.112 -5.912) 6.284 7.411 ( -10.684 -3.149 -10.292) 15.166 7.853 ( 1.841 0.965 1.950) 2.850 7.981 ( 0.506 -0.785 -4.920) 5.008 9.599 ( 2.634 3.387 10.800) 11.621 9.866 ( 0.142 0.513 3.894) 3.930 9.915 ( 2.061 -0.636 3.398) 4.025 10.058 ( 0.187 0.075 2.633) 2.641 10.333 ( 1.514 2.718 0.304) 3.126 10.414 ( -0.049 1.764 -4.224) 4.578 13.068 ( -1.695 -0.836 -0.909) 2.097 13.133 ( -2.081 -2.729 -1.930) 3.938 13.229 ( -5.151 -2.778 -2.125) 6.226 13.407 ( -1.049 -2.882 -6.790) 7.451 14.526 ( -0.470 3.272 8.739) 9.343 14.905 ( 3.757 -4.264 -8.805) 10.480 18.282 ( -0.846 2.012 4.974) 5.432 18.411 ( 1.455 0.819 0.291) 1.695 18.590 ( 2.594 2.035 4.422) 5.516 18.775 ( -2.273 -2.311 -5.100) 6.043======================= Grid point 487 (253/312) =======================q-point: (-0.40 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.852 ( -17.414 -5.220 13.910) 22.891 2.231 ( -14.198 4.404 5.066) 15.705 2.685 ( 16.015 -5.578 0.575) 16.968 2.958 ( 12.767 -11.474 -21.095) 27.196 3.629 ( -12.545 0.389 14.112) 18.886 3.981 ( -12.687 15.019 12.675) 23.392 4.202 ( 5.092 -1.436 -5.695) 7.773 4.398 ( -1.794 5.365 -6.655) 8.735 4.613 ( 3.307 -1.933 11.714) 12.325 4.680 ( -4.760 1.406 -5.866) 7.684 4.791 ( 6.353 -0.362 -3.343) 7.188 4.972 ( 5.694 5.612 -7.988) 11.302 5.481 ( -5.453 -3.938 3.833) 7.742 5.575 ( -1.353 -6.086 2.807) 6.837 5.687 ( 1.097 -6.732 -1.171) 6.921 5.849 ( 6.748 -5.390 -3.813) 9.440 7.222 ( -2.244 -1.398 -1.012) 2.831 7.403 ( 8.029 -3.450 2.051) 8.976 7.868 ( -2.089 0.531 -0.293) 2.176 7.944 ( 0.295 0.306 -3.282) 3.310 9.706 ( -1.274 2.539 5.984) 6.624 9.832 ( -0.907 2.788 -3.698) 4.719 9.990 ( -1.797 -3.155 5.704) 6.762 10.039 ( -1.797 -0.788 -1.712) 2.604 10.353 ( -0.023 2.579 -2.155) 3.361 10.392 ( 2.445 2.827 -1.710) 4.110 13.058 ( -0.845 -0.148 0.388) 0.941 13.088 ( 0.682 -0.030 1.027) 1.233 13.198 ( -0.972 -4.421 5.360) 7.016 13.367 ( 2.177 -3.827 -3.087) 5.377 14.591 ( -0.971 1.336 6.281) 6.494 14.892 ( 4.832 -2.715 -9.360) 10.878 18.296 ( -2.012 1.795 3.560) 4.466 18.439 ( 1.609 -0.034 -1.496) 2.197 18.635 ( -2.331 0.838 0.430) 2.514 18.700 ( -0.151 -0.356 -1.042) 1.112======================= Grid point 488 (254/312) =======================q-point: (-0.30 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.717 ( -11.888 -0.297 15.142) 19.253 2.175 ( -7.252 8.504 21.730) 24.435 3.021 ( 16.423 -14.006 -16.550) 27.198 3.036 ( 14.091 -4.290 7.632) 16.589 3.527 ( -13.283 0.103 13.712) 19.091 3.864 ( -12.447 15.347 12.744) 23.513 4.187 ( 1.052 -1.060 -9.322) 9.441 4.243 ( -4.743 4.695 -9.567) 11.664 4.548 ( -1.154 1.525 -7.928) 8.155 4.703 ( -3.910 -1.128 5.209) 6.610 4.872 ( 3.537 -0.849 -3.146) 4.809 5.074 ( 9.213 3.997 -0.288) 10.046 5.373 ( -3.298 -2.178 -2.041) 4.449 5.594 ( -0.605 -6.259 2.449) 6.748 5.661 ( -0.064 -6.442 -4.286) 7.738 5.942 ( 5.900 -3.518 -0.834) 6.920 7.316 ( 7.183 1.326 8.406) 11.136 7.641 ( 9.516 -3.117 7.146) 12.302 7.800 ( -1.601 2.455 -0.812) 3.041 7.917 ( -1.161 -0.006 -0.854) 1.441 9.640 ( -4.796 1.568 -5.261) 7.290 9.788 ( -3.763 3.245 -1.183) 5.107 9.903 ( -4.585 -3.407 -4.533) 7.292 10.021 ( -2.578 -0.897 1.790) 3.264 10.321 ( -0.850 3.607 -1.242) 3.908 10.437 ( 3.618 2.476 -2.001) 4.819 13.069 ( 0.906 -0.320 3.065) 3.212 13.168 ( 2.969 0.111 5.913) 6.618 13.275 ( 2.366 -3.423 7.511) 8.587 13.430 ( 5.179 -3.998 2.003) 6.843 14.608 ( -0.870 -0.371 0.930) 1.327 14.895 ( 4.178 -2.574 -7.432) 8.905 18.295 ( -1.340 1.752 3.052) 3.765 18.411 ( -1.811 0.548 -4.230) 4.634 18.552 ( -3.070 2.492 -3.529) 5.300 18.730 ( 0.571 -3.002 3.205) 4.428======================= Grid point 489 (255/312) =======================q-point: (-0.20 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.736 ( -4.311 4.304 18.742) 19.707 2.328 ( -4.326 12.613 26.811) 29.944 3.126 ( 13.912 -14.602 -15.719) 25.571 3.341 ( 4.493 2.682 5.871) 7.864 3.454 ( -5.708 -2.813 13.294) 14.738 3.813 ( -7.711 11.325 14.891) 20.235 4.036 ( -5.073 3.564 -9.567) 11.401 4.135 ( 1.650 2.426 -6.086) 6.757 4.463 ( -0.450 1.103 -6.928) 7.029 4.587 ( -8.444 -1.485 -2.923) 9.059 4.886 ( 2.283 -1.865 -3.546) 4.611 5.146 ( 0.953 -2.918 -4.218) 5.217 5.453 ( 8.013 6.556 6.823) 12.400 5.601 ( 1.395 -7.179 -2.100) 7.609 5.636 ( 0.576 -6.171 -0.119) 6.199 6.040 ( 4.191 -1.186 1.277) 4.539 7.546 ( 5.837 3.500 4.980) 8.434 7.645 ( -3.369 2.007 -2.845) 4.845 7.915 ( 2.785 0.289 5.577) 6.241 8.035 ( 11.491 -0.244 13.251) 17.541 9.473 ( -5.138 1.211 -9.150) 10.564 9.618 ( -9.333 0.192 -5.817) 10.999 9.796 ( -3.368 -0.389 -4.634) 5.742 9.952 ( -4.701 -0.689 -2.304) 5.281 10.305 ( -0.617 3.916 0.956) 4.078 10.475 ( 3.026 2.533 -2.809) 4.844 13.141 ( 1.557 -1.276 6.084) 6.409 13.289 ( 3.285 -0.462 6.211) 7.041 13.427 ( 5.457 -2.114 8.357) 10.202 13.582 ( 6.666 -2.930 5.738) 9.271 14.592 ( 0.191 -1.369 -2.183) 2.584 14.880 ( 1.497 -3.311 -6.704) 7.626 18.277 ( -5.059 2.568 0.056) 5.673 18.338 ( 0.335 -0.774 -3.046) 3.161 18.470 ( -1.156 2.898 -3.319) 4.555 18.765 ( -0.408 -3.861 2.900) 4.847======================= Grid point 490 (256/312) =======================q-point: (-0.10 0.27 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.909 ( 1.070 5.852 20.931) 21.760 2.489 ( -4.854 14.608 22.404) 27.183 3.186 ( 9.213 -11.075 -17.597) 22.742 3.355 ( -2.928 3.059 4.389) 6.099 3.505 ( -1.205 3.212 2.119) 4.032 3.817 ( -4.513 1.946 2.024) 5.315 3.913 ( -2.315 6.186 3.106) 7.299 4.167 ( 1.376 5.778 3.742) 7.020 4.372 ( -6.957 -3.309 -0.315) 7.710 4.464 ( 3.690 -1.515 -5.553) 6.838 4.891 ( 1.494 -3.759 -2.226) 4.617 5.113 ( 1.429 -2.439 -5.325) 6.028 5.601 ( 2.298 -0.792 0.007) 2.431 5.618 ( 0.657 -2.701 1.455) 3.138 5.742 ( 8.009 -1.013 6.495) 10.361 6.105 ( 1.178 1.663 1.321) 2.429 7.527 ( -3.605 3.094 -1.587) 5.009 7.591 ( -1.639 2.061 -4.078) 4.854 8.167 ( 11.381 2.442 13.430) 17.772 8.367 ( 9.302 1.215 13.123) 16.131 9.293 ( -3.945 0.360 -8.978) 9.813 9.390 ( -8.816 -0.932 -4.728) 10.047 9.665 ( -4.606 0.653 -6.981) 8.389 9.808 ( -6.382 -0.463 -6.005) 8.775 10.315 ( -0.332 3.948 2.518) 4.694 10.491 ( 2.098 2.808 -3.341) 4.843 13.231 ( 0.768 -2.172 7.411) 7.761 13.398 ( 2.643 -1.367 4.402) 5.313 13.617 ( 6.079 -0.801 7.465) 9.660 13.759 ( 6.037 -1.628 5.278) 8.182 14.580 ( 0.459 -2.038 -1.513) 2.580 14.820 ( -0.196 -3.439 -7.344) 8.112 18.165 ( -4.960 1.574 -1.694) 5.473 18.273 ( -2.992 -0.376 -5.091) 5.917 18.509 ( 5.321 0.994 1.694) 5.672 18.762 ( -2.360 -2.871 1.321) 3.944======================= Grid point 491 (257/312) =======================q-point: ( 0.00 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.274 ( 3.257 7.679 14.969) 17.136 2.779 ( -0.676 1.565 1.744) 2.439 3.054 ( 2.122 1.949 0.362) 2.904 3.405 ( 0.167 1.711 -1.105) 2.043 3.581 ( 0.639 3.414 1.381) 3.738 3.766 ( 1.220 1.882 -4.397) 4.936 3.958 ( -3.316 3.384 -0.990) 4.840 4.184 ( -1.392 -2.947 -5.005) 5.973 4.365 ( 0.292 -4.685 5.017) 6.871 4.511 ( 0.678 10.572 -0.041) 10.594 4.787 ( -2.205 -6.461 4.379) 8.110 5.075 ( 3.662 -3.697 -2.857) 5.937 5.539 ( -0.199 -4.327 0.337) 4.345 5.545 ( 1.536 -4.739 -0.001) 4.981 6.028 ( 3.684 5.489 6.215) 9.073 6.164 ( -0.289 2.105 0.242) 2.139 7.508 ( -1.708 1.794 -1.437) 2.864 7.539 ( -1.816 0.790 -3.252) 3.808 8.571 ( 10.623 4.078 9.208) 14.638 8.635 ( 4.096 2.617 7.092) 8.598 9.159 ( -2.266 -1.926 -3.870) 4.881 9.188 ( -4.101 -2.680 -2.526) 5.512 9.550 ( -4.385 2.307 -4.466) 6.670 9.620 ( -6.069 0.079 -5.643) 8.287 10.418 ( -0.457 4.404 2.386) 5.030 10.532 ( 1.128 1.314 -2.496) 3.038 13.269 ( 0.582 -0.574 3.350) 3.448 13.413 ( 2.287 -3.342 -1.002) 4.172 13.770 ( 4.093 -0.131 4.374) 5.992 13.849 ( 4.104 -2.338 1.080) 4.845 14.565 ( -1.476 1.103 1.556) 2.412 14.694 ( 0.358 -2.850 -4.818) 5.609 18.094 ( -3.978 0.940 0.239) 4.094 18.171 ( -0.940 -1.056 -3.309) 3.598 18.629 ( 4.019 -0.159 1.705) 4.369 18.682 ( -2.127 -1.218 -0.632) 2.531======================= Grid point 492 (258/312) =======================q-point: ( 0.10 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.440 ( -0.010 3.975 11.165) 11.852 2.749 ( 1.754 -3.014 -12.535) 13.011 3.058 ( -3.071 9.875 7.721) 12.906 3.440 ( 5.599 2.151 -2.247) 6.405 3.613 ( 1.109 2.358 -1.888) 3.218 3.730 ( 0.372 6.037 -1.532) 6.240 3.969 ( 0.400 0.251 7.834) 7.849 4.147 ( 3.063 -4.086 -6.587) 8.335 4.343 ( -3.188 -4.349 -0.455) 5.412 4.527 ( -1.830 9.045 1.233) 9.310 4.793 ( -1.948 -6.995 4.946) 8.786 5.091 ( 1.579 -3.866 -4.871) 6.416 5.521 ( -1.601 -3.623 -0.370) 3.979 5.566 ( 0.947 -4.973 -0.762) 5.119 6.053 ( -5.745 4.750 0.038) 7.454 6.131 ( -2.136 2.420 0.041) 3.228 7.493 ( 0.327 1.288 0.822) 1.563 7.511 ( 0.628 0.752 0.096) 0.984 8.621 ( -5.276 4.560 -3.878) 7.979 8.749 ( 1.743 2.327 -1.614) 3.326 9.085 ( -2.686 -1.730 0.504) 3.234 9.202 ( 3.362 -4.265 0.683) 5.473 9.513 ( 1.270 2.242 3.945) 4.712 9.537 ( 1.357 1.754 2.183) 3.112 10.423 ( -1.362 4.117 1.881) 4.727 10.524 ( 0.756 1.192 -2.453) 2.830 13.289 ( -1.272 -1.133 1.666) 2.383 13.414 ( 0.265 -3.275 -3.676) 4.931 13.829 ( 0.201 -0.569 -0.761) 0.972 13.876 ( 0.492 -1.415 -3.920) 4.196 14.539 ( -3.382 2.126 2.370) 4.645 14.684 ( 2.636 -3.839 -2.794) 5.431 18.062 ( -0.947 1.543 2.827) 3.357 18.171 ( 2.575 -0.489 0.173) 2.627 18.618 ( -3.503 0.868 -1.579) 3.939 18.709 ( 3.356 -3.195 0.408) 4.652======================= Grid point 493 (259/312) =======================q-point: ( 0.20 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.469 ( -5.459 -0.247 4.578) 7.129 2.595 ( -0.019 -1.091 -18.903) 18.934 3.138 ( 0.054 6.617 11.342) 13.131 3.517 ( 6.699 9.447 -14.929) 18.894 3.603 ( 0.140 -5.184 8.403) 9.874 3.777 ( 3.090 6.197 1.596) 7.106 4.040 ( -1.551 -3.708 3.208) 5.142 4.172 ( 3.283 0.627 1.169) 3.541 4.304 ( 0.962 -1.610 -3.112) 3.633 4.448 ( -5.551 9.166 2.002) 10.901 4.828 ( 1.136 -8.965 4.015) 9.889 5.044 ( -0.183 -4.938 -5.672) 7.523 5.473 ( -2.756 -3.131 -1.379) 4.393 5.565 ( 0.143 -5.763 -1.676) 6.003 5.868 ( -10.266 5.873 -5.010) 12.844 6.056 ( -5.961 -0.759 -1.015) 6.094 7.534 ( 1.830 1.078 2.910) 3.603 7.552 ( 1.930 0.690 2.374) 3.137 8.411 ( -8.262 3.487 -11.514) 14.594 8.585 ( -9.605 -0.890 -12.640) 15.900 9.128 ( 3.116 1.809 6.754) 7.655 9.296 ( 4.526 -3.857 5.067) 7.813 9.642 ( 5.929 2.776 6.883) 9.499 9.686 ( 5.609 1.522 9.208) 10.889 10.408 ( -1.766 3.807 1.102) 4.339 10.511 ( 0.342 0.619 -2.386) 2.488 13.256 ( -2.936 -1.761 -0.174) 3.428 13.350 ( -2.021 -2.914 -5.670) 6.688 13.759 ( -3.574 -0.803 -6.654) 7.596 13.801 ( -2.296 -1.080 -7.339) 7.765 14.503 ( -2.946 3.401 2.953) 5.382 14.721 ( 3.226 -5.455 -1.247) 6.459 18.114 ( 2.005 2.905 5.245) 6.322 18.258 ( 4.539 0.354 3.479) 5.730 18.533 ( -3.725 2.499 -1.678) 4.789 18.755 ( 2.188 -5.787 -1.489) 6.364======================= Grid point 494 (260/312) =======================q-point: ( 0.30 0.36 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.349 ( -8.068 -1.640 -1.515) 8.371 2.425 ( -0.062 -1.577 -14.829) 14.913 3.176 ( -3.100 1.435 -4.145) 5.372 3.400 ( -3.038 0.628 -13.240) 13.599 3.718 ( 0.179 0.125 8.502) 8.505 3.841 ( 2.858 1.727 -5.296) 6.261 4.013 ( -0.545 -0.126 8.220) 8.239 4.262 ( 2.240 9.978 1.967) 10.414 4.298 ( 5.077 4.157 -0.589) 6.588 4.500 ( 1.996 1.777 10.029) 10.379 4.919 ( 4.655 -9.528 4.191) 11.403 5.007 ( 1.510 -5.573 -2.990) 6.502 5.385 ( -5.299 -3.280 -2.209) 6.612 5.504 ( -5.681 -4.751 -5.277) 9.094 5.653 ( -4.678 3.952 -3.662) 7.135 5.908 ( -7.695 -3.666 -2.296) 8.828 7.576 ( -1.015 1.303 0.888) 1.876 7.619 ( 2.106 0.106 3.309) 3.924 8.136 ( -6.800 1.043 -14.188) 15.768 8.236 ( -11.494 -1.179 -15.442) 19.286 9.294 ( 4.853 3.108 10.552) 12.023 9.465 ( 5.688 -3.241 9.392) 11.449 9.814 ( 5.323 2.737 5.542) 8.157 9.870 ( 4.736 1.187 7.960) 9.338 10.385 ( -1.533 3.388 0.754) 3.794 10.490 ( 0.050 0.123 -2.543) 2.546 13.186 ( -3.695 -2.356 -1.118) 4.523 13.238 ( -3.441 -2.299 -6.235) 7.483 13.590 ( -5.527 -0.565 -9.810) 11.274 13.655 ( -3.854 -1.826 -10.184) 11.041 14.500 ( -1.412 4.250 4.567) 6.397 14.768 ( 3.192 -6.054 -1.430) 6.992 18.216 ( 2.382 4.043 5.822) 7.478 18.389 ( 4.825 0.940 4.747) 6.833 18.462 ( -2.574 3.237 -0.203) 4.141 18.763 ( 1.342 -6.953 -3.054) 7.712======================= Grid point 495 (261/312) =======================q-point: ( 0.40 0.36 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.172 ( -11.402 -2.063 1.983) 11.756 2.319 ( 4.947 -3.265 -14.353) 15.529 2.949 ( -9.636 -1.461 -14.983) 17.874 3.113 ( -7.454 -3.997 -20.935) 22.578 3.760 ( -5.306 2.087 10.278) 11.754 3.881 ( 4.327 -1.283 2.767) 5.294 4.176 ( 4.429 3.395 11.244) 12.552 4.315 ( 5.041 7.104 -2.508) 9.064 4.465 ( 8.995 9.349 2.535) 13.219 4.613 ( -1.769 2.332 11.041) 11.423 5.018 ( 2.463 -3.343 -0.093) 4.154 5.108 ( 9.382 -9.637 -1.661) 13.552 5.207 ( -9.572 -0.495 -0.903) 9.627 5.338 ( -5.241 -4.889 0.111) 7.168 5.621 ( 1.528 -2.310 -1.892) 3.354 5.752 ( -6.245 -4.992 -2.719) 8.445 7.479 ( -5.753 1.383 -6.929) 9.112 7.621 ( -5.927 -2.997 -4.216) 7.867 7.892 ( -3.717 1.669 -8.433) 9.366 7.999 ( -0.647 -1.612 -7.914) 8.102 9.491 ( 4.400 3.430 11.422) 12.712 9.666 ( 4.835 -2.963 10.883) 12.272 9.925 ( 2.460 2.671 1.912) 4.104 10.003 ( 2.631 0.518 4.812) 5.509 10.372 ( -0.588 2.925 0.849) 3.102 10.464 ( -0.025 0.106 -2.587) 2.589 13.111 ( -3.534 -2.363 -0.656) 4.302 13.122 ( -2.551 -1.964 -4.660) 5.664 13.384 ( -5.762 -0.273 -9.903) 11.461 13.482 ( -3.147 -2.764 -10.938) 11.713 14.538 ( -0.252 4.431 5.892) 7.376 14.805 ( 3.134 -5.388 -3.009) 6.921 18.292 ( 0.440 3.725 4.072) 5.536 18.428 ( -0.969 1.446 0.653) 1.859 18.527 ( 3.893 2.328 5.291) 6.969 18.751 ( 0.885 -5.630 -3.270) 6.571======================= Grid point 496 (262/312) =======================q-point: (-0.50 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.984 ( -12.429 -0.353 4.878) 13.357 2.339 ( 10.304 -7.117 -9.522) 15.732 2.583 ( -14.484 0.885 -9.161) 17.161 2.844 ( 1.300 -7.271 -20.889) 22.156 3.741 ( -7.660 3.234 10.241) 13.191 3.992 ( 3.774 -3.768 2.811) 6.028 4.355 ( 2.964 6.875 3.227) 8.152 4.392 ( 2.810 4.874 9.841) 11.335 4.586 ( 2.675 8.088 -2.818) 8.973 4.670 ( -0.560 0.772 6.422) 6.492 4.929 ( -6.559 0.157 -10.669) 12.525 5.036 ( 2.449 0.768 -5.320) 5.906 5.317 ( 0.906 -4.974 10.897) 12.013 5.402 ( 6.571 -8.501 7.722) 13.231 5.607 ( -2.980 -3.315 -3.369) 5.588 5.664 ( 2.554 -6.068 -3.651) 7.529 7.317 ( -1.736 -1.022 -7.233) 7.508 7.359 ( -8.998 -2.272 -10.002) 13.644 7.873 ( 1.422 1.159 0.266) 1.853 7.959 ( 1.176 -1.438 -4.301) 4.685 9.664 ( 2.455 3.250 10.224) 11.005 9.838 ( 2.182 -2.651 10.113) 10.680 9.940 ( -0.291 2.510 -2.254) 3.386 10.054 ( -0.051 -0.597 0.536) 0.804 10.383 ( 0.835 2.474 0.806) 2.732 10.440 ( 0.025 0.810 -2.241) 2.383 13.051 ( -1.208 -0.884 -0.619) 1.620 13.075 ( -1.103 -2.727 0.705) 3.025 13.206 ( -3.935 0.060 -7.178) 8.186 13.343 ( -0.776 -3.708 -9.289) 10.032 14.595 ( -0.159 3.863 5.853) 7.014 14.824 ( 3.456 -4.099 -5.168) 7.447 18.324 ( -0.727 2.308 3.485) 4.243 18.419 ( -0.404 -0.063 -0.028) 0.410 18.629 ( 2.042 1.903 3.667) 4.609 18.730 ( -0.209 -2.325 -2.582) 3.481======================= Grid point 497 (263/312) =======================q-point: (-0.40 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.833 ( -9.988 3.316 7.476) 12.909 2.332 ( -8.892 5.983 4.577) 11.654 2.509 ( 15.302 -13.055 -5.206) 20.777 2.751 ( 5.797 -8.903 -10.274) 14.779 3.686 ( -8.791 4.968 9.237) 13.686 4.052 ( -0.065 -4.647 1.605) 4.916 4.332 ( -4.146 11.505 -0.635) 12.245 4.504 ( -4.430 5.353 -6.829) 9.742 4.586 ( 2.648 -0.680 11.260) 11.587 4.722 ( -2.119 2.381 2.022) 3.774 4.775 ( 2.505 -0.413 -5.551) 6.103 5.047 ( 4.411 1.215 -4.856) 6.672 5.426 ( -1.666 -1.325 4.579) 5.049 5.472 ( -1.829 -4.181 1.115) 4.698 5.560 ( 1.218 -6.005 -1.658) 6.347 5.725 ( 7.748 -7.218 -3.664) 11.205 7.212 ( 0.402 0.358 -0.623) 0.823 7.337 ( 7.358 -3.356 1.382) 8.205 7.879 ( -1.003 0.734 -0.791) 1.473 7.938 ( 0.676 -0.769 -3.410) 3.561 9.754 ( -2.280 2.537 5.315) 6.315 9.891 ( -0.479 3.241 -2.976) 4.426 9.926 ( -2.869 -3.433 5.325) 6.955 10.023 ( -0.957 -1.027 -2.173) 2.587 10.401 ( 0.191 2.353 -0.665) 2.453 10.434 ( 1.831 1.585 -0.997) 2.619 13.056 ( 0.091 -0.079 1.589) 1.594 13.087 ( 1.337 -0.438 1.152) 1.818 13.132 ( 0.184 -1.830 1.549) 2.405 13.284 ( 2.709 -4.645 -5.719) 7.850 14.634 ( -0.913 2.968 3.477) 4.662 14.834 ( 3.782 -3.260 -6.233) 7.986 18.331 ( -1.836 1.791 2.907) 3.876 18.422 ( 0.797 -1.391 -0.222) 1.619 18.659 ( -1.555 1.367 0.287) 2.090 18.695 ( -0.710 -0.201 -1.360) 1.548======================= Grid point 498 (264/312) =======================q-point: (-0.30 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.786 ( -4.808 7.604 10.854) 14.097 2.361 ( -1.204 10.446 18.585) 21.354 2.685 ( 12.469 -19.068 -12.486) 25.980 2.932 ( 13.083 -7.037 11.221) 18.617 3.603 ( -9.301 6.581 7.578) 13.684 4.009 ( -6.173 -1.953 1.879) 6.742 4.237 ( -2.631 7.690 -4.962) 9.523 4.335 ( -5.282 4.474 -7.382) 10.120 4.611 ( -2.123 4.026 -4.113) 6.134 4.697 ( -3.017 1.884 3.641) 5.090 4.837 ( 1.723 -3.020 0.077) 3.478 5.089 ( 3.005 -2.880 -3.079) 5.177 5.362 ( 1.916 0.339 -3.068) 3.633 5.516 ( -0.091 -2.082 4.007) 4.516 5.537 ( 1.111 -4.670 -4.495) 6.576 5.850 ( 7.863 -5.977 -0.604) 9.895 7.358 ( 9.595 2.927 8.505) 13.152 7.574 ( 11.083 -3.750 7.393) 13.840 7.838 ( -0.865 1.715 -0.752) 2.063 7.911 ( -0.547 -0.630 -1.982) 2.150 9.671 ( -5.876 1.650 -4.268) 7.447 9.807 ( -7.189 -2.256 -4.740) 8.902 9.885 ( -1.684 2.355 0.265) 2.907 10.005 ( -1.846 -0.955 0.575) 2.156 10.389 ( -0.398 3.423 -0.457) 3.476 10.471 ( 2.968 1.077 -1.405) 3.456 13.073 ( 1.458 0.776 0.998) 1.930 13.165 ( 3.256 -0.616 4.172) 5.328 13.220 ( 3.801 -1.991 7.126) 8.318 13.341 ( 6.395 -4.972 0.594) 8.122 14.629 ( -1.161 2.397 -0.126) 2.666 14.836 ( 2.712 -3.527 -5.937) 7.419 18.328 ( -1.135 1.746 2.466) 3.227 18.413 ( -2.041 -0.478 -1.215) 2.423 18.597 ( -2.736 2.053 -2.885) 4.475 18.681 ( -0.453 -2.087 0.385) 2.170======================= Grid point 499 (265/312) =======================q-point: (-0.20 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.870 ( 0.282 9.773 14.112) 17.168 2.587 ( 1.069 13.258 22.656) 26.272 2.793 ( 11.153 -17.716 -8.148) 22.464 3.302 ( 10.870 -7.124 13.565) 18.786 3.507 ( -6.931 7.091 4.270) 10.795 3.899 ( -5.927 -2.207 -0.141) 6.326 4.137 ( -2.660 6.943 -5.692) 9.364 4.204 ( -2.052 4.072 -2.765) 5.333 4.516 ( -5.508 2.771 -3.044) 6.876 4.602 ( -3.630 4.968 -6.101) 8.665 4.826 ( -0.806 -4.683 -1.943) 5.133 5.071 ( 0.327 -5.142 -4.082) 6.574 5.450 ( 4.247 -5.006 0.950) 6.634 5.515 ( 0.930 -6.085 -1.017) 6.239 5.618 ( 7.156 7.533 4.997) 11.529 5.993 ( 6.880 -3.793 1.604) 8.018 7.612 ( 6.117 3.122 3.170) 7.564 7.672 ( -1.557 0.828 -2.821) 3.327 7.930 ( 5.092 1.196 6.232) 8.136 8.021 ( 12.006 -1.116 12.885) 17.647 9.493 ( -6.454 0.977 -7.936) 10.275 9.592 ( -9.109 -2.337 -7.177) 11.829 9.825 ( -3.929 2.703 -2.493) 5.382 9.939 ( -4.497 -0.804 -2.302) 5.115 10.385 ( -0.187 4.223 0.876) 4.317 10.508 ( 2.723 0.813 -2.025) 3.489 13.131 ( 2.355 0.354 3.125) 3.929 13.265 ( 3.846 -2.155 2.815) 5.230 13.398 ( 6.443 -0.763 9.016) 11.107 13.511 ( 8.008 -4.045 5.658) 10.606 14.600 ( -0.729 1.960 -1.810) 2.766 14.809 ( 0.668 -3.985 -5.783) 7.055 18.318 ( -5.857 1.474 -0.437) 6.055 18.329 ( -1.168 -0.088 -1.592) 1.976 18.525 ( -1.039 2.781 -2.516) 3.891 18.692 ( 0.532 -3.634 1.183) 3.859======================= Grid point 500 (266/312) =======================q-point: (-0.10 0.36 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.056 ( 3.330 9.633 15.758) 18.767 2.750 ( -1.989 7.037 11.064) 13.262 2.942 ( 8.709 -7.290 0.110) 11.358 3.436 ( -4.507 2.918 3.954) 6.668 3.532 ( 4.178 0.410 3.318) 5.351 3.805 ( -1.537 -2.964 -4.494) 5.599 4.042 ( -2.802 6.602 -3.268) 7.882 4.232 ( 2.741 -0.270 3.733) 4.639 4.343 ( -7.537 1.079 -2.110) 7.900 4.525 ( 0.446 8.418 -4.617) 9.611 4.795 ( -1.423 -6.534 0.492) 6.705 5.050 ( 1.957 -4.602 -3.594) 6.158 5.506 ( 2.490 -4.959 -0.237) 5.554 5.532 ( 0.382 -5.278 1.030) 5.391 5.842 ( 8.456 7.303 7.482) 13.447 6.116 ( 4.093 -0.838 1.973) 4.621 7.578 ( -3.174 2.211 -2.940) 4.859 7.620 ( -1.830 0.925 -4.683) 5.112 8.230 ( 12.867 3.893 13.376) 18.964 8.378 ( 11.146 -0.139 13.392) 17.424 9.297 ( -5.540 0.062 -8.522) 10.165 9.358 ( -8.547 -2.113 -6.132) 10.730 9.698 ( -5.392 2.432 -5.201) 7.877 9.799 ( -6.460 -0.589 -5.313) 8.385 10.399 ( -0.016 4.532 2.012) 4.959 10.529 ( 1.884 1.006 -2.311) 3.147 13.208 ( 1.932 -0.100 3.989) 4.433 13.355 ( 3.574 -3.034 1.318) 4.870 13.607 ( 6.558 -0.149 7.989) 10.337 13.711 ( 7.099 -3.130 5.239) 9.362 14.575 ( -0.401 1.381 -0.872) 1.682 14.751 ( -0.625 -3.563 -5.495) 6.579 18.192 ( -5.511 1.202 -1.915) 5.956 18.256 ( -3.590 -1.209 -3.747) 5.328 18.543 ( 3.103 2.407 1.211) 4.109 18.705 ( -0.398 -3.007 0.576) 3.087======================= Grid point 501 (267/312) =======================q-point: ( 0.00 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.448 ( 4.342 10.356 6.611) 13.031 2.656 ( 4.316 -10.584 -2.184) 11.637 3.201 ( -3.786 9.920 10.860) 15.188 3.362 ( -4.802 -5.976 6.820) 10.261 3.677 ( 5.396 5.734 -2.351) 8.217 3.763 ( 7.106 -2.630 -3.539) 8.363 4.011 ( -3.929 3.206 -6.793) 8.477 4.103 ( -1.287 -5.810 -8.832) 10.650 4.394 ( -3.094 7.712 4.495) 9.447 4.566 ( 0.202 -7.830 -3.260) 8.484 4.784 ( -1.310 8.855 7.412) 11.622 4.960 ( 2.211 -8.159 0.307) 8.459 5.481 ( 0.307 -1.496 0.770) 1.711 5.483 ( 1.163 -1.654 0.502) 2.083 6.122 ( 2.591 4.010 4.197) 6.357 6.173 ( 1.366 -1.196 1.968) 2.677 7.535 ( -1.742 0.992 -2.440) 3.158 7.546 ( -1.792 -0.114 -3.076) 3.562 8.640 ( 9.557 2.774 9.256) 13.590 8.666 ( 7.199 0.227 8.620) 11.233 9.132 ( -3.951 -0.567 -4.705) 6.170 9.143 ( -4.408 -1.685 -4.167) 6.296 9.591 ( -4.998 1.812 -3.930) 6.611 9.616 ( -5.526 -0.716 -4.512) 7.170 10.493 ( -0.099 3.256 1.061) 3.426 10.535 ( 0.453 -1.016 -0.712) 1.321 13.285 ( 2.183 2.128 -0.361) 3.070 13.343 ( 2.863 -3.647 -2.014) 5.055 13.775 ( 4.170 0.780 3.440) 5.462 13.803 ( 4.350 -2.129 2.038) 5.255 14.600 ( -1.320 2.282 0.821) 2.761 14.645 ( -0.896 -2.389 -1.443) 2.931 18.116 ( -2.997 1.349 -0.803) 3.383 18.145 ( -1.599 -1.584 -2.132) 3.100 18.637 ( 1.613 0.889 0.809) 2.011 18.658 ( -0.233 -1.256 -0.111) 1.282======================= Grid point 502 (268/312) =======================q-point: ( 0.10 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.537 ( 0.354 6.041 1.712) 6.289 2.658 ( 0.962 -6.077 -7.492) 9.694 3.236 ( -2.394 8.630 8.624) 12.433 3.384 ( -0.059 -6.479 6.988) 9.530 3.729 ( 3.653 8.839 -5.622) 11.094 3.851 ( 5.780 3.452 -4.874) 8.311 3.919 ( -1.398 -2.813 1.438) 3.454 4.029 ( 2.881 -8.018 -7.156) 11.126 4.381 ( -3.062 7.913 4.822) 9.760 4.556 ( 1.242 -8.072 -1.613) 8.325 4.795 ( -4.860 8.643 4.964) 11.089 4.971 ( -0.845 -8.374 -1.901) 8.629 5.479 ( -0.823 -0.660 -0.244) 1.083 5.495 ( 0.070 -2.272 -0.417) 2.311 6.126 ( -4.816 2.753 -0.078) 5.548 6.154 ( -3.794 -0.092 -0.445) 3.821 7.512 ( 0.386 0.658 0.349) 0.839 7.518 ( 0.514 0.019 0.134) 0.532 8.708 ( -4.615 4.172 -3.636) 7.206 8.763 ( -2.101 -1.177 -2.979) 3.831 9.075 ( 0.782 1.074 1.038) 1.685 9.124 ( 2.769 -3.652 0.827) 4.657 9.548 ( 1.397 1.271 3.783) 4.228 9.558 ( 1.510 0.306 3.230) 3.579 10.492 ( -1.068 2.906 0.751) 3.186 10.528 ( -0.356 -0.837 -0.824) 1.227 13.296 ( 0.274 1.765 -2.217) 2.847 13.348 ( 0.859 -3.377 -4.143) 5.413 13.825 ( 0.420 0.358 -1.863) 1.943 13.845 ( 0.817 -1.541 -3.165) 3.614 14.582 ( -2.111 2.301 1.921) 3.666 14.627 ( -0.308 -2.450 0.052) 2.469 18.100 ( 0.842 2.377 1.969) 3.199 18.145 ( 2.339 -2.080 0.961) 3.275 18.635 ( -1.662 1.021 -0.881) 2.140 18.661 ( 0.563 -1.834 -0.150) 1.925======================= Grid point 503 (269/312) =======================q-point: ( 0.20 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.491 ( -3.825 2.353 -4.026) 6.031 2.548 ( -1.525 -3.250 -12.625) 13.126 3.287 ( -2.199 8.590 8.663) 12.397 3.456 ( -1.985 -8.757 6.633) 11.164 3.705 ( 5.164 9.942 -11.432) 16.006 3.882 ( 3.162 -5.191 -10.800) 12.393 3.947 ( 1.976 4.581 6.582) 8.259 4.098 ( 5.831 -7.796 2.938) 10.169 4.393 ( -0.710 9.838 5.203) 11.152 4.572 ( 2.326 -4.913 -2.246) 5.882 4.730 ( -5.854 5.703 5.659) 9.940 4.906 ( -2.569 -9.121 -2.673) 9.845 5.444 ( -2.112 0.097 -1.631) 2.670 5.476 ( -1.077 -3.212 -1.709) 3.794 5.965 ( -9.544 4.192 -4.024) 11.174 6.027 ( -8.158 -2.318 -2.662) 8.889 7.551 ( 1.807 0.636 2.644) 3.265 7.558 ( 1.859 -0.072 2.485) 3.104 8.485 ( -9.599 3.887 -12.299) 16.078 8.550 ( -10.193 -2.733 -12.745) 16.547 9.169 ( 4.564 2.541 6.663) 8.467 9.226 ( 4.831 -3.363 5.926) 8.353 9.685 ( 5.712 1.632 7.665) 9.698 9.701 ( 5.704 -0.000 8.304) 10.075 10.471 ( -1.622 2.719 0.285) 3.179 10.508 ( -0.895 -1.021 -0.974) 1.671 13.252 ( -1.654 1.204 -3.817) 4.331 13.294 ( -1.342 -2.836 -5.728) 6.531 13.755 ( -3.059 0.427 -7.087) 7.731 13.774 ( -2.447 -1.464 -7.712) 8.222 14.568 ( -1.595 3.347 2.579) 4.516 14.634 ( 0.491 -3.799 1.186) 4.009 18.179 ( 3.836 3.627 4.497) 6.935 18.240 ( 4.881 -2.295 3.838) 6.620 18.585 ( -2.439 3.066 -1.290) 4.125 18.655 ( -0.292 -4.438 -1.294) 4.632======================= Grid point 504 (270/312) =======================q-point: ( 0.30 0.45 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.344 ( -5.714 1.153 -6.591) 8.799 2.384 ( -1.808 -2.557 -13.283) 13.647 3.242 ( -7.452 5.190 -4.283) 10.041 3.350 ( -8.609 -5.167 -8.154) 12.935 3.743 ( 4.297 3.039 -0.482) 5.285 3.816 ( 1.464 -3.788 -6.259) 7.461 4.095 ( 5.542 7.474 7.506) 11.954 4.241 ( 5.363 -6.829 2.807) 9.125 4.475 ( 4.293 11.269 6.451) 13.676 4.623 ( 4.386 4.059 2.752) 6.580 4.744 ( -0.058 -4.724 7.627) 8.971 4.865 ( -0.614 -8.881 1.125) 8.973 5.363 ( -4.508 0.714 -3.189) 5.568 5.409 ( -3.962 -4.062 -3.711) 6.780 5.745 ( -8.388 4.884 -4.410) 10.661 5.833 ( -8.767 -4.270 -3.562) 10.382 7.599 ( -0.246 1.039 1.643) 1.959 7.614 ( 0.872 -0.589 2.478) 2.692 8.167 ( -8.885 2.043 -15.145) 17.678 8.206 ( -10.515 -1.915 -15.503) 18.830 9.350 ( 5.540 2.869 10.194) 11.952 9.406 ( 5.781 -2.989 9.812) 11.774 9.858 ( 4.951 1.793 6.274) 8.191 9.879 ( 4.880 -0.322 6.916) 8.470 10.443 ( -1.545 2.542 0.082) 2.976 10.480 ( -0.968 -1.233 -1.090) 1.910 13.169 ( -2.742 0.455 -4.199) 5.035 13.196 ( -2.744 -2.021 -5.905) 6.818 13.591 ( -4.933 0.735 -10.377) 11.514 13.617 ( -4.210 -1.885 -10.907) 11.842 14.581 ( -0.198 4.273 3.430) 5.482 14.666 ( 1.435 -4.758 1.449) 5.176 18.302 ( 3.549 4.564 4.813) 7.523 18.374 ( 4.296 -2.512 4.346) 6.607 18.536 ( -1.361 4.463 -0.140) 4.668 18.636 ( 0.227 -6.065 -1.687) 6.300======================= Grid point 505 (271/312) =======================q-point: ( 0.40 0.45 -0.60)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.175 ( -5.999 2.194 -5.282) 8.288 2.242 ( 0.259 -4.352 -11.732) 12.515 2.960 ( -10.775 2.525 -14.666) 18.373 3.030 ( -10.403 -4.360 -17.139) 20.518 3.801 ( -0.725 2.179 4.707) 5.237 3.844 ( 2.976 -2.259 1.488) 4.021 4.261 ( 4.581 5.075 7.262) 9.974 4.346 ( 4.726 -2.874 1.633) 5.767 4.668 ( 8.014 11.649 4.977) 14.990 4.731 ( -1.112 8.647 8.259) 12.009 4.897 ( 8.220 -9.809 2.846) 13.110 4.905 ( 3.815 -9.863 5.128) 11.753 5.216 ( -7.242 1.580 -2.262) 7.749 5.264 ( -6.602 -3.258 -2.124) 7.663 5.615 ( -2.213 1.542 -2.829) 3.909 5.668 ( -5.356 -3.737 -3.118) 7.237 7.514 ( -6.758 2.285 -6.787) 9.846 7.564 ( -6.923 -2.864 -5.973) 9.582 7.928 ( -2.225 1.992 -8.018) 8.556 7.966 ( -1.339 -1.892 -8.105) 8.430 9.552 ( 4.664 3.064 11.087) 12.412 9.610 ( 4.844 -2.969 10.980) 12.363 9.971 ( 2.275 2.068 2.679) 4.078 10.000 ( 2.453 -0.844 3.494) 4.352 10.422 ( -0.772 2.221 0.287) 2.368 10.455 ( -0.553 -1.131 -0.944) 1.574 13.084 ( -2.432 -0.303 -2.809) 3.728 13.094 ( -2.437 -1.142 -4.227) 5.011 13.393 ( -4.682 1.176 -10.950) 11.967 13.429 ( -3.621 -2.519 -11.671) 12.476 14.623 ( 0.774 4.451 3.618) 5.788 14.709 ( 2.034 -4.674 0.620) 5.135 18.369 ( 0.053 4.017 1.859) 4.427 18.428 ( -0.769 -1.687 0.638) 1.960 18.576 ( 3.079 3.035 3.934) 5.846 18.649 ( 2.151 -4.692 0.105) 5.163======================= Grid point 506 (272/312) =======================q-point: (-0.50 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.035 ( -4.468 5.520 -2.780) 7.627 2.178 ( 3.987 -8.767 -8.477) 12.830 2.631 ( -9.910 3.832 -10.103) 14.662 2.722 ( -4.933 -5.562 -14.426) 16.229 3.817 ( -2.585 4.502 4.863) 7.113 3.907 ( 1.774 -4.777 1.770) 5.394 4.420 ( 4.890 2.811 7.643) 9.499 4.460 ( 4.754 -0.400 3.149) 5.717 4.734 ( -4.991 4.608 3.272) 7.540 4.736 ( -4.037 5.940 0.511) 7.200 4.925 ( -0.424 0.439 -8.125) 8.147 4.997 ( 2.183 -4.876 -3.431) 6.349 5.253 ( 2.790 -1.485 10.668) 11.126 5.272 ( 7.076 -4.004 10.612) 13.369 5.563 ( -2.355 -1.017 -4.013) 4.763 5.577 ( 0.564 -2.676 -3.923) 4.782 7.309 ( -4.213 0.213 -8.421) 9.418 7.324 ( -6.704 -1.336 -9.351) 11.584 7.899 ( 1.319 1.490 -1.586) 2.545 7.929 ( 1.329 -1.615 -3.201) 3.823 9.724 ( 2.283 3.069 10.045) 10.749 9.782 ( 2.263 -3.045 10.058) 10.749 9.991 ( -0.474 2.569 -1.562) 3.044 10.032 ( -0.290 -1.660 -0.774) 1.854 10.423 ( 0.413 1.620 0.486) 1.741 10.443 ( 0.163 -0.450 -0.594) 0.762 13.037 ( -0.843 -0.417 -0.227) 0.967 13.041 ( -0.591 -0.897 -0.260) 1.106 13.224 ( -2.448 1.815 -9.116) 9.612 13.274 ( -1.231 -3.264 -10.062) 10.650 14.671 ( 0.851 4.011 2.690) 4.903 14.747 ( 2.247 -3.972 -1.056) 4.684 18.369 ( -0.926 2.266 1.057) 2.666 18.405 ( -1.209 -1.387 -0.328) 1.869 18.661 ( 1.676 1.505 2.885) 3.661 18.691 ( 1.121 -1.735 0.688) 2.177======================= Grid point 507 (273/312) =======================q-point: (-0.40 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.972 ( -0.857 10.736 0.030) 10.770 2.223 ( 7.918 -14.835 -5.834) 17.799 2.464 ( -3.288 7.042 2.840) 8.274 2.602 ( 1.507 -7.309 -1.415) 7.596 3.802 ( -3.668 6.818 3.622) 8.548 3.936 ( -0.064 -6.869 0.374) 6.880 4.496 ( -2.472 5.211 -3.399) 6.695 4.550 ( -1.786 -0.973 -3.643) 4.173 4.624 ( -2.115 4.455 6.436) 8.109 4.702 ( -1.141 -3.316 6.973) 7.806 4.855 ( -0.468 7.502 -4.168) 8.595 4.998 ( 0.950 -6.019 -2.140) 6.458 5.421 ( 1.451 -0.526 4.995) 5.228 5.430 ( 0.885 -0.520 1.308) 1.662 5.495 ( 1.864 1.159 -3.869) 4.449 5.587 ( 6.492 -6.772 -3.387) 9.974 7.233 ( 3.205 1.780 -0.035) 3.666 7.278 ( 5.658 -2.790 0.658) 6.343 7.897 ( -0.099 1.067 -1.767) 2.067 7.919 ( 0.515 -1.149 -2.768) 3.041 9.804 ( -3.074 2.749 5.142) 6.592 9.861 ( -3.251 -3.198 4.948) 6.729 9.951 ( -0.324 2.832 -2.306) 3.667 9.996 ( -0.474 -1.858 -2.434) 3.098 10.438 ( 0.662 1.359 -0.182) 1.522 10.450 ( 1.249 0.073 -0.366) 1.303 13.056 ( 1.068 0.160 3.030) 3.216 13.067 ( 1.501 -1.019 3.512) 3.953 13.140 ( 1.357 2.087 -4.893) 5.490 13.199 ( 2.370 -3.948 -6.555) 8.011 14.698 ( 0.206 3.632 0.607) 3.688 14.768 ( 1.972 -3.584 -2.697) 4.899 18.363 ( -1.045 1.576 1.530) 2.432 18.393 ( -0.098 -1.551 0.449) 1.617 18.681 ( -1.275 0.826 0.077) 1.521 18.691 ( -1.036 -0.304 -0.543) 1.209======================= Grid point 508 (274/312) =======================q-point: (-0.30 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.999 ( 2.100 14.307 2.992) 14.766 2.315 ( 7.781 -18.043 -5.076) 20.294 2.575 ( 4.383 10.579 16.121) 19.775 2.771 ( 9.203 -9.586 13.724) 19.103 3.749 ( -4.932 8.247 1.471) 9.721 3.903 ( -3.073 -7.427 -1.515) 8.180 4.364 ( -5.043 4.252 -5.085) 8.329 4.395 ( -5.477 1.103 -5.916) 8.137 4.671 ( -2.911 3.503 2.891) 5.394 4.758 ( -0.662 -4.902 2.100) 5.374 4.813 ( -1.002 8.768 -2.033) 9.056 4.980 ( -0.490 -7.872 -2.422) 8.251 5.371 ( 0.923 1.207 -4.312) 4.572 5.423 ( 0.327 -4.278 -3.933) 5.820 5.592 ( 6.288 6.075 2.578) 9.115 5.722 ( 8.332 -7.096 0.779) 10.972 7.424 ( 11.158 3.797 8.271) 14.400 7.499 ( 11.665 -4.022 7.826) 14.612 7.868 ( -0.372 1.466 -1.270) 1.975 7.894 ( -0.235 -1.162 -1.893) 2.233 9.706 ( -6.912 2.114 -3.703) 8.122 9.753 ( -7.483 -2.781 -3.939) 8.902 9.939 ( -1.342 2.676 0.129) 2.996 9.980 ( -1.441 -1.664 0.066) 2.202 10.446 ( 0.670 2.361 -0.341) 2.478 10.476 ( 1.914 -0.684 -0.746) 2.165 13.099 ( 2.335 1.884 -0.143) 3.003 13.138 ( 2.915 -1.998 1.559) 3.863 13.211 ( 5.344 0.996 5.516) 7.744 13.255 ( 6.395 -3.607 2.162) 7.654 14.690 ( -0.491 3.699 -1.599) 4.060 14.764 ( 0.946 -3.903 -3.696) 5.458 18.362 ( -1.042 1.749 1.605) 2.592 18.393 ( -1.417 -1.450 0.876) 2.209 18.629 ( -2.487 1.298 -2.283) 3.617 18.651 ( -1.728 -1.173 -1.498) 2.570======================= Grid point 509 (275/312) =======================q-point: (-0.20 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 552Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.107 ( 4.533 14.753 6.329) 16.681 2.422 ( 7.915 -17.824 -1.914) 19.596 2.875 ( 5.806 13.736 21.486) 26.154 3.120 ( 8.801 -11.481 18.703) 23.645 3.657 ( -4.115 8.022 -2.403) 9.330 3.802 ( -4.100 -6.844 -4.326) 9.076 4.241 ( -2.922 3.388 -4.994) 6.705 4.264 ( -3.744 1.301 -2.849) 4.881 4.577 ( -6.048 4.934 -3.419) 8.522 4.698 ( -1.772 -5.817 -6.574) 8.955 4.771 ( -2.533 8.393 0.233) 8.770 4.944 ( -0.378 -8.182 -2.772) 8.647 5.393 ( 2.727 -0.670 0.037) 2.808 5.421 ( 1.802 -3.420 -0.679) 3.925 5.765 ( 8.814 7.514 4.415) 12.395 5.897 ( 8.551 -6.106 2.849) 10.887 7.659 ( 4.043 1.723 0.289) 4.404 7.677 ( 1.012 -0.286 -1.964) 2.228 7.959 ( 8.409 1.768 8.983) 12.431 7.994 ( 11.052 -1.726 11.607) 16.119 9.514 ( -7.724 1.329 -7.129) 10.595 9.547 ( -8.595 -2.109 -7.011) 11.291 9.878 ( -4.253 2.567 -2.269) 5.462 9.918 ( -4.345 -1.549 -2.326) 5.166 10.459 ( 0.803 3.239 0.232) 3.345 10.503 ( 1.905 -1.313 -0.855) 2.467 13.156 ( 3.590 2.252 0.522) 4.270 13.211 ( 4.216 -3.191 0.180) 5.290 13.402 ( 7.174 1.167 8.661) 11.307 13.442 ( 7.909 -2.981 7.189) 11.096 14.656 ( -0.859 3.647 -2.325) 4.410 14.731 ( -0.278 -4.090 -3.895) 5.655 18.331 ( -3.750 0.341 -2.108) 4.316 18.334 ( -4.700 0.148 0.256) 4.709 18.577 ( -0.256 2.630 -1.426) 3.002 18.629 ( 0.572 -2.955 -0.295) 3.024======================= Grid point 510 (276/312) =======================q-point: (-0.10 0.45 0.40)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.277 ( 5.765 13.333 8.020) 16.593 2.556 ( 7.320 -15.411 -0.359) 17.065 3.123 ( -1.259 14.214 17.741) 22.767 3.361 ( -3.097 -9.640 15.163) 18.232 3.603 ( 4.484 5.879 -5.491) 9.210 3.718 ( 1.940 -5.709 -5.990) 8.500 4.141 ( -2.679 3.699 -6.255) 7.745 4.199 ( -1.548 -2.522 -3.271) 4.411 4.437 ( -4.873 8.357 -1.246) 9.754 4.613 ( -0.780 -7.843 -5.243) 9.466 4.746 ( -1.601 8.976 3.727) 9.850 4.926 ( 1.223 -8.341 -1.423) 8.550 5.445 ( 2.122 -1.267 0.905) 2.632 5.456 ( 1.339 -2.379 1.074) 2.933 5.973 ( 7.616 6.181 5.588) 11.289 6.071 ( 6.295 -3.826 3.562) 8.182 7.611 ( -2.586 1.266 -3.993) 4.923 7.626 ( -2.125 -0.248 -4.619) 5.091 8.304 ( 13.292 3.582 13.525) 19.298 8.358 ( 12.660 -1.977 13.592) 18.680 9.301 ( -7.033 0.527 -7.750) 10.479 9.321 ( -8.002 -1.572 -6.969) 10.726 9.746 ( -6.047 2.314 -4.705) 8.004 9.781 ( -6.323 -1.348 -4.891) 8.107 10.478 ( 0.623 3.514 0.866) 3.673 10.526 ( 1.335 -1.358 -0.718) 2.035 13.230 ( 3.428 2.294 0.737) 4.190 13.289 ( 4.116 -3.620 -0.397) 5.496 13.616 ( 6.812 1.168 7.510) 10.206 13.653 ( 7.148 -2.641 6.292) 9.882 14.621 ( -0.935 3.076 -1.192) 3.429 14.684 ( -0.946 -3.450 -2.969) 4.648 18.212 ( -5.292 1.012 -2.419) 5.906 18.233 ( -4.592 -1.163 -2.917) 5.563 18.594 ( 1.862 2.796 0.703) 3.432 18.649 ( 0.942 -2.910 0.396) 3.084======================= Grid point 561 (277/312) =======================q-point: ( 0.00 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 156Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.563 ( -5.490 0.000 -24.065) 24.684 2.563 ( 5.492 0.000 24.058) 24.677 2.661 ( 0.404 0.000 -22.186) 22.190 2.661 ( -0.404 0.000 22.193) 22.196 3.648 ( -1.648 0.000 -12.021) 12.133 3.648 ( 1.649 0.000 12.021) 12.134 4.179 ( 13.515 0.000 -21.180) 25.125 4.179 ( -13.515 0.000 21.179) 25.124 4.360 ( 2.626 0.000 -9.577) 9.930 4.360 ( -2.626 0.000 9.577) 9.930 5.198 ( 6.939 0.000 -4.303) 8.165 5.198 ( -6.939 0.000 4.303) 8.165 5.437 ( -4.050 0.000 -4.865) 6.331 5.437 ( 4.051 0.000 4.865) 6.331 6.082 ( 3.660 0.000 -1.344) 3.899 6.082 ( -3.659 0.000 1.344) 3.898 7.394 ( -0.139 0.000 -1.716) 1.722 7.394 ( 0.139 0.000 1.716) 1.722 8.540 ( -0.924 0.000 -1.987) 2.191 8.540 ( 0.925 0.000 1.987) 2.192 9.298 ( -7.706 0.000 -7.002) 10.412 9.298 ( 7.706 0.000 7.002) 10.412 9.410 ( -1.956 0.000 -10.507) 10.687 9.410 ( 1.956 0.000 10.507) 10.688 10.288 ( 3.114 0.000 -2.178) 3.801 10.288 ( -3.114 0.000 2.179) 3.800 13.555 ( 2.317 0.000 -3.716) 4.379 13.555 ( -2.315 0.000 3.716) 4.378 13.830 ( 0.230 0.000 -2.751) 2.761 13.830 ( -0.231 0.000 2.752) 2.761 14.778 ( 11.621 0.000 -5.504) 12.858 14.778 ( -11.619 0.000 5.503) 12.857 18.061 ( -0.362 0.000 -2.093) 2.124 18.061 ( 0.362 0.000 2.093) 2.124 18.750 ( -10.888 0.000 0.676) 10.909 18.750 ( 10.889 0.000 -0.675) 10.910======================= Grid point 563 (278/312) =======================q-point: ( 0.10 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.260 ( 0.396 0.000 -26.179) 26.182 2.499 ( 5.995 0.000 -20.892) 21.735 2.919 ( 3.275 0.000 22.789) 23.023 2.924 ( 8.199 0.000 21.255) 22.781 3.519 ( -0.176 0.000 -9.783) 9.785 3.800 ( 0.490 0.000 13.848) 13.856 4.071 ( -16.579 0.000 14.080) 21.752 4.121 ( 8.199 0.000 -30.796) 31.869 4.354 ( 5.562 0.000 -7.020) 8.956 4.422 ( -1.290 0.000 9.430) 9.518 5.125 ( -5.521 0.000 4.046) 6.845 5.240 ( -2.208 0.000 -5.651) 6.067 5.352 ( 5.762 0.000 -4.822) 7.513 5.523 ( 1.932 0.000 1.342) 2.352 6.012 ( -4.968 0.000 0.850) 5.040 6.115 ( 1.685 0.000 -1.857) 2.508 7.405 ( 2.413 0.000 -0.472) 2.458 7.441 ( 2.182 0.000 2.755) 3.514 8.427 ( -4.711 0.000 -9.820) 10.892 8.484 ( -4.461 0.000 -7.112) 8.395 9.155 ( -3.998 0.000 1.712) 4.349 9.354 ( 3.393 0.000 -2.265) 4.080 9.528 ( 7.628 0.000 9.326) 12.048 9.589 ( 3.852 0.000 13.193) 13.744 10.255 ( -2.559 0.000 1.696) 3.070 10.320 ( 2.959 0.000 -2.914) 4.153 13.514 ( -3.911 0.000 -0.411) 3.933 13.525 ( 0.639 0.000 -7.840) 7.866 13.771 ( -1.545 0.000 -6.155) 6.346 13.811 ( -2.573 0.000 -1.311) 2.888 14.639 ( -11.265 0.000 9.443) 14.700 14.934 ( 9.928 0.000 -4.103) 10.743 18.063 ( 1.367 0.000 0.436) 1.435 18.115 ( 1.861 0.000 4.362) 4.743 18.550 ( -10.667 0.000 0.192) 10.669 18.914 ( 8.253 0.000 -2.291) 8.565======================= Grid point 564 (279/312) =======================q-point: ( 0.20 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.086 ( 8.147 0.000 -24.381) 25.706 2.471 ( 11.359 0.000 -17.368) 20.753 3.163 ( 0.125 0.000 14.309) 14.309 3.248 ( 6.954 0.000 13.374) 15.073 3.499 ( 6.248 0.000 -0.350) 6.258 3.799 ( -19.438 0.000 14.315) 24.140 3.915 ( 6.725 0.000 -36.222) 36.841 3.992 ( -0.713 0.000 10.291) 10.316 4.400 ( 5.777 0.000 -5.621) 8.060 4.485 ( -3.362 0.000 11.365) 11.852 5.071 ( -3.999 0.000 2.109) 4.521 5.087 ( -5.226 0.000 -7.353) 9.021 5.484 ( 10.099 0.000 -2.388) 10.377 5.556 ( 1.645 0.000 0.538) 1.730 5.925 ( -5.048 0.000 0.732) 5.101 6.106 ( -0.492 0.000 -2.243) 2.297 7.471 ( 4.838 0.000 0.368) 4.852 7.505 ( 1.804 0.000 1.276) 2.209 8.208 ( -5.468 0.000 -12.991) 14.094 8.259 ( -8.386 0.000 -12.971) 15.446 9.193 ( 0.987 0.000 10.284) 10.332 9.470 ( 7.403 0.000 3.634) 8.247 9.739 ( 5.697 0.000 8.483) 10.219 9.785 ( 3.387 0.000 12.631) 13.077 10.230 ( -1.667 0.000 1.147) 2.024 10.333 ( 1.988 0.000 -4.044) 4.506 13.408 ( -5.311 0.000 -3.531) 6.378 13.428 ( -1.136 0.000 -10.484) 10.546 13.666 ( -1.948 0.000 -7.852) 8.090 13.719 ( -4.083 0.000 -4.193) 5.852 14.563 ( -9.505 0.000 13.912) 16.849 15.037 ( 6.093 0.000 -5.804) 8.415 18.114 ( 2.653 0.000 2.003) 3.324 18.206 ( 2.503 0.000 5.298) 5.860 18.392 ( -6.789 0.000 1.648) 6.986 18.996 ( 4.107 0.000 -4.237) 5.901======================= Grid point 565 (280/312) =======================q-point: ( 0.30 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.081 ( 14.350 0.000 -18.758) 23.618 2.562 ( 14.959 0.000 -13.710) 20.291 3.176 ( -5.809 0.000 3.846) 6.967 3.268 ( -12.708 0.000 -4.502) 13.482 3.691 ( 9.559 0.000 -28.536) 30.095 3.692 ( -7.802 0.000 21.749) 23.106 3.755 ( 12.144 0.000 3.012) 12.512 4.073 ( -2.912 0.000 10.956) 11.336 4.451 ( 5.636 0.000 -4.991) 7.529 4.523 ( -6.101 0.000 14.679) 15.897 4.922 ( -4.175 0.000 -8.666) 9.619 5.007 ( -3.101 0.000 -2.848) 4.210 5.619 ( 2.842 0.000 4.110) 4.997 5.644 ( 8.484 0.000 -0.651) 8.509 5.858 ( -2.903 0.000 1.384) 3.216 6.056 ( -2.228 0.000 -2.473) 3.329 7.498 ( -1.288 0.000 -4.047) 4.247 7.584 ( 6.570 0.000 0.869) 6.627 7.957 ( -9.613 0.000 -13.329) 16.434 8.027 ( -2.113 0.000 -8.187) 8.455 9.359 ( 3.548 0.000 13.330) 13.794 9.649 ( 7.272 0.000 2.970) 7.855 9.902 ( 3.762 0.000 7.375) 8.279 9.954 ( 2.138 0.000 11.132) 11.336 10.215 ( -0.754 0.000 0.138) 0.766 10.311 ( 0.725 0.000 -5.286) 5.336 13.264 ( -5.441 0.000 -4.796) 7.253 13.290 ( -2.389 0.000 -10.318) 10.591 13.559 ( -1.380 0.000 -7.238) 7.369 13.598 ( -3.972 0.000 -4.504) 6.006 14.565 ( -6.877 0.000 16.923) 18.267 15.032 ( 1.791 0.000 -9.778) 9.941 18.188 ( 3.023 0.000 1.932) 3.587 18.269 ( -1.201 0.000 3.714) 3.903 18.382 ( 2.453 0.000 5.568) 6.084 18.980 ( -0.305 0.000 -5.948) 5.956======================= Grid point 566 (281/312) =======================q-point: ( 0.40 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.231 ( 17.390 0.000 -10.223) 20.172 2.730 ( 15.930 0.000 -10.700) 19.190 2.893 ( -19.691 0.000 -4.893) 20.290 3.074 ( -10.055 0.000 5.248) 11.342 3.601 ( 15.144 0.000 -29.872) 33.492 3.737 ( -13.125 0.000 20.777) 24.576 4.048 ( 11.527 0.000 3.901) 12.169 4.133 ( -1.601 0.000 11.127) 11.241 4.517 ( 6.005 0.000 -2.610) 6.547 4.558 ( -6.256 0.000 15.377) 16.601 4.771 ( -2.363 0.000 -9.030) 9.334 4.886 ( -4.553 0.000 -7.761) 8.998 5.720 ( 2.232 0.000 5.369) 5.815 5.762 ( 4.680 0.000 -0.720) 4.735 5.860 ( 0.609 0.000 3.091) 3.151 5.984 ( -2.683 0.000 -2.539) 3.694 7.423 ( -0.334 0.000 -4.468) 4.481 7.634 ( -5.479 0.000 -9.339) 10.827 7.755 ( 3.340 0.000 1.175) 3.540 7.948 ( -1.458 0.000 -3.734) 4.008 9.555 ( 3.558 0.000 12.144) 12.655 9.751 ( 2.978 0.000 -2.704) 4.022 10.033 ( 3.205 0.000 6.387) 7.146 10.080 ( 0.561 0.000 9.488) 9.505 10.200 ( -0.172 0.000 -1.832) 1.840 10.260 ( -0.155 0.000 -5.901) 5.903 13.138 ( -3.448 0.000 -3.056) 4.607 13.158 ( -2.079 0.000 -6.996) 7.298 13.483 ( -0.412 0.000 -4.604) 4.622 13.500 ( -2.637 0.000 -2.480) 3.620 14.641 ( -3.748 0.000 17.941) 18.328 14.924 ( -0.199 0.000 -14.029) 14.030 18.252 ( 2.528 0.000 0.392) 2.558 18.281 ( -1.182 0.000 3.465) 3.661 18.527 ( 5.796 0.000 6.738) 8.888 18.874 ( -3.985 0.000 -7.046) 8.095======================= Grid point 567 (282/312) =======================q-point: ( 0.50 0.00 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 156Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.511 ( 19.155 0.000 -1.088) 19.186 2.511 ( -19.156 0.000 1.084) 19.187 2.916 ( 14.104 0.000 -8.057) 16.242 2.916 ( -14.104 0.000 8.057) 16.243 3.651 ( 18.238 0.000 -23.958) 30.109 3.651 ( -18.238 0.000 23.957) 30.109 4.186 ( 4.955 0.000 -7.506) 8.994 4.186 ( -4.956 0.000 7.505) 8.994 4.591 ( 5.418 0.000 -10.128) 11.486 4.591 ( -5.418 0.000 10.129) 11.487 4.724 ( -3.422 0.000 -4.264) 5.468 4.724 ( 3.421 0.000 4.263) 5.466 5.786 ( -0.052 0.000 -2.934) 2.934 5.786 ( 0.052 0.000 2.934) 2.934 5.917 ( -1.646 0.000 -3.186) 3.586 5.917 ( 1.646 0.000 3.186) 3.586 7.452 ( -4.701 0.000 -3.083) 5.622 7.452 ( 4.701 0.000 3.083) 5.622 7.867 ( -4.102 0.000 -2.926) 5.039 7.867 ( 4.102 0.000 2.925) 5.038 9.706 ( -1.416 0.000 -8.334) 8.454 9.706 ( 1.416 0.000 8.334) 8.454 10.127 ( -2.458 0.000 -0.152) 2.462 10.127 ( 2.458 0.000 0.152) 2.462 10.198 ( -0.990 0.000 -3.300) 3.446 10.198 ( 0.990 0.000 3.301) 3.446 13.095 ( 0.250 0.000 -1.649) 1.668 13.095 ( -0.252 0.000 1.648) 1.667 13.459 ( 0.965 0.000 -0.949) 1.353 13.459 ( -0.965 0.000 0.948) 1.353 14.773 ( 0.897 0.000 -16.945) 16.969 14.773 ( -0.897 0.000 16.944) 16.968 18.283 ( 1.643 0.000 -1.821) 2.453 18.283 ( -1.643 0.000 1.821) 2.453 18.708 ( -6.044 0.000 -7.283) 9.464 18.708 ( 6.044 0.000 7.283) 9.464======================= Grid point 573 (283/312) =======================q-point: ( 0.00 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.550 ( -4.056 -0.403 -23.063) 23.420 2.550 ( 4.055 -0.406 23.060) 23.417 2.734 ( 1.538 6.362 -21.896) 22.853 2.734 ( -1.535 6.364 21.898) 22.856 3.648 ( -2.130 0.067 -10.697) 10.907 3.648 ( 2.131 0.067 10.697) 10.908 4.132 ( 9.993 -3.561 -11.138) 15.382 4.132 ( -9.992 -3.561 11.138) 15.381 4.416 ( 2.049 4.327 -6.687) 8.224 4.416 ( -2.048 4.326 6.687) 8.224 5.116 ( -1.459 -6.171 -1.842) 6.603 5.116 ( 1.460 -6.170 1.842) 6.603 5.532 ( -3.892 7.257 -3.012) 8.768 5.532 ( 3.893 7.256 3.012) 8.768 6.056 ( -2.670 -2.393 0.050) 3.586 6.056 ( 2.671 -2.393 -0.050) 3.586 7.408 ( -0.123 1.367 -1.651) 2.147 7.408 ( 0.123 1.367 1.651) 2.147 8.544 ( -2.488 0.502 -2.031) 3.251 8.544 ( 2.488 0.502 2.032) 3.251 9.291 ( -7.357 -0.851 -6.384) 9.777 9.291 ( 7.357 -0.851 6.383) 9.778 9.417 ( -2.428 0.832 -9.625) 9.961 9.417 ( 2.428 0.831 9.626) 9.962 10.303 ( 1.810 1.554 -2.902) 3.756 10.303 ( -1.809 1.554 2.902) 3.756 13.541 ( 1.215 -1.471 -2.886) 3.460 13.541 ( -1.213 -1.471 2.887) 3.460 13.837 ( 0.316 0.739 -3.222) 3.321 13.837 ( -0.316 0.738 3.222) 3.321 14.749 ( 5.564 -2.857 -4.850) 7.915 14.749 ( -5.563 -2.857 4.850) 7.914 18.071 ( -0.121 0.947 -2.334) 2.522 18.071 ( 0.122 0.947 2.334) 2.522 18.739 ( -10.143 -1.083 0.168) 10.202 18.739 ( 10.144 -1.083 -0.168) 10.203======================= Grid point 575 (284/312) =======================q-point: ( 0.10 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.259 ( -0.232 0.461 -24.866) 24.871 2.562 ( 6.226 5.596 -20.658) 22.289 2.895 ( 5.400 -0.009 20.822) 21.511 2.988 ( 4.601 4.057 21.290) 22.157 3.524 ( -0.807 0.567 -7.747) 7.810 3.797 ( 1.299 -0.308 11.447) 11.524 4.030 ( -10.762 -2.848 8.110) 13.774 4.132 ( 7.046 0.635 -24.625) 25.621 4.400 ( 1.856 3.683 -3.174) 5.204 4.419 ( -2.697 -0.271 6.459) 7.005 5.034 ( -3.873 -5.335 -0.177) 6.595 5.217 ( 5.947 -6.373 -0.320) 8.723 5.409 ( -4.695 8.308 -5.100) 10.820 5.603 ( 2.215 5.402 0.379) 5.851 5.976 ( -5.125 -3.559 0.344) 6.250 6.100 ( 1.806 -1.334 -1.284) 2.586 7.420 ( 2.398 1.513 -0.214) 2.844 7.453 ( 2.053 1.275 2.815) 3.710 8.403 ( -5.972 -1.599 -9.584) 11.405 8.512 ( -3.675 2.131 -7.490) 8.611 9.156 ( -3.608 0.070 2.000) 4.126 9.361 ( 3.664 0.590 -2.272) 4.351 9.511 ( 6.790 -1.305 9.680) 11.896 9.602 ( 4.657 1.088 12.396) 13.286 10.268 ( -2.142 1.400 0.735) 2.662 10.336 ( 2.441 1.620 -1.910) 3.497 13.489 ( -2.291 -2.043 -4.231) 5.228 13.522 ( -1.129 -0.766 -3.471) 3.730 13.773 ( -1.736 0.182 -6.663) 6.888 13.820 ( -2.801 0.795 -1.010) 3.082 14.616 ( -10.299 -2.153 8.328) 13.418 14.899 ( 9.262 -3.481 -3.353) 10.447 18.073 ( 1.305 1.016 0.901) 1.883 18.127 ( 2.082 1.236 4.308) 4.942 18.546 ( -9.994 -0.318 -0.450) 10.009 18.896 ( 7.785 -1.802 -1.991) 8.235======================= Grid point 576 (285/312) =======================q-point: ( 0.20 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.080 ( 6.744 -0.215 -22.736) 23.716 2.528 ( 11.723 5.492 -20.028) 23.848 3.120 ( -2.811 -4.202 15.365) 16.175 3.266 ( 5.058 1.252 12.831) 13.848 3.521 ( 6.579 2.277 0.651) 6.993 3.811 ( -11.906 1.779 7.357) 14.108 3.939 ( 2.709 2.216 -23.693) 23.950 3.992 ( 0.215 -0.042 3.313) 3.320 4.378 ( -0.302 -2.123 0.175) 2.151 4.497 ( 1.031 0.960 7.017) 7.157 4.963 ( -2.699 -4.062 -2.470) 5.466 5.244 ( -5.615 8.855 -2.624) 10.808 5.353 ( 7.185 -8.396 -2.614) 11.356 5.642 ( 2.440 3.872 0.198) 4.581 5.886 ( -4.835 -3.972 0.425) 6.272 6.095 ( -0.675 -1.014 -1.859) 2.223 7.486 ( 4.066 1.501 0.354) 4.348 7.517 ( 2.048 1.209 1.772) 2.966 8.174 ( -5.700 -2.480 -12.639) 14.085 8.283 ( -8.782 1.606 -13.377) 16.083 9.204 ( 1.377 1.124 10.297) 10.450 9.483 ( 7.702 1.183 3.681) 8.618 9.714 ( 5.052 -2.022 9.018) 10.533 9.803 ( 4.153 1.276 11.354) 12.157 10.242 ( -1.269 1.284 0.315) 1.832 10.349 ( 1.443 1.594 -3.016) 3.704 13.380 ( -3.830 -2.245 -6.319) 7.722 13.435 ( -2.666 -0.084 -6.966) 7.459 13.658 ( -2.464 -0.869 -8.159) 8.568 13.725 ( -4.452 0.419 -4.003) 6.001 14.547 ( -8.377 -1.483 12.445) 15.075 14.999 ( 5.641 -3.721 -4.871) 8.330 18.130 ( 2.644 1.580 2.830) 4.183 18.221 ( 2.710 1.554 5.118) 5.996 18.392 ( -6.336 0.091 0.864) 6.395 18.975 ( 3.906 -2.219 -4.057) 6.053======================= Grid point 577 (286/312) =======================q-point: ( 0.30 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.066 ( 13.049 -1.361 -17.001) 21.474 2.580 ( 14.765 1.726 -19.486) 24.509 3.098 ( -11.284 -7.405 10.116) 16.867 3.267 ( -10.453 -0.391 -6.044) 12.081 3.715 ( 3.289 3.395 -7.001) 8.448 3.756 ( 10.859 3.415 -0.582) 11.398 3.795 ( 0.970 5.572 2.928) 6.369 4.054 ( -0.983 -1.737 7.850) 8.100 4.412 ( 0.169 -3.432 6.204) 7.092 4.560 ( -1.481 3.065 6.806) 7.610 4.879 ( -2.130 -1.813 -5.931) 6.558 5.091 ( -5.410 6.032 -6.828) 10.596 5.495 ( 7.648 -7.948 2.451) 11.299 5.704 ( 2.775 1.317 2.406) 3.902 5.823 ( -2.332 -3.447 0.854) 4.249 6.043 ( -2.652 -1.374 -2.187) 3.702 7.481 ( -1.894 -1.094 -5.032) 5.487 7.616 ( 6.142 2.549 2.044) 6.957 7.948 ( -9.647 -0.890 -13.032) 16.238 8.020 ( -2.437 -0.684 -8.272) 8.651 9.372 ( 3.632 1.384 12.981) 13.550 9.666 ( 7.417 1.713 2.855) 8.130 9.873 ( 3.327 -2.453 8.235) 9.214 9.970 ( 2.816 1.110 9.478) 9.950 10.226 ( -0.434 1.250 -0.493) 1.412 10.328 ( 0.226 1.669 -4.135) 4.465 13.239 ( -4.242 -1.952 -6.302) 7.844 13.300 ( -3.464 0.414 -8.254) 8.962 13.539 ( -1.886 -1.976 -7.264) 7.761 13.597 ( -4.518 -0.352 -4.325) 6.265 14.554 ( -5.715 -0.963 15.162) 16.232 14.999 ( 1.546 -3.239 -8.473) 9.202 18.212 ( 2.785 2.314 2.793) 4.573 18.280 ( -1.122 1.005 2.702) 3.094 18.386 ( 2.789 0.549 5.546) 6.232 18.959 ( -0.214 -2.180 -5.829) 6.227======================= Grid point 578 (287/312) =======================q-point: ( 0.40 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.216 ( 16.784 -1.592 -8.454) 18.860 2.676 ( 16.242 -4.768 -18.430) 25.024 2.881 ( -19.281 -1.510 -2.132) 19.457 2.987 ( -13.901 -7.869 6.538) 17.260 3.687 ( 12.356 8.341 -20.740) 25.542 3.811 ( -6.966 6.460 11.655) 15.037 4.035 ( 9.869 -1.057 3.926) 10.674 4.135 ( -0.329 0.241 10.574) 10.582 4.493 ( 0.744 -2.156 9.250) 9.527 4.592 ( -1.197 3.237 5.607) 6.584 4.773 ( -1.726 0.662 -7.634) 7.855 4.907 ( -5.956 1.776 -9.620) 11.453 5.656 ( 5.768 -5.154 3.835) 8.634 5.773 ( 1.439 -0.382 1.621) 2.201 5.826 ( 0.930 -3.413 2.789) 4.505 5.964 ( -3.230 -2.075 -2.265) 4.458 7.389 ( -0.285 -2.901 -5.434) 6.167 7.632 ( -9.305 -1.000 -10.146) 13.803 7.763 ( 5.324 1.233 2.915) 6.194 7.952 ( -0.823 0.259 -3.650) 3.751 9.565 ( 3.556 1.058 11.718) 12.291 9.763 ( 2.630 1.240 -2.951) 4.143 10.011 ( 3.158 -1.891 7.620) 8.463 10.089 ( 1.143 0.374 6.977) 7.080 10.212 ( 0.164 1.518 -1.777) 2.343 10.280 ( -0.641 1.980 -4.545) 4.999 13.123 ( -2.504 -1.200 -3.578) 4.529 13.165 ( -2.885 0.384 -6.178) 6.830 13.457 ( -0.410 -2.465 -4.600) 5.235 13.490 ( -3.331 -1.333 -2.270) 4.246 14.631 ( -2.773 -0.818 16.031) 16.290 14.901 ( -0.496 -2.207 -12.368) 12.573 18.274 ( 2.433 2.172 -0.087) 3.262 18.292 ( -1.079 1.089 3.934) 4.222 18.529 ( 5.534 0.288 6.536) 8.569 18.859 ( -3.648 -1.623 -6.910) 7.981======================= Grid point 579 (288/312) =======================q-point: ( 0.50 0.09 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.504 ( 18.701 -0.832 0.393) 18.723 2.504 ( -18.702 -0.834 -0.398) 18.724 2.815 ( 16.767 -9.079 -14.901) 24.200 2.815 ( -16.767 -9.079 14.902) 24.200 3.751 ( 12.970 8.933 -15.876) 22.362 3.751 ( -12.969 8.933 15.875) 22.361 4.173 ( 4.634 -1.164 -5.140) 7.018 4.173 ( -4.635 -1.164 5.139) 7.018 4.613 ( 2.410 2.171 -8.299) 8.910 4.613 ( -2.409 2.171 8.300) 8.911 4.721 ( -2.887 -0.160 -3.513) 4.550 4.721 ( 2.886 -0.160 3.511) 4.548 5.762 ( -1.085 -2.447 -3.196) 4.169 5.762 ( 1.084 -2.447 3.196) 4.169 5.890 ( -1.555 -2.801 -3.591) 4.812 5.890 ( 1.556 -2.801 3.590) 4.812 7.420 ( -5.609 -2.976 -2.549) 6.842 7.420 ( 5.609 -2.976 2.549) 6.842 7.881 ( -3.479 1.176 -3.281) 4.925 7.881 ( 3.479 1.176 3.281) 4.924 9.713 ( -1.422 0.809 -8.242) 8.402 9.713 ( 1.422 0.809 8.241) 8.402 10.113 ( -1.375 -1.248 -2.564) 3.166 10.113 ( 1.375 -1.248 2.564) 3.166 10.223 ( -1.218 2.444 -2.664) 3.815 10.223 ( 1.218 2.444 2.664) 3.815 13.093 ( -0.241 -0.261 -1.691) 1.728 13.093 ( 0.239 -0.260 1.690) 1.727 13.439 ( 1.318 -2.167 -1.522) 2.958 13.439 ( -1.319 -2.167 1.521) 2.958 14.759 ( 1.152 -1.249 -16.053) 16.142 14.759 ( -1.153 -1.249 16.052) 16.142 18.300 ( 1.941 1.638 -2.782) 3.767 18.300 ( -1.941 1.638 2.782) 3.767 18.702 ( -5.529 -0.663 -7.156) 9.067 18.702 ( 5.529 -0.662 7.155) 9.067======================= Grid point 585 (289/312) =======================q-point: ( 0.00 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.557 ( -2.185 1.015 -21.713) 21.847 2.557 ( 2.184 1.013 21.713) 21.846 2.880 ( 3.799 8.627 -19.482) 21.643 2.880 ( -3.797 8.627 19.482) 21.642 3.651 ( -3.173 0.208 -7.431) 8.083 3.651 ( 3.174 0.207 7.431) 8.083 4.076 ( 0.825 -1.929 -8.083) 8.351 4.076 ( -0.825 -1.929 8.083) 8.351 4.483 ( 1.894 1.931 -9.206) 9.595 4.483 ( -1.893 1.931 9.205) 9.594 5.014 ( -1.322 -3.869 -3.121) 5.143 5.014 ( 1.322 -3.869 3.121) 5.143 5.646 ( -1.974 3.255 -1.188) 3.988 5.646 ( 1.974 3.254 1.188) 3.987 6.015 ( -3.945 -0.793 -2.202) 4.587 6.015 ( 3.946 -0.793 2.202) 4.588 7.441 ( -0.092 1.894 -1.454) 2.390 7.441 ( 0.092 1.894 1.454) 2.390 8.564 ( -4.544 1.750 -2.222) 5.352 8.564 ( 4.544 1.750 2.222) 5.352 9.263 ( -6.030 -2.109 -4.581) 7.861 9.263 ( 6.031 -2.109 4.581) 7.862 9.443 ( -2.610 1.822 -7.211) 7.882 9.443 ( 2.610 1.821 7.212) 7.883 10.347 ( 1.494 2.903 -3.976) 5.145 10.347 ( -1.494 2.903 3.977) 5.145 13.498 ( 0.255 -2.978 -3.147) 4.340 13.498 ( -0.254 -2.978 3.148) 4.340 13.852 ( 0.278 0.589 -3.705) 3.762 13.852 ( -0.277 0.589 3.705) 3.762 14.683 ( 1.974 -3.574 -5.044) 6.490 14.683 ( -1.973 -3.575 5.044) 6.490 18.093 ( 0.343 1.182 -2.652) 2.924 18.093 ( -0.343 1.182 2.652) 2.924 18.712 ( -8.289 -1.595 -0.834) 8.482 18.712 ( 8.290 -1.595 0.834) 8.483======================= Grid point 587 (290/312) =======================q-point: ( 0.10 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.288 ( -0.983 2.514 -23.727) 23.880 2.679 ( 5.791 5.855 -11.517) 14.159 2.913 ( 2.243 1.695 11.982) 12.308 3.075 ( 2.978 5.128 18.329) 19.264 3.547 ( -0.975 2.098 -3.685) 4.351 3.788 ( 3.152 -0.699 6.700) 7.437 3.992 ( -2.144 -0.821 -0.926) 2.476 4.150 ( 2.531 1.561 -7.575) 8.138 4.392 ( -1.569 -2.183 -0.983) 2.862 4.470 ( -4.245 2.391 -0.267) 4.880 4.966 ( -0.405 -1.731 -3.545) 3.965 5.087 ( 3.593 -6.238 2.077) 7.493 5.568 ( -4.113 6.773 -3.284) 8.577 5.670 ( 0.428 0.937 -0.649) 1.217 5.893 ( -6.140 -4.253 -1.785) 7.679 6.083 ( 1.496 0.136 0.280) 1.528 7.457 ( 2.357 2.145 0.522) 3.229 7.485 ( 1.864 1.846 2.907) 3.916 8.385 ( -7.765 -0.052 -9.733) 12.451 8.555 ( -3.473 2.275 -7.941) 8.961 9.156 ( -2.424 -0.121 2.900) 3.782 9.362 ( 4.583 -1.010 -0.691) 4.744 9.498 ( 5.662 0.472 8.250) 10.018 9.624 ( 5.484 1.223 11.114) 12.453 10.309 ( -1.463 2.893 -0.782) 3.335 10.379 ( 1.424 2.712 -0.255) 3.074 13.440 ( -1.612 -3.062 -5.864) 6.809 13.490 ( -2.166 -2.635 -0.347) 3.428 13.775 ( -2.365 -0.027 -7.442) 7.809 13.833 ( -3.281 0.379 -0.826) 3.404 14.570 ( -7.583 -2.162 5.268) 9.483 14.815 ( 7.364 -4.872 -1.297) 8.924 18.096 ( 0.973 1.224 2.202) 2.701 18.157 ( 2.879 1.685 3.844) 5.089 18.543 ( -8.122 0.107 -1.789) 8.317 18.848 ( 6.399 -3.164 -1.266) 7.250======================= Grid point 588 (291/312) =======================q-point: ( 0.20 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.091 ( 4.249 1.451 -21.362) 21.829 2.661 ( 10.849 8.025 -22.308) 26.072 3.005 ( -9.049 -7.622 15.917) 19.832 3.289 ( 2.903 1.329 10.115) 10.607 3.583 ( 6.734 4.053 0.590) 7.882 3.867 ( 1.615 2.954 0.506) 3.404 3.977 ( -5.111 0.397 8.577) 9.992 4.013 ( 2.114 4.267 -20.038) 20.596 4.328 ( -6.955 -2.797 5.108) 9.071 4.509 ( 4.968 0.058 4.629) 6.790 4.924 ( -0.053 -0.376 -4.280) 4.297 5.184 ( 5.345 -7.976 1.497) 9.718 5.424 ( -6.736 8.922 -5.868) 12.626 5.662 ( -0.639 -2.134 0.227) 2.239 5.785 ( -3.795 -6.189 -0.607) 7.285 6.076 ( -1.848 -0.813 -0.912) 2.215 7.524 ( 2.375 2.349 0.533) 3.383 7.547 ( 2.555 1.772 2.833) 4.206 8.132 ( -6.350 -1.639 -12.478) 14.097 8.308 ( -10.022 0.912 -13.904) 17.163 9.233 ( 2.453 1.793 10.344) 10.781 9.504 ( 8.142 0.535 4.613) 9.374 9.681 ( 4.919 -0.866 7.777) 9.242 9.826 ( 4.796 1.077 9.912) 11.064 10.281 ( -0.712 2.805 -0.854) 3.017 10.389 ( 0.411 2.438 -1.296) 2.791 13.331 ( -3.136 -2.791 -7.144) 8.286 13.416 ( -3.596 -1.974 -3.673) 5.506 13.635 ( -3.621 -1.392 -8.926) 9.732 13.725 ( -5.343 -0.561 -4.202) 6.820 14.519 ( -5.455 -1.036 8.601) 10.237 14.908 ( 4.406 -5.398 -2.379) 7.362 18.165 ( 2.378 1.787 4.910) 5.741 18.260 ( 3.469 2.297 4.307) 5.988 18.403 ( -5.021 1.329 -0.759) 5.250 18.913 ( 3.269 -4.105 -3.543) 6.331======================= Grid point 589 (292/312) =======================q-point: ( 0.30 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.041 ( 10.590 -1.034 -15.896) 19.129 2.625 ( 11.798 2.956 -27.101) 29.705 2.920 ( -15.639 -10.677 15.074) 24.203 3.253 ( -10.149 -0.928 -7.198) 12.477 3.754 ( 11.094 0.907 -2.410) 11.389 3.876 ( 0.962 7.943 -2.546) 8.396 3.930 ( 2.412 7.560 1.366) 8.052 4.024 ( 3.482 -0.536 4.038) 5.359 4.337 ( -2.643 -3.777 12.438) 13.265 4.623 ( 0.705 3.198 6.510) 7.287 4.875 ( -0.084 1.120 -5.778) 5.886 5.192 ( -5.955 3.065 -11.759) 13.532 5.350 ( 5.992 -5.760 5.880) 10.181 5.668 ( -0.542 -5.101 4.117) 6.577 5.744 ( -0.269 -4.443 -0.746) 4.513 6.006 ( -4.187 -2.403 -1.432) 5.036 7.472 ( -4.025 0.220 -6.342) 7.515 7.661 ( 5.305 1.886 3.369) 6.561 7.926 ( -9.096 -1.276 -11.853) 14.995 8.004 ( -3.671 -0.952 -8.765) 9.550 9.409 ( 4.001 2.420 12.169) 13.037 9.706 ( 7.884 2.005 3.568) 8.883 9.823 ( 3.066 -2.233 7.244) 8.177 9.986 ( 3.350 0.591 7.373) 8.120 10.265 ( -0.106 2.820 -0.903) 2.963 10.369 ( -0.546 2.406 -2.311) 3.381 13.199 ( -3.499 -2.145 -6.392) 7.596 13.296 ( -3.976 -0.886 -5.971) 7.228 13.488 ( -3.212 -3.128 -7.229) 8.506 13.576 ( -5.537 -2.003 -4.938) 7.685 14.538 ( -2.952 -0.380 10.818) 11.220 14.920 ( 0.927 -4.660 -5.120) 6.985 18.261 ( 1.375 2.188 6.523) 7.016 18.308 ( 0.436 2.238 -1.563) 2.764 18.410 ( 3.109 2.083 5.522) 6.670 18.898 ( 0.018 -4.062 -5.372) 6.735======================= Grid point 590 (293/312) =======================q-point: ( 0.40 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.169 ( 15.864 -3.352 -7.408) 17.826 2.586 ( 13.720 -3.843 -26.496) 30.084 2.766 ( -18.091 -10.928 17.656) 27.540 2.879 ( -17.994 -2.294 -10.086) 20.755 3.878 ( 5.372 9.998 -3.166) 11.783 3.908 ( 8.170 1.504 -9.412) 12.553 4.052 ( 2.352 4.863 10.373) 11.695 4.145 ( 1.742 1.104 6.718) 7.027 4.448 ( 1.217 -1.986 13.696) 13.892 4.671 ( -1.578 4.658 6.270) 7.969 4.804 ( -0.622 2.437 -7.110) 7.542 4.938 ( -7.878 1.251 -12.603) 14.915 5.544 ( 7.745 -6.267 5.006) 11.150 5.727 ( 0.796 -5.236 6.307) 8.235 5.742 ( 0.887 -4.332 -1.762) 4.760 5.906 ( -4.880 -3.949 -1.472) 6.448 7.335 ( -1.275 -2.442 -6.843) 7.376 7.589 ( -11.639 -3.201 -9.733) 15.506 7.798 ( 4.771 2.042 3.275) 6.136 7.951 ( 0.072 -0.437 -3.089) 3.120 9.596 ( 3.654 2.200 10.719) 11.537 9.796 ( 1.864 2.235 -3.272) 4.379 9.968 ( 3.872 -2.475 8.143) 9.350 10.086 ( 1.351 -0.647 3.356) 3.675 10.260 ( 0.403 3.269 -0.424) 3.321 10.328 ( -1.034 2.823 -2.788) 4.101 13.099 ( -1.716 -1.265 -3.205) 3.849 13.168 ( -3.360 -0.146 -5.524) 6.468 13.392 ( -1.273 -4.263 -3.525) 5.676 13.445 ( -3.965 -3.376 -3.265) 6.147 14.617 ( -0.605 -0.420 11.469) 11.493 14.849 ( -1.132 -2.989 -8.256) 8.853 18.313 ( 0.863 1.246 1.218) 1.944 18.331 ( 0.519 3.238 2.604) 4.188 18.542 ( 4.742 1.217 5.748) 7.551 18.815 ( -2.662 -2.847 -6.284) 7.394======================= Grid point 591 (294/312) =======================q-point: ( 0.50 0.18 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.464 ( 17.825 -4.402 2.978) 18.600 2.464 ( -17.827 -4.408 -2.980) 18.604 2.634 ( 16.861 -7.851 -22.120) 28.900 2.634 ( -16.860 -7.848 22.118) 28.897 3.926 ( 2.277 7.263 -5.090) 9.156 3.926 ( -2.277 7.263 5.089) 9.156 4.164 ( 2.488 1.644 -5.663) 6.401 4.164 ( -2.489 1.644 5.664) 6.401 4.655 ( -5.930 1.356 -11.115) 12.671 4.655 ( 5.929 1.356 11.115) 12.671 4.732 ( 1.299 2.076 -4.821) 5.407 4.732 ( -1.300 2.076 4.820) 5.407 5.695 ( -2.591 -4.391 -4.292) 6.665 5.695 ( 2.591 -4.392 4.292) 6.665 5.812 ( -1.347 -5.291 -4.576) 7.124 5.812 ( 1.347 -5.291 4.576) 7.124 7.353 ( -6.547 -3.680 -1.720) 7.705 7.353 ( 6.547 -3.680 1.720) 7.705 7.900 ( -2.170 0.666 -3.476) 4.152 7.900 ( 2.169 0.666 3.476) 4.151 9.739 ( -1.425 1.908 -7.886) 8.238 9.739 ( 1.424 1.908 7.886) 8.237 10.083 ( -1.720 -1.867 -3.449) 4.282 10.083 ( 1.720 -1.867 3.449) 4.282 10.282 ( -1.077 3.474 -2.058) 4.179 10.282 ( 1.077 3.474 2.058) 4.179 13.086 ( -1.014 -0.428 -1.840) 2.144 13.086 ( 1.012 -0.428 1.838) 2.142 13.377 ( 1.495 -4.223 -3.429) 5.641 13.377 ( -1.495 -4.223 3.428) 5.640 14.733 ( 1.582 -1.341 -13.471) 13.630 14.733 ( -1.582 -1.341 13.471) 13.630 18.339 ( 2.236 2.197 -3.795) 4.922 18.339 ( -2.236 2.197 3.795) 4.922 18.687 ( -4.100 -0.747 -6.437) 7.668 18.687 ( 4.099 -0.747 6.437) 7.668======================= Grid point 597 (295/312) =======================q-point: ( 0.00 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.577 ( -0.504 0.774 -20.125) 20.146 2.577 ( 0.504 0.773 20.125) 20.146 3.055 ( 4.443 9.504 -15.868) 19.023 3.055 ( -4.441 9.503 15.868) 19.021 3.658 ( -2.419 0.616 -5.065) 5.647 3.658 ( 2.420 0.616 5.065) 5.648 4.059 ( 0.525 -0.290 -11.234) 11.250 4.059 ( -0.525 -0.290 11.234) 11.250 4.479 ( -1.821 -1.881 -4.402) 5.122 4.479 ( 1.821 -1.881 4.402) 5.122 4.974 ( 3.096 -0.699 -7.002) 7.688 4.974 ( -3.096 -0.700 7.002) 7.687 5.632 ( -1.358 -3.943 -0.115) 4.172 5.632 ( 1.359 -3.943 0.115) 4.172 6.050 ( -3.601 3.923 -4.318) 6.856 6.051 ( 3.603 3.923 4.319) 6.857 7.475 ( -0.075 1.581 -1.123) 1.941 7.475 ( 0.075 1.581 1.123) 1.941 8.613 ( -5.337 3.358 -2.292) 6.709 8.613 ( 5.338 3.358 2.292) 6.710 9.211 ( -4.412 -3.236 -2.800) 6.146 9.211 ( 4.412 -3.236 2.800) 6.147 9.484 ( -2.030 2.394 -4.628) 5.592 9.484 ( 2.030 2.394 4.629) 5.593 10.410 ( 1.345 3.560 -4.093) 5.589 10.410 ( -1.345 3.561 4.093) 5.589 13.429 ( 1.181 -4.082 -4.619) 6.276 13.429 ( -1.180 -4.082 4.619) 6.276 13.854 ( 0.099 -0.499 -3.288) 3.327 13.854 ( -0.098 -0.499 3.288) 3.327 14.629 ( 0.163 -1.818 -4.522) 4.877 14.629 ( -0.162 -1.818 4.523) 4.877 18.111 ( 0.809 0.651 -2.568) 2.770 18.111 ( -0.809 0.651 2.568) 2.770 18.682 ( -5.717 -1.394 -1.539) 6.082 18.682 ( 5.717 -1.394 1.539) 6.083======================= Grid point 599 (296/312) =======================q-point: ( 0.10 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.344 ( -0.978 3.067 -22.498) 22.727 2.735 ( -0.366 -1.114 11.124) 11.185 2.991 ( 2.225 7.672 -10.226) 12.976 3.184 ( 1.470 6.137 13.049) 14.494 3.610 ( 1.650 4.362 -1.915) 5.042 3.761 ( 2.451 -2.469 5.249) 6.297 3.998 ( 3.130 1.073 -7.006) 7.748 4.191 ( 1.188 1.944 9.566) 9.833 4.341 ( -4.243 -2.170 -5.083) 6.968 4.479 ( -3.614 -1.164 -2.164) 4.371 4.954 ( 2.610 -0.157 -7.617) 8.053 4.995 ( -0.913 -3.383 5.586) 6.595 5.594 ( -2.345 -3.749 -0.193) 4.427 5.647 ( 0.541 -3.706 -0.827) 3.836 5.880 ( -8.660 3.900 -6.263) 11.377 6.107 ( -0.552 1.909 1.036) 2.241 7.496 ( 2.219 1.857 1.482) 3.251 7.518 ( 1.882 1.548 2.931) 3.811 8.407 ( -9.399 2.453 -10.009) 13.948 8.596 ( -4.646 1.952 -8.950) 10.271 9.150 ( -0.394 -0.436 4.358) 4.397 9.318 ( 5.275 -3.215 2.525) 6.673 9.533 ( 5.204 2.877 5.463) 8.075 9.647 ( 5.976 1.136 9.476) 11.261 10.375 ( -1.043 3.810 -1.570) 4.250 10.435 ( 0.422 3.011 0.720) 3.124 13.375 ( -1.121 -3.693 -6.144) 7.256 13.424 ( -2.963 -4.178 1.669) 5.387 13.770 ( -3.157 -0.563 -7.473) 8.132 13.827 ( -3.585 -1.059 -1.727) 4.118 14.548 ( -4.259 0.027 1.905) 4.666 14.729 ( 4.709 -3.803 1.020) 6.138 18.116 ( 0.672 0.897 3.532) 3.706 18.185 ( 4.170 1.085 2.845) 5.164 18.554 ( -5.700 1.000 -2.536) 6.319 18.780 ( 4.215 -3.705 -0.499) 5.634======================= Grid point 600 (297/312) =======================q-point: ( 0.20 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.134 ( 2.151 2.910 -21.029) 21.338 2.771 ( -3.855 -3.339 3.209) 6.025 2.896 ( -0.781 3.297 -12.303) 12.761 3.326 ( 0.994 2.680 7.326) 7.863 3.661 ( 5.904 3.406 -4.014) 7.910 3.859 ( 2.795 -3.271 6.248) 7.586 4.018 ( 4.153 2.910 -3.929) 6.415 4.124 ( -5.660 6.329 -5.334) 10.027 4.296 ( -7.401 0.750 8.419) 11.234 4.493 ( 7.252 -1.652 4.532) 8.710 4.928 ( 2.343 0.112 -6.666) 7.067 5.052 ( 1.710 -5.754 4.446) 7.470 5.551 ( -2.605 -2.410 0.624) 3.603 5.609 ( -7.709 4.102 -6.411) 10.833 5.660 ( -2.938 -6.655 -2.055) 7.559 6.060 ( -4.416 -1.022 -0.632) 4.576 7.569 ( 0.898 2.139 1.298) 2.658 7.580 ( 3.001 1.546 3.585) 4.925 8.120 ( -8.052 0.516 -12.845) 15.169 8.316 ( -11.306 -0.046 -14.443) 18.342 9.269 ( 3.944 1.896 10.334) 11.222 9.487 ( 7.745 -2.231 6.887) 10.602 9.697 ( 5.668 2.399 5.273) 8.105 9.843 ( 5.307 0.702 8.269) 9.850 10.345 ( -0.556 3.758 -1.331) 4.026 10.437 ( -0.541 2.450 -0.161) 2.514 13.275 ( -2.534 -2.982 -6.890) 7.924 13.359 ( -4.546 -3.896 -0.439) 6.003 13.608 ( -4.720 -1.305 -9.655) 10.826 13.699 ( -5.925 -2.123 -5.709) 8.497 14.518 ( -2.417 1.097 4.566) 5.282 14.808 ( 2.817 -4.805 0.474) 5.590 18.195 ( 2.155 1.425 6.187) 6.704 18.302 ( 4.793 1.869 2.976) 5.943 18.444 ( -3.474 2.814 -1.245) 4.640 18.822 ( 2.111 -5.219 -2.728) 6.256======================= Grid point 601 (298/312) =======================q-point: ( 0.30 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.033 ( 7.760 0.342 -16.992) 18.683 2.668 ( -5.702 -4.736 -4.620) 8.734 2.731 ( -4.717 -2.374 -9.418) 10.797 3.231 ( -11.984 -1.485 -8.813) 14.949 3.753 ( 10.655 -1.008 -6.722) 12.638 3.957 ( -2.817 0.197 11.762) 12.096 4.077 ( 7.677 4.828 -5.235) 10.472 4.081 ( 4.475 7.964 2.442) 9.456 4.314 ( -3.104 3.029 13.918) 14.578 4.671 ( 3.349 1.549 7.981) 8.792 4.905 ( 2.065 1.524 -6.836) 7.302 5.135 ( 3.090 -6.532 -1.992) 7.496 5.350 ( -8.385 2.939 -2.594) 9.256 5.545 ( -1.375 -6.641 4.550) 8.167 5.648 ( 0.910 -5.385 -1.407) 5.640 5.949 ( -6.459 -3.649 -1.078) 7.496 7.490 ( -6.194 1.659 -6.892) 9.414 7.681 ( 2.836 0.109 2.711) 3.925 7.905 ( -7.634 -0.719 -9.768) 12.418 7.985 ( -5.086 -0.971 -9.418) 10.748 9.460 ( 4.718 2.734 11.260) 12.511 9.710 ( 7.702 -1.943 8.202) 11.418 9.820 ( 3.431 2.197 2.252) 4.655 9.992 ( 3.596 0.058 5.192) 6.316 10.329 ( -0.156 3.632 -0.676) 3.698 10.415 ( -1.080 2.275 -1.020) 2.717 13.159 ( -2.896 -1.982 -5.711) 6.704 13.261 ( -4.482 -2.886 -2.066) 5.717 13.429 ( -4.667 -2.767 -8.287) 9.905 13.521 ( -5.896 -3.481 -7.166) 9.911 14.548 ( -0.451 1.396 6.457) 6.621 14.833 ( 0.338 -4.228 -1.361) 4.454 18.288 ( 0.438 1.125 6.078) 6.197 18.366 ( 2.278 3.261 -2.096) 4.496 18.461 ( 2.837 2.976 5.340) 6.740 18.808 ( 0.281 -5.225 -4.300) 6.773======================= Grid point 602 (299/312) =======================q-point: ( 0.40 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.094 ( 14.080 -3.982 -10.935) 18.267 2.516 ( -8.411 -8.398 0.851) 11.916 2.571 ( -1.677 -3.669 -9.106) 9.960 2.839 ( -16.695 -2.303 -10.168) 19.683 3.883 ( 11.519 -2.144 -9.876) 15.324 4.001 ( -6.218 0.878 12.644) 14.118 4.195 ( 8.462 8.658 -2.613) 12.386 4.216 ( 4.497 6.639 4.046) 8.982 4.441 ( 1.602 1.906 14.766) 14.975 4.755 ( -1.751 3.616 7.423) 8.441 4.857 ( 0.721 2.887 -8.347) 8.861 4.954 ( -8.684 0.566 -12.259) 15.034 5.427 ( 7.301 -5.694 6.874) 11.532 5.599 ( 0.720 -7.415 6.969) 10.202 5.652 ( 1.272 -5.097 -2.632) 5.875 5.815 ( -6.830 -5.416 -0.927) 8.766 7.303 ( -3.309 -0.819 -7.894) 8.599 7.521 ( -11.907 -3.727 -9.369) 15.603 7.831 ( 3.094 1.388 2.527) 4.229 7.936 ( 0.415 -1.040 -2.161) 2.434 9.646 ( 3.979 2.826 9.674) 10.835 9.847 ( 1.317 2.905 -3.247) 4.552 9.919 ( 4.398 -2.647 8.297) 9.756 10.068 ( 1.243 -1.111 0.715) 1.814 10.328 ( 0.264 3.634 0.473) 3.674 10.382 ( -1.031 2.654 -1.589) 3.261 13.076 ( -1.245 -1.033 -2.391) 2.887 13.158 ( -3.426 -0.894 -3.901) 5.268 13.301 ( -2.943 -4.915 -2.269) 6.161 13.365 ( -3.578 -4.666 -6.057) 8.441 14.621 ( 1.108 0.886 6.902) 7.046 14.796 ( -1.461 -2.461 -3.814) 4.769 18.332 ( 0.947 0.888 2.272) 2.617 18.391 ( 0.135 2.748 0.831) 2.874 18.576 ( 3.772 2.120 4.549) 6.278 18.755 ( -1.107 -3.170 -4.591) 5.688======================= Grid point 603 (300/312) =======================q-point: ( 0.50 0.27 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.315 ( 10.422 -9.601 -8.531) 16.541 2.315 ( -10.423 -9.601 8.534) 16.542 2.558 ( 10.434 -1.309 -12.683) 16.476 2.558 ( -10.436 -1.309 12.675) 16.471 3.972 ( 9.852 -1.319 -11.927) 15.526 3.972 ( -9.853 -1.319 11.926) 15.526 4.277 ( 6.015 8.803 -10.692) 15.100 4.277 ( -6.015 8.804 10.692) 15.100 4.661 ( -6.146 -0.112 -14.567) 15.811 4.661 ( 6.145 -0.113 14.566) 15.810 4.801 ( 2.207 4.390 -9.230) 10.456 4.801 ( -2.208 4.390 9.229) 10.456 5.602 ( -3.052 -5.148 -5.951) 8.440 5.602 ( 3.052 -5.148 5.950) 8.439 5.693 ( -1.204 -6.943 -5.776) 9.111 5.693 ( 1.204 -6.943 5.776) 9.111 7.288 ( -5.990 -3.020 -1.237) 6.822 7.288 ( 5.990 -3.020 1.237) 6.822 7.905 ( -1.028 -0.139 -2.994) 3.168 7.905 ( 1.028 -0.138 2.993) 3.168 9.785 ( -1.476 2.780 -7.459) 8.096 9.785 ( 1.476 2.780 7.459) 8.096 10.044 ( -1.846 -2.149 -4.517) 5.332 10.044 ( 1.846 -2.149 4.517) 5.332 10.349 ( -0.511 3.313 -1.823) 3.815 10.349 ( 0.510 3.313 1.823) 3.815 13.078 ( -1.427 -0.433 -2.101) 2.577 13.078 ( 1.425 -0.432 2.100) 2.574 13.283 ( 1.574 -5.355 -5.346) 7.729 13.283 ( -1.574 -5.355 5.345) 7.728 14.714 ( 1.663 -0.493 -9.771) 9.924 14.714 ( -1.663 -0.493 9.771) 9.924 18.375 ( 1.183 1.358 -3.640) 4.061 18.375 ( -1.183 1.358 3.640) 4.061 18.678 ( -2.267 -0.039 -4.572) 5.104 18.678 ( 2.267 -0.039 4.572) 5.103======================= Grid point 609 (301/312) =======================q-point: ( 0.00 0.36 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.583 ( 0.527 -0.135 -15.123) 15.132 2.583 ( -0.527 -0.135 15.122) 15.132 3.235 ( 4.735 8.897 -11.961) 15.641 3.235 ( -4.734 8.895 11.960) 15.638 3.676 ( 1.574 1.227 -5.062) 5.441 3.676 ( -1.573 1.226 5.062) 5.441 4.034 ( -0.466 -3.015 -7.839) 8.412 4.034 ( 0.467 -3.016 7.839) 8.412 4.454 ( 2.939 0.320 -3.978) 4.956 4.454 ( -2.938 0.319 3.978) 4.956 4.959 ( 4.890 -1.496 -8.726) 10.114 4.959 ( -4.890 -1.496 8.726) 10.114 5.544 ( -0.990 -4.243 -0.118) 4.358 5.544 ( 0.990 -4.242 0.118) 4.358 6.130 ( -1.992 3.706 -3.594) 5.533 6.130 ( 1.994 3.706 3.594) 5.534 7.500 ( -0.067 0.956 -0.699) 1.186 7.500 ( 0.067 0.956 0.699) 1.186 8.686 ( -4.583 3.991 -1.982) 6.392 8.686 ( 4.583 3.991 1.982) 6.392 9.144 ( -3.118 -3.538 -1.690) 5.010 9.144 ( 3.119 -3.538 1.690) 5.010 9.528 ( -1.187 2.064 -2.568) 3.502 9.528 ( 1.187 2.064 2.568) 3.502 10.475 ( 0.981 3.015 -3.055) 4.403 10.475 ( -0.981 3.015 3.055) 4.403 13.351 ( 1.572 -3.764 -4.358) 5.969 13.351 ( -1.572 -3.764 4.358) 5.969 13.836 ( 0.034 -1.190 -2.119) 2.431 13.836 ( -0.033 -1.189 2.120) 2.431 14.615 ( -0.206 0.119 -3.120) 3.129 14.615 ( 0.207 0.120 3.121) 3.130 18.117 ( 0.938 0.005 -1.884) 2.105 18.117 ( -0.938 0.005 1.884) 2.105 18.661 ( -3.067 -0.806 -1.439) 3.483 18.661 ( 3.067 -0.806 1.440) 3.483======================= Grid point 611 (302/312) =======================q-point: ( 0.10 0.36 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.403 ( -1.412 3.104 -18.393) 18.707 2.662 ( -4.939 -5.416 10.199) 12.560 3.190 ( 3.484 12.006 -12.616) 17.760 3.305 ( 0.937 6.512 8.286) 10.581 3.688 ( 1.267 -1.929 4.279) 4.862 3.700 ( 1.775 1.043 -3.838) 4.355 3.999 ( 1.856 -1.625 -1.963) 3.153 4.169 ( 4.563 -4.204 8.538) 10.554 4.368 ( -5.507 4.772 0.681) 7.319 4.468 ( -0.269 1.119 -3.023) 3.234 4.930 ( 0.099 -2.750 -4.018) 4.870 4.944 ( -1.779 -2.510 1.468) 3.408 5.509 ( -2.249 -3.848 -0.578) 4.494 5.551 ( 0.103 -4.994 -0.801) 5.059 5.984 ( -8.012 5.676 -6.139) 11.580 6.136 ( -3.217 0.764 -0.065) 3.307 7.526 ( 2.034 1.234 2.226) 3.258 7.541 ( 1.944 0.798 2.949) 3.622 8.473 ( -10.418 4.171 -10.419) 15.313 8.622 ( -7.073 0.594 -10.315) 12.521 9.143 ( 2.284 -0.156 5.859) 6.291 9.252 ( 5.480 -3.542 4.252) 7.788 9.593 ( 5.423 3.106 4.861) 7.917 9.665 ( 6.107 0.648 7.766) 9.900 10.447 ( -0.926 3.494 -1.484) 3.908 10.487 ( -0.381 2.240 0.797) 2.408 13.307 ( -1.150 -3.141 -4.851) 5.893 13.340 ( -2.975 -4.180 1.484) 5.341 13.757 ( -3.559 -0.642 -6.708) 7.621 13.797 ( -3.510 -1.845 -3.354) 5.194 14.569 ( -1.958 1.857 0.328) 2.718 14.673 ( 2.188 -2.079 2.022) 3.633 18.133 ( 1.343 0.903 3.813) 4.142 18.194 ( 5.103 -0.199 2.114) 5.527 18.579 ( -3.615 1.626 -2.123) 4.496 18.712 ( 1.686 -3.315 -0.096) 3.720======================= Grid point 612 (303/312) =======================q-point: ( 0.20 0.36 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.200 ( -0.159 4.052 -18.441) 18.882 2.605 ( -10.052 -9.897 7.314) 15.890 3.071 ( 0.447 11.068 -20.680) 23.460 3.393 ( -1.612 4.123 4.088) 6.026 3.666 ( 3.810 -3.623 -9.419) 10.787 3.797 ( 3.523 -3.109 6.905) 8.352 4.042 ( 1.773 0.935 3.399) 3.946 4.223 ( -1.529 2.925 -3.742) 4.989 4.382 ( -1.682 6.793 12.667) 14.472 4.474 ( 6.325 1.314 1.961) 6.751 4.903 ( 3.253 -3.077 -6.820) 8.159 4.955 ( -1.381 -4.783 6.592) 8.261 5.453 ( -3.396 -4.333 -0.290) 5.513 5.531 ( -1.383 -6.151 -1.728) 6.537 5.744 ( -9.856 7.020 -6.926) 13.943 6.028 ( -7.085 -2.499 -1.694) 7.702 7.601 ( 0.341 1.138 2.817) 3.058 7.605 ( 3.019 1.000 3.293) 4.578 8.151 ( -10.268 2.621 -13.603) 17.243 8.304 ( -12.285 -1.243 -14.803) 19.276 9.304 ( 5.460 1.786 10.080) 11.602 9.434 ( 7.430 -2.954 8.078) 11.366 9.755 ( 6.052 3.253 4.510) 8.219 9.851 ( 5.677 0.083 6.697) 8.780 10.417 ( -0.820 3.502 -1.178) 3.785 10.477 ( -1.227 1.583 0.208) 2.014 13.221 ( -2.366 -2.396 -5.446) 6.403 13.277 ( -4.701 -4.232 0.479) 6.344 13.589 ( -5.351 -0.606 -9.769) 11.156 13.652 ( -5.979 -2.546 -7.583) 9.986 14.557 ( -0.725 2.711 2.442) 3.720 14.729 ( 1.440 -3.493 2.150) 4.347 18.225 ( 3.033 1.886 5.548) 6.598 18.324 ( 5.962 0.281 2.318) 6.403 18.504 ( -2.490 3.233 -0.701) 4.140 18.721 ( 0.461 -5.104 -1.687) 5.395======================= Grid point 613 (304/312) =======================q-point: ( 0.30 0.36 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.059 ( 3.737 2.520 -15.946) 16.571 2.467 ( -12.475 -11.102 7.693) 18.387 2.818 ( -2.286 6.558 -24.031) 25.014 3.186 ( -14.004 -3.525 -12.336) 18.992 3.733 ( 9.509 -0.345 -4.893) 10.699 3.919 ( 0.090 -3.942 9.133) 9.948 4.151 ( 6.154 4.353 4.742) 8.906 4.229 ( 3.377 6.300 1.670) 7.340 4.452 ( -0.617 9.712 9.366) 13.507 4.682 ( 7.252 -0.048 6.844) 9.971 4.912 ( 4.026 -1.202 -6.064) 7.377 5.012 ( 0.970 -6.160 4.505) 7.693 5.354 ( -7.794 -2.620 -1.833) 8.424 5.446 ( -4.582 -4.406 1.851) 6.620 5.589 ( -0.967 0.985 -3.080) 3.376 5.866 ( -8.184 -4.909 -1.775) 9.707 7.531 ( -7.349 2.492 -6.407) 10.063 7.667 ( -1.088 -1.500 0.175) 1.861 7.902 ( -6.000 0.385 -7.984) 9.994 7.966 ( -5.669 -1.113 -9.479) 11.101 9.511 ( 5.605 2.541 10.449) 12.127 9.659 ( 7.212 -2.869 9.347) 12.149 9.878 ( 3.818 3.248 1.242) 5.164 9.989 ( 3.686 -0.481 3.379) 5.024 10.396 ( -0.563 3.212 -0.344) 3.279 10.451 ( -1.386 1.384 -0.292) 1.981 13.125 ( -2.569 -1.488 -4.289) 5.216 13.192 ( -4.715 -3.858 0.643) 6.126 13.390 ( -5.334 -1.204 -9.787) 11.211 13.454 ( -5.894 -3.295 -9.298) 11.491 14.589 ( 0.632 2.727 3.911) 4.809 14.761 ( 0.164 -3.316 1.195) 3.528 18.317 ( 1.101 2.061 3.783) 4.447 18.414 ( 2.830 1.422 -1.257) 3.408 18.518 ( 2.252 2.859 4.687) 5.934 18.707 ( 0.478 -5.066 -2.259) 5.568======================= Grid point 614 (305/312) =======================q-point: ( 0.40 0.36 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.036 ( 9.051 -1.625 -12.016) 15.132 2.311 ( -13.830 -10.424 9.490) 19.748 2.586 ( 1.112 2.561 -18.038) 18.253 2.787 ( -14.113 -3.083 -10.703) 17.979 3.851 ( 8.756 -0.901 -6.104) 10.712 3.963 ( -4.829 -3.400 8.943) 10.717 4.332 ( 7.260 5.041 4.206) 9.788 4.345 ( 5.657 5.752 3.549) 8.814 4.543 ( 0.559 8.529 8.493) 12.049 4.797 ( 0.864 0.997 -0.057) 1.320 4.904 ( 2.325 1.573 -7.797) 8.287 4.958 ( -7.671 -0.553 -3.427) 8.420 5.333 ( 4.674 -3.861 7.838) 9.909 5.457 ( -0.646 -7.000 8.387) 10.943 5.568 ( 1.127 -3.101 -3.859) 5.078 5.706 ( -7.546 -5.803 -1.641) 9.660 7.304 ( -5.768 0.851 -8.602) 10.391 7.450 ( -11.321 -3.629 -9.282) 15.083 7.853 ( 1.838 1.002 1.488) 2.568 7.914 ( 0.455 -1.187 -1.282) 1.805 9.700 ( 4.476 2.858 8.906) 10.369 9.861 ( 5.130 -2.598 7.069) 9.112 9.911 ( 0.507 2.993 -1.620) 3.441 10.045 ( 1.002 -1.384 -1.039) 2.000 10.391 ( -0.113 2.845 0.665) 2.924 10.425 ( -0.937 1.693 -0.690) 2.054 13.060 ( -1.116 -0.630 -1.146) 1.719 13.128 ( -2.975 -2.369 0.378) 3.822 13.223 ( -4.112 -2.723 -5.070) 7.073 13.279 ( -3.232 -4.063 -8.351) 9.833 14.649 ( 1.495 1.864 3.957) 4.623 14.755 ( -1.064 -1.800 -0.671) 2.196 18.351 ( 0.759 1.200 1.524) 2.082 18.425 ( -0.571 0.585 -0.822) 1.159 18.617 ( 3.086 2.047 3.635) 5.189 18.702 ( 0.739 -2.206 -1.488) 2.762======================= Grid point 615 (306/312) =======================q-point: ( 0.50 0.36 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.147 ( 12.820 -7.337 -9.937) 17.803 2.147 ( -12.820 -7.338 9.937) 17.803 2.547 ( 5.100 -0.180 -6.600) 8.343 2.547 ( -5.102 -0.181 6.594) 8.340 3.930 ( 7.418 -2.292 -7.793) 11.000 3.930 ( -7.419 -2.292 7.792) 11.000 4.435 ( 2.530 6.604 -6.789) 9.804 4.435 ( -2.531 6.605 6.789) 9.804 4.672 ( -2.842 1.749 -13.657) 14.059 4.672 ( 2.841 1.749 13.656) 14.058 4.878 ( 4.794 3.168 -9.969) 11.507 4.878 ( -4.794 3.169 9.969) 11.507 5.509 ( -2.777 -4.302 -6.909) 8.600 5.509 ( 2.776 -4.302 6.909) 8.599 5.559 ( -1.268 -6.567 -6.739) 9.495 5.559 ( 1.268 -6.567 6.740) 9.495 7.240 ( -4.070 -1.910 -0.868) 4.579 7.240 ( 4.070 -1.910 0.868) 4.579 7.899 ( -0.372 -0.359 -2.004) 2.070 7.899 ( 0.372 -0.359 2.004) 2.070 9.841 ( -1.528 2.926 -7.228) 7.946 9.841 ( 1.528 2.926 7.228) 7.946 10.002 ( -1.726 -2.174 -5.756) 6.390 10.002 ( 1.726 -2.174 5.755) 6.390 10.403 ( -0.141 2.299 -1.293) 2.641 10.403 ( 0.141 2.299 1.293) 2.641 13.071 ( -1.353 -0.199 -2.547) 2.891 13.071 ( 1.351 -0.198 2.546) 2.889 13.184 ( 1.108 -4.658 -5.815) 7.533 13.184 ( -1.108 -4.658 5.814) 7.532 14.713 ( 1.239 0.203 -5.787) 5.922 14.713 ( -1.240 0.203 5.787) 5.922 18.389 ( -0.327 0.207 -2.647) 2.675 18.389 ( 0.327 0.207 2.647) 2.675 18.685 ( -0.927 0.623 -2.192) 2.460 18.685 ( 0.927 0.624 2.192) 2.460======================= Grid point 621 (307/312) =======================q-point: ( 0.00 0.45 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.578 ( 0.384 -0.230 -5.639) 5.657 2.578 ( -0.384 -0.230 5.639) 5.657 3.370 ( 3.278 4.313 -5.350) 7.614 3.370 ( -3.277 4.312 5.348) 7.611 3.703 ( 1.397 1.309 -3.163) 3.697 3.703 ( -1.396 1.313 3.166) 3.701 3.956 ( -1.136 -3.650 -3.433) 5.138 3.956 ( 1.137 -3.648 3.431) 5.136 4.486 ( 2.480 1.879 -4.374) 5.368 4.486 ( -2.480 1.878 4.374) 5.368 4.919 ( 2.602 -1.840 -4.694) 5.674 4.919 ( -2.602 -1.840 4.694) 5.673 5.489 ( -0.373 -1.379 -0.034) 1.429 5.489 ( 0.373 -1.378 0.034) 1.428 6.180 ( -0.609 1.368 -1.358) 2.021 6.180 ( 0.611 1.368 1.359) 2.023 7.512 ( -0.031 0.316 -0.236) 0.395 7.512 ( 0.031 0.315 0.236) 0.395 8.750 ( -2.020 2.102 -0.910) 3.054 8.750 ( 2.020 2.102 0.910) 3.054 9.088 ( -1.385 -1.865 -0.705) 2.427 9.088 ( 1.385 -1.864 0.705) 2.427 9.557 ( -0.375 0.818 -0.831) 1.225 9.557 ( 0.375 0.818 0.831) 1.225 10.517 ( 0.363 1.196 -1.130) 1.685 10.517 ( -0.363 1.196 1.130) 1.685 13.298 ( 0.725 -1.550 -1.790) 2.477 13.298 ( -0.725 -1.551 1.790) 2.477 13.817 ( 0.009 -0.595 -0.708) 0.925 13.817 ( -0.008 -0.595 0.709) 0.925 14.622 ( -0.070 0.352 -1.106) 1.163 14.622 ( 0.071 0.353 1.106) 1.163 18.115 ( 0.423 -0.115 -0.689) 0.817 18.115 ( -0.423 -0.115 0.689) 0.817 18.651 ( -0.919 -0.241 -0.576) 1.111 18.651 ( 0.919 -0.241 0.576) 1.111======================= Grid point 623 (308/312) =======================q-point: ( 0.10 0.45 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.468 ( -2.997 3.924 -10.410) 11.522 2.556 ( -4.791 -5.226 0.060) 7.090 3.401 ( 0.840 8.025 1.291) 8.172 3.433 ( 7.115 6.136 -1.705) 9.549 3.608 ( -6.225 -2.311 1.151) 6.739 3.687 ( 2.628 -5.606 -12.317) 13.786 3.987 ( 1.600 2.316 7.183) 7.715 4.071 ( 3.859 -5.389 7.390) 9.927 4.473 ( -0.672 4.943 0.989) 5.086 4.509 ( 0.994 1.477 0.746) 1.930 4.872 ( -2.538 -2.143 -2.313) 4.047 4.885 ( -2.225 -3.034 -1.301) 3.982 5.466 ( -1.629 -0.700 -1.063) 2.067 5.480 ( -0.806 -2.244 -1.065) 2.612 6.077 ( -6.945 3.901 -4.385) 9.093 6.130 ( -5.404 -1.534 -2.142) 6.012 7.543 ( 1.923 0.607 2.666) 3.343 7.549 ( 1.920 0.047 2.893) 3.472 8.554 ( -10.571 3.918 -10.942) 15.711 8.611 ( -9.490 -1.849 -11.128) 14.742 9.151 ( 4.563 1.198 6.365) 7.923 9.190 ( 5.456 -2.746 5.555) 8.256 9.644 ( 5.725 2.015 5.341) 8.085 9.668 ( 5.977 -0.498 6.342) 8.729 10.500 ( -0.954 1.863 -0.760) 2.226 10.514 ( -0.845 0.401 0.174) 0.951 13.265 ( -1.658 -0.909 -2.651) 3.256 13.277 ( -2.347 -2.120 -0.369) 3.184 13.751 ( -3.538 0.161 -5.698) 6.709 13.765 ( -3.449 -1.308 -4.664) 5.946 14.608 ( -0.715 1.991 0.546) 2.185 14.641 ( 0.424 -1.541 1.502) 2.193 18.154 ( 3.041 1.286 3.136) 4.554 18.179 ( 4.694 -1.216 2.300) 5.367 18.614 ( -2.040 1.973 -1.154) 3.064 18.656 ( -0.457 -2.514 -0.341) 2.578======================= Grid point 624 (309/312) =======================q-point: ( 0.20 0.45 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.293 ( -3.448 5.875 -11.730) 13.564 2.428 ( -7.191 -8.254 -2.231) 11.172 3.283 ( -5.681 10.514 -16.400) 20.292 3.435 ( -9.248 -3.012 -8.041) 12.620 3.602 ( 8.513 0.947 0.161) 8.567 3.700 ( 5.850 -6.639 1.646) 9.001 4.103 ( 2.450 5.039 8.208) 9.938 4.201 ( 3.204 -4.306 4.479) 6.990 4.510 ( 2.818 6.226 5.184) 8.578 4.550 ( 2.097 3.388 3.066) 5.027 4.828 ( 1.079 -2.872 -2.310) 3.840 4.860 ( -1.596 -4.886 4.083) 6.565 5.409 ( -3.109 -0.270 -1.548) 3.483 5.438 ( -2.283 -3.253 -1.857) 4.387 5.867 ( -9.768 5.795 -5.426) 12.587 5.963 ( -8.932 -4.250 -3.519) 10.499 7.615 ( 1.281 0.396 3.477) 3.726 7.617 ( 1.835 0.245 3.233) 3.725 8.211 ( -11.953 3.285 -14.338) 18.954 8.268 ( -12.605 -2.537 -14.780) 19.590 9.339 ( 6.609 1.961 9.536) 11.767 9.381 ( 7.212 -2.506 8.833) 11.675 9.811 ( 6.018 2.381 4.776) 8.044 9.843 ( 5.896 -1.012 5.507) 8.131 10.471 ( -1.263 2.061 -0.631) 2.498 10.492 ( -1.484 -0.085 -0.039) 1.487 13.192 ( -2.903 -0.413 -3.229) 4.361 13.211 ( -3.872 -2.374 -0.984) 4.647 13.588 ( -5.680 0.513 -9.367) 10.967 13.610 ( -5.871 -1.748 -8.711) 10.649 14.613 ( -0.027 3.001 2.076) 3.649 14.669 ( 0.533 -2.899 2.371) 3.783 18.268 ( 4.736 2.435 4.059) 6.696 18.310 ( 6.065 -1.690 2.744) 6.868 18.565 ( -1.904 3.283 -0.392) 3.815 18.634 ( -1.085 -4.004 -0.754) 4.216======================= Grid point 625 (310/312) =======================q-point: ( 0.30 0.45 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.135 ( -1.660 5.584 -10.109) 11.667 2.274 ( -7.512 -8.836 -1.099) 11.650 2.955 ( -8.525 7.461 -20.053) 23.032 3.091 ( -12.885 -6.353 -16.466) 21.852 3.756 ( 6.860 2.776 0.596) 7.424 3.831 ( 3.265 -4.690 4.916) 7.539 4.241 ( 4.596 4.501 6.890) 9.426 4.293 ( 3.682 -0.066 3.410) 5.019 4.634 ( 2.361 8.057 7.541) 11.285 4.693 ( 8.916 1.072 3.468) 9.627 4.862 ( 3.682 -2.861 -1.136) 4.800 4.893 ( -0.601 -5.867 5.705) 8.205 5.322 ( -5.193 0.181 -0.183) 5.200 5.361 ( -4.459 -3.672 0.214) 5.780 5.660 ( -6.593 5.190 -3.950) 9.274 5.765 ( -8.462 -5.539 -3.043) 10.561 7.581 ( -6.863 2.633 -4.867) 8.816 7.629 ( -4.664 -2.324 -2.573) 5.811 7.918 ( -5.354 1.152 -7.864) 9.583 7.942 ( -5.535 -1.308 -8.771) 10.453 9.558 ( 6.419 2.446 9.884) 12.037 9.606 ( 6.967 -2.645 9.584) 12.140 9.934 ( 3.722 2.525 1.510) 4.745 9.972 ( 3.699 -1.381 2.172) 4.506 10.446 ( -1.099 1.834 -0.070) 2.139 10.464 ( -1.421 -0.105 -0.005) 1.425 13.108 ( -2.952 -0.022 -2.221) 3.694 13.130 ( -3.962 -2.334 -0.088) 4.600 13.382 ( -5.684 0.321 -10.206) 11.686 13.403 ( -5.893 -1.897 -10.104) 11.850 14.645 ( 0.681 3.035 2.890) 4.246 14.702 ( 0.377 -2.958 2.339) 3.790 18.366 ( 1.988 2.839 1.424) 3.747 18.412 ( 2.791 -1.567 -0.353) 3.220 18.569 ( 1.547 2.581 3.164) 4.366 18.624 ( 0.844 -3.455 0.672) 3.620======================= Grid point 626 (311/312) =======================q-point: ( 0.40 0.45 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 550Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.045 ( 1.245 2.689 -7.073) 7.669 2.140 ( -7.176 -7.158 1.403) 10.233 2.648 ( -4.713 3.733 -14.430) 15.633 2.721 ( -10.040 -3.749 -12.055) 16.130 3.854 ( 4.271 1.283 -1.129) 4.600 3.897 ( -0.632 -3.098 4.005) 5.102 4.400 ( 5.154 2.375 6.566) 8.678 4.415 ( 4.559 1.269 5.349) 7.142 4.720 ( 0.587 8.706 1.856) 8.921 4.810 ( 3.212 -0.022 -7.088) 7.782 4.903 ( 3.424 -1.315 -4.937) 6.150 4.918 ( -3.434 -3.285 5.603) 7.347 5.296 ( 0.945 0.370 8.365) 8.426 5.345 ( -0.925 -4.445 8.639) 9.759 5.549 ( -2.362 1.169 -4.075) 4.853 5.605 ( -6.042 -4.408 -3.151) 8.116 7.333 ( -8.126 2.187 -9.022) 12.338 7.385 ( -10.032 -3.114 -9.213) 13.973 7.872 ( 1.031 0.998 0.457) 1.506 7.892 ( 0.600 -1.108 -0.463) 1.342 9.754 ( 4.919 2.787 8.443) 10.161 9.808 ( 5.143 -2.811 8.104) 10.001 9.969 ( 0.475 2.739 -2.273) 3.591 10.013 ( 0.698 -1.947 -1.989) 2.869 10.433 ( -0.529 1.400 0.484) 1.573 10.444 ( -0.804 0.238 0.019) 0.839 13.056 ( -1.462 0.367 0.541) 1.601 13.080 ( -2.276 -2.146 2.080) 3.757 13.199 ( -4.056 0.011 -7.932) 8.909 13.219 ( -3.593 -2.073 -8.733) 9.668 14.687 ( 0.884 1.995 2.349) 3.206 14.723 ( -0.133 -1.728 1.121) 2.064 18.380 ( 0.097 1.791 -0.178) 1.803 18.414 ( -0.589 -1.489 -1.492) 2.189 18.650 ( 2.624 1.356 2.901) 4.140 18.672 ( 2.043 -1.128 1.480) 2.764======================= Grid point 627 (312/312) =======================q-point: ( 0.50 0.45 -0.50)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.46e-03 1.46e-03 2.11e-04 2.11e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 286Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.049 ( 4.896 -2.682 -3.990) 6.862 2.049 ( -4.897 -2.682 3.989) 6.862 2.546 ( 1.566 -0.016 -2.194) 2.696 2.546 ( -1.568 -0.017 2.190) 2.693 3.898 ( 2.690 -0.949 -2.692) 3.922 3.898 ( -2.690 -0.949 2.692) 3.922 4.510 ( 0.784 1.545 -2.356) 2.924 4.510 ( -0.786 1.545 2.355) 2.924 4.725 ( 0.430 2.693 -6.620) 7.160 4.725 ( -0.430 2.693 6.619) 7.159 4.911 ( 3.482 0.447 -5.867) 6.838 4.912 ( -3.483 0.447 5.867) 6.838 5.448 ( -1.694 -1.785 -4.615) 5.230 5.448 ( 1.694 -1.785 4.616) 5.231 5.464 ( -1.069 -2.799 -4.752) 5.618 5.464 ( 1.069 -2.798 4.751) 5.617 7.216 ( -1.426 -0.652 -0.326) 1.602 7.216 ( 1.426 -0.652 0.326) 1.602 7.894 ( -0.082 -0.155 -0.707) 0.729 7.894 ( 0.082 -0.155 0.707) 0.728 9.891 ( -1.160 1.998 -5.452) 5.922 9.891 ( 1.160 1.998 5.452) 5.921 9.963 ( -1.208 -1.673 -5.033) 5.440 9.963 ( 1.208 -1.673 5.033) 5.440 10.434 ( -0.016 0.815 -0.464) 0.938 10.434 ( 0.016 0.815 0.464) 0.938 13.072 ( -0.736 0.263 -2.472) 2.593 13.072 ( 0.736 0.264 2.471) 2.592 13.116 ( 0.210 -2.160 -3.839) 4.410 13.116 ( -0.212 -2.160 3.838) 4.409 14.717 ( 0.455 0.188 -1.906) 1.969 14.717 ( -0.455 0.188 1.906) 1.969 18.389 ( -0.341 -0.093 -1.017) 1.076 18.389 ( 0.340 -0.092 1.017) 1.076 18.696 ( -0.243 0.364 -0.565) 0.715 18.696 ( 0.243 0.364 0.565) 0.715=================== 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 3/39600 10.0 413.348 270.191 421.466 0.000 -14.244 0.000 3/39600 20.0 111.549 85.382 156.409 0.000 6.914 0.000 3/39600 30.0 35.001 30.157 58.514 0.000 2.904 0.000 3/39600 40.0 17.003 15.523 31.300 0.000 1.381 0.000 3/39600 50.0 10.701 10.130 20.671 0.000 0.777 0.000 3/39600 60.0 7.706 7.474 15.237 0.000 0.495 0.000 3/39600 70.0 5.991 5.905 11.979 0.000 0.351 0.000 3/39600 80.0 4.887 4.871 9.825 0.000 0.271 0.000 3/39600 90.0 4.123 4.139 8.308 0.000 0.223 0.000 3/39600 100.0 3.564 3.596 7.190 0.000 0.193 0.000 3/39600 110.0 3.139 3.179 6.336 0.000 0.172 0.000 3/39600 120.0 2.807 2.850 5.665 0.000 0.157 0.000 3/39600 130.0 2.540 2.584 5.126 0.000 0.145 0.000 3/39600 140.0 2.321 2.366 4.684 0.000 0.136 0.000 3/39600 150.0 2.140 2.184 4.315 0.000 0.128 0.000 3/39600 160.0 1.986 2.029 4.003 0.000 0.122 0.000 3/39600 170.0 1.854 1.896 3.736 0.000 0.116 0.000 3/39600 180.0 1.740 1.781 3.504 0.000 0.111 0.000 3/39600 190.0 1.641 1.680 3.301 0.000 0.106 0.000 3/39600 200.0 1.553 1.591 3.122 0.000 0.102 0.000 3/39600 210.0 1.475 1.511 2.963 0.000 0.099 0.000 3/39600 220.0 1.405 1.440 2.820 0.000 0.096 0.000 3/39600 230.0 1.342 1.376 2.691 0.000 0.092 0.000 3/39600 240.0 1.285 1.317 2.574 0.000 0.090 0.000 3/39600 250.0 1.233 1.264 2.468 0.000 0.087 0.000 3/39600 260.0 1.185 1.215 2.370 0.000 0.085 0.000 3/39600 270.0 1.141 1.170 2.280 0.000 0.082 0.000 3/39600 280.0 1.100 1.128 2.197 0.000 0.080 0.000 3/39600 290.0 1.063 1.090 2.121 0.000 0.078 0.000 3/39600 300.0 1.028 1.054 2.049 0.000 0.076 0.000 3/39600 310.0 0.995 1.020 1.983 0.000 0.074 0.000 3/39600 320.0 0.965 0.989 1.921 0.000 0.073 0.000 3/39600 330.0 0.936 0.959 1.862 0.000 0.071 0.000 3/39600 340.0 0.909 0.932 1.807 0.000 0.070 0.000 3/39600 350.0 0.884 0.905 1.756 0.000 0.068 0.000 3/39600 360.0 0.860 0.881 1.707 0.000 0.067 0.000 3/39600 370.0 0.837 0.858 1.661 0.000 0.065 0.000 3/39600 380.0 0.816 0.835 1.618 0.000 0.064 0.000 3/39600 390.0 0.796 0.815 1.577 0.000 0.063 0.000 3/39600 400.0 0.776 0.795 1.538 0.000 0.061 0.000 3/39600 410.0 0.758 0.776 1.501 0.000 0.060 0.000 3/39600 420.0 0.740 0.758 1.465 0.000 0.059 0.000 3/39600 430.0 0.724 0.741 1.431 0.000 0.058 0.000 3/39600 440.0 0.708 0.724 1.399 0.000 0.057 0.000 3/39600 450.0 0.693 0.708 1.369 0.000 0.056 0.000 3/39600 460.0 0.678 0.693 1.339 0.000 0.055 0.000 3/39600 470.0 0.664 0.679 1.311 0.000 0.054 0.000 3/39600 480.0 0.651 0.665 1.284 0.000 0.053 0.000 3/39600 490.0 0.638 0.652 1.258 0.000 0.052 0.000 3/39600 500.0 0.625 0.639 1.233 0.000 0.051 0.000 3/39600 510.0 0.614 0.627 1.209 0.000 0.051 0.000 3/39600 520.0 0.602 0.615 1.186 0.000 0.050 0.000 3/39600 530.0 0.591 0.604 1.164 0.000 0.049 0.000 3/39600 540.0 0.580 0.593 1.143 0.000 0.048 0.000 3/39600 550.0 0.570 0.582 1.122 0.000 0.047 0.000 3/39600 560.0 0.560 0.572 1.103 0.000 0.047 0.000 3/39600 570.0 0.551 0.562 1.083 0.000 0.046 0.000 3/39600 580.0 0.541 0.553 1.065 0.000 0.045 0.000 3/39600 590.0 0.533 0.544 1.047 0.000 0.045 0.000 3/39600 600.0 0.524 0.535 1.030 0.000 0.044 0.000 3/39600 610.0 0.516 0.526 1.013 0.000 0.043 0.000 3/39600 620.0 0.507 0.518 0.997 0.000 0.043 0.000 3/39600 630.0 0.500 0.510 0.981 0.000 0.042 0.000 3/39600 640.0 0.492 0.502 0.966 0.000 0.042 0.000 3/39600 650.0 0.485 0.495 0.952 0.000 0.041 0.000 3/39600 660.0 0.477 0.487 0.937 0.000 0.041 0.000 3/39600 670.0 0.471 0.480 0.924 0.000 0.040 0.000 3/39600 680.0 0.464 0.473 0.910 0.000 0.040 0.000 3/39600 690.0 0.457 0.466 0.897 0.000 0.039 0.000 3/39600 700.0 0.451 0.460 0.884 0.000 0.039 0.000 3/39600 710.0 0.445 0.454 0.872 0.000 0.038 0.000 3/39600 720.0 0.439 0.447 0.860 0.000 0.038 0.000 3/39600 730.0 0.433 0.441 0.848 0.000 0.037 0.000 3/39600 740.0 0.427 0.435 0.837 0.000 0.037 0.000 3/39600 750.0 0.421 0.430 0.826 0.000 0.036 0.000 3/39600 760.0 0.416 0.424 0.815 0.000 0.036 0.000 3/39600 770.0 0.411 0.419 0.805 0.000 0.035 0.000 3/39600 780.0 0.406 0.413 0.795 0.000 0.035 0.000 3/39600 790.0 0.401 0.408 0.785 0.000 0.035 0.000 3/39600 800.0 0.396 0.403 0.775 0.000 0.034 0.000 3/39600 810.0 0.391 0.398 0.765 0.000 0.034 0.000 3/39600 820.0 0.386 0.394 0.756 0.000 0.033 0.000 3/39600 830.0 0.382 0.389 0.747 0.000 0.033 0.000 3/39600 840.0 0.377 0.384 0.738 0.000 0.033 0.000 3/39600 850.0 0.373 0.380 0.730 0.000 0.032 0.000 3/39600 860.0 0.369 0.376 0.721 0.000 0.032 0.000 3/39600 870.0 0.364 0.371 0.713 0.000 0.032 0.000 3/39600 880.0 0.360 0.367 0.705 0.000 0.031 0.000 3/39600 890.0 0.356 0.363 0.697 0.000 0.031 0.000 3/39600 900.0 0.352 0.359 0.690 0.000 0.031 0.000 3/39600 910.0 0.349 0.355 0.682 0.000 0.030 0.000 3/39600 920.0 0.345 0.351 0.675 0.000 0.030 0.000 3/39600 930.0 0.341 0.348 0.667 0.000 0.030 0.000 3/39600 940.0 0.338 0.344 0.660 0.000 0.030 0.000 3/39600 950.0 0.334 0.340 0.654 0.000 0.029 0.000 3/39600 960.0 0.331 0.337 0.647 0.000 0.029 0.000 3/39600 970.0 0.327 0.333 0.640 0.000 0.029 0.000 3/39600 980.0 0.324 0.330 0.634 0.000 0.028 0.000 3/39600 990.0 0.321 0.327 0.627 0.000 0.028 0.000 3/39600 1000.0 0.318 0.324 0.621 0.000 0.028 0.000 3/39600Thermal conductivity related properties were written into "kappa-m101110.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 23:07:55]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|