----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 06:26:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.321189375003700 -3.995781075000000 0.000000000000000 b 5.321189375003700 3.995781075000000 0.000000000000000 c -2.178654377090562 0.000000000000000 5.865679800831050 Atomic positions (fractional): *1 B 0.07104893303915 0.74673313153116 0.33350186564248 10.811 2 B 0.25326686846884 0.92895106696085 0.16649813435752 10.811 3 B 0.92895106696085 0.25326686846884 0.66649813435752 10.811 4 B 0.74673313153116 0.07104893303915 0.83350186564248 10.811 *5 O 0.92781060278448 0.07218939721552 0.75000000000000 15.999 6 O 0.07218939721552 0.92781060278448 0.25000000000000 15.999 *7 O 0.65211777479204 0.25818868827440 0.96060566212882 15.999 8 O 0.74181131172560 0.34788222520796 0.53939433787118 15.999 *9 O 0.88072533584713 0.68588760459317 0.28551513396676 15.999 10 O 0.31411239540683 0.11927466415287 0.21448486603324 15.999 11 O 0.11927466415287 0.31411239540683 0.71448486603324 15.999 12 O 0.68588760459317 0.88072533584713 0.78551513396676 15.999 13 O 0.25818868827440 0.65211777479204 0.46060566212882 15.999 14 O 0.34788222520796 0.74181131172560 0.03939433787118 15.999 *15 Na 0.96781799703638 0.31552162253151 0.27310287244772 22.990 16 Na 0.68447837746849 0.03218200296362 0.22689712755228 22.990 17 Na 0.03218200296362 0.68447837746849 0.72689712755228 22.990 18 Na 0.31552162253151 0.96781799703638 0.77310287244772 22.990 *19 Na 0.67075939870063 0.59650622409315 0.92502571828874 22.990 20 Na 0.40349377590685 0.32924060129937 0.57497428171126 22.990 21 Na 0.32924060129937 0.40349377590685 0.07497428171126 22.990 22 Na 0.59650622409315 0.67075939870063 0.42502571828874 22.990 -------------------------------- unit cell --------------------------------- Lattice vectors: a 10.642378750007399 0.000000000000000 0.000000000000000 b 0.000000000000000 7.991562150000000 0.000000000000000 c -2.178654377090562 0.000000000000000 5.865679800831050 Atomic positions (fractional): *1 B 0.40889103228515 0.33784209924601 0.33350186564248 10.811 > 1 2 B 0.59110896771485 0.33784209924601 0.16649813435752 10.811 > 2 3 B 0.59110896771485 0.66215790075400 0.66649813435752 10.811 > 3 4 B 0.40889103228515 0.66215790075400 0.83350186564248 10.811 > 4 5 B 0.90889103228515 0.83784209924600 0.33350186564248 10.811 > 1 6 B 0.09110896771485 0.83784209924600 0.16649813435752 10.811 > 2 7 B 0.09110896771485 0.16215790075399 0.66649813435752 10.811 > 3 8 B 0.90889103228515 0.16215790075399 0.83350186564248 10.811 > 4 *9 O 0.50000000000000 0.57218939721552 0.75000000000000 15.999 > 5 10 O 0.50000000000000 0.42781060278448 0.25000000000000 15.999 > 6 *11 O 0.45515323153322 0.80303545674118 0.96060566212882 15.999 > 7 12 O 0.54484676846678 0.80303545674118 0.53939433787118 15.999 > 8 *13 O 0.78330647022015 0.90258113437302 0.28551513396676 15.999 > 9 14 O 0.21669352977985 0.90258113437302 0.21448486603324 15.999 > 10 15 O 0.21669352977985 0.09741886562698 0.71448486603324 15.999 > 11 16 O 0.78330647022015 0.09741886562698 0.78551513396676 15.999 > 12 17 O 0.45515323153322 0.19696454325882 0.46060566212882 15.999 > 13 18 O 0.54484676846678 0.19696454325882 0.03939433787118 15.999 > 14 19 O 0.00000000000000 0.07218939721552 0.75000000000000 15.999 > 5 20 O 0.00000000000000 0.92781060278448 0.25000000000000 15.999 > 6 21 O 0.95515323153322 0.30303545674118 0.96060566212882 15.999 > 7 22 O 0.04484676846678 0.30303545674118 0.53939433787118 15.999 > 8 23 O 0.28330647022015 0.40258113437302 0.28551513396676 15.999 > 9 24 O 0.71669352977985 0.40258113437302 0.21448486603324 15.999 > 10 25 O 0.71669352977985 0.59741886562698 0.71448486603324 15.999 > 11 26 O 0.28330647022015 0.59741886562698 0.78551513396676 15.999 > 12 27 O 0.95515323153322 0.69696454325882 0.46060566212882 15.999 > 13 28 O 0.04484676846678 0.69696454325882 0.03939433787118 15.999 > 14 *29 Na 0.64166980978395 0.67385181274756 0.27310287244772 22.990 > 15 30 Na 0.35833019021605 0.67385181274756 0.22689712755228 22.990 > 16 31 Na 0.35833019021605 0.32614818725244 0.72689712755228 22.990 > 17 32 Na 0.64166980978395 0.32614818725244 0.77310287244772 22.990 > 18 *33 Na 0.63363281139689 0.96287341269626 0.92502571828874 22.990 > 19 34 Na 0.36636718860311 0.96287341269626 0.57497428171126 22.990 > 20 35 Na 0.36636718860311 0.03712658730374 0.07497428171126 22.990 > 21 36 Na 0.63363281139689 0.03712658730374 0.42502571828874 22.990 > 22 37 Na 0.14166980978395 0.17385181274757 0.27310287244772 22.990 > 15 38 Na 0.85833019021605 0.17385181274757 0.22689712755228 22.990 > 16 39 Na 0.85833019021605 0.82614818725244 0.72689712755228 22.990 > 17 40 Na 0.14166980978395 0.82614818725244 0.77310287244772 22.990 > 18 41 Na 0.13363281139689 0.46287341269626 0.92502571828874 22.990 > 19 42 Na 0.86636718860311 0.46287341269626 0.57497428171126 22.990 > 20 43 Na 0.86636718860311 0.53712658730374 0.07497428171126 22.990 > 21 44 Na 0.13363281139689 0.53712658730374 0.42502571828874 22.990 > 22 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.642378750007399 0.000000000000000 0.000000000000000 b 0.000000000000000 7.991562150000000 0.000000000000000 c -4.357308754181124 0.000000000000000 11.731359601662099 Atomic positions (fractional): *1 B 0.40889103228515 0.33784209924601 0.16675093282124 10.811 > 1 2 B 0.40889103228515 0.33784209924601 0.66675093282124 10.811 > 1 3 B 0.59110896771485 0.33784209924601 0.08324906717876 10.811 > 2 4 B 0.59110896771485 0.33784209924601 0.58324906717876 10.811 > 2 5 B 0.59110896771485 0.66215790075400 0.33324906717876 10.811 > 3 6 B 0.59110896771485 0.66215790075400 0.83324906717876 10.811 > 3 7 B 0.40889103228515 0.66215790075400 0.41675093282124 10.811 > 4 8 B 0.40889103228515 0.66215790075400 0.91675093282124 10.811 > 4 9 B 0.90889103228515 0.83784209924600 0.16675093282124 10.811 > 1 10 B 0.90889103228515 0.83784209924600 0.66675093282124 10.811 > 1 11 B 0.09110896771485 0.83784209924600 0.08324906717876 10.811 > 2 12 B 0.09110896771485 0.83784209924600 0.58324906717876 10.811 > 2 13 B 0.09110896771485 0.16215790075399 0.33324906717876 10.811 > 3 14 B 0.09110896771485 0.16215790075399 0.83324906717876 10.811 > 3 15 B 0.90889103228515 0.16215790075399 0.41675093282124 10.811 > 4 16 B 0.90889103228515 0.16215790075399 0.91675093282124 10.811 > 4 *17 O 0.50000000000000 0.57218939721552 0.37500000000000 15.999 > 5 18 O 0.50000000000000 0.57218939721552 0.87500000000000 15.999 > 5 19 O 0.50000000000000 0.42781060278448 0.12500000000000 15.999 > 6 20 O 0.50000000000000 0.42781060278448 0.62500000000000 15.999 > 6 *21 O 0.45515323153322 0.80303545674118 0.48030283106441 15.999 > 7 22 O 0.45515323153322 0.80303545674118 0.98030283106441 15.999 > 7 23 O 0.54484676846678 0.80303545674118 0.26969716893559 15.999 > 8 24 O 0.54484676846678 0.80303545674118 0.76969716893559 15.999 > 8 *25 O 0.78330647022015 0.90258113437302 0.14275756698338 15.999 > 9 26 O 0.78330647022015 0.90258113437302 0.64275756698338 15.999 > 9 27 O 0.21669352977985 0.90258113437302 0.10724243301662 15.999 > 10 28 O 0.21669352977985 0.90258113437302 0.60724243301662 15.999 > 10 29 O 0.21669352977985 0.09741886562698 0.35724243301662 15.999 > 11 30 O 0.21669352977985 0.09741886562698 0.85724243301662 15.999 > 11 31 O 0.78330647022015 0.09741886562698 0.39275756698338 15.999 > 12 32 O 0.78330647022015 0.09741886562698 0.89275756698338 15.999 > 12 33 O 0.45515323153322 0.19696454325882 0.23030283106441 15.999 > 13 34 O 0.45515323153322 0.19696454325882 0.73030283106441 15.999 > 13 35 O 0.54484676846678 0.19696454325882 0.01969716893559 15.999 > 14 36 O 0.54484676846678 0.19696454325882 0.51969716893559 15.999 > 14 37 O 0.00000000000000 0.07218939721552 0.37500000000000 15.999 > 5 38 O 0.00000000000000 0.07218939721552 0.87500000000000 15.999 > 5 39 O 0.00000000000000 0.92781060278448 0.12500000000000 15.999 > 6 40 O 0.00000000000000 0.92781060278448 0.62500000000000 15.999 > 6 41 O 0.95515323153322 0.30303545674118 0.48030283106441 15.999 > 7 42 O 0.95515323153322 0.30303545674118 0.98030283106441 15.999 > 7 43 O 0.04484676846678 0.30303545674118 0.26969716893559 15.999 > 8 44 O 0.04484676846678 0.30303545674118 0.76969716893559 15.999 > 8 45 O 0.28330647022015 0.40258113437302 0.14275756698338 15.999 > 9 46 O 0.28330647022015 0.40258113437302 0.64275756698338 15.999 > 9 47 O 0.71669352977985 0.40258113437302 0.10724243301662 15.999 > 10 48 O 0.71669352977985 0.40258113437302 0.60724243301662 15.999 > 10 49 O 0.71669352977985 0.59741886562698 0.35724243301662 15.999 > 11 50 O 0.71669352977985 0.59741886562698 0.85724243301662 15.999 > 11 51 O 0.28330647022015 0.59741886562698 0.39275756698338 15.999 > 12 52 O 0.28330647022015 0.59741886562698 0.89275756698338 15.999 > 12 53 O 0.95515323153322 0.69696454325882 0.23030283106441 15.999 > 13 54 O 0.95515323153322 0.69696454325882 0.73030283106441 15.999 > 13 55 O 0.04484676846678 0.69696454325882 0.01969716893559 15.999 > 14 56 O 0.04484676846678 0.69696454325882 0.51969716893559 15.999 > 14 *57 Na 0.64166980978395 0.67385181274756 0.13655143622386 22.990 > 15 58 Na 0.64166980978395 0.67385181274756 0.63655143622386 22.990 > 15 59 Na 0.35833019021605 0.67385181274756 0.11344856377614 22.990 > 16 60 Na 0.35833019021605 0.67385181274756 0.61344856377614 22.990 > 16 61 Na 0.35833019021605 0.32614818725244 0.36344856377614 22.990 > 17 62 Na 0.35833019021605 0.32614818725244 0.86344856377614 22.990 > 17 63 Na 0.64166980978395 0.32614818725244 0.38655143622386 22.990 > 18 64 Na 0.64166980978395 0.32614818725244 0.88655143622386 22.990 > 18 *65 Na 0.63363281139689 0.96287341269626 0.46251285914437 22.990 > 19 66 Na 0.63363281139689 0.96287341269626 0.96251285914437 22.990 > 19 67 Na 0.36636718860311 0.96287341269626 0.28748714085563 22.990 > 20 68 Na 0.36636718860311 0.96287341269626 0.78748714085563 22.990 > 20 69 Na 0.36636718860311 0.03712658730374 0.03748714085563 22.990 > 21 70 Na 0.36636718860311 0.03712658730374 0.53748714085563 22.990 > 21 71 Na 0.63363281139689 0.03712658730374 0.21251285914437 22.990 > 22 72 Na 0.63363281139689 0.03712658730374 0.71251285914437 22.990 > 22 73 Na 0.14166980978395 0.17385181274757 0.13655143622386 22.990 > 15 74 Na 0.14166980978395 0.17385181274757 0.63655143622386 22.990 > 15 75 Na 0.85833019021605 0.17385181274757 0.11344856377614 22.990 > 16 76 Na 0.85833019021605 0.17385181274757 0.61344856377614 22.990 > 16 77 Na 0.85833019021605 0.82614818725244 0.36344856377614 22.990 > 17 78 Na 0.85833019021605 0.82614818725244 0.86344856377614 22.990 > 17 79 Na 0.14166980978395 0.82614818725244 0.38655143622386 22.990 > 18 80 Na 0.14166980978395 0.82614818725244 0.88655143622386 22.990 > 18 81 Na 0.13363281139689 0.46287341269626 0.46251285914437 22.990 > 19 82 Na 0.13363281139689 0.46287341269626 0.96251285914437 22.990 > 19 83 Na 0.86636718860311 0.46287341269626 0.28748714085563 22.990 > 20 84 Na 0.86636718860311 0.46287341269626 0.78748714085563 22.990 > 20 85 Na 0.86636718860311 0.53712658730374 0.03748714085563 22.990 > 21 86 Na 0.86636718860311 0.53712658730374 0.53748714085563 22.990 > 21 87 Na 0.13363281139689 0.53712658730374 0.21251285914437 22.990 > 22 88 Na 0.13363281139689 0.53712658730374 0.71251285914437 22.990 > 22 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.5846194 0.0000000 -0.0280331 0.0000000 2.4652835 0.0000000 -0.0280331 0.0000000 2.3928714 -------------------------- Born effective charges -------------------------- 1 B 2.5483068 -0.0155587 -0.1055019 -0.1366214 1.6791464 -0.7800613 -0.1316346 -0.8979297 1.0729425 2 B 2.5483068 0.0155587 -0.1055019 0.1366214 1.6791464 0.7800613 -0.1316346 0.8979297 1.0729425 3 B 2.5483068 -0.0155587 -0.1055019 -0.1366214 1.6791464 -0.7800613 -0.1316346 -0.8979297 1.0729425 4 B 2.5483068 0.0155587 -0.1055019 0.1366214 1.6791464 0.7800613 -0.1316346 0.8979297 1.0729425 5 O -2.3371782 0.0000000 0.5403970 0.0000000 -1.3182992 0.0000000 0.6497391 0.0000000 -1.0386445 6 O -2.3371782 0.0000000 0.5403970 0.0000000 -1.3182992 0.0000000 0.6497391 0.0000000 -1.0386445 7 O -1.3688721 -0.0507688 -0.0354519 -0.0947119 -1.8046915 -0.4286337 -0.0252617 -0.5046874 -1.4422324 8 O -1.3688721 0.0507688 -0.0354519 0.0947119 -1.8046915 0.4286337 -0.0252617 0.5046874 -1.4422324 9 O -2.0816918 0.3140421 -0.1562373 0.3208467 -1.3315094 0.1322927 -0.1848143 0.1752345 -1.2294129 10 O -2.0816918 -0.3140421 -0.1562373 -0.3208467 -1.3315094 -0.1322927 -0.1848143 -0.1752345 -1.2294129 11 O -2.0816918 0.3140421 -0.1562373 0.3208467 -1.3315094 0.1322927 -0.1848143 0.1752345 -1.2294129 12 O -2.0816918 -0.3140421 -0.1562373 -0.3208467 -1.3315094 -0.1322927 -0.1848143 -0.1752345 -1.2294129 13 O -1.3688721 0.0507688 -0.0354519 0.0947119 -1.8046915 0.4286337 -0.0252617 0.5046874 -1.4422324 14 O -1.3688721 -0.0507688 -0.0354519 -0.0947119 -1.8046915 -0.4286337 -0.0252617 -0.5046874 -1.4422324 15 Na 1.0029748 0.1132669 -0.0027499 0.0878061 0.9824915 0.0472870 0.0040763 0.0191720 1.0955528 16 Na 1.0029748 -0.1132669 -0.0027499 -0.0878061 0.9824915 -0.0472870 0.0040763 -0.0191720 1.0955528 17 Na 1.0029748 0.1132669 -0.0027499 0.0878061 0.9824915 0.0472870 0.0040763 0.0191720 1.0955528 18 Na 1.0029748 -0.1132669 -0.0027499 -0.0878061 0.9824915 -0.0472870 0.0040763 -0.0191720 1.0955528 19 Na 1.0678714 0.0516201 0.0297425 0.0546995 1.1337127 0.0380459 0.0127648 0.0765943 1.0224722 20 Na 1.0678714 -0.0516201 0.0297425 -0.0546995 1.1337127 -0.0380459 0.0127648 -0.0765943 1.0224722 21 Na 1.0678714 0.0516201 0.0297425 0.0546995 1.1337127 0.0380459 0.0127648 0.0765943 1.0224722 22 Na 1.0678714 -0.0516201 0.0297425 -0.0546995 1.1337127 -0.0380459 0.0127648 -0.0765943 1.0224722 ---------------------------------------------------------------------------- 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: 264/264 Permutation basis: 10398/10398 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2278 Number of blocks in projector: 2278 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 486 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 276 Use standard eigh solver. Tree of FC basis block matrices: - (2278, 2229), data: False |-- (276, 270), data: True |-- (276, 270), data: True |-- (276, 270), data: True |-- (482, 472), data: True |-- (482, 472), data: True |-- (486, 475), data: True ----- Solver_atoms: 1 -- 88 / 88 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.578 Solver_block: 200 / 720 - Time: 0.523 Solver_block: 300 / 720 - Time: 0.518 Solver_block: 400 / 720 - Time: 0.528 Solver_block: 500 / 720 - Time: 0.518 Solver_block: 600 / 720 - Time: 0.516 Solver_block: 700 / 720 - Time: 0.519 Solver_block: 720 / 720 - Time: 0.197 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.980 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 264/264 Permutation basis: 10398/10398 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2278 Number of blocks in projector: 2278 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 486 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 276 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 276 Use standard eigh solver. Tree of FC basis block matrices: - (2278, 2229), data: False |-- (276, 270), data: True |-- (276, 270), data: True |-- (276, 270), data: True |-- (482, 472), data: True |-- (482, 472), data: True |-- (486, 475), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 06:26:47]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 06:26:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.321189375003700 -3.995781075000000 0.000000000000000 b 5.321189375003700 3.995781075000000 0.000000000000000 c -2.178654377090562 0.000000000000000 5.865679800831050 Atomic positions (fractional): 1 B 0.07104893303915 0.74673313153116 0.33350186564248 10.811 2 B 0.25326686846884 0.92895106696085 0.16649813435752 10.811 3 B 0.92895106696085 0.25326686846884 0.66649813435752 10.811 4 B 0.74673313153116 0.07104893303915 0.83350186564248 10.811 5 O 0.92781060278448 0.07218939721552 0.75000000000000 15.999 6 O 0.07218939721552 0.92781060278448 0.25000000000000 15.999 7 O 0.65211777479204 0.25818868827440 0.96060566212882 15.999 8 O 0.74181131172560 0.34788222520796 0.53939433787118 15.999 9 O 0.88072533584713 0.68588760459317 0.28551513396676 15.999 10 O 0.31411239540683 0.11927466415287 0.21448486603324 15.999 11 O 0.11927466415287 0.31411239540683 0.71448486603324 15.999 12 O 0.68588760459317 0.88072533584713 0.78551513396676 15.999 13 O 0.25818868827440 0.65211777479204 0.46060566212882 15.999 14 O 0.34788222520796 0.74181131172560 0.03939433787118 15.999 15 Na 0.96781799703638 0.31552162253151 0.27310287244772 22.990 16 Na 0.68447837746849 0.03218200296362 0.22689712755228 22.990 17 Na 0.03218200296362 0.68447837746849 0.72689712755228 22.990 18 Na 0.31552162253151 0.96781799703638 0.77310287244772 22.990 19 Na 0.67075939870063 0.59650622409315 0.92502571828874 22.990 20 Na 0.40349377590685 0.32924060129937 0.57497428171126 22.990 21 Na 0.32924060129937 0.40349377590685 0.07497428171126 22.990 22 Na 0.59650622409315 0.67075939870063 0.42502571828874 22.990 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.642378750007399 0.000000000000000 0.000000000000000 b 0.000000000000000 7.991562150000000 0.000000000000000 c -4.357308754181124 0.000000000000000 11.731359601662099 Atomic positions (fractional): 1 B 0.40889103228515 0.33784209924601 0.16675093282124 10.811 > 1 2 B 0.40889103228515 0.33784209924601 0.66675093282124 10.811 > 1 3 B 0.59110896771485 0.33784209924601 0.08324906717876 10.811 > 3 4 B 0.59110896771485 0.33784209924601 0.58324906717876 10.811 > 3 5 B 0.59110896771485 0.66215790075400 0.33324906717876 10.811 > 5 6 B 0.59110896771485 0.66215790075400 0.83324906717876 10.811 > 5 7 B 0.40889103228515 0.66215790075400 0.41675093282124 10.811 > 7 8 B 0.40889103228515 0.66215790075400 0.91675093282124 10.811 > 7 9 B 0.90889103228515 0.83784209924600 0.16675093282124 10.811 > 1 10 B 0.90889103228515 0.83784209924600 0.66675093282124 10.811 > 1 11 B 0.09110896771485 0.83784209924600 0.08324906717876 10.811 > 3 12 B 0.09110896771485 0.83784209924600 0.58324906717876 10.811 > 3 13 B 0.09110896771485 0.16215790075399 0.33324906717876 10.811 > 5 14 B 0.09110896771485 0.16215790075399 0.83324906717876 10.811 > 5 15 B 0.90889103228515 0.16215790075399 0.41675093282124 10.811 > 7 16 B 0.90889103228515 0.16215790075399 0.91675093282124 10.811 > 7 17 O 0.50000000000000 0.57218939721552 0.37500000000000 15.999 > 17 18 O 0.50000000000000 0.57218939721552 0.87500000000000 15.999 > 17 19 O 0.50000000000000 0.42781060278448 0.12500000000000 15.999 > 19 20 O 0.50000000000000 0.42781060278448 0.62500000000000 15.999 > 19 21 O 0.45515323153322 0.80303545674118 0.48030283106441 15.999 > 21 22 O 0.45515323153322 0.80303545674118 0.98030283106441 15.999 > 21 23 O 0.54484676846678 0.80303545674118 0.26969716893559 15.999 > 23 24 O 0.54484676846678 0.80303545674118 0.76969716893559 15.999 > 23 25 O 0.78330647022015 0.90258113437302 0.14275756698338 15.999 > 25 26 O 0.78330647022015 0.90258113437302 0.64275756698338 15.999 > 25 27 O 0.21669352977985 0.90258113437302 0.10724243301662 15.999 > 27 28 O 0.21669352977985 0.90258113437302 0.60724243301662 15.999 > 27 29 O 0.21669352977985 0.09741886562698 0.35724243301662 15.999 > 29 30 O 0.21669352977985 0.09741886562698 0.85724243301662 15.999 > 29 31 O 0.78330647022015 0.09741886562698 0.39275756698338 15.999 > 31 32 O 0.78330647022015 0.09741886562698 0.89275756698338 15.999 > 31 33 O 0.45515323153322 0.19696454325882 0.23030283106441 15.999 > 33 34 O 0.45515323153322 0.19696454325882 0.73030283106441 15.999 > 33 35 O 0.54484676846678 0.19696454325882 0.01969716893559 15.999 > 35 36 O 0.54484676846678 0.19696454325882 0.51969716893559 15.999 > 35 37 O 0.00000000000000 0.07218939721552 0.37500000000000 15.999 > 17 38 O 0.00000000000000 0.07218939721552 0.87500000000000 15.999 > 17 39 O 0.00000000000000 0.92781060278448 0.12500000000000 15.999 > 19 40 O 0.00000000000000 0.92781060278448 0.62500000000000 15.999 > 19 41 O 0.95515323153322 0.30303545674118 0.48030283106441 15.999 > 21 42 O 0.95515323153322 0.30303545674118 0.98030283106441 15.999 > 21 43 O 0.04484676846678 0.30303545674118 0.26969716893559 15.999 > 23 44 O 0.04484676846678 0.30303545674118 0.76969716893559 15.999 > 23 45 O 0.28330647022015 0.40258113437302 0.14275756698338 15.999 > 25 46 O 0.28330647022015 0.40258113437302 0.64275756698338 15.999 > 25 47 O 0.71669352977985 0.40258113437302 0.10724243301662 15.999 > 27 48 O 0.71669352977985 0.40258113437302 0.60724243301662 15.999 > 27 49 O 0.71669352977985 0.59741886562698 0.35724243301662 15.999 > 29 50 O 0.71669352977985 0.59741886562698 0.85724243301662 15.999 > 29 51 O 0.28330647022015 0.59741886562698 0.39275756698338 15.999 > 31 52 O 0.28330647022015 0.59741886562698 0.89275756698338 15.999 > 31 53 O 0.95515323153322 0.69696454325882 0.23030283106441 15.999 > 33 54 O 0.95515323153322 0.69696454325882 0.73030283106441 15.999 > 33 55 O 0.04484676846678 0.69696454325882 0.01969716893559 15.999 > 35 56 O 0.04484676846678 0.69696454325882 0.51969716893559 15.999 > 35 57 Na 0.64166980978395 0.67385181274756 0.13655143622386 22.990 > 57 58 Na 0.64166980978395 0.67385181274756 0.63655143622386 22.990 > 57 59 Na 0.35833019021605 0.67385181274756 0.11344856377614 22.990 > 59 60 Na 0.35833019021605 0.67385181274756 0.61344856377614 22.990 > 59 61 Na 0.35833019021605 0.32614818725244 0.36344856377614 22.990 > 61 62 Na 0.35833019021605 0.32614818725244 0.86344856377614 22.990 > 61 63 Na 0.64166980978395 0.32614818725244 0.38655143622386 22.990 > 63 64 Na 0.64166980978395 0.32614818725244 0.88655143622386 22.990 > 63 65 Na 0.63363281139689 0.96287341269626 0.46251285914437 22.990 > 65 66 Na 0.63363281139689 0.96287341269626 0.96251285914437 22.990 > 65 67 Na 0.36636718860311 0.96287341269626 0.28748714085563 22.990 > 67 68 Na 0.36636718860311 0.96287341269626 0.78748714085563 22.990 > 67 69 Na 0.36636718860311 0.03712658730374 0.03748714085563 22.990 > 69 70 Na 0.36636718860311 0.03712658730374 0.53748714085563 22.990 > 69 71 Na 0.63363281139689 0.03712658730374 0.21251285914437 22.990 > 71 72 Na 0.63363281139689 0.03712658730374 0.71251285914437 22.990 > 71 73 Na 0.14166980978395 0.17385181274757 0.13655143622386 22.990 > 57 74 Na 0.14166980978395 0.17385181274757 0.63655143622386 22.990 > 57 75 Na 0.85833019021605 0.17385181274757 0.11344856377614 22.990 > 59 76 Na 0.85833019021605 0.17385181274757 0.61344856377614 22.990 > 59 77 Na 0.85833019021605 0.82614818725244 0.36344856377614 22.990 > 61 78 Na 0.85833019021605 0.82614818725244 0.86344856377614 22.990 > 61 79 Na 0.14166980978395 0.82614818725244 0.38655143622386 22.990 > 63 80 Na 0.14166980978395 0.82614818725244 0.88655143622386 22.990 > 63 81 Na 0.13363281139689 0.46287341269626 0.46251285914437 22.990 > 65 82 Na 0.13363281139689 0.46287341269626 0.96251285914437 22.990 > 65 83 Na 0.86636718860311 0.46287341269626 0.28748714085563 22.990 > 67 84 Na 0.86636718860311 0.46287341269626 0.78748714085563 22.990 > 67 85 Na 0.86636718860311 0.53712658730374 0.03748714085563 22.990 > 69 86 Na 0.86636718860311 0.53712658730374 0.53748714085563 22.990 > 69 87 Na 0.13363281139689 0.53712658730374 0.21251285914437 22.990 > 71 88 Na 0.13363281139689 0.53712658730374 0.71251285914437 22.990 > 71 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.5846194 0.0000000 -0.0280331 0.0000000 2.4652835 0.0000000 -0.0280331 0.0000000 2.3928714 -------------------------- Born effective charges -------------------------- 1 B 2.5483068 -0.0155587 -0.1055019 -0.1366214 1.6791464 -0.7800613 -0.1316346 -0.8979297 1.0729425 2 B 2.5483068 0.0155587 -0.1055019 0.1366214 1.6791464 0.7800613 -0.1316346 0.8979297 1.0729425 3 B 2.5483068 -0.0155587 -0.1055019 -0.1366214 1.6791464 -0.7800613 -0.1316346 -0.8979297 1.0729425 4 B 2.5483068 0.0155587 -0.1055019 0.1366214 1.6791464 0.7800613 -0.1316346 0.8979297 1.0729425 5 O -2.3371782 0.0000000 0.5403970 0.0000000 -1.3182992 0.0000000 0.6497391 0.0000000 -1.0386445 6 O -2.3371782 0.0000000 0.5403970 0.0000000 -1.3182992 0.0000000 0.6497391 0.0000000 -1.0386445 7 O -1.3688721 -0.0507688 -0.0354519 -0.0947119 -1.8046915 -0.4286337 -0.0252617 -0.5046874 -1.4422324 8 O -1.3688721 0.0507688 -0.0354519 0.0947119 -1.8046915 0.4286337 -0.0252617 0.5046874 -1.4422324 9 O -2.0816918 0.3140421 -0.1562373 0.3208467 -1.3315094 0.1322927 -0.1848143 0.1752345 -1.2294129 10 O -2.0816918 -0.3140421 -0.1562373 -0.3208467 -1.3315094 -0.1322927 -0.1848143 -0.1752345 -1.2294129 11 O -2.0816918 0.3140421 -0.1562373 0.3208467 -1.3315094 0.1322927 -0.1848143 0.1752345 -1.2294129 12 O -2.0816918 -0.3140421 -0.1562373 -0.3208467 -1.3315094 -0.1322927 -0.1848143 -0.1752345 -1.2294129 13 O -1.3688721 0.0507688 -0.0354519 0.0947119 -1.8046915 0.4286337 -0.0252617 0.5046874 -1.4422324 14 O -1.3688721 -0.0507688 -0.0354519 -0.0947119 -1.8046915 -0.4286337 -0.0252617 -0.5046874 -1.4422324 15 Na 1.0029748 0.1132669 -0.0027499 0.0878061 0.9824915 0.0472870 0.0040763 0.0191720 1.0955528 16 Na 1.0029748 -0.1132669 -0.0027499 -0.0878061 0.9824915 -0.0472870 0.0040763 -0.0191720 1.0955528 17 Na 1.0029748 0.1132669 -0.0027499 0.0878061 0.9824915 0.0472870 0.0040763 0.0191720 1.0955528 18 Na 1.0029748 -0.1132669 -0.0027499 -0.0878061 0.9824915 -0.0472870 0.0040763 -0.0191720 1.0955528 19 Na 1.0678714 0.0516201 0.0297425 0.0546995 1.1337127 0.0380459 0.0127648 0.0765943 1.0224722 20 Na 1.0678714 -0.0516201 0.0297425 -0.0546995 1.1337127 -0.0380459 0.0127648 -0.0765943 1.0224722 21 Na 1.0678714 0.0516201 0.0297425 0.0546995 1.1337127 0.0380459 0.0127648 0.0765943 1.0224722 22 Na 1.0678714 -0.0516201 0.0297425 -0.0546995 1.1337127 -0.0380459 0.0127648 -0.0765943 1.0224722 ---------------------------------------------------------------------------- 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 17, 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 21, 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 57, 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] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000004 (xxy) 0.00000004 (xxy) 0.00000004 (xyx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000003 (yx) 0.00000003 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency 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 06:27:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 06:27:06]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.321189375003700 -3.995781075000000 0.000000000000000 b 5.321189375003700 3.995781075000000 0.000000000000000 c -2.178654377090562 0.000000000000000 5.865679800831050 Atomic positions (fractional): 1 B 0.07104893303915 0.74673313153116 0.33350186564248 10.811 2 B 0.25326686846884 0.92895106696085 0.16649813435752 10.811 3 B 0.92895106696085 0.25326686846884 0.66649813435752 10.811 4 B 0.74673313153116 0.07104893303915 0.83350186564248 10.811 5 O 0.92781060278448 0.07218939721552 0.75000000000000 15.999 6 O 0.07218939721552 0.92781060278448 0.25000000000000 15.999 7 O 0.65211777479204 0.25818868827440 0.96060566212882 15.999 8 O 0.74181131172560 0.34788222520796 0.53939433787118 15.999 9 O 0.88072533584713 0.68588760459317 0.28551513396676 15.999 10 O 0.31411239540683 0.11927466415287 0.21448486603324 15.999 11 O 0.11927466415287 0.31411239540683 0.71448486603324 15.999 12 O 0.68588760459317 0.88072533584713 0.78551513396676 15.999 13 O 0.25818868827440 0.65211777479204 0.46060566212882 15.999 14 O 0.34788222520796 0.74181131172560 0.03939433787118 15.999 15 Na 0.96781799703638 0.31552162253151 0.27310287244772 22.990 16 Na 0.68447837746849 0.03218200296362 0.22689712755228 22.990 17 Na 0.03218200296362 0.68447837746849 0.72689712755228 22.990 18 Na 0.31552162253151 0.96781799703638 0.77310287244772 22.990 19 Na 0.67075939870063 0.59650622409315 0.92502571828874 22.990 20 Na 0.40349377590685 0.32924060129937 0.57497428171126 22.990 21 Na 0.32924060129937 0.40349377590685 0.07497428171126 22.990 22 Na 0.59650622409315 0.67075939870063 0.42502571828874 22.990 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.642378750007399 0.000000000000000 0.000000000000000 b 0.000000000000000 7.991562150000000 0.000000000000000 c -4.357308754181124 0.000000000000000 11.731359601662099 Atomic positions (fractional): 1 B 0.40889103228515 0.33784209924601 0.16675093282124 10.811 > 1 2 B 0.40889103228515 0.33784209924601 0.66675093282124 10.811 > 1 3 B 0.59110896771485 0.33784209924601 0.08324906717876 10.811 > 3 4 B 0.59110896771485 0.33784209924601 0.58324906717876 10.811 > 3 5 B 0.59110896771485 0.66215790075400 0.33324906717876 10.811 > 5 6 B 0.59110896771485 0.66215790075400 0.83324906717876 10.811 > 5 7 B 0.40889103228515 0.66215790075400 0.41675093282124 10.811 > 7 8 B 0.40889103228515 0.66215790075400 0.91675093282124 10.811 > 7 9 B 0.90889103228515 0.83784209924600 0.16675093282124 10.811 > 1 10 B 0.90889103228515 0.83784209924600 0.66675093282124 10.811 > 1 11 B 0.09110896771485 0.83784209924600 0.08324906717876 10.811 > 3 12 B 0.09110896771485 0.83784209924600 0.58324906717876 10.811 > 3 13 B 0.09110896771485 0.16215790075399 0.33324906717876 10.811 > 5 14 B 0.09110896771485 0.16215790075399 0.83324906717876 10.811 > 5 15 B 0.90889103228515 0.16215790075399 0.41675093282124 10.811 > 7 16 B 0.90889103228515 0.16215790075399 0.91675093282124 10.811 > 7 17 O 0.50000000000000 0.57218939721552 0.37500000000000 15.999 > 17 18 O 0.50000000000000 0.57218939721552 0.87500000000000 15.999 > 17 19 O 0.50000000000000 0.42781060278448 0.12500000000000 15.999 > 19 20 O 0.50000000000000 0.42781060278448 0.62500000000000 15.999 > 19 21 O 0.45515323153322 0.80303545674118 0.48030283106441 15.999 > 21 22 O 0.45515323153322 0.80303545674118 0.98030283106441 15.999 > 21 23 O 0.54484676846678 0.80303545674118 0.26969716893559 15.999 > 23 24 O 0.54484676846678 0.80303545674118 0.76969716893559 15.999 > 23 25 O 0.78330647022015 0.90258113437302 0.14275756698338 15.999 > 25 26 O 0.78330647022015 0.90258113437302 0.64275756698338 15.999 > 25 27 O 0.21669352977985 0.90258113437302 0.10724243301662 15.999 > 27 28 O 0.21669352977985 0.90258113437302 0.60724243301662 15.999 > 27 29 O 0.21669352977985 0.09741886562698 0.35724243301662 15.999 > 29 30 O 0.21669352977985 0.09741886562698 0.85724243301662 15.999 > 29 31 O 0.78330647022015 0.09741886562698 0.39275756698338 15.999 > 31 32 O 0.78330647022015 0.09741886562698 0.89275756698338 15.999 > 31 33 O 0.45515323153322 0.19696454325882 0.23030283106441 15.999 > 33 34 O 0.45515323153322 0.19696454325882 0.73030283106441 15.999 > 33 35 O 0.54484676846678 0.19696454325882 0.01969716893559 15.999 > 35 36 O 0.54484676846678 0.19696454325882 0.51969716893559 15.999 > 35 37 O 0.00000000000000 0.07218939721552 0.37500000000000 15.999 > 17 38 O 0.00000000000000 0.07218939721552 0.87500000000000 15.999 > 17 39 O 0.00000000000000 0.92781060278448 0.12500000000000 15.999 > 19 40 O 0.00000000000000 0.92781060278448 0.62500000000000 15.999 > 19 41 O 0.95515323153322 0.30303545674118 0.48030283106441 15.999 > 21 42 O 0.95515323153322 0.30303545674118 0.98030283106441 15.999 > 21 43 O 0.04484676846678 0.30303545674118 0.26969716893559 15.999 > 23 44 O 0.04484676846678 0.30303545674118 0.76969716893559 15.999 > 23 45 O 0.28330647022015 0.40258113437302 0.14275756698338 15.999 > 25 46 O 0.28330647022015 0.40258113437302 0.64275756698338 15.999 > 25 47 O 0.71669352977985 0.40258113437302 0.10724243301662 15.999 > 27 48 O 0.71669352977985 0.40258113437302 0.60724243301662 15.999 > 27 49 O 0.71669352977985 0.59741886562698 0.35724243301662 15.999 > 29 50 O 0.71669352977985 0.59741886562698 0.85724243301662 15.999 > 29 51 O 0.28330647022015 0.59741886562698 0.39275756698338 15.999 > 31 52 O 0.28330647022015 0.59741886562698 0.89275756698338 15.999 > 31 53 O 0.95515323153322 0.69696454325882 0.23030283106441 15.999 > 33 54 O 0.95515323153322 0.69696454325882 0.73030283106441 15.999 > 33 55 O 0.04484676846678 0.69696454325882 0.01969716893559 15.999 > 35 56 O 0.04484676846678 0.69696454325882 0.51969716893559 15.999 > 35 57 Na 0.64166980978395 0.67385181274756 0.13655143622386 22.990 > 57 58 Na 0.64166980978395 0.67385181274756 0.63655143622386 22.990 > 57 59 Na 0.35833019021605 0.67385181274756 0.11344856377614 22.990 > 59 60 Na 0.35833019021605 0.67385181274756 0.61344856377614 22.990 > 59 61 Na 0.35833019021605 0.32614818725244 0.36344856377614 22.990 > 61 62 Na 0.35833019021605 0.32614818725244 0.86344856377614 22.990 > 61 63 Na 0.64166980978395 0.32614818725244 0.38655143622386 22.990 > 63 64 Na 0.64166980978395 0.32614818725244 0.88655143622386 22.990 > 63 65 Na 0.63363281139689 0.96287341269626 0.46251285914437 22.990 > 65 66 Na 0.63363281139689 0.96287341269626 0.96251285914437 22.990 > 65 67 Na 0.36636718860311 0.96287341269626 0.28748714085563 22.990 > 67 68 Na 0.36636718860311 0.96287341269626 0.78748714085563 22.990 > 67 69 Na 0.36636718860311 0.03712658730374 0.03748714085563 22.990 > 69 70 Na 0.36636718860311 0.03712658730374 0.53748714085563 22.990 > 69 71 Na 0.63363281139689 0.03712658730374 0.21251285914437 22.990 > 71 72 Na 0.63363281139689 0.03712658730374 0.71251285914437 22.990 > 71 73 Na 0.14166980978395 0.17385181274757 0.13655143622386 22.990 > 57 74 Na 0.14166980978395 0.17385181274757 0.63655143622386 22.990 > 57 75 Na 0.85833019021605 0.17385181274757 0.11344856377614 22.990 > 59 76 Na 0.85833019021605 0.17385181274757 0.61344856377614 22.990 > 59 77 Na 0.85833019021605 0.82614818725244 0.36344856377614 22.990 > 61 78 Na 0.85833019021605 0.82614818725244 0.86344856377614 22.990 > 61 79 Na 0.14166980978395 0.82614818725244 0.38655143622386 22.990 > 63 80 Na 0.14166980978395 0.82614818725244 0.88655143622386 22.990 > 63 81 Na 0.13363281139689 0.46287341269626 0.46251285914437 22.990 > 65 82 Na 0.13363281139689 0.46287341269626 0.96251285914437 22.990 > 65 83 Na 0.86636718860311 0.46287341269626 0.28748714085563 22.990 > 67 84 Na 0.86636718860311 0.46287341269626 0.78748714085563 22.990 > 67 85 Na 0.86636718860311 0.53712658730374 0.03748714085563 22.990 > 69 86 Na 0.86636718860311 0.53712658730374 0.53748714085563 22.990 > 69 87 Na 0.13363281139689 0.53712658730374 0.21251285914437 22.990 > 71 88 Na 0.13363281139689 0.53712658730374 0.71251285914437 22.990 > 71 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.5846194 0.0000000 -0.0280331 0.0000000 2.4652835 0.0000000 -0.0280331 0.0000000 2.3928714 -------------------------- Born effective charges -------------------------- 1 B 2.5483068 -0.0155587 -0.1055019 -0.1366214 1.6791464 -0.7800613 -0.1316346 -0.8979297 1.0729425 2 B 2.5483068 0.0155587 -0.1055019 0.1366214 1.6791464 0.7800613 -0.1316346 0.8979297 1.0729425 3 B 2.5483068 -0.0155587 -0.1055019 -0.1366214 1.6791464 -0.7800613 -0.1316346 -0.8979297 1.0729425 4 B 2.5483068 0.0155587 -0.1055019 0.1366214 1.6791464 0.7800613 -0.1316346 0.8979297 1.0729425 5 O -2.3371782 0.0000000 0.5403970 0.0000000 -1.3182992 0.0000000 0.6497391 0.0000000 -1.0386445 6 O -2.3371782 0.0000000 0.5403970 0.0000000 -1.3182992 0.0000000 0.6497391 0.0000000 -1.0386445 7 O -1.3688721 -0.0507688 -0.0354519 -0.0947119 -1.8046915 -0.4286337 -0.0252617 -0.5046874 -1.4422324 8 O -1.3688721 0.0507688 -0.0354519 0.0947119 -1.8046915 0.4286337 -0.0252617 0.5046874 -1.4422324 9 O -2.0816918 0.3140421 -0.1562373 0.3208467 -1.3315094 0.1322927 -0.1848143 0.1752345 -1.2294129 10 O -2.0816918 -0.3140421 -0.1562373 -0.3208467 -1.3315094 -0.1322927 -0.1848143 -0.1752345 -1.2294129 11 O -2.0816918 0.3140421 -0.1562373 0.3208467 -1.3315094 0.1322927 -0.1848143 0.1752345 -1.2294129 12 O -2.0816918 -0.3140421 -0.1562373 -0.3208467 -1.3315094 -0.1322927 -0.1848143 -0.1752345 -1.2294129 13 O -1.3688721 0.0507688 -0.0354519 0.0947119 -1.8046915 0.4286337 -0.0252617 0.5046874 -1.4422324 14 O -1.3688721 -0.0507688 -0.0354519 -0.0947119 -1.8046915 -0.4286337 -0.0252617 -0.5046874 -1.4422324 15 Na 1.0029748 0.1132669 -0.0027499 0.0878061 0.9824915 0.0472870 0.0040763 0.0191720 1.0955528 16 Na 1.0029748 -0.1132669 -0.0027499 -0.0878061 0.9824915 -0.0472870 0.0040763 -0.0191720 1.0955528 17 Na 1.0029748 0.1132669 -0.0027499 0.0878061 0.9824915 0.0472870 0.0040763 0.0191720 1.0955528 18 Na 1.0029748 -0.1132669 -0.0027499 -0.0878061 0.9824915 -0.0472870 0.0040763 -0.0191720 1.0955528 19 Na 1.0678714 0.0516201 0.0297425 0.0546995 1.1337127 0.0380459 0.0127648 0.0765943 1.0224722 20 Na 1.0678714 -0.0516201 0.0297425 -0.0546995 1.1337127 -0.0380459 0.0127648 -0.0765943 1.0224722 21 Na 1.0678714 0.0516201 0.0297425 0.0546995 1.1337127 0.0380459 0.0127648 0.0765943 1.0224722 22 Na 1.0678714 -0.0516201 0.0297425 -0.0546995 1.1337127 -0.0380459 0.0127648 -0.0765943 1.0224722 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000004 (xxy) 0.00000004 (xxy) 0.00000004 (xyx) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 8 8 9 ] 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: 0.66, Number of G-points: 299, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/165) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency 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 2.462 ( 0.000 0.000 0.000) 0.000 2.928 ( 0.000 0.000 0.000) 0.000 3.547 ( 0.000 0.000 0.000) 0.000 3.586 ( 0.000 0.000 0.000) 0.000 3.921 ( 0.000 0.000 0.000) 0.000 4.159 ( 0.000 0.000 0.000) 0.000 4.384 ( 0.000 0.000 0.000) 0.000 4.420 ( 0.000 0.000 0.000) 0.000 4.630 ( 0.000 0.000 0.000) 0.000 4.741 ( 0.000 0.000 0.000) 0.000 4.789 ( 0.000 0.000 0.000) 0.000 5.072 ( 0.000 0.000 0.000) 0.000 5.408 ( 0.000 0.000 0.000) 0.000 5.579 ( 0.000 0.000 0.000) 0.000 5.600 ( 0.000 0.000 0.000) 0.000 5.917 ( 0.000 0.000 0.000) 0.000 5.957 ( 0.000 0.000 0.000) 0.000 6.046 ( 0.000 0.000 0.000) 0.000 6.073 ( 0.000 0.000 0.000) 0.000 6.137 ( 0.000 0.000 0.000) 0.000 6.295 ( 0.000 0.000 0.000) 0.000 6.392 ( 0.000 0.000 0.000) 0.000 6.514 ( 0.000 0.000 0.000) 0.000 6.587 ( 0.000 0.000 0.000) 0.000 6.708 ( 0.000 0.000 0.000) 0.000 6.787 ( 0.000 0.000 0.000) 0.000 6.914 ( 0.000 0.000 0.000) 0.000 7.188 ( 0.000 0.000 0.000) 0.000 7.320 ( 0.000 0.000 0.000) 0.000 7.367 ( 0.000 0.000 0.000) 0.000 7.421 ( 0.000 0.000 0.000) 0.000 7.653 ( 0.000 0.000 0.000) 0.000 7.690 ( 0.000 0.000 0.000) 0.000 7.727 ( 0.000 0.000 0.000) 0.000 7.823 ( 0.000 0.000 0.000) 0.000 8.045 ( 0.000 0.000 0.000) 0.000 8.152 ( 0.000 0.000 0.000) 0.000 8.328 ( 0.000 0.000 0.000) 0.000 9.029 ( 0.000 0.000 0.000) 0.000 13.094 ( 0.000 0.000 0.000) 0.000 13.151 ( 0.000 0.000 0.000) 0.000 14.515 ( 0.000 0.000 0.000) 0.000 14.874 ( 0.000 0.000 0.000) 0.000 17.327 ( 0.000 0.000 0.000) 0.000 17.351 ( 0.000 0.000 0.000) 0.000 17.515 ( 0.000 0.000 0.000) 0.000 17.985 ( 0.000 0.000 0.000) 0.000 21.019 ( 0.000 0.000 0.000) 0.000 21.489 ( 0.000 0.000 0.000) 0.000 21.769 ( 0.000 0.000 0.000) 0.000 21.827 ( 0.000 0.000 0.000) 0.000 24.049 ( 0.000 0.000 0.000) 0.000 24.146 ( 0.000 0.000 0.000) 0.000 28.148 ( 0.000 0.000 0.000) 0.000 28.265 ( 0.000 0.000 0.000) 0.000 32.646 ( 0.000 0.000 0.000) 0.000 32.705 ( 0.000 0.000 0.000) 0.000 36.280 ( 0.000 0.000 0.000) 0.000 36.963 ( 0.000 0.000 0.000) 0.000 39.863 ( 0.000 0.000 0.000) 0.000 40.233 ( 0.000 0.000 0.000) 0.000 40.500 ( 0.000 0.000 0.000) 0.000 40.762 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/165) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.630 ( 21.450 -22.173 4.176) 31.132 0.810 ( 33.645 -26.343 -2.168) 42.786 1.204 ( 34.742 -45.088 10.159) 57.820 2.539 ( 5.122 -4.575 2.770) 7.405 2.947 ( 1.331 -1.821 -1.086) 2.504 3.459 ( -3.408 2.126 -21.944) 22.308 3.575 ( -7.391 -0.461 15.571) 17.242 3.897 ( -8.505 -2.953 -0.517) 9.018 4.238 ( 2.941 10.415 4.050) 11.555 4.381 ( 0.971 1.715 0.711) 2.095 4.431 ( 4.277 5.417 5.879) 9.066 4.539 ( 1.883 10.030 0.133) 10.206 4.792 ( 1.941 13.455 4.100) 14.199 4.852 ( 2.528 -1.635 3.965) 4.979 5.079 ( 1.114 6.382 15.518) 16.816 5.346 ( -6.827 2.838 2.724) 7.879 5.543 ( -2.348 -1.298 -1.397) 3.024 5.699 ( 4.441 -1.673 -1.517) 4.982 5.799 ( -9.605 8.002 -3.589) 13.007 5.905 ( -4.404 -4.812 0.555) 6.547 6.047 ( 0.347 -1.437 5.168) 5.375 6.064 ( -2.981 7.123 4.952) 9.174 6.157 ( -4.074 -2.215 3.386) 5.742 6.296 ( -3.138 -0.630 0.198) 3.207 6.403 ( 4.681 -3.454 -2.437) 6.307 6.572 ( 1.130 3.510 0.134) 3.690 6.610 ( 1.484 -0.931 0.811) 1.930 6.746 ( 2.867 2.381 -4.039) 5.496 6.921 ( 3.712 3.606 -0.227) 5.180 6.943 ( -2.004 -8.709 -2.055) 9.170 7.132 ( 2.347 0.981 -4.401) 5.083 7.357 ( -3.089 2.341 -5.243) 6.520 7.406 ( -0.046 -2.183 -1.362) 2.574 7.468 ( 4.397 -3.229 -1.200) 5.585 7.666 ( 2.822 0.063 1.799) 3.347 7.742 ( 3.990 -1.683 1.392) 4.548 7.766 ( -0.041 -2.443 4.930) 5.502 7.974 ( 12.353 5.660 4.903) 14.446 8.065 ( 5.064 -0.001 -2.130) 5.494 8.317 ( -1.908 -0.792 -0.588) 2.148 9.001 ( -0.401 3.522 1.386) 3.806 10.169 ( -43.744 -18.308 -1.023) 47.431 13.115 ( 1.086 1.591 -1.722) 2.584 13.165 ( -3.305 -3.710 1.156) 5.101 14.526 ( 2.217 -0.306 -2.193) 3.134 14.877 ( 1.440 1.420 -1.949) 2.809 17.337 ( -1.743 -0.613 -0.891) 2.051 17.365 ( -1.566 -1.264 1.114) 2.300 17.612 ( 10.300 5.292 -9.638) 15.066 18.004 ( 0.853 -1.177 1.368) 1.996 21.072 ( 1.512 3.964 10.299) 11.138 21.495 ( 0.281 -0.525 -0.223) 0.636 21.764 ( -0.190 0.692 0.874) 1.131 21.884 ( -3.383 -2.769 -0.121) 4.374 24.098 ( -3.067 -2.782 -0.634) 4.189 24.150 ( -0.274 -0.608 0.223) 0.703 28.154 ( 0.238 -0.425 -0.475) 0.680 28.265 ( 0.480 0.463 0.125) 0.678 32.743 ( 3.058 -2.089 0.890) 3.808 33.132 ( 66.063 32.372 -53.920) 91.212 36.543 ( -14.456 -10.058 -10.247) 20.375 36.975 ( 0.632 -1.327 -1.666) 2.221 39.811 ( -0.916 4.918 -2.997) 5.832 40.277 ( -1.119 10.203 6.333) 12.061 40.717 ( 19.939 1.232 6.362) 20.966 42.403 ( -1.772 1.544 7.011) 7.394 ======================= Grid point 2 (3/165) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.220 ( 19.480 -19.796 3.805) 28.033 1.579 ( 32.011 -23.164 -2.230) 39.575 2.209 ( 19.588 -29.725 9.356) 36.807 2.725 ( 6.616 -8.437 2.481) 11.005 3.006 ( 2.929 -3.281 -5.985) 7.427 3.310 ( 0.124 -2.948 -15.643) 15.918 3.562 ( -6.566 -0.715 13.290) 14.841 3.806 ( -12.120 -0.698 2.571) 12.409 4.123 ( 1.409 6.866 -4.782) 8.485 4.238 ( 0.859 18.681 3.301) 18.990 4.406 ( 5.393 0.382 -4.275) 6.892 4.502 ( -0.662 1.235 -2.197) 2.606 4.645 ( -3.647 1.785 0.157) 4.063 4.923 ( 4.922 -0.109 1.440) 5.129 5.001 ( -4.687 6.359 3.926) 8.822 5.211 ( -7.597 4.575 7.264) 11.463 5.410 ( -11.024 7.881 -0.620) 13.566 5.603 ( -2.994 1.672 0.779) 3.516 5.845 ( 8.724 -3.810 -3.286) 10.071 5.913 ( -4.164 6.224 4.282) 8.627 5.972 ( -9.270 -8.411 5.887) 13.832 6.085 ( 4.748 4.408 -0.101) 6.480 6.129 ( -8.124 -3.408 6.228) 10.789 6.302 ( 2.326 0.399 -1.790) 2.962 6.459 ( -1.231 -2.954 -4.606) 5.609 6.517 ( -0.922 4.271 4.435) 6.226 6.593 ( 0.568 3.447 -1.316) 3.733 6.734 ( 3.687 1.194 -4.894) 6.243 6.865 ( 3.146 5.965 -5.195) 8.513 7.020 ( 1.551 -0.628 -3.266) 3.670 7.198 ( 1.410 -5.650 -3.715) 6.907 7.263 ( -0.325 1.837 -2.309) 2.969 7.431 ( 0.409 -1.478 0.808) 1.734 7.512 ( 0.514 2.070 -0.357) 2.163 7.723 ( 5.829 0.425 1.668) 6.078 7.801 ( -2.884 -2.130 1.380) 3.841 7.850 ( 4.154 -4.348 3.332) 6.875 8.095 ( 7.501 -2.003 1.486) 7.904 8.149 ( 7.440 -0.898 0.869) 7.544 8.346 ( 3.872 -4.010 0.904) 5.647 8.925 ( -0.037 6.558 2.043) 6.869 9.853 ( -34.798 -2.014 -0.761) 34.865 13.091 ( 1.087 2.194 -1.258) 2.753 13.194 ( -1.977 -3.235 0.862) 3.888 14.553 ( 3.136 -0.502 -3.259) 4.550 14.859 ( 0.056 1.500 0.221) 1.517 17.327 ( -0.620 -0.344 -0.767) 1.044 17.366 ( -1.124 -0.293 0.680) 1.346 17.610 ( 4.013 1.798 -4.011) 5.952 18.043 ( 0.787 -1.430 1.842) 2.461 21.073 ( 0.823 1.751 4.398) 4.805 21.508 ( 0.339 -0.698 -0.334) 0.844 21.755 ( -0.063 0.734 1.179) 1.390 21.886 ( -1.587 -1.248 0.010) 2.019 24.104 ( -1.182 -1.502 -0.488) 1.973 24.159 ( -0.477 -0.803 0.390) 1.012 28.165 ( 0.000 -0.962 -0.196) 0.982 28.262 ( 0.644 0.853 0.172) 1.082 32.837 ( 4.418 -3.056 1.455) 5.565 33.175 ( 27.786 11.598 -22.535) 37.609 36.473 ( -8.068 -2.168 -3.447) 9.037 36.998 ( 0.736 -1.457 -1.960) 2.551 39.682 ( -1.902 6.500 -3.605) 7.672 40.177 ( -2.922 2.768 3.329) 5.223 40.942 ( 13.593 -1.503 3.661) 14.158 42.384 ( -2.148 0.494 2.593) 3.404 ======================= Grid point 3 (4/165) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( 15.397 -15.424 3.235) 22.033 2.235 ( 28.675 -14.300 -3.145) 32.197 2.486 ( -8.073 -1.570 4.665) 9.455 2.891 ( -4.426 -5.529 0.010) 7.082 3.015 ( 4.571 0.145 -12.489) 13.300 3.471 ( -5.551 -5.900 7.271) 10.885 3.661 ( 7.062 -0.528 -0.540) 7.103 3.764 ( 4.429 -12.722 4.161) 14.099 3.966 ( 0.323 11.717 -1.746) 11.850 4.065 ( -1.617 1.499 1.497) 2.665 4.346 ( -5.208 4.546 -1.905) 7.171 4.494 ( 1.949 -4.109 -5.501) 7.137 4.685 ( 5.541 -1.950 0.827) 5.931 4.832 ( -3.695 6.903 -1.717) 8.016 5.015 ( 0.910 -2.370 5.379) 5.948 5.107 ( -3.717 1.406 4.875) 6.290 5.212 ( -6.949 1.463 0.345) 7.109 5.486 ( -2.921 9.605 0.008) 10.039 5.771 ( -4.571 12.002 0.544) 12.855 5.942 ( -3.281 -2.731 5.027) 6.595 5.998 ( 1.035 -2.042 2.526) 3.409 6.026 ( -5.128 -4.388 -4.596) 8.165 6.209 ( 1.883 -5.288 4.679) 7.307 6.299 ( -0.306 1.007 -1.478) 1.814 6.437 ( -0.436 3.704 -1.016) 3.865 6.475 ( -0.711 -0.407 -4.398) 4.474 6.549 ( 4.217 5.873 8.142) 10.889 6.721 ( -3.241 2.500 -10.257) 11.043 6.794 ( 3.632 -0.518 -3.035) 4.761 6.982 ( 1.740 3.661 -4.092) 5.760 7.239 ( 1.044 -0.113 -3.403) 3.561 7.299 ( 3.552 -0.388 3.328) 4.883 7.436 ( -5.777 -0.505 -5.004) 7.659 7.499 ( 1.710 -3.341 5.453) 6.620 7.740 ( -0.811 3.286 -0.187) 3.390 7.825 ( 1.428 -2.640 2.081) 3.652 7.993 ( 5.879 -4.057 0.197) 7.146 8.146 ( -1.664 -0.823 -0.385) 1.896 8.253 ( 5.852 -1.321 0.476) 6.018 8.565 ( 11.082 -8.112 3.670) 14.216 8.831 ( 4.177 8.373 1.626) 9.497 9.452 ( -29.897 2.500 -1.193) 30.026 13.066 ( 0.349 1.400 -0.646) 1.580 13.222 ( -0.795 -1.862 0.432) 2.070 14.581 ( 2.276 -0.454 -2.497) 3.409 14.838 ( -0.284 1.126 0.702) 1.357 17.327 ( 0.222 -0.370 -0.518) 0.674 17.356 ( -1.097 0.137 0.434) 1.187 17.614 ( 1.689 0.512 -1.671) 2.430 18.076 ( 0.337 -0.886 1.253) 1.571 21.075 ( 0.433 0.758 1.872) 2.065 21.519 ( 0.190 -0.453 -0.246) 0.549 21.751 ( 0.083 0.380 0.812) 0.900 21.886 ( -0.762 -0.496 0.060) 0.911 24.111 ( -0.413 -0.782 -0.343) 0.948 24.166 ( -0.403 -0.526 0.342) 0.746 28.180 ( -0.038 -0.990 -0.090) 0.995 28.255 ( 0.452 0.885 0.127) 1.002 32.934 ( 3.198 -2.278 1.258) 4.123 33.216 ( 11.663 4.124 -9.605) 15.662 36.406 ( -4.201 -0.164 -1.230) 4.380 37.017 ( 0.451 -0.850 -1.214) 1.549 39.562 ( -1.425 4.096 -2.182) 4.855 40.136 ( -1.603 0.748 1.532) 2.340 41.101 ( 7.319 -1.187 1.795) 7.629 42.364 ( -1.578 0.127 0.933) 1.838 ======================= Grid point 4 (5/165) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 146 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( -0.000 -0.000 -0.000) 0.000 2.333 ( 0.000 -0.000 0.000) 0.000 2.678 ( -0.000 -0.000 0.000) 0.000 2.785 ( 0.000 -0.000 0.000) 0.000 3.025 ( 0.000 -0.000 0.000) 0.000 3.477 ( 0.000 -0.000 0.000) 0.000 3.680 ( -0.000 -0.000 -0.000) 0.000 3.852 ( 0.000 -0.000 0.000) 0.000 3.906 ( -0.000 -0.000 0.000) 0.000 4.121 ( 0.000 -0.000 -0.000) 0.000 4.299 ( 0.000 -0.000 0.000) 0.000 4.577 ( 0.000 -0.000 0.000) 0.000 4.692 ( -0.000 -0.000 0.000) 0.000 4.767 ( 0.000 -0.000 0.000) 0.000 5.002 ( -0.000 -0.000 0.000) 0.000 5.184 ( -0.000 -0.000 0.000) 0.000 5.200 ( 0.000 0.000 0.000) 0.000 5.334 ( 0.000 -0.000 0.000) 0.000 5.545 ( 0.000 -0.000 0.000) 0.000 5.962 ( 0.000 -0.000 0.000) 0.000 6.030 ( -0.000 0.000 -0.000) 0.000 6.048 ( 0.000 -0.000 0.000) 0.000 6.259 ( 0.000 -0.000 0.000) 0.000 6.331 ( 0.000 -0.000 0.000) 0.000 6.350 ( -0.000 -0.000 0.000) 0.000 6.462 ( 0.000 -0.000 0.000) 0.000 6.588 ( -0.000 -0.000 -0.000) 0.000 6.602 ( 0.000 -0.000 0.000) 0.000 6.852 ( -0.000 -0.000 -0.000) 0.000 6.938 ( 0.000 -0.000 0.000) 0.000 7.225 ( 0.000 -0.000 0.000) 0.000 7.359 ( 0.000 0.000 0.000) 0.000 7.364 ( -0.000 -0.000 -0.000) 0.000 7.585 ( 0.000 -0.000 0.000) 0.000 7.676 ( 0.000 -0.000 0.000) 0.000 7.866 ( 0.000 -0.000 0.000) 0.000 8.084 ( -0.000 0.000 0.000) 0.000 8.119 ( 0.000 -0.000 0.000) 0.000 8.304 ( -0.000 -0.000 0.000) 0.000 8.716 ( 0.000 0.000 0.000) 0.000 8.847 ( -0.000 -0.000 0.000) 0.000 9.177 ( 0.000 -0.000 0.000) 0.000 13.055 ( 0.000 -0.000 0.000) 0.000 13.234 ( 0.000 -0.000 0.000) 0.000 14.594 ( 0.000 -0.000 0.000) 0.000 14.828 ( 0.000 -0.000 0.000) 0.000 17.334 ( 0.000 -0.000 0.000) 0.000 17.345 ( 0.000 -0.000 0.000) 0.000 17.617 ( 0.000 -0.000 0.000) 0.000 18.087 ( 0.000 -0.000 0.000) 0.000 21.075 ( 0.000 -0.000 0.000) 0.000 21.523 ( 0.000 -0.000 0.000) 0.000 21.751 ( 0.000 -0.000 0.000) 0.000 21.885 ( 0.000 -0.000 0.000) 0.000 24.115 ( 0.000 -0.000 0.000) 0.000 24.168 ( 0.000 -0.000 -0.000) 0.000 28.189 ( 0.000 -0.000 0.000) 0.000 28.250 ( 0.000 -0.000 0.000) 0.000 32.976 ( -0.000 -0.000 0.000) 0.000 33.232 ( 0.000 -0.000 0.000) 0.000 36.379 ( 0.000 -0.000 0.000) 0.000 37.024 ( 0.000 -0.000 0.000) 0.000 39.515 ( 0.000 -0.000 0.000) 0.000 40.125 ( 0.000 -0.000 0.000) 0.000 41.158 ( 0.000 -0.000 0.000) 0.000 42.355 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 10 (6/165) ======================= q-point: ( 0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.633 ( 23.831 -0.000 13.209) 27.247 0.959 ( 33.802 -0.000 15.836) 37.328 1.713 ( 69.841 -0.000 1.011) 69.848 2.604 ( 8.567 -0.000 4.867) 9.853 2.948 ( 2.686 -0.000 -2.653) 3.775 3.295 ( -8.898 0.000 -22.252) 23.965 3.541 ( -8.082 0.000 12.842) 15.174 3.755 ( -10.623 0.000 0.418) 10.631 4.324 ( -6.420 0.000 1.887) 6.692 4.425 ( 4.278 -0.000 -3.835) 5.745 4.449 ( 3.417 -0.000 -4.551) 5.691 4.765 ( 7.865 -0.000 2.112) 8.144 4.785 ( -1.170 0.000 -5.764) 5.881 5.019 ( -4.320 0.000 -1.528) 4.582 5.075 ( -22.063 0.000 23.151) 31.981 5.295 ( -7.847 0.000 2.867) 8.355 5.505 ( -8.436 0.000 9.684) 12.843 5.667 ( -15.255 0.000 -12.692) 19.845 5.682 ( -2.096 0.000 -0.310) 2.119 5.793 ( -7.496 0.000 4.882) 8.945 5.978 ( -12.285 0.000 10.013) 15.849 6.115 ( 5.320 -0.000 8.052) 9.651 6.309 ( 0.122 -0.000 -0.016) 0.123 6.316 ( 3.000 -0.000 9.647) 10.103 6.437 ( 4.646 -0.000 0.493) 4.672 6.501 ( 2.072 -0.000 -5.919) 6.271 6.684 ( 9.775 -0.000 -13.405) 16.591 6.773 ( -2.626 0.000 -0.359) 2.650 6.826 ( 3.561 -0.000 -0.705) 3.630 6.971 ( 3.542 -0.000 5.522) 6.560 7.212 ( 2.943 -0.000 -0.121) 2.946 7.282 ( -7.439 0.000 -1.951) 7.691 7.332 ( -1.361 0.000 -7.791) 7.909 7.526 ( 9.912 -0.000 -4.355) 10.827 7.666 ( -0.593 0.000 -0.021) 0.594 7.799 ( 3.403 -0.000 5.441) 6.418 7.845 ( 8.528 -0.000 3.675) 9.286 8.086 ( 0.119 -0.000 3.643) 3.645 8.147 ( 3.286 -0.000 0.011) 3.286 8.246 ( -4.910 0.000 -2.875) 5.689 9.031 ( -0.552 0.000 2.397) 2.460 9.606 ( -15.598 0.000 8.758) 17.889 13.115 ( 2.848 -0.000 -1.932) 3.442 13.175 ( 2.859 -0.000 -2.006) 3.492 14.534 ( 2.152 -0.000 -2.342) 3.181 14.894 ( 0.641 -0.000 -2.127) 2.221 17.325 ( -0.228 0.000 0.535) 0.582 17.356 ( -0.036 0.000 1.083) 1.084 17.719 ( 5.601 -0.000 -13.142) 14.286 17.939 ( -4.924 0.000 2.948) 5.739 21.160 ( -3.701 0.000 11.603) 12.179 21.475 ( -0.912 0.000 -0.634) 1.111 21.771 ( -0.561 0.000 1.522) 1.622 21.830 ( -0.048 0.000 0.722) 0.724 24.065 ( 1.610 -0.000 -0.487) 1.682 24.144 ( -0.363 0.000 0.352) 0.505 28.151 ( 0.089 -0.000 -0.535) 0.543 28.276 ( 0.796 -0.000 -0.233) 0.830 32.778 ( 4.896 -0.000 2.601) 5.544 33.806 ( 28.763 -0.000 -85.075) 89.806 36.278 ( -0.181 0.000 0.584) 0.611 36.966 ( 1.070 -0.000 -2.370) 2.601 39.797 ( -2.923 0.000 -6.580) 7.200 40.529 ( 1.540 -0.000 2.177) 2.667 40.681 ( -6.493 0.000 -0.384) 6.505 42.515 ( 0.712 -0.000 11.815) 11.836 ======================= Grid point 11 (7/165) ======================= q-point: ( 0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( 21.511 -19.576 7.011) 29.918 1.542 ( 28.062 -16.863 13.108) 35.265 2.508 ( 50.832 -0.154 1.030) 50.842 2.740 ( 7.474 -1.777 3.135) 8.297 2.990 ( 5.898 -1.861 -7.609) 9.805 3.146 ( -3.876 -6.097 -12.664) 14.580 3.510 ( -6.410 -2.312 10.395) 12.429 3.666 ( -8.080 -1.766 4.492) 9.412 4.198 ( -5.337 5.272 -1.447) 7.641 4.447 ( 5.714 2.301 -4.420) 7.582 4.462 ( -0.595 3.316 -6.985) 7.755 4.612 ( -2.936 10.879 -0.412) 11.276 4.648 ( -3.969 11.865 -4.404) 13.264 4.937 ( 0.351 -4.743 2.164) 5.225 5.050 ( -9.224 2.334 7.290) 11.986 5.187 ( -7.580 1.450 0.214) 7.720 5.318 ( -15.737 3.973 0.839) 16.252 5.511 ( -8.680 -5.087 -2.099) 10.278 5.711 ( -3.829 -5.493 2.498) 7.146 5.787 ( -5.259 -5.669 1.309) 7.843 5.944 ( -8.879 -5.642 8.529) 13.543 6.102 ( 0.695 10.690 0.159) 10.714 6.261 ( 8.030 4.621 5.385) 10.716 6.329 ( -7.351 -1.367 -0.804) 7.521 6.430 ( 4.214 6.250 -2.433) 7.921 6.612 ( 6.049 -2.508 -2.847) 7.141 6.669 ( 3.110 5.951 7.977) 10.427 6.772 ( 5.223 0.383 -7.180) 8.887 6.948 ( 4.256 -5.285 -6.426) 9.346 7.022 ( -0.707 5.553 0.724) 5.644 7.105 ( -0.973 -3.514 1.135) 3.819 7.276 ( -1.198 1.483 -7.221) 7.468 7.340 ( -0.973 -6.178 -0.504) 6.275 7.569 ( -0.538 2.391 -1.621) 2.939 7.689 ( -0.985 -4.744 -0.733) 4.900 7.877 ( 5.622 2.561 3.751) 7.228 7.890 ( 5.738 2.699 2.415) 6.786 8.121 ( 0.688 -1.680 0.805) 1.986 8.198 ( 0.253 -2.406 1.270) 2.732 8.291 ( 5.379 -7.466 3.017) 9.684 9.016 ( 0.814 2.981 2.557) 4.010 9.448 ( -24.611 -1.675 5.813) 25.343 13.152 ( 4.456 0.826 -3.474) 5.710 13.183 ( 3.420 1.582 -0.596) 3.815 14.556 ( 2.125 -0.950 -3.469) 4.177 14.881 ( -0.178 1.231 0.065) 1.246 17.326 ( 0.325 0.151 0.510) 0.623 17.360 ( -0.220 0.114 1.095) 1.123 17.676 ( 2.803 3.964 -5.431) 7.284 17.955 ( -5.069 -6.261 1.249) 8.151 21.140 ( -0.709 2.868 6.012) 6.699 21.478 ( -1.238 -1.875 -0.603) 2.327 21.765 ( -0.896 0.428 1.964) 2.201 21.848 ( -0.506 -1.545 0.682) 1.764 24.090 ( 1.840 -0.412 -0.493) 1.949 24.145 ( -0.445 -0.562 0.382) 0.812 28.154 ( 0.181 -0.463 -0.230) 0.548 28.280 ( 0.578 0.460 -0.260) 0.783 32.868 ( 5.538 -1.271 3.460) 6.652 33.611 ( 19.716 16.730 -40.590) 48.127 36.327 ( -2.580 -4.539 -0.601) 5.256 36.977 ( 1.148 -1.105 -2.980) 3.379 39.699 ( -3.776 3.006 -8.123) 9.449 40.317 ( -0.023 13.135 4.165) 13.779 40.848 ( -4.243 -15.156 -1.206) 15.785 42.518 ( 4.873 7.253 8.071) 11.895 ======================= Grid point 12 (8/165) ======================= q-point: ( 0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( 18.070 -14.416 3.148) 23.329 2.174 ( 18.098 -19.800 10.235) 28.711 2.585 ( 0.010 10.082 -7.089) 12.325 2.887 ( 7.577 2.761 -0.833) 8.107 3.103 ( 15.179 0.881 -6.075) 16.373 3.251 ( -9.102 -8.642 3.455) 13.018 3.627 ( -3.194 -4.978 7.618) 9.644 3.769 ( 18.726 -6.960 0.777) 19.993 4.069 ( -6.779 3.083 3.811) 8.366 4.180 ( 0.597 11.816 -4.790) 12.764 4.386 ( -3.165 7.414 -1.576) 8.214 4.505 ( 5.594 1.739 -3.822) 6.995 4.627 ( 0.884 -5.687 -10.385) 11.873 4.868 ( -4.361 5.428 -0.666) 6.995 5.020 ( -2.835 -6.669 -0.257) 7.251 5.086 ( -9.184 7.425 11.216) 16.287 5.141 ( -4.535 -1.078 -2.270) 5.185 5.545 ( -1.995 -2.273 2.268) 3.781 5.734 ( -10.169 -6.716 4.233) 12.901 5.821 ( -3.333 -4.645 -2.805) 6.368 5.895 ( -3.243 6.487 1.282) 7.365 6.043 ( -3.007 -5.983 2.951) 7.318 6.196 ( -12.427 -1.879 -7.639) 14.707 6.262 ( 5.130 7.267 -0.111) 8.896 6.373 ( 1.274 4.080 -0.235) 4.281 6.619 ( 5.737 7.006 2.993) 9.537 6.708 ( 1.396 2.497 8.006) 8.502 6.788 ( 0.119 8.659 -8.362) 12.038 6.843 ( 8.140 1.106 -0.242) 8.219 7.039 ( 1.341 0.527 -4.732) 4.947 7.208 ( -4.503 0.160 -0.795) 4.576 7.268 ( 5.728 -9.330 -2.636) 11.261 7.342 ( -4.841 0.334 -3.995) 6.285 7.541 ( 1.885 -0.716 1.485) 2.504 7.723 ( -2.118 -1.342 -0.089) 2.509 7.865 ( 2.364 2.630 2.816) 4.521 7.991 ( 4.533 -2.714 0.865) 5.354 8.123 ( -0.437 -0.037 -0.953) 1.049 8.264 ( 0.422 -2.829 0.990) 3.027 8.506 ( 0.980 -8.754 5.790) 10.541 9.008 ( 4.721 4.262 2.619) 6.878 9.171 ( -20.355 0.898 3.838) 20.733 13.138 ( 4.226 4.526 -1.992) 6.505 13.226 ( 4.475 -0.283 -1.167) 4.633 14.577 ( 1.211 -1.008 -3.511) 3.848 14.856 ( -0.872 1.518 1.264) 2.159 17.334 ( 1.122 0.058 0.369) 1.182 17.356 ( -0.192 0.558 0.839) 1.025 17.637 ( 0.507 1.720 -1.533) 2.359 17.995 ( -4.773 -5.659 -0.039) 7.403 21.115 ( 0.160 2.395 2.830) 3.711 21.492 ( -1.235 -1.933 -0.424) 2.333 21.756 ( -1.085 0.319 1.735) 2.071 21.866 ( -0.335 -1.124 0.542) 1.292 24.113 ( 1.732 0.007 -0.101) 1.735 24.154 ( 0.042 -0.777 0.050) 0.779 28.167 ( 0.344 -0.841 -0.078) 0.912 28.272 ( 0.054 0.851 -0.241) 0.886 32.956 ( 3.504 -0.577 3.616) 5.068 33.447 ( 11.926 11.907 -19.133) 25.497 36.348 ( -1.391 -2.026 0.037) 2.458 36.997 ( 0.728 -1.400 -2.481) 2.941 39.571 ( -3.271 2.922 -6.652) 7.968 40.200 ( 1.234 5.700 2.971) 6.545 40.977 ( -7.666 -10.893 -2.009) 13.471 42.500 ( 7.140 7.773 6.001) 12.141 ======================= Grid point 13 (9/165) ======================= q-point: ( 0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( 4.649 -2.232 1.760) 5.449 2.341 ( -3.076 6.901 -6.339) 9.862 2.649 ( 7.101 -9.284 9.230) 14.893 2.825 ( -1.871 5.424 0.211) 5.741 3.207 ( 16.435 7.255 -2.455) 18.132 3.295 ( -7.290 -10.185 -0.882) 12.556 3.660 ( -2.709 -0.716 0.649) 2.876 3.833 ( -12.907 5.150 4.289) 14.544 3.915 ( 6.712 -1.136 0.449) 6.822 4.283 ( 2.113 3.860 -2.322) 4.976 4.365 ( 16.018 1.552 2.123) 16.233 4.526 ( 2.461 -2.498 -1.826) 3.954 4.635 ( -5.306 -4.122 -9.491) 11.629 4.859 ( -1.083 12.451 6.675) 14.169 4.934 ( 0.498 -8.988 0.340) 9.008 5.068 ( -4.614 -4.314 -1.145) 6.420 5.198 ( 2.613 -8.673 -1.638) 9.205 5.422 ( 0.099 11.464 -0.931) 11.502 5.602 ( -7.344 10.854 1.066) 13.148 5.868 ( -7.315 -10.807 -1.387) 13.123 5.954 ( 2.791 -11.685 1.512) 12.108 6.043 ( 0.029 2.871 2.896) 4.078 6.168 ( -6.706 -10.310 -9.016) 15.250 6.239 ( -2.642 -2.398 -1.767) 3.981 6.296 ( -2.181 4.528 2.205) 5.488 6.515 ( 2.873 9.174 -0.495) 9.626 6.652 ( 1.986 8.103 -0.092) 8.343 6.725 ( 1.493 -0.211 2.381) 2.818 6.951 ( 9.160 3.713 4.091) 10.697 6.982 ( -1.898 3.181 0.189) 3.709 7.115 ( -8.569 -1.129 -3.258) 9.237 7.309 ( 0.048 -1.921 -1.737) 2.590 7.460 ( 8.765 -3.817 -1.110) 9.624 7.585 ( 0.489 -0.128 1.181) 1.285 7.699 ( 1.397 1.784 -2.164) 3.133 7.859 ( -1.779 0.716 1.370) 2.356 8.045 ( -2.317 -0.602 1.401) 2.774 8.132 ( 2.164 -1.085 -0.814) 2.554 8.278 ( -3.710 -0.585 0.376) 3.774 8.567 ( -12.188 -6.000 2.226) 13.766 8.815 ( -11.879 6.900 2.178) 13.909 9.290 ( 18.552 -6.990 3.288) 20.096 13.110 ( 3.663 4.056 -0.739) 5.515 13.270 ( 4.802 1.097 -1.519) 5.154 14.582 ( -0.518 -0.519 -1.818) 1.960 14.830 ( -1.038 0.818 1.161) 1.759 17.347 ( 0.487 0.831 0.713) 1.199 17.352 ( 1.265 -0.051 0.241) 1.289 17.615 ( -1.110 0.515 0.455) 1.306 18.016 ( -4.591 -4.435 -1.313) 6.517 21.093 ( 0.094 1.767 0.843) 1.960 21.503 ( -1.175 -1.465 -0.166) 1.885 21.745 ( -1.157 0.054 0.998) 1.529 21.881 ( 0.125 -0.691 0.362) 0.790 24.128 ( 1.073 0.235 0.407) 1.171 24.169 ( 1.158 -0.292 -0.442) 1.274 28.185 ( 0.442 -0.768 -0.038) 0.887 28.254 ( -0.478 0.876 -0.237) 1.025 32.983 ( -0.599 1.471 3.066) 3.453 33.329 ( 4.736 8.829 -7.892) 12.754 36.376 ( 1.518 -1.614 0.787) 2.351 37.013 ( 0.195 -1.011 -1.295) 1.655 39.494 ( -1.705 -0.177 -3.962) 4.317 40.172 ( 3.007 2.674 1.219) 4.205 40.988 ( -12.764 -7.210 -2.939) 14.951 42.496 ( 8.042 7.211 4.517) 11.708 ======================= Grid point 14 (10/165) ======================= q-point: (-0.38 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.813 ( -10.702 16.967 -1.014) 20.085 2.128 ( -16.999 12.045 0.109) 20.834 2.699 ( 12.049 7.067 -2.573) 14.203 2.915 ( 0.316 -6.708 6.370) 9.256 3.203 ( 5.848 11.047 8.227) 14.964 3.405 ( 1.805 -10.102 -9.917) 14.271 3.597 ( -9.182 2.850 1.377) 9.712 3.718 ( -5.193 -2.977 -0.062) 5.986 4.041 ( 8.206 0.173 3.414) 8.890 4.135 ( -3.263 15.087 -1.834) 15.544 4.399 ( 1.687 2.962 -1.282) 3.642 4.596 ( 2.786 1.860 3.163) 4.607 4.614 ( -0.038 0.251 -1.750) 1.769 4.720 ( 0.606 -5.226 -1.541) 5.482 5.032 ( 3.261 -2.977 -8.253) 9.360 5.081 ( -4.398 2.220 3.749) 6.191 5.259 ( -2.205 -1.205 -1.751) 3.063 5.398 ( 7.914 -4.318 0.194) 9.018 5.612 ( 4.339 -12.379 1.049) 13.160 5.862 ( -9.168 -4.234 -4.009) 10.865 6.016 ( -4.309 4.106 -2.582) 6.488 6.093 ( -4.576 -3.884 -2.042) 6.340 6.195 ( 5.310 -6.220 -0.475) 8.192 6.298 ( 0.567 -5.669 -1.573) 5.911 6.307 ( 0.620 -4.048 -1.108) 4.242 6.474 ( 4.932 2.515 0.965) 5.620 6.564 ( 1.957 6.765 6.596) 9.648 6.750 ( -2.556 -1.437 0.614) 2.996 6.879 ( 1.797 4.447 3.701) 6.058 6.981 ( -2.051 2.714 5.410) 6.391 7.100 ( -3.011 -6.877 -3.684) 8.363 7.335 ( 3.379 2.129 0.900) 4.094 7.518 ( -2.870 4.382 -2.010) 5.611 7.579 ( 8.619 2.899 2.350) 9.392 7.692 ( -2.705 0.024 -1.432) 3.060 7.826 ( -1.007 -0.876 -1.729) 2.184 7.993 ( -2.224 3.442 0.556) 4.136 8.160 ( -1.810 -0.207 0.859) 2.014 8.197 ( -6.884 2.183 -0.512) 7.240 8.437 ( -16.120 -0.458 -1.366) 16.184 8.717 ( -0.143 -2.595 0.050) 2.599 9.696 ( 23.214 -9.882 3.201) 25.432 13.092 ( 2.486 2.611 0.082) 3.606 13.289 ( 4.589 2.571 -1.581) 5.493 14.565 ( -2.248 0.217 0.530) 2.320 14.821 ( -0.525 -0.559 0.252) 0.807 17.345 ( 0.854 0.749 0.974) 1.497 17.370 ( 1.524 0.072 -0.066) 1.527 17.594 ( -2.386 0.157 1.545) 2.847 18.014 ( -4.350 -3.035 -2.318) 5.788 21.069 ( -0.226 1.190 -0.561) 1.335 21.508 ( -1.102 -0.793 0.067) 1.359 21.737 ( -0.925 -0.298 0.191) 0.990 21.895 ( 0.572 -0.404 0.203) 0.730 24.135 ( 0.716 0.384 0.466) 0.937 24.183 ( 1.744 0.590 -0.475) 1.901 28.195 ( 0.415 0.313 0.002) 0.520 28.237 ( -0.749 -0.094 -0.269) 0.801 32.924 ( -4.767 3.285 2.619) 6.354 33.198 ( -1.736 7.984 -1.190) 8.257 36.446 ( 4.115 -2.347 1.432) 4.950 37.021 ( -0.160 -0.242 -0.088) 0.303 39.506 ( 0.034 -4.004 -1.290) 4.207 40.192 ( 5.752 1.709 0.094) 6.001 40.880 ( -17.650 -4.049 -4.021) 18.550 42.498 ( 7.311 6.392 3.051) 10.179 ======================= Grid point 15 (11/165) ======================= q-point: (-0.25 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( -13.829 22.763 1.092) 26.657 1.608 ( -17.143 24.910 -0.720) 30.247 2.652 ( 9.617 18.021 -5.055) 21.043 2.860 ( -4.826 23.941 -0.802) 24.436 3.087 ( -4.447 10.158 5.636) 12.439 3.356 ( -5.152 -1.264 13.619) 14.616 3.520 ( 3.088 -6.725 -14.693) 16.451 3.821 ( 4.586 -10.317 -2.159) 11.494 4.039 ( 1.572 -3.541 2.736) 4.743 4.108 ( 1.823 0.631 5.072) 5.427 4.314 ( -8.134 -0.645 -4.580) 9.358 4.562 ( 2.264 6.250 2.416) 7.073 4.680 ( 5.847 0.038 -1.626) 6.069 4.820 ( -2.306 -5.989 -0.843) 6.472 5.006 ( 0.077 2.788 -0.706) 2.878 5.165 ( 6.512 -9.673 -0.857) 11.692 5.321 ( -2.041 -9.369 -0.931) 9.634 5.580 ( 7.108 -5.181 -1.487) 8.920 5.725 ( -6.015 -0.572 -2.609) 6.581 5.883 ( -3.964 -1.618 0.090) 4.283 5.921 ( -1.677 -11.475 -1.083) 11.648 6.130 ( -0.427 -2.207 -1.106) 2.505 6.216 ( 8.270 9.504 -6.763) 14.299 6.345 ( -0.194 -3.113 1.104) 3.309 6.429 ( 0.468 -8.505 0.279) 8.522 6.518 ( 0.761 -0.009 1.695) 1.858 6.548 ( 1.502 1.472 5.080) 5.498 6.711 ( -1.982 0.927 0.459) 2.236 6.861 ( -1.266 6.555 3.931) 7.747 7.022 ( 3.802 -6.321 6.486) 9.822 7.169 ( -1.282 -6.509 -4.422) 7.973 7.310 ( 0.694 5.486 2.817) 6.206 7.372 ( -6.469 3.769 -2.656) 7.944 7.603 ( 0.939 3.949 0.334) 4.073 7.655 ( 2.614 0.291 1.471) 3.014 7.836 ( -0.423 -0.173 -2.425) 2.468 7.904 ( 0.740 6.433 0.094) 6.476 8.026 ( -11.595 5.590 -0.945) 12.907 8.091 ( -5.113 1.521 -1.488) 5.538 8.326 ( -2.619 -0.703 -0.178) 2.718 8.808 ( 0.454 -7.349 -0.765) 7.403 10.129 ( 19.314 -10.677 2.225) 22.181 13.086 ( 0.840 0.919 0.367) 1.298 13.285 ( 3.749 3.382 -1.173) 5.184 14.534 ( -2.401 0.445 1.407) 2.818 14.834 ( -0.129 -1.362 -0.105) 1.373 17.353 ( 1.293 0.535 0.950) 1.691 17.385 ( 1.518 0.158 -0.186) 1.537 17.565 ( -3.427 0.201 1.875) 3.911 17.993 ( -3.406 -1.601 -2.235) 4.378 21.045 ( -0.495 0.742 -1.364) 1.629 21.503 ( -0.830 -0.121 0.141) 0.851 21.737 ( -0.391 -0.745 -0.235) 0.874 21.908 ( 0.751 -0.190 0.125) 0.785 24.138 ( 0.671 0.465 0.273) 0.861 24.185 ( 1.420 1.314 -0.213) 1.946 28.184 ( 0.112 1.239 0.044) 1.245 28.239 ( -0.448 -0.978 -0.228) 1.100 32.807 ( -7.323 3.692 3.033) 8.744 33.025 ( -5.609 8.416 1.835) 10.279 36.552 ( 4.732 -3.340 1.835) 6.076 37.016 ( -0.223 0.673 0.588) 0.921 39.598 ( 0.783 -6.758 0.368) 6.813 40.258 ( 10.510 1.897 0.270) 10.683 40.673 ( -21.054 -1.455 -4.949) 21.677 42.488 ( 4.728 5.268 1.376) 7.211 ======================= Grid point 16 (12/165) ======================= q-point: (-0.12 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.848 ( 0.000 26.735 0.000) 26.735 1.038 ( 0.000 31.529 0.000) 31.529 1.966 ( 0.000 58.920 0.000) 58.920 2.599 ( 0.000 7.417 0.000) 7.417 2.984 ( 0.000 3.765 0.000) 3.765 3.477 ( -0.000 -5.026 -0.000) 5.026 3.569 ( -0.000 -2.240 -0.000) 2.240 4.014 ( 0.000 4.381 0.000) 4.381 4.077 ( -0.000 -13.580 -0.000) 13.580 4.220 ( -0.000 -3.236 -0.000) 3.236 4.290 ( -0.000 -11.296 -0.000) 11.296 4.493 ( 0.000 3.711 0.000) 3.711 4.687 ( 0.000 1.011 0.000) 1.011 4.853 ( -0.000 -1.012 -0.000) 1.012 4.999 ( -0.000 -1.116 -0.000) 1.116 5.338 ( -0.000 -4.258 -0.000) 4.258 5.479 ( -0.000 -10.820 -0.000) 10.820 5.673 ( -0.000 -0.713 -0.000) 0.713 5.707 ( -0.000 -7.639 -0.000) 7.639 5.917 ( -0.000 -4.178 -0.000) 4.178 6.042 ( -0.000 -2.062 -0.000) 2.062 6.113 ( 0.000 6.642 0.000) 6.642 6.146 ( -0.000 -1.434 -0.000) 1.434 6.402 ( -0.000 -0.476 -0.000) 0.476 6.436 ( 0.000 4.627 0.000) 4.627 6.520 ( 0.000 0.126 0.000) 0.126 6.614 ( -0.000 -2.073 -0.000) 2.073 6.701 ( -0.000 -0.888 -0.000) 0.888 6.792 ( -0.000 -3.551 -0.000) 3.551 7.094 ( 0.000 5.925 0.000) 5.925 7.165 ( 0.000 6.633 0.000) 6.633 7.276 ( -0.000 -8.852 -0.000) 8.852 7.365 ( -0.000 -4.991 -0.000) 4.991 7.564 ( 0.000 3.801 0.000) 3.801 7.652 ( 0.000 4.164 0.000) 4.164 7.783 ( 0.000 3.617 0.000) 3.617 7.825 ( 0.000 5.333 0.000) 5.333 7.841 ( 0.000 2.606 0.000) 2.606 8.045 ( 0.000 0.367 0.000) 0.367 8.329 ( -0.000 -0.377 -0.000) 0.377 8.921 ( -0.000 -6.433 -0.000) 6.433 10.437 ( -0.000 -9.819 -0.000) 9.819 13.089 ( -0.000 -0.777 -0.000) 0.777 13.256 ( 0.000 3.358 0.000) 3.358 14.516 ( 0.000 0.212 0.000) 0.212 14.854 ( -0.000 -1.205 -0.000) 1.205 17.357 ( 0.000 0.367 0.000) 0.367 17.401 ( -0.000 -0.257 -0.000) 0.257 17.531 ( 0.000 0.871 0.000) 0.871 17.980 ( -0.000 -0.534 -0.000) 0.534 21.026 ( 0.000 0.554 0.000) 0.554 21.497 ( 0.000 0.283 0.000) 0.283 21.749 ( -0.000 -1.007 -0.000) 1.007 21.917 ( -0.000 -0.066 -0.000) 0.066 24.138 ( 0.000 0.352 0.000) 0.352 24.173 ( 0.000 1.398 0.000) 1.398 28.166 ( 0.000 1.070 0.000) 1.070 28.251 ( -0.000 -0.847 -0.000) 0.847 32.691 ( 0.000 3.621 0.000) 3.621 32.851 ( 0.000 8.161 0.000) 8.161 36.655 ( -0.000 -4.150 -0.000) 4.150 37.000 ( 0.000 1.419 0.000) 1.419 39.717 ( -0.000 -7.155 -0.000) 7.155 40.346 ( 0.000 5.340 0.000) 5.340 40.465 ( -0.000 -2.205 -0.000) 2.205 42.450 ( 0.000 3.753 0.000) 3.753 ======================= Grid point 19 (13/165) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.344 ( 25.762 -0.000 13.689) 29.173 1.831 ( 29.191 -0.000 11.614) 31.416 2.817 ( 2.246 -0.000 7.277) 7.616 2.958 ( -2.975 0.000 -14.632) 14.932 3.005 ( 5.606 -0.000 -7.257) 9.170 3.156 ( 38.416 -0.000 -1.817) 38.459 3.473 ( 5.779 -0.000 9.088) 10.770 3.633 ( 0.749 -0.000 8.539) 8.572 4.145 ( -8.895 0.000 -0.579) 8.914 4.456 ( 2.951 -0.000 -10.897) 11.289 4.527 ( 7.661 -0.000 -5.890) 9.664 4.624 ( -4.002 0.000 -13.538) 14.117 4.714 ( -18.137 0.000 9.198) 20.336 4.761 ( -14.197 0.000 -2.155) 14.360 4.957 ( 1.439 -0.000 0.561) 1.545 5.148 ( -6.966 0.000 2.308) 7.338 5.205 ( -14.707 0.000 -1.060) 14.745 5.310 ( -2.387 0.000 -7.901) 8.254 5.653 ( -3.820 0.000 2.385) 4.503 5.741 ( -2.538 0.000 10.368) 10.674 5.812 ( -7.272 0.000 7.482) 10.434 6.139 ( -9.408 0.000 -3.067) 9.895 6.299 ( 1.998 -0.000 1.606) 2.563 6.460 ( 2.564 -0.000 4.771) 5.417 6.471 ( -8.422 0.000 -2.165) 8.696 6.555 ( 7.948 -0.000 -0.974) 8.008 6.768 ( 5.217 -0.000 -3.054) 6.045 6.846 ( 6.815 -0.000 -3.864) 7.835 6.954 ( 7.994 -0.000 1.284) 8.096 7.094 ( 0.262 -0.000 8.187) 8.192 7.099 ( -4.821 0.000 -2.250) 5.321 7.109 ( -5.727 0.000 -6.324) 8.532 7.356 ( 7.427 -0.000 -4.579) 8.726 7.577 ( -7.796 0.000 0.471) 7.810 7.586 ( 0.613 -0.000 -5.065) 5.102 7.986 ( 8.816 -0.000 -0.800) 8.852 8.054 ( -3.175 0.000 3.154) 4.475 8.062 ( 5.276 -0.000 4.612) 7.007 8.132 ( -0.494 0.000 -2.229) 2.283 8.343 ( 5.185 -0.000 8.545) 9.994 9.063 ( 2.193 -0.000 2.245) 3.139 9.211 ( -22.989 0.000 7.199) 24.090 13.207 ( 6.967 -0.000 -3.424) 7.763 13.253 ( 5.396 -0.000 -2.612) 5.995 14.552 ( 1.142 -0.000 -3.298) 3.490 14.889 ( -0.535 0.000 0.503) 0.734 17.336 ( 0.742 -0.000 0.985) 1.233 17.368 ( 0.208 -0.000 1.238) 1.255 17.731 ( 2.761 -0.000 -7.077) 7.597 17.815 ( -7.949 0.000 4.330) 9.052 21.178 ( -1.038 0.000 4.996) 5.102 21.440 ( -1.421 0.000 -0.922) 1.694 21.764 ( -1.362 0.000 2.068) 2.477 21.839 ( 0.133 -0.000 1.085) 1.093 24.117 ( 3.129 -0.000 -0.541) 3.176 24.135 ( -0.645 0.000 0.415) 0.767 28.153 ( 0.391 -0.000 -0.066) 0.396 28.286 ( 0.194 -0.000 -0.505) 0.541 32.949 ( 6.290 -0.000 4.048) 7.480 33.723 ( 8.626 -0.000 -33.761) 34.845 36.292 ( 0.930 -0.000 1.030) 1.388 36.968 ( 1.167 -0.000 -3.425) 3.619 39.630 ( -4.593 0.000 -9.957) 10.966 40.479 ( -9.522 0.000 -0.436) 9.532 40.598 ( 2.083 -0.000 3.051) 3.694 42.670 ( 4.867 -0.000 6.971) 8.502 ======================= Grid point 20 (14/165) ======================= q-point: ( 0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.766 ( 20.804 -8.219 9.002) 24.112 2.248 ( 21.111 -7.344 8.739) 24.000 2.719 ( 0.517 10.787 -1.439) 10.895 2.986 ( 5.179 -0.652 -7.075) 8.792 3.033 ( -4.961 -3.552 5.078) 7.938 3.277 ( 2.664 -2.582 -1.493) 3.999 3.665 ( 10.582 4.069 6.819) 13.230 3.885 ( 10.696 -3.486 -0.737) 11.274 4.058 ( 1.604 0.069 4.776) 5.039 4.309 ( -3.292 10.104 -7.126) 12.795 4.453 ( -1.960 0.270 -4.479) 4.897 4.501 ( -6.982 2.713 -6.408) 9.858 4.584 ( 6.516 0.681 -3.633) 7.492 4.775 ( -6.247 -9.666 -2.809) 11.847 4.919 ( -7.629 5.828 0.536) 9.615 5.013 ( -6.537 -4.807 -5.346) 9.717 5.125 ( 0.465 0.678 -0.435) 0.930 5.400 ( 0.297 -10.472 2.616) 10.798 5.657 ( -2.923 -5.374 -0.245) 6.123 5.678 ( -4.224 3.829 6.687) 8.788 5.892 ( -2.099 -7.783 4.921) 9.445 5.995 ( -13.174 0.493 -4.226) 13.844 6.089 ( -3.562 17.220 0.068) 17.585 6.341 ( -1.996 0.679 3.277) 3.897 6.567 ( 7.566 7.987 -4.884) 12.037 6.696 ( -2.648 -8.612 7.266) 11.575 6.756 ( 2.340 3.019 -2.312) 4.465 6.851 ( -4.250 7.483 -7.270) 11.266 6.958 ( 4.569 -4.578 1.292) 6.596 6.998 ( -3.026 0.226 -4.568) 5.484 7.138 ( 1.191 -0.801 0.756) 1.622 7.174 ( 2.429 -0.373 3.182) 4.021 7.392 ( 3.833 4.379 -4.928) 7.626 7.493 ( 0.373 -4.101 -0.251) 4.125 7.654 ( 0.080 -6.691 -2.335) 7.087 7.953 ( -1.742 5.490 3.421) 6.699 8.054 ( 4.864 2.319 -0.336) 5.399 8.113 ( 1.890 -1.372 -2.316) 3.289 8.222 ( 1.604 -3.072 2.457) 4.248 8.439 ( -1.808 -2.880 9.002) 9.623 8.951 ( -22.162 1.533 6.375) 23.111 9.125 ( 6.627 -2.096 1.795) 7.178 13.258 ( 6.507 3.358 -3.360) 8.057 13.295 ( 6.550 0.904 -1.812) 6.856 14.554 ( 0.130 -0.893 -3.151) 3.277 14.873 ( -0.953 1.264 1.196) 1.984 17.352 ( 1.281 0.031 0.872) 1.550 17.372 ( 0.406 0.536 0.962) 1.174 17.666 ( -1.591 3.268 -0.605) 3.685 17.830 ( -4.799 -6.589 -0.669) 8.179 21.167 ( -0.257 2.268 2.893) 3.685 21.438 ( -1.494 -2.106 -0.628) 2.657 21.753 ( -1.508 0.304 1.831) 2.391 21.852 ( 0.138 -0.806 0.906) 1.220 24.129 ( -0.202 -0.048 0.365) 0.420 24.156 ( 2.834 -0.341 -0.446) 2.889 28.162 ( 0.550 -0.437 0.055) 0.705 28.279 ( -0.305 0.496 -0.493) 0.763 33.028 ( 4.656 0.985 3.797) 6.088 33.620 ( 5.565 7.022 -19.618) 21.568 36.323 ( 1.264 -1.356 0.973) 2.093 36.974 ( 0.804 -1.007 -2.976) 3.243 39.522 ( -4.248 1.116 -8.787) 9.823 40.308 ( -3.310 5.631 1.077) 6.620 40.717 ( -4.248 -8.489 0.699) 9.518 42.716 ( 5.914 4.966 5.500) 9.481 ======================= Grid point 21 (15/165) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( 8.738 -2.095 3.265) 9.560 2.449 ( 1.487 9.366 -2.244) 9.746 2.639 ( 5.118 -3.320 3.421) 6.994 2.941 ( 2.533 6.724 5.882) 9.286 3.106 ( -0.305 -7.481 1.358) 7.609 3.427 ( 10.174 -4.992 -3.502) 11.861 3.642 ( -3.361 5.900 -2.178) 7.131 3.806 ( -9.149 10.230 4.324) 14.390 4.018 ( 8.086 1.191 3.237) 8.791 4.245 ( -3.650 -0.395 -4.351) 5.693 4.414 ( -7.215 -5.617 -6.999) 11.515 4.541 ( 4.065 -1.569 0.419) 4.377 4.718 ( 4.945 10.141 2.298) 11.515 4.763 ( 10.009 -13.367 3.147) 16.993 4.914 ( 0.924 -7.722 -5.616) 9.593 5.036 ( -4.668 -8.246 -4.794) 10.620 5.065 ( -1.385 6.617 -1.442) 6.913 5.568 ( -2.965 7.076 3.546) 8.452 5.583 ( -4.852 -10.607 -1.214) 11.727 5.664 ( -11.261 8.625 -2.403) 14.387 5.804 ( 2.332 -7.265 -1.680) 7.813 5.957 ( -0.772 -3.175 0.027) 3.267 6.019 ( 0.708 -5.440 2.447) 6.006 6.322 ( 0.074 2.213 5.108) 5.568 6.432 ( 3.935 15.023 -2.466) 15.725 6.656 ( -1.176 6.624 -1.587) 6.912 6.709 ( -2.607 1.839 0.008) 3.191 6.760 ( 1.134 -0.025 -0.780) 1.376 6.889 ( -10.488 -1.204 -4.196) 11.360 7.034 ( -5.863 4.579 -1.490) 7.587 7.151 ( 7.302 0.845 7.705) 10.649 7.267 ( 4.541 -8.119 -3.656) 9.996 7.434 ( 3.914 -4.319 -1.502) 6.019 7.578 ( 4.084 -0.996 -0.563) 4.241 7.744 ( 3.333 -2.265 -2.587) 4.788 7.864 ( -3.825 3.376 2.517) 5.689 8.051 ( -0.245 1.698 1.851) 2.524 8.142 ( 2.719 0.276 -2.380) 3.623 8.231 ( -2.871 1.133 1.544) 3.451 8.405 ( -10.456 0.960 4.216) 11.315 8.755 ( -11.882 0.448 4.395) 12.677 9.344 ( 11.758 -10.445 2.419) 15.912 13.238 ( 4.771 5.684 -1.441) 7.559 13.350 ( 6.043 1.244 -1.866) 6.445 14.553 ( -0.739 -0.940 -2.167) 2.475 14.842 ( -1.160 1.649 1.310) 2.404 17.367 ( 0.711 0.435 0.677) 1.074 17.375 ( 1.360 0.369 0.548) 1.512 17.611 ( -2.329 1.129 1.025) 2.784 17.869 ( -4.109 -5.724 -1.759) 7.262 21.134 ( 0.031 2.683 1.151) 2.920 21.456 ( -1.283 -2.351 -0.233) 2.688 21.738 ( -1.298 0.287 1.190) 1.784 21.871 ( 0.190 -0.924 0.547) 1.090 24.132 ( -0.266 -0.411 0.315) 0.582 24.191 ( 2.688 -0.043 -0.359) 2.712 28.178 ( 0.479 -0.719 0.041) 0.865 28.261 ( -0.545 0.897 -0.355) 1.108 33.044 ( 1.386 3.603 2.733) 4.730 33.486 ( 3.217 8.697 -9.088) 12.983 36.372 ( 1.971 -2.026 0.979) 2.991 36.990 ( 0.310 -1.395 -1.799) 2.298 39.441 ( -2.583 -0.426 -5.554) 6.140 40.244 ( 0.683 1.469 0.314) 1.650 40.741 ( -8.499 -4.169 -0.395) 9.475 42.716 ( 5.974 6.461 3.955) 9.648 ======================= Grid point 22 (16/165) ======================= q-point: (-0.38 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -4.399 15.437 0.776) 16.071 2.234 ( -2.451 14.877 -1.653) 15.168 2.745 ( -2.163 -6.901 -0.654) 7.261 3.001 ( 14.038 2.767 8.354) 16.568 3.233 ( 1.813 -5.037 -3.014) 6.144 3.455 ( -5.694 3.917 0.921) 6.972 3.540 ( -3.786 9.132 0.723) 9.913 3.616 ( -0.143 -5.478 -2.979) 6.238 4.141 ( 5.888 -0.287 5.975) 8.394 4.237 ( -0.989 -0.988 -4.410) 4.626 4.354 ( -6.465 0.974 -4.388) 7.874 4.619 ( 4.588 1.637 3.691) 6.111 4.716 ( 8.073 0.906 5.784) 9.972 4.834 ( -1.070 10.883 -4.899) 11.983 4.955 ( -2.932 -5.702 -7.352) 9.755 5.074 ( -0.757 -4.395 6.291) 7.711 5.133 ( 2.774 -2.787 -2.554) 4.689 5.405 ( -8.930 -7.725 -3.027) 12.189 5.544 ( 7.489 2.234 1.956) 8.056 5.669 ( -2.827 -6.682 -2.996) 7.850 5.817 ( -11.222 -3.131 -4.951) 12.659 6.070 ( -0.551 -4.257 4.495) 6.216 6.147 ( 4.389 -4.489 -0.760) 6.324 6.270 ( 2.853 6.661 0.200) 7.249 6.379 ( 10.247 -1.421 -0.572) 10.361 6.587 ( -1.350 3.319 4.206) 5.525 6.637 ( -3.369 3.167 2.151) 5.099 6.761 ( 1.049 0.425 -2.358) 2.615 6.793 ( -9.906 -5.074 -3.035) 11.536 6.928 ( -0.440 0.437 -0.899) 1.092 7.170 ( 2.837 6.180 2.724) 7.325 7.418 ( 5.171 -1.365 3.786) 6.553 7.517 ( -1.665 -1.498 -3.376) 4.051 7.622 ( 1.367 -0.757 -1.765) 2.357 7.751 ( 3.245 1.991 1.571) 4.119 7.793 ( -2.078 1.725 -0.499) 2.747 8.025 ( -0.923 0.972 0.037) 1.341 8.134 ( -2.147 1.924 1.128) 3.095 8.166 ( -3.552 2.381 -0.449) 4.300 8.282 ( -6.884 0.314 0.119) 6.892 8.683 ( -3.018 -0.777 1.325) 3.386 9.698 ( 10.021 -15.403 1.900) 18.474 13.189 ( 2.440 5.383 -0.287) 5.917 13.374 ( 3.670 2.198 -1.190) 4.440 14.545 ( -1.096 -0.158 -0.571) 1.246 14.815 ( -0.669 0.622 0.595) 1.090 17.369 ( 0.716 0.468 0.613) 1.053 17.389 ( 1.071 0.183 0.090) 1.090 17.578 ( -2.013 0.505 1.034) 2.319 17.899 ( -2.814 -4.329 -1.604) 5.407 21.097 ( -0.026 2.412 0.133) 2.416 21.476 ( -0.786 -1.732 -0.020) 1.902 21.726 ( -0.724 0.057 0.437) 0.848 21.890 ( 0.228 -0.865 0.218) 0.921 24.138 ( -0.088 -0.424 0.166) 0.463 24.214 ( 1.730 0.395 -0.177) 1.784 28.194 ( 0.245 -0.753 -0.017) 0.792 28.238 ( -0.418 1.048 -0.175) 1.142 32.975 ( -1.180 6.071 1.491) 6.362 33.338 ( 0.761 10.100 -2.730) 10.490 36.442 ( 2.058 -3.227 0.791) 3.908 37.007 ( 0.013 -1.137 -0.576) 1.275 39.435 ( -0.672 -3.341 -2.099) 4.003 40.273 ( 4.409 -1.189 -0.200) 4.571 40.652 ( -10.607 0.381 -1.032) 10.664 42.686 ( 4.020 6.689 2.109) 8.084 ======================= Grid point 23 (17/165) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( 0.000 22.696 0.000) 22.696 1.907 ( 0.000 22.757 0.000) 22.757 2.792 ( 0.000 0.922 0.000) 0.922 3.127 ( 0.000 3.589 0.000) 3.589 3.255 ( -0.000 -7.017 -0.000) 7.017 3.337 ( 0.000 14.615 0.000) 14.615 3.419 ( 0.000 0.668 0.000) 0.668 3.710 ( -0.000 -6.383 -0.000) 6.383 4.105 ( 0.000 12.141 0.000) 12.141 4.197 ( 0.000 3.386 0.000) 3.386 4.222 ( -0.000 -0.019 -0.000) 0.019 4.672 ( -0.000 -4.780 -0.000) 4.780 4.741 ( 0.000 5.320 0.000) 5.320 4.743 ( 0.000 3.136 0.000) 3.136 5.005 ( -0.000 -3.834 -0.000) 3.834 5.120 ( -0.000 -3.359 -0.000) 3.359 5.132 ( -0.000 -4.885 -0.000) 4.885 5.596 ( -0.000 -10.523 -0.000) 10.523 5.642 ( -0.000 -0.359 -0.000) 0.359 5.695 ( -0.000 -8.705 -0.000) 8.705 5.786 ( -0.000 -6.108 -0.000) 6.108 6.108 ( -0.000 -0.509 -0.000) 0.509 6.260 ( -0.000 -3.481 -0.000) 3.481 6.264 ( -0.000 -8.445 -0.000) 8.445 6.420 ( 0.000 7.861 0.000) 7.861 6.560 ( 0.000 1.045 0.000) 1.045 6.572 ( 0.000 0.781 0.000) 0.781 6.740 ( 0.000 2.995 0.000) 2.995 6.853 ( -0.000 -9.624 -0.000) 9.624 7.007 ( -0.000 -7.105 -0.000) 7.105 7.072 ( 0.000 6.451 0.000) 6.451 7.418 ( 0.000 6.973 0.000) 6.973 7.440 ( 0.000 6.619 0.000) 6.619 7.583 ( 0.000 0.120 0.000) 0.120 7.749 ( 0.000 1.951 0.000) 1.951 7.847 ( -0.000 -2.544 -0.000) 2.544 7.971 ( 0.000 3.502 0.000) 3.502 8.041 ( 0.000 6.791 0.000) 6.791 8.085 ( 0.000 2.794 0.000) 2.794 8.277 ( -0.000 -2.907 -0.000) 2.907 8.714 ( -0.000 -4.492 -0.000) 4.492 10.022 ( -0.000 -15.960 -0.000) 15.960 13.130 ( 0.000 3.633 0.000) 3.633 13.354 ( 0.000 2.779 0.000) 2.779 14.532 ( 0.000 0.594 0.000) 0.594 14.815 ( -0.000 -0.812 -0.000) 0.812 17.370 ( 0.000 0.378 0.000) 0.378 17.394 ( -0.000 -0.048 -0.000) 0.048 17.557 ( 0.000 0.715 0.000) 0.715 17.932 ( -0.000 -2.784 -0.000) 2.784 21.062 ( 0.000 1.846 0.000) 1.846 21.491 ( -0.000 -0.859 -0.000) 0.859 21.725 ( -0.000 -0.358 -0.000) 0.358 21.904 ( -0.000 -0.706 -0.000) 0.706 24.143 ( -0.000 -0.168 -0.000) 0.168 24.214 ( 0.000 0.962 0.000) 0.962 28.201 ( 0.000 0.472 0.000) 0.472 28.224 ( -0.000 -0.142 -0.000) 0.142 32.862 ( 0.000 6.790 0.000) 6.790 33.167 ( 0.000 11.104 0.000) 11.104 36.518 ( -0.000 -4.230 -0.000) 4.230 37.018 ( -0.000 -0.379 -0.000) 0.379 39.502 ( -0.000 -5.779 -0.000) 5.779 40.367 ( -0.000 -3.890 -0.000) 3.890 40.510 ( 0.000 4.843 0.000) 4.843 42.614 ( 0.000 6.347 0.000) 6.347 ======================= Grid point 28 (18/165) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( 17.640 -0.000 9.683) 20.123 2.442 ( 14.203 -0.000 3.474) 14.622 2.876 ( -1.884 0.000 15.140) 15.256 2.954 ( 8.185 -0.000 -0.951) 8.240 3.080 ( 7.992 -0.000 -13.112) 15.356 3.178 ( -5.070 0.000 1.779) 5.373 3.836 ( -7.752 0.000 -3.997) 8.722 3.919 ( 11.672 -0.000 12.328) 16.976 4.171 ( 9.658 -0.000 0.365) 9.665 4.296 ( -11.070 0.000 -4.039) 11.784 4.333 ( -10.253 0.000 2.224) 10.492 4.487 ( -2.257 0.000 -8.966) 9.246 4.515 ( -0.412 0.000 -13.349) 13.355 4.664 ( -0.932 0.000 -4.241) 4.342 4.742 ( -8.748 0.000 -2.330) 9.053 5.118 ( -1.413 0.000 -3.354) 3.640 5.151 ( 16.836 -0.000 1.989) 16.953 5.306 ( 1.476 -0.000 1.126) 1.857 5.573 ( -0.525 0.000 -0.330) 0.621 5.773 ( -5.914 0.000 5.317) 7.953 5.781 ( -1.002 0.000 6.518) 6.595 5.851 ( -7.461 0.000 -3.631) 8.298 6.275 ( -5.674 0.000 2.445) 6.178 6.297 ( -2.513 0.000 4.244) 4.933 6.518 ( -0.056 0.000 -0.467) 0.471 6.708 ( 5.316 -0.000 -2.492) 5.871 6.782 ( -0.521 0.000 -4.018) 4.051 6.810 ( -6.766 0.000 -5.084) 8.463 6.853 ( -8.473 0.000 -2.013) 8.709 6.969 ( 1.866 -0.000 -0.719) 1.999 7.259 ( 4.323 -0.000 5.970) 7.371 7.290 ( 9.534 -0.000 0.833) 9.571 7.385 ( -5.836 0.000 2.481) 6.341 7.507 ( 3.449 -0.000 -5.984) 6.907 7.570 ( 6.786 -0.000 -3.868) 7.811 7.976 ( -5.088 0.000 2.861) 5.837 8.080 ( -0.136 0.000 -0.419) 0.440 8.168 ( 7.824 -0.000 -4.606) 9.079 8.253 ( 4.712 -0.000 2.465) 5.317 8.432 ( -4.374 0.000 10.184) 11.084 8.714 ( -22.217 0.000 5.872) 22.980 9.174 ( 4.873 -0.000 1.104) 4.996 13.354 ( 6.853 -0.000 -2.944) 7.459 13.364 ( 4.925 -0.000 -1.712) 5.214 14.532 ( -0.455 0.000 -2.318) 2.362 14.878 ( -0.839 0.000 1.015) 1.317 17.372 ( 1.353 -0.000 0.802) 1.573 17.384 ( 0.381 -0.000 0.705) 0.802 17.669 ( -6.530 0.000 3.257) 7.297 17.724 ( 0.836 -0.000 -3.801) 3.892 21.195 ( -0.250 0.000 2.156) 2.170 21.401 ( -1.091 0.000 -0.681) 1.287 21.745 ( -1.372 0.000 1.406) 1.965 21.852 ( 0.249 -0.000 0.825) 0.862 24.123 ( -0.529 0.000 0.230) 0.577 24.188 ( 2.770 -0.000 -0.288) 2.785 28.166 ( 0.567 -0.000 0.134) 0.582 28.276 ( -0.509 0.000 -0.468) 0.692 33.107 ( 3.867 -0.000 3.113) 4.964 33.641 ( 2.234 -0.000 -13.343) 13.529 36.337 ( 1.770 -0.000 0.959) 2.014 36.962 ( 0.599 -0.000 -2.470) 2.542 39.444 ( -3.860 0.000 -7.562) 8.490 40.272 ( -6.869 0.000 -0.262) 6.874 40.665 ( 1.418 -0.000 2.132) 2.561 42.831 ( 4.032 -0.000 3.776) 5.524 ======================= Grid point 29 (19/165) ======================= q-point: ( 0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 7.135 0.380 3.531) 7.970 2.556 ( 2.902 0.249 1.421) 3.241 2.784 ( 1.670 15.269 2.479) 15.559 3.031 ( 0.711 -2.568 3.476) 4.379 3.117 ( 9.077 0.731 2.563) 9.460 3.322 ( 3.699 -12.598 -4.314) 13.820 3.657 ( -8.663 7.537 -1.512) 11.581 4.007 ( 0.035 12.565 3.695) 13.097 4.136 ( 5.684 0.711 4.501) 7.285 4.189 ( -3.887 1.206 -1.668) 4.398 4.257 ( -4.518 0.308 -7.547) 8.802 4.473 ( 0.344 -12.964 2.956) 13.301 4.570 ( -0.847 -6.945 -2.370) 7.387 4.697 ( -7.865 -9.834 -5.297) 13.661 4.784 ( 3.519 -8.427 -3.803) 9.892 5.035 ( -4.729 2.928 -4.802) 7.348 5.167 ( 9.409 10.128 1.772) 13.937 5.439 ( -0.597 -6.025 0.476) 6.073 5.594 ( -6.398 6.773 -0.877) 9.359 5.701 ( 4.397 0.337 0.885) 4.498 5.761 ( -0.196 -0.508 2.289) 2.353 5.902 ( 3.777 -6.915 -0.051) 7.880 6.079 ( -0.374 9.234 2.218) 9.503 6.356 ( 0.439 -1.669 8.424) 8.599 6.553 ( -6.471 -4.641 -6.880) 10.524 6.671 ( -2.420 5.727 -1.613) 6.423 6.718 ( -1.519 0.320 0.975) 1.833 6.750 ( 2.140 0.641 -9.364) 9.626 6.802 ( -6.176 2.637 4.947) 8.341 7.052 ( 3.399 -9.763 -1.444) 10.438 7.103 ( -3.248 12.424 1.523) 12.931 7.327 ( 2.684 3.201 0.873) 4.267 7.433 ( 3.091 -1.818 2.024) 4.118 7.638 ( 1.165 -11.418 -3.601) 12.028 7.657 ( 7.762 0.632 -1.846) 8.004 7.890 ( -4.682 3.876 2.594) 6.609 8.075 ( 0.771 1.316 -0.584) 1.633 8.210 ( 5.758 2.712 -4.081) 7.560 8.269 ( -1.210 4.187 3.459) 5.565 8.355 ( -7.630 3.142 4.111) 9.219 8.594 ( -9.590 -6.239 4.062) 12.141 9.290 ( 4.266 -8.031 0.894) 9.137 13.361 ( 3.105 4.250 -1.151) 5.388 13.416 ( 3.763 0.293 -1.253) 3.976 14.524 ( -0.508 -0.710 -1.256) 1.530 14.862 ( -0.612 1.443 0.701) 1.717 17.383 ( 0.511 0.444 0.378) 0.776 17.393 ( 0.718 -0.047 0.387) 0.817 17.604 ( -2.760 1.251 1.297) 3.296 17.753 ( -0.872 -3.948 -1.518) 4.319 21.179 ( -0.046 2.274 0.861) 2.432 21.407 ( -0.659 -2.067 -0.253) 2.184 21.734 ( -0.801 0.291 0.730) 1.122 21.863 ( 0.150 -0.623 0.414) 0.763 24.122 ( -0.278 -0.376 0.120) 0.483 24.215 ( 1.621 -0.142 -0.146) 1.634 28.175 ( 0.330 -0.342 0.079) 0.482 28.265 ( -0.378 0.485 -0.255) 0.665 33.128 ( 1.617 2.928 1.640) 3.725 33.581 ( 1.063 4.430 -5.768) 7.351 36.368 ( 1.240 -1.279 0.590) 1.876 36.967 ( 0.244 -0.960 -1.252) 1.597 39.384 ( -2.032 -0.419 -3.917) 4.433 40.219 ( -2.823 -1.359 -0.241) 3.142 40.679 ( -0.557 0.776 0.965) 1.358 42.855 ( 2.543 3.229 1.996) 4.569 ======================= Grid point 30 (20/165) ======================= q-point: (-0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( 0.000 7.912 0.000) 7.912 2.466 ( 0.000 14.783 0.000) 14.783 2.650 ( -0.000 -1.188 -0.000) 1.188 3.087 ( -0.000 -2.953 -0.000) 2.953 3.261 ( -0.000 -6.642 -0.000) 6.642 3.398 ( 0.000 10.134 0.000) 10.134 3.515 ( -0.000 -5.977 -0.000) 5.977 3.758 ( 0.000 16.008 0.000) 16.008 4.161 ( -0.000 -2.609 -0.000) 2.609 4.180 ( -0.000 -1.700 -0.000) 1.700 4.307 ( -0.000 -2.151 -0.000) 2.151 4.664 ( -0.000 -11.291 -0.000) 11.291 4.703 ( -0.000 -4.754 -0.000) 4.754 4.852 ( -0.000 -19.895 -0.000) 19.895 4.882 ( 0.000 7.854 0.000) 7.854 4.903 ( -0.000 -1.109 -0.000) 1.109 5.160 ( -0.000 -1.655 -0.000) 1.655 5.364 ( 0.000 13.482 0.000) 13.482 5.533 ( -0.000 -6.915 -0.000) 6.915 5.680 ( 0.000 1.816 0.000) 1.816 5.729 ( 0.000 4.763 0.000) 4.763 6.028 ( -0.000 -1.391 -0.000) 1.391 6.089 ( -0.000 -7.194 -0.000) 7.194 6.453 ( -0.000 -1.603 -0.000) 1.603 6.485 ( 0.000 5.647 0.000) 5.647 6.552 ( 0.000 8.871 0.000) 8.871 6.614 ( -0.000 -0.324 -0.000) 0.324 6.734 ( 0.000 4.339 0.000) 4.339 6.734 ( -0.000 -2.334 -0.000) 2.334 6.970 ( 0.000 3.981 0.000) 3.981 7.279 ( 0.000 4.967 0.000) 4.967 7.296 ( -0.000 -16.142 -0.000) 16.142 7.479 ( -0.000 -1.074 -0.000) 1.074 7.677 ( 0.000 3.179 0.000) 3.179 7.762 ( -0.000 -3.092 -0.000) 3.092 7.809 ( 0.000 2.168 0.000) 2.168 8.045 ( 0.000 2.415 0.000) 2.415 8.156 ( 0.000 3.578 0.000) 3.578 8.204 ( 0.000 3.480 0.000) 3.480 8.280 ( 0.000 3.028 0.000) 3.028 8.631 ( -0.000 -3.478 -0.000) 3.478 9.510 ( -0.000 -14.931 -0.000) 14.931 13.295 ( 0.000 5.904 0.000) 5.904 13.422 ( 0.000 1.414 0.000) 1.414 14.530 ( -0.000 -0.740 -0.000) 0.740 14.832 ( 0.000 1.750 0.000) 1.750 17.381 ( 0.000 0.375 0.000) 0.375 17.398 ( 0.000 0.121 0.000) 0.121 17.577 ( 0.000 0.707 0.000) 0.707 17.810 ( -0.000 -4.492 -0.000) 4.492 21.139 ( 0.000 2.843 0.000) 2.843 21.438 ( -0.000 -2.339 -0.000) 2.339 21.726 ( 0.000 0.315 0.000) 0.315 21.877 ( -0.000 -0.904 -0.000) 0.904 24.129 ( -0.000 -0.586 -0.000) 0.586 24.226 ( -0.000 -0.058 -0.000) 0.058 28.184 ( -0.000 -0.618 -0.000) 0.618 28.251 ( 0.000 0.892 0.000) 0.892 33.071 ( 0.000 5.661 0.000) 5.661 33.479 ( 0.000 7.811 0.000) 7.811 36.408 ( -0.000 -2.567 -0.000) 2.567 36.985 ( -0.000 -1.401 -0.000) 1.401 39.382 ( -0.000 -1.935 -0.000) 1.935 40.245 ( -0.000 -3.407 -0.000) 3.407 40.639 ( 0.000 3.199 0.000) 3.199 42.808 ( 0.000 5.289 0.000) 5.289 ======================= Grid point 38 (21/165) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 93 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 0.000 -0.000 0.000) 0.000 2.575 ( 0.000 -0.000 0.000) 0.000 3.016 ( 0.000 -0.000 0.000) 0.000 3.085 ( 0.000 -0.000 0.000) 0.000 3.098 ( -0.000 0.000 0.000) 0.000 3.188 ( 0.000 -0.000 0.000) 0.000 3.671 ( 0.000 -0.000 0.000) 0.000 4.116 ( 0.000 -0.000 -0.000) 0.000 4.168 ( 0.000 -0.000 -0.000) 0.000 4.180 ( 0.000 -0.000 0.000) 0.000 4.283 ( 0.000 -0.000 0.000) 0.000 4.356 ( 0.000 -0.000 0.000) 0.000 4.391 ( 0.000 -0.000 0.000) 0.000 4.613 ( 0.000 -0.000 0.000) 0.000 4.723 ( 0.000 -0.000 0.000) 0.000 5.003 ( 0.000 -0.000 0.000) 0.000 5.333 ( 0.000 -0.000 0.000) 0.000 5.358 ( 0.000 -0.000 0.000) 0.000 5.628 ( 0.000 -0.000 0.000) 0.000 5.758 ( -0.000 0.000 0.000) 0.000 5.801 ( 0.000 -0.000 0.000) 0.000 5.822 ( 0.000 -0.000 0.000) 0.000 6.245 ( 0.000 -0.000 -0.000) 0.000 6.285 ( 0.000 -0.000 -0.000) 0.000 6.430 ( 0.000 -0.000 0.000) 0.000 6.680 ( 0.000 -0.000 -0.000) 0.000 6.700 ( 0.000 -0.000 0.000) 0.000 6.754 ( -0.000 0.000 0.000) 0.000 6.777 ( 0.000 -0.000 -0.000) 0.000 7.014 ( 0.000 -0.000 -0.000) 0.000 7.293 ( 0.000 -0.000 0.000) 0.000 7.367 ( 0.000 -0.000 -0.000) 0.000 7.451 ( 0.000 -0.000 0.000) 0.000 7.455 ( 0.000 -0.000 0.000) 0.000 7.716 ( 0.000 -0.000 0.000) 0.000 7.892 ( 0.000 -0.000 0.000) 0.000 8.101 ( 0.000 -0.000 0.000) 0.000 8.260 ( -0.000 0.000 0.000) 0.000 8.315 ( 0.000 -0.000 0.000) 0.000 8.393 ( 0.000 -0.000 -0.000) 0.000 8.425 ( 0.000 -0.000 0.000) 0.000 9.246 ( 0.000 -0.000 0.000) 0.000 13.420 ( 0.000 -0.000 0.000) 0.000 13.430 ( 0.000 -0.000 0.000) 0.000 14.512 ( 0.000 -0.000 0.000) 0.000 14.872 ( 0.000 -0.000 0.000) 0.000 17.393 ( 0.000 -0.000 0.000) 0.000 17.395 ( 0.000 -0.000 0.000) 0.000 17.600 ( 0.000 -0.000 0.000) 0.000 17.715 ( 0.000 -0.000 0.000) 0.000 21.201 ( 0.000 -0.000 0.000) 0.000 21.384 ( 0.000 -0.000 0.000) 0.000 21.734 ( 0.000 -0.000 0.000) 0.000 21.860 ( 0.000 -0.000 0.000) 0.000 24.117 ( 0.000 -0.000 0.000) 0.000 24.223 ( 0.000 -0.000 -0.000) 0.000 28.174 ( 0.000 -0.000 0.000) 0.000 28.266 ( 0.000 -0.000 0.000) 0.000 33.167 ( 0.000 -0.000 0.000) 0.000 33.607 ( 0.000 -0.000 0.000) 0.000 36.367 ( 0.000 -0.000 0.000) 0.000 36.957 ( 0.000 -0.000 0.000) 0.000 39.358 ( 0.000 -0.000 0.000) 0.000 40.186 ( 0.000 -0.000 0.000) 0.000 40.693 ( 0.000 -0.000 0.000) 0.000 42.898 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 67 (22/165) ======================= q-point: ( 0.00 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.531 ( 1.458 -0.000 28.230) 28.267 0.687 ( -9.657 0.000 36.152) 37.420 0.859 ( -1.540 0.000 44.475) 44.502 2.526 ( 2.109 -0.000 5.884) 6.251 2.988 ( -3.823 0.000 6.664) 7.683 3.215 ( -3.249 0.000 -17.471) 17.770 3.844 ( -3.917 0.000 7.957) 8.869 3.929 ( -2.490 0.000 0.897) 2.647 4.376 ( -1.629 0.000 2.538) 3.016 4.417 ( -1.587 0.000 -1.082) 1.921 4.423 ( 5.663 -0.000 4.869) 7.468 4.537 ( 4.864 -0.000 -9.978) 11.100 4.674 ( 5.246 -0.000 -10.796) 12.003 5.063 ( -0.503 0.000 -0.256) 0.564 5.092 ( 19.915 -0.000 -3.170) 20.166 5.391 ( 2.700 -0.000 -1.581) 3.128 5.568 ( 2.256 -0.000 -0.919) 2.436 5.740 ( 13.629 -0.000 2.017) 13.778 5.757 ( -4.414 0.000 -11.569) 12.382 5.890 ( 3.291 -0.000 -3.070) 4.500 6.130 ( 6.541 -0.000 -0.148) 6.543 6.131 ( 3.002 -0.000 -1.348) 3.291 6.205 ( 0.962 -0.000 7.301) 7.364 6.372 ( -4.553 0.000 8.770) 9.881 6.430 ( 5.645 -0.000 1.350) 5.804 6.466 ( -11.698 0.000 -1.389) 11.780 6.722 ( 11.421 -0.000 1.251) 11.489 6.795 ( -1.562 0.000 0.970) 1.839 6.890 ( 1.498 -0.000 -2.671) 3.063 7.184 ( -9.656 0.000 -0.302) 9.661 7.298 ( 2.450 -0.000 -1.323) 2.785 7.353 ( -0.204 0.000 -1.049) 1.068 7.413 ( -5.802 0.000 -0.529) 5.826 7.620 ( -13.432 0.000 -2.067) 13.590 7.649 ( 0.626 -0.000 -3.651) 3.705 7.744 ( 8.743 -0.000 1.270) 8.834 7.817 ( -16.501 0.000 5.148) 17.286 8.012 ( -0.066 0.000 -1.580) 1.581 8.248 ( -3.560 0.000 7.296) 8.119 8.321 ( -1.879 0.000 -0.714) 2.010 9.019 ( 2.762 -0.000 -0.672) 2.842 9.543 ( 23.081 -0.000 -0.346) 23.083 13.095 ( -1.615 0.000 0.131) 1.620 13.151 ( 2.509 -0.000 -0.025) 2.509 14.531 ( -2.677 0.000 1.719) 3.181 14.950 ( -5.566 0.000 -1.140) 5.682 17.326 ( 0.490 -0.000 -0.189) 0.525 17.343 ( -1.303 0.000 -0.745) 1.501 17.603 ( -17.579 0.000 1.939) 17.685 17.978 ( 2.773 -0.000 -0.672) 2.853 21.338 ( 14.841 -0.000 0.463) 14.848 21.485 ( -0.395 0.000 -0.487) 0.627 21.769 ( -0.395 0.000 0.006) 0.395 21.825 ( 0.700 -0.000 -0.239) 0.739 24.048 ( -0.438 0.000 -0.059) 0.442 24.141 ( 0.542 -0.000 -0.573) 0.789 28.165 ( -1.205 0.000 0.528) 1.316 28.262 ( -0.057 0.000 -0.271) 0.277 32.731 ( 1.328 -0.000 2.743) 3.047 33.304 (-144.156 0.000 -0.786) 144.158 36.299 ( -0.303 0.000 2.027) 2.049 36.935 ( 0.532 -0.000 -2.935) 2.982 39.881 ( -6.355 0.000 1.932) 6.642 40.467 ( 0.738 -0.000 -3.166) 3.251 40.751 ( -0.017 0.000 -1.189) 1.189 40.882 ( 102.398 -0.000 -0.521) 102.400 ======================= Grid point 68 (23/165) ======================= q-point: ( 0.12 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.809 ( 12.982 -13.258 17.761) 25.686 1.001 ( 17.714 -20.106 19.914) 33.386 1.672 ( 26.681 -33.901 32.424) 53.968 2.645 ( 6.025 -4.188 7.198) 10.279 2.973 ( -6.166 0.832 0.412) 6.235 3.067 ( -3.005 -0.796 -13.588) 13.939 3.814 ( -6.243 0.342 6.896) 9.309 3.919 ( -5.065 -4.889 2.517) 7.476 4.218 ( -6.199 11.828 -3.215) 13.735 4.332 ( -0.336 2.681 -2.923) 3.980 4.484 ( -1.385 -1.136 -3.504) 3.936 4.523 ( 6.355 10.722 -2.366) 12.687 4.667 ( -0.354 0.172 -6.318) 6.331 4.946 ( 2.743 7.398 3.234) 8.527 5.228 ( 4.344 1.838 -5.035) 6.900 5.339 ( -8.541 4.126 -3.228) 10.020 5.561 ( 1.669 0.784 -1.173) 2.185 5.653 ( -4.983 -0.581 -6.941) 8.564 5.755 ( 2.621 7.352 7.362) 10.729 5.926 ( 4.617 1.897 -1.882) 5.335 6.080 ( 2.053 7.851 0.340) 8.122 6.198 ( 5.704 -0.313 -1.893) 6.018 6.219 ( 0.399 2.137 4.101) 4.641 6.328 ( -3.046 -0.164 4.137) 5.140 6.367 ( -9.966 -2.671 4.342) 11.195 6.504 ( 0.149 -3.580 -2.230) 4.221 6.767 ( -2.223 2.151 5.084) 5.951 6.830 ( 1.007 -1.534 -5.491) 5.790 6.860 ( -1.251 6.437 -3.792) 7.574 7.018 ( -18.640 13.948 16.956) 28.801 7.123 ( 1.278 -0.846 2.837) 3.225 7.254 ( -8.357 -1.983 -4.232) 9.575 7.386 ( 5.428 -2.452 -0.930) 6.028 7.480 ( -1.808 -2.305 1.888) 3.485 7.671 ( 1.270 -1.785 -1.268) 2.531 7.767 ( 6.723 1.677 1.822) 7.165 7.899 ( 6.045 -4.006 6.833) 9.964 8.039 ( 8.094 -0.911 -0.383) 8.154 8.104 ( 0.068 7.722 7.628) 10.855 8.300 ( -2.564 -1.540 -1.115) 3.192 9.020 ( 1.461 3.206 0.763) 3.605 9.920 ( -10.375 -15.057 -16.056) 24.334 13.082 ( -0.549 0.311 -1.271) 1.419 13.189 ( -1.220 -2.928 1.238) 3.405 14.517 ( -1.498 -0.370 0.836) 1.755 14.884 ( -1.349 1.255 1.307) 2.258 17.320 ( -0.620 0.356 -0.974) 1.208 17.362 ( 1.039 -1.237 -1.240) 2.036 17.533 ( -0.260 -0.777 0.996) 1.289 18.016 ( 1.708 -1.794 0.225) 2.488 21.262 ( -1.048 9.407 6.615) 11.548 21.484 ( 0.174 -0.563 -0.900) 1.076 21.771 ( 1.501 0.814 -0.143) 1.713 21.865 ( -0.672 -2.488 -1.195) 2.841 24.074 ( -0.865 -2.581 -1.234) 2.989 24.148 ( 0.327 -0.560 -0.395) 0.760 28.160 ( -0.632 -0.591 0.899) 1.248 28.268 ( 0.055 -0.281 -0.015) 0.287 32.687 ( 2.764 -1.601 1.354) 3.469 32.815 ( 3.654 -4.412 4.190) 7.097 36.408 ( -5.153 -9.201 -3.016) 10.969 36.929 ( 0.388 -0.658 -3.414) 3.498 39.773 ( -6.722 3.515 -0.838) 7.632 40.353 ( -0.963 8.920 2.080) 9.209 40.775 ( 11.551 -2.181 -0.138) 11.756 41.949 ( 38.308 -12.177 -30.143) 50.243 ======================= Grid point 69 (24/165) ======================= q-point: ( 0.25 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.310 ( 18.326 -17.207 7.025) 26.101 1.656 ( 25.978 -19.688 10.234) 34.165 2.531 ( 7.690 -21.049 19.295) 29.571 2.727 ( -2.186 -1.149 -5.214) 5.769 2.881 ( 4.138 -3.507 0.039) 5.425 3.216 ( 11.380 -13.601 5.054) 18.440 3.741 ( -6.911 1.820 2.645) 7.621 3.939 ( -12.692 0.732 11.565) 17.187 3.981 ( 1.137 3.357 -8.438) 9.152 4.261 ( 4.830 15.857 -2.373) 16.746 4.313 ( 0.737 1.775 -4.524) 4.915 4.482 ( -4.427 0.979 0.978) 4.639 4.629 ( -6.516 -4.458 -2.696) 8.343 4.948 ( 5.261 4.488 2.583) 7.382 5.029 ( -7.754 9.687 0.251) 12.411 5.235 ( -2.968 -0.779 -5.580) 6.368 5.496 ( -11.595 4.048 4.765) 13.173 5.610 ( -0.796 1.284 -0.728) 1.677 5.782 ( 4.967 -2.783 0.880) 5.761 5.923 ( 1.275 3.414 -0.760) 3.723 6.008 ( 3.756 4.733 -2.830) 6.672 6.150 ( -7.935 0.409 1.916) 8.174 6.256 ( -0.712 2.026 0.431) 2.191 6.296 ( -4.956 -4.550 7.723) 10.243 6.370 ( 1.788 1.159 -3.781) 4.340 6.497 ( -0.308 1.957 -3.866) 4.344 6.657 ( -4.605 2.570 0.793) 5.333 6.745 ( -2.133 4.215 3.044) 5.620 6.773 ( 0.941 6.162 -3.069) 6.948 6.885 ( 3.998 3.567 -2.216) 5.799 7.144 ( -2.708 -3.670 -2.967) 5.441 7.280 ( 1.439 -3.789 3.331) 5.246 7.447 ( -4.741 -2.321 0.323) 5.289 7.512 ( 5.066 0.400 0.862) 5.154 7.741 ( 5.794 -2.249 0.290) 6.222 7.824 ( 2.825 0.371 0.272) 2.862 7.943 ( -3.858 0.798 5.348) 6.642 8.112 ( 4.693 -0.434 0.516) 4.741 8.174 ( 7.185 -0.684 1.247) 7.325 8.369 ( 8.722 -5.756 1.640) 10.578 8.962 ( 0.265 6.004 1.856) 6.290 9.745 ( -22.649 0.917 -9.222) 24.472 13.062 ( -0.032 0.910 -1.567) 1.812 13.223 ( -2.441 -3.305 1.967) 4.555 14.522 ( 0.359 -1.107 -0.112) 1.169 14.868 ( 0.403 1.260 0.811) 1.552 17.308 ( 0.543 0.402 -1.237) 1.410 17.369 ( -0.272 0.103 -0.414) 0.506 17.561 ( 1.888 -0.874 -0.772) 2.219 18.065 ( 0.711 -2.052 0.605) 2.255 21.170 ( -1.072 4.592 5.006) 6.877 21.495 ( 0.465 -0.783 -1.008) 1.358 21.770 ( 1.095 1.320 0.280) 1.738 21.879 ( -0.600 -1.026 -0.671) 1.365 24.091 ( -0.700 -1.518 -0.870) 1.885 24.160 ( -0.072 -0.804 -0.254) 0.846 28.172 ( -0.420 -1.113 0.919) 1.503 28.268 ( 0.039 0.422 0.326) 0.534 32.817 ( 11.845 -0.598 -3.425) 12.345 32.988 ( 7.164 -6.430 2.795) 10.024 36.425 ( -5.031 -2.845 -1.274) 5.918 36.940 ( 0.947 -1.773 -4.101) 4.568 39.633 ( -5.884 3.405 -1.392) 6.939 40.245 ( -2.259 4.380 3.723) 6.176 40.948 ( 8.712 -4.367 -3.029) 10.205 42.200 ( 15.305 0.274 -17.501) 23.251 ======================= Grid point 70 (25/165) ======================= q-point: ( 0.38 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.792 ( 14.783 -15.571 4.218) 21.882 2.243 ( 22.199 -9.040 3.213) 24.183 2.443 ( -8.120 1.076 -6.665) 10.560 2.924 ( -3.060 -4.495 2.673) 6.059 3.024 ( 4.190 -4.479 11.880) 13.369 3.626 ( 10.891 -0.320 -3.157) 11.344 3.652 ( -12.821 -7.821 11.102) 18.676 3.820 ( 0.123 3.543 0.141) 3.548 3.965 ( 0.100 2.383 2.768) 3.654 4.149 ( 4.953 -1.617 5.870) 7.849 4.356 ( -5.932 -0.287 -2.078) 6.292 4.368 ( 1.878 1.300 -0.240) 2.296 4.657 ( -5.399 -8.645 -4.251) 11.043 4.818 ( 0.207 4.130 1.618) 4.440 5.041 ( 7.996 -0.614 0.498) 8.035 5.189 ( -4.702 -2.034 -1.517) 5.342 5.295 ( -13.789 5.011 8.148) 16.782 5.465 ( -3.669 12.643 -2.189) 13.345 5.798 ( -1.325 13.551 2.289) 13.807 5.887 ( 0.930 -3.641 -3.951) 5.453 5.970 ( -3.341 -0.773 -2.450) 4.214 6.102 ( -3.590 -3.893 2.169) 5.723 6.223 ( -2.374 -3.122 -1.063) 4.063 6.312 ( -5.604 -3.889 -6.476) 9.406 6.358 ( -1.517 0.706 4.163) 4.486 6.465 ( 6.714 4.759 -0.807) 8.269 6.532 ( -3.370 5.574 -6.526) 9.221 6.727 ( 10.773 0.504 -1.023) 10.833 6.771 ( 0.949 2.144 7.349) 7.714 6.875 ( 2.519 0.480 -3.640) 4.452 7.176 ( 0.851 -2.666 -2.830) 3.980 7.340 ( -4.709 -2.671 -1.858) 5.724 7.403 ( -1.079 -0.792 3.913) 4.136 7.583 ( 2.074 -1.472 2.793) 3.777 7.762 ( -2.072 4.207 2.154) 5.160 7.843 ( 0.105 -2.050 0.115) 2.056 7.983 ( 5.819 -2.350 -1.502) 6.452 8.137 ( -1.227 -0.391 -0.553) 1.401 8.253 ( 5.553 -0.312 -0.456) 5.581 8.633 ( 13.976 -6.078 3.503) 15.638 8.870 ( 2.577 8.051 2.297) 8.760 9.370 ( -23.423 5.646 -7.103) 25.119 13.043 ( 0.124 0.463 -1.523) 1.596 13.249 ( -2.434 -2.374 2.201) 4.051 14.556 ( 0.980 -2.160 -0.240) 2.384 14.855 ( 0.274 1.506 1.228) 1.963 17.310 ( 1.314 0.119 -1.368) 1.901 17.356 ( -0.532 0.496 -0.318) 0.794 17.592 ( 1.698 -0.699 -0.477) 1.897 18.093 ( -0.796 -1.116 0.564) 1.483 21.122 ( -0.957 2.517 2.870) 3.935 21.508 ( 0.486 -0.661 -0.893) 1.213 21.760 ( 0.689 1.357 0.108) 1.526 21.881 ( -0.165 -0.236 -0.524) 0.598 24.101 ( 0.060 -0.748 -0.738) 1.053 24.167 ( -0.430 -0.538 -0.228) 0.725 28.190 ( -0.426 -1.127 1.080) 1.618 28.260 ( -0.081 0.699 0.331) 0.778 32.924 ( 7.341 0.235 -1.588) 7.515 33.177 ( 3.671 -7.078 4.778) 9.295 36.397 ( -2.716 -0.378 0.372) 2.767 36.966 ( 1.254 -1.992 -4.001) 4.642 39.538 ( -4.141 0.384 -0.267) 4.167 40.185 ( -2.076 2.338 3.503) 4.695 41.068 ( 3.826 -3.474 -5.087) 7.252 42.244 ( 9.559 3.232 -12.298) 15.908 ======================= Grid point 71 (26/165) ======================= q-point: (-0.50 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( -8.218 7.543 3.362) 11.651 2.236 ( 6.456 -9.000 -6.691) 12.940 2.692 ( 13.298 0.001 3.026) 13.638 2.804 ( -8.184 5.545 1.999) 10.086 3.204 ( 0.053 -7.905 12.841) 15.079 3.541 ( -13.478 0.191 6.629) 15.021 3.633 ( 2.734 5.759 -4.475) 7.789 3.894 ( -1.643 -4.129 4.381) 6.240 3.936 ( 12.461 2.091 3.363) 13.075 4.175 ( -12.168 6.703 5.940) 15.109 4.335 ( 0.938 -3.273 0.772) 3.491 4.447 ( 5.973 -5.527 -8.239) 11.580 4.659 ( -5.030 -0.027 -1.556) 5.265 4.844 ( 0.219 -1.010 5.126) 5.229 5.030 ( -12.428 8.776 1.643) 15.303 5.171 ( 6.075 5.082 -1.420) 8.047 5.217 ( -1.427 -5.780 2.165) 6.335 5.322 ( 0.085 -4.864 -0.269) 4.872 5.591 ( -2.492 2.019 3.365) 4.649 5.839 ( 3.548 5.137 -8.402) 10.468 6.004 ( -3.010 -3.201 -1.553) 4.660 6.106 ( 0.805 2.243 1.937) 3.071 6.250 ( 0.853 -2.239 -7.222) 7.609 6.285 ( -4.121 2.229 -0.362) 4.699 6.358 ( -2.997 -8.024 -4.896) 9.866 6.381 ( 0.519 2.405 1.437) 2.849 6.572 ( 1.461 -3.277 5.546) 6.605 6.786 ( 4.830 1.901 6.137) 8.038 6.858 ( 7.691 -0.598 -5.162) 9.282 6.893 ( 1.877 -1.422 3.615) 4.315 7.217 ( 0.450 -3.414 -0.500) 3.480 7.296 ( -4.506 -1.658 -1.543) 5.043 7.464 ( 1.986 -1.488 4.639) 5.261 7.555 ( -2.411 5.450 -2.131) 6.329 7.733 ( -1.704 -2.128 4.228) 5.031 7.833 ( -0.763 1.388 -2.394) 2.870 8.068 ( 2.069 0.061 -1.524) 2.571 8.116 ( -0.212 -0.605 -0.350) 0.730 8.287 ( 0.786 0.721 -1.582) 1.908 8.748 ( -1.338 5.874 2.748) 6.622 8.840 ( -7.170 0.581 -0.657) 7.224 9.121 ( 11.919 1.133 -5.613) 13.224 13.041 ( 0.398 -0.667 -1.317) 1.529 13.255 ( -2.355 -0.749 2.117) 3.254 14.605 ( 0.128 -2.797 0.987) 2.969 14.839 ( -0.126 1.323 1.221) 1.804 17.322 ( 1.566 -0.098 -1.211) 1.982 17.342 ( -0.036 0.590 -0.358) 0.692 17.618 ( 1.274 -0.592 0.193) 1.418 18.086 ( -2.026 -0.020 -0.178) 2.034 21.088 ( -1.072 1.494 1.361) 2.288 21.517 ( 0.319 -0.270 -0.634) 0.759 21.745 ( 0.355 1.084 -0.424) 1.217 21.880 ( 0.444 0.276 -0.554) 0.762 24.109 ( 0.771 -0.006 -0.576) 0.962 24.164 ( -0.445 -0.006 -0.396) 0.596 28.201 ( -0.415 -0.032 1.165) 1.237 28.253 ( -0.381 -0.125 0.286) 0.493 32.960 ( 2.251 1.935 -0.605) 3.029 33.333 ( -3.760 -9.232 9.000) 13.430 36.392 ( 0.981 -0.099 1.434) 1.741 36.993 ( 1.046 -1.565 -3.177) 3.693 39.529 ( -2.078 -3.706 1.450) 4.489 40.150 ( -1.036 1.569 2.691) 3.283 41.093 ( -2.751 -1.956 -6.577) 7.393 42.234 ( 8.826 4.838 -12.276) 15.875 ======================= Grid point 72 (27/165) ======================= q-point: (-0.38 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( -15.772 17.047 -1.331) 23.262 2.324 ( -10.872 25.392 3.938) 27.901 2.448 ( -8.810 -8.497 4.030) 12.886 2.886 ( 4.844 2.817 -0.004) 5.604 3.315 ( -6.539 4.913 11.026) 13.729 3.419 ( -1.720 -1.437 5.806) 6.224 3.621 ( 8.530 0.917 -4.972) 9.916 3.751 ( -22.278 18.519 3.426) 29.172 3.995 ( 2.210 -8.885 0.941) 9.204 4.120 ( 4.951 -3.625 7.503) 9.693 4.400 ( 4.568 -5.295 1.925) 7.254 4.546 ( 0.858 -0.130 -1.284) 1.550 4.625 ( -5.682 -4.895 -2.898) 8.040 4.781 ( -3.950 -1.347 -3.256) 5.293 4.992 ( 4.717 0.943 4.376) 6.503 5.125 ( -5.197 4.217 3.284) 7.455 5.183 ( 8.085 -1.685 -2.579) 8.652 5.466 ( 1.795 -9.849 -2.555) 10.332 5.757 ( 6.997 8.316 -6.497) 12.662 5.781 ( 6.374 -10.564 -1.466) 12.425 5.970 ( -5.951 -0.622 -2.672) 6.553 6.103 ( -1.310 0.704 0.003) 1.487 6.125 ( -5.023 1.249 -2.893) 5.930 6.306 ( 1.579 -0.782 -0.769) 1.923 6.393 ( 6.065 0.755 -1.066) 6.204 6.482 ( 0.619 -8.965 -0.790) 9.021 6.595 ( 0.245 4.475 5.969) 7.465 6.857 ( -2.594 -1.386 3.393) 4.490 6.912 ( 2.237 -5.011 7.325) 9.153 6.995 ( 4.462 -1.450 -0.287) 4.701 7.261 ( -3.998 -1.647 -1.404) 4.546 7.294 ( 0.328 -2.524 2.028) 3.255 7.400 ( -3.066 3.348 -4.059) 6.090 7.537 ( 3.849 0.846 4.633) 6.082 7.724 ( -2.892 0.616 -2.490) 3.866 7.821 ( -0.208 -0.416 3.206) 3.240 7.987 ( -6.192 3.941 -0.290) 7.345 8.147 ( 1.593 1.255 -0.342) 2.057 8.236 ( -5.341 0.803 -1.112) 5.514 8.493 ( -11.235 8.713 -3.929) 14.751 8.814 ( -3.188 -5.513 -0.189) 6.371 9.413 ( 33.010 0.202 -4.875) 33.369 13.062 ( 0.504 -1.825 -1.072) 2.176 13.236 ( -2.115 0.921 1.700) 2.865 14.644 ( -2.297 -2.053 3.651) 4.777 14.828 ( 0.333 0.102 -0.178) 0.391 17.332 ( 0.755 0.362 0.025) 0.838 17.341 ( 1.504 0.175 -1.103) 1.873 17.645 ( 0.513 -1.163 1.360) 1.861 18.048 ( -2.648 0.719 -1.549) 3.151 21.061 ( -1.141 0.945 0.553) 1.581 21.518 ( 0.026 0.229 -0.411) 0.471 21.733 ( 0.289 0.478 -0.846) 1.013 21.879 ( 1.179 0.719 -0.638) 1.521 24.113 ( 1.077 0.749 -0.242) 1.334 24.155 ( 0.022 0.465 -0.702) 0.843 28.191 ( -0.301 1.041 0.961) 1.448 28.258 ( -0.728 -1.001 0.490) 1.331 32.915 ( -1.642 3.615 -0.028) 3.971 33.469 ( -14.537 -15.949 14.836) 26.188 36.439 ( 5.065 -0.220 2.044) 5.466 37.009 ( 0.324 -0.888 -2.057) 2.264 39.613 ( -0.479 -7.395 3.012) 7.999 40.133 ( 0.654 1.431 1.463) 2.149 41.007 ( -9.889 -0.626 -7.629) 12.506 42.186 ( 9.718 7.577 -17.198) 21.158 ======================= Grid point 73 (28/165) ======================= q-point: (-0.25 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.163 ( -16.414 22.711 -0.634) 28.029 1.695 ( -19.901 31.771 9.182) 38.598 2.249 ( -29.825 19.096 12.197) 37.456 2.719 ( -8.630 9.990 2.135) 13.373 3.096 ( -7.034 5.230 3.924) 9.604 3.352 ( -3.481 3.451 -5.880) 7.655 3.630 ( 7.489 -2.173 13.527) 15.614 3.755 ( 12.388 -2.820 -4.433) 13.456 4.169 ( 0.365 -10.072 -3.271) 10.596 4.235 ( -0.645 -4.461 7.486) 8.738 4.485 ( -11.080 -2.260 5.490) 12.570 4.517 ( -5.012 -2.343 -0.559) 5.561 4.653 ( 3.482 -5.487 0.993) 6.574 4.825 ( 1.117 -3.285 -7.999) 8.720 4.922 ( 2.305 3.975 -1.086) 4.722 5.183 ( 8.789 -1.080 2.763) 9.276 5.438 ( 13.101 -12.391 0.253) 18.034 5.579 ( -1.434 -2.907 -1.753) 3.685 5.710 ( 9.251 4.875 -11.305) 15.400 5.852 ( -9.894 -5.026 -1.184) 11.160 5.963 ( 6.603 -0.151 -2.386) 7.023 5.999 ( -3.107 0.656 -0.510) 3.217 6.175 ( 5.211 1.683 4.356) 6.997 6.306 ( -2.758 -0.751 -0.856) 2.984 6.475 ( 6.737 0.805 1.017) 6.860 6.537 ( -0.003 2.770 3.123) 4.174 6.617 ( 1.112 -5.752 -0.337) 5.868 6.856 ( -5.316 -1.721 3.591) 6.643 6.951 ( -2.976 3.935 -0.773) 4.994 7.022 ( -1.315 -2.612 6.252) 6.902 7.251 ( 2.867 4.953 0.757) 5.772 7.298 ( -1.683 -6.719 -0.236) 6.931 7.431 ( -3.204 -7.514 -0.106) 8.169 7.552 ( 4.088 5.454 4.931) 8.413 7.692 ( -4.640 -2.383 -1.136) 5.339 7.800 ( -2.398 3.569 1.371) 4.513 7.829 ( -5.576 5.717 0.569) 8.006 8.063 ( -9.466 2.957 -1.457) 10.024 8.153 ( -6.809 -1.569 1.496) 7.146 8.330 ( -0.721 1.884 -0.629) 2.113 8.886 ( 1.449 -4.895 -2.008) 5.486 9.758 ( 35.949 5.728 -9.703) 37.673 13.095 ( 0.014 -2.382 -0.921) 2.554 13.196 ( -1.295 2.193 0.910) 2.705 14.636 ( -4.610 0.319 4.868) 6.712 14.853 ( 1.120 -2.418 -0.725) 2.761 17.338 ( 1.658 0.774 0.077) 1.831 17.349 ( 0.988 0.226 -0.675) 1.218 17.685 ( -1.403 -3.483 3.258) 4.971 17.994 ( -2.402 0.856 -3.178) 4.075 21.040 ( -0.574 0.626 1.313) 1.564 21.508 ( -0.267 0.577 -0.317) 0.711 21.733 ( 0.552 -0.358 -0.868) 1.089 21.878 ( 1.904 1.412 -0.774) 2.493 24.108 ( 1.159 1.499 -0.126) 1.899 24.146 ( 0.585 0.680 -0.879) 1.255 28.176 ( -0.233 0.885 0.829) 1.235 28.266 ( -0.747 -0.793 0.592) 1.240 32.825 ( -2.931 4.015 0.517) 4.998 33.654 ( -32.562 -34.193 22.690) 52.386 36.528 ( 8.680 0.554 1.593) 8.842 37.007 ( -0.976 -0.203 -1.381) 1.703 39.758 ( -0.865 -9.265 4.003) 10.130 40.136 ( 3.728 1.668 -0.388) 4.102 40.820 ( -16.660 -0.177 -8.577) 18.739 42.036 ( 11.319 16.590 -30.304) 36.355 ======================= Grid point 74 (29/165) ======================= q-point: (-0.12 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.621 ( -9.800 24.641 8.709) 27.912 1.004 ( -12.425 36.764 17.757) 42.677 1.439 ( -48.809 25.672 27.725) 61.726 2.554 ( -3.420 4.730 3.710) 6.916 3.019 ( -4.684 1.080 6.313) 7.935 3.281 ( 0.804 -0.231 -13.157) 13.183 3.792 ( 4.678 -0.940 11.111) 12.093 3.902 ( 8.647 -0.084 -1.050) 8.711 4.262 ( 3.105 -0.662 8.053) 8.656 4.322 ( -1.250 -6.704 -0.590) 6.845 4.433 ( -5.355 -1.909 -0.075) 5.685 4.506 ( -3.921 -6.156 -2.117) 7.600 4.698 ( -1.630 1.067 -1.083) 2.229 4.840 ( 0.825 -4.582 0.511) 4.684 5.021 ( 6.368 -4.034 1.858) 7.764 5.321 ( 9.389 -0.898 -0.144) 9.433 5.550 ( -0.034 0.749 -0.791) 1.090 5.653 ( 1.597 2.659 -6.685) 7.369 5.737 ( 4.243 -8.781 -5.245) 11.073 5.913 ( 3.060 1.580 -3.417) 4.851 5.970 ( 7.305 -5.063 -1.732) 9.055 6.077 ( 1.359 -4.198 7.842) 8.998 6.189 ( 0.419 3.146 1.786) 3.642 6.300 ( 3.394 -0.364 2.376) 4.159 6.440 ( -0.437 4.733 4.418) 6.489 6.602 ( 3.248 -0.228 0.880) 3.372 6.618 ( -5.302 0.263 -1.058) 5.412 6.833 ( -1.328 -0.306 -1.835) 2.285 6.876 ( -0.340 -0.663 -4.523) 4.584 7.161 ( 1.760 -8.882 14.083) 16.743 7.229 ( -0.511 -0.603 4.776) 4.841 7.357 ( -4.660 -4.644 -1.431) 6.732 7.498 ( -4.400 -0.538 2.540) 5.109 7.551 ( 0.312 -2.320 7.995) 8.331 7.628 ( 3.123 0.258 -0.027) 3.134 7.719 ( -3.694 0.759 0.477) 3.802 7.751 ( 1.212 2.807 2.100) 3.709 7.910 ( -13.052 -3.631 -1.737) 13.658 8.146 ( -6.750 -3.833 6.854) 10.355 8.324 ( 1.136 0.639 0.307) 1.339 8.967 ( 3.018 -2.869 -2.082) 4.656 9.880 ( 31.717 27.329 -21.117) 46.891 13.119 ( -1.511 -1.731 -0.843) 2.447 13.150 ( 1.059 3.108 -0.306) 3.298 14.580 ( -4.356 1.679 3.047) 5.574 14.920 ( 0.478 -4.784 0.266) 4.816 17.338 ( 1.825 1.746 -1.046) 2.734 17.353 ( 0.186 0.104 0.167) 0.271 17.735 ( -9.986 -7.782 1.875) 12.798 17.953 ( 1.231 0.664 -3.177) 3.471 21.073 ( 5.044 -1.951 7.500) 9.246 21.494 ( -0.344 0.476 -0.322) 0.670 21.749 ( 0.626 -1.117 -0.381) 1.336 21.866 ( 2.298 3.032 -1.377) 4.047 24.088 ( 1.108 2.712 -0.934) 3.075 24.141 ( 0.672 0.497 -0.762) 1.131 28.168 ( -0.297 0.113 0.726) 0.792 28.269 ( -0.335 -0.049 0.288) 0.445 32.746 ( -1.546 2.646 1.371) 3.357 34.000 ( -80.222 -79.079 16.038) 113.781 36.586 ( 5.865 7.493 -7.575) 12.163 36.971 ( -3.169 0.794 -3.363) 4.688 39.877 ( -4.316 -6.426 4.166) 8.791 40.177 ( 11.030 3.130 -0.110) 11.466 40.564 ( -18.267 0.001 -7.996) 19.940 41.530 ( 16.026 52.025 -45.764) 71.118 ======================= Grid point 76 (30/165) ======================= q-point: ( 0.12 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.022 ( 17.493 -0.000 25.277) 30.740 1.182 ( 32.856 -0.000 12.092) 35.011 2.041 ( 46.938 -0.000 27.619) 54.461 2.738 ( 8.361 -0.000 7.188) 11.026 2.889 ( -6.798 0.000 -17.918) 19.164 2.976 ( -2.039 0.000 7.451) 7.725 3.789 ( -7.056 0.000 2.995) 7.665 3.802 ( -7.150 0.000 12.353) 14.273 4.275 ( -4.837 0.000 -7.952) 9.308 4.290 ( -1.456 0.000 -12.295) 12.381 4.382 ( -2.350 0.000 0.375) 2.380 4.629 ( -4.006 0.000 -6.420) 7.567 4.713 ( 11.097 -0.000 -9.986) 14.929 5.006 ( -5.822 0.000 2.888) 6.499 5.134 ( -7.240 0.000 -6.806) 9.937 5.295 ( -4.824 0.000 -3.409) 5.907 5.505 ( -8.730 0.000 -5.494) 10.314 5.507 ( -11.825 0.000 -2.709) 12.132 5.807 ( -3.636 0.000 4.612) 5.873 6.027 ( -6.362 0.000 12.274) 13.825 6.173 ( -14.293 0.000 9.140) 16.965 6.232 ( 3.136 -0.000 0.740) 3.223 6.291 ( 9.496 -0.000 -4.834) 10.656 6.330 ( -3.556 0.000 -8.527) 9.239 6.339 ( 11.109 -0.000 -1.318) 11.187 6.370 ( -0.434 0.000 1.961) 2.009 6.719 ( -7.291 0.000 -4.121) 8.375 6.776 ( -5.479 0.000 5.984) 8.113 6.928 ( -5.018 0.000 10.175) 11.345 6.983 ( 6.076 -0.000 -8.797) 10.692 7.213 ( 5.302 -0.000 5.594) 7.707 7.268 ( -5.542 0.000 -0.589) 5.574 7.299 ( -10.124 0.000 4.581) 11.112 7.453 ( 8.369 -0.000 -2.993) 8.889 7.660 ( 0.537 -0.000 -0.848) 1.004 7.881 ( 0.329 -0.000 3.576) 3.592 7.931 ( 9.184 -0.000 4.762) 10.345 8.143 ( 10.420 -0.000 2.676) 10.759 8.189 ( -5.923 0.000 -2.695) 6.507 8.196 ( -1.888 0.000 3.105) 3.634 9.062 ( 0.401 -0.000 1.171) 1.237 9.670 ( -8.561 0.000 -1.148) 8.638 13.079 ( 1.292 -0.000 -1.785) 2.204 13.165 ( -0.045 0.000 1.371) 1.372 14.506 ( -0.065 0.000 -0.593) 0.597 14.889 ( -0.005 0.000 1.005) 1.005 17.334 ( 0.319 -0.000 0.462) 0.562 17.364 ( 2.076 -0.000 -1.111) 2.354 17.546 ( 3.900 -0.000 -3.740) 5.404 17.987 ( -2.678 0.000 2.038) 3.365 21.320 ( -5.901 0.000 4.882) 7.659 21.458 ( -1.143 0.000 -1.188) 1.649 21.795 ( 0.953 -0.000 0.577) 1.114 21.840 ( 0.516 -0.000 0.377) 0.639 24.054 ( 1.339 -0.000 -0.574) 1.457 24.145 ( 0.045 -0.000 -0.225) 0.229 28.153 ( -0.301 0.000 0.800) 0.855 28.268 ( 0.658 -0.000 -0.535) 0.848 32.862 ( 5.827 -0.000 6.280) 8.566 32.865 ( 27.143 -0.000 -18.879) 33.063 36.308 ( -0.499 0.000 2.456) 2.506 36.911 ( 0.231 -0.000 -3.739) 3.746 39.700 ( -7.832 0.000 -3.596) 8.618 40.518 ( 4.481 -0.000 -2.370) 5.069 40.660 ( -6.183 0.000 -1.853) 6.454 42.253 ( 32.956 -0.000 -22.423) 39.860 ======================= Grid point 77 (31/165) ======================= q-point: ( 0.25 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( 21.302 -6.433 15.129) 26.908 1.751 ( 29.108 -15.335 11.151) 34.739 2.617 ( 9.326 5.960 -3.299) 11.549 2.776 ( 16.079 -0.458 8.269) 18.087 2.896 ( 11.185 -5.366 4.492) 13.193 3.129 ( 5.603 -13.359 9.238) 17.181 3.713 ( -4.049 1.624 8.071) 9.174 3.812 ( -9.740 -3.663 11.803) 15.735 4.068 ( 1.199 8.571 -12.690) 15.360 4.282 ( -0.154 -1.886 -9.015) 9.212 4.398 ( -0.353 -4.447 -6.766) 8.105 4.480 ( -7.431 7.780 -2.445) 11.033 4.616 ( 0.457 12.496 -4.569) 13.312 4.984 ( -7.475 -5.166 1.923) 9.287 5.070 ( -4.042 -3.839 -6.879) 8.855 5.108 ( -8.012 9.905 -1.181) 12.795 5.349 ( -14.666 -1.322 -1.377) 14.790 5.487 ( -5.166 -10.136 1.035) 11.423 5.782 ( -3.435 -0.433 5.581) 6.568 5.943 ( -7.685 3.841 9.510) 12.816 6.064 ( -6.033 6.098 -1.753) 8.755 6.130 ( -6.497 -1.664 8.713) 10.995 6.259 ( -3.824 5.840 -4.024) 8.058 6.333 ( 0.120 5.378 -3.289) 6.305 6.378 ( 2.236 0.060 0.686) 2.340 6.498 ( 12.234 -3.016 -7.270) 14.547 6.687 ( 3.606 -1.833 -2.229) 4.619 6.791 ( 2.221 -0.712 -4.980) 5.499 6.886 ( 3.622 8.708 4.202) 10.325 7.002 ( -4.370 -2.043 -6.453) 8.057 7.052 ( 2.987 6.640 2.715) 7.771 7.288 ( -0.497 -1.901 7.293) 7.553 7.343 ( -5.159 -3.893 -0.103) 6.464 7.531 ( 0.469 -1.858 -2.017) 2.782 7.690 ( -0.896 -5.206 0.951) 5.367 7.916 ( 4.063 -0.394 1.178) 4.249 7.972 ( 1.961 6.690 4.627) 8.368 8.108 ( -1.382 -0.890 -1.575) 2.276 8.220 ( 0.099 -3.336 0.609) 3.392 8.386 ( 12.756 -6.828 5.729) 15.561 9.042 ( 0.369 3.006 0.389) 3.053 9.505 ( -18.334 2.360 0.019) 18.485 13.090 ( 3.280 1.201 -2.851) 4.508 13.187 ( 1.194 -0.936 1.272) 1.980 14.510 ( 0.592 -0.745 -1.362) 1.662 14.891 ( 0.315 0.658 0.955) 1.202 17.333 ( 1.172 1.003 0.181) 1.553 17.374 ( 0.480 0.530 0.059) 0.718 17.575 ( 3.650 -0.063 -4.029) 5.437 17.988 ( -4.652 -4.115 1.934) 6.505 21.241 ( -2.879 4.276 4.210) 6.656 21.461 ( -1.207 -2.162 -1.183) 2.744 21.797 ( 0.005 0.787 1.084) 1.340 21.857 ( 0.120 -0.972 0.252) 1.011 24.078 ( 1.915 -0.515 -0.740) 2.117 24.147 ( -0.260 -0.499 -0.162) 0.586 28.160 ( -0.061 -0.574 0.857) 1.033 28.273 ( 0.307 0.055 -0.485) 0.576 32.960 ( 7.956 0.847 3.954) 8.924 33.073 ( 19.278 0.116 -13.209) 23.370 36.339 ( -1.277 -2.609 1.745) 3.388 36.908 ( 0.898 -1.165 -4.357) 4.598 39.579 ( -7.032 1.337 -4.420) 8.413 40.370 ( -0.437 10.420 1.680) 10.564 40.785 ( -2.823 -13.444 -5.053) 14.637 42.424 ( 19.082 5.590 -13.435) 23.997 ======================= Grid point 78 (32/165) ======================= q-point: ( 0.38 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( 18.215 -8.916 7.371) 21.578 2.349 ( 16.829 -14.850 7.665) 23.717 2.439 ( 3.324 10.120 -4.641) 11.619 2.893 ( 2.638 -1.172 1.279) 3.158 3.165 ( 12.591 2.843 9.627) 16.103 3.397 ( -10.411 -9.444 11.043) 17.875 3.728 ( -4.294 -2.037 1.032) 4.864 3.785 ( 5.020 3.442 1.457) 6.258 4.090 ( 13.153 -2.181 -2.249) 13.521 4.209 ( -7.139 2.269 8.812) 11.565 4.335 ( 4.292 3.784 -4.392) 7.214 4.414 ( -5.584 -4.472 -8.207) 10.888 4.473 ( 3.659 2.463 -1.426) 4.635 4.866 ( -3.852 4.957 0.646) 6.311 4.996 ( -9.484 -8.297 -3.938) 13.202 5.093 ( -0.851 -2.136 -0.753) 2.419 5.221 ( -10.109 -0.231 3.027) 10.555 5.592 ( -0.101 0.603 0.928) 1.111 5.788 ( -9.552 -2.189 0.820) 9.834 5.801 ( -5.185 -2.173 2.389) 6.108 5.916 ( -5.200 6.332 0.716) 8.225 6.023 ( -12.283 -0.873 -4.633) 13.157 6.186 ( -6.188 -1.672 6.035) 8.804 6.217 ( 7.863 8.269 -3.768) 12.016 6.382 ( 0.454 1.247 0.317) 1.364 6.600 ( -2.029 8.791 -5.325) 10.476 6.634 ( 8.501 2.282 -5.559) 10.410 6.788 ( 2.325 -0.873 1.890) 3.121 6.897 ( 9.785 2.915 -6.325) 12.010 6.977 ( 4.102 3.016 5.581) 7.554 7.121 ( 4.891 -3.287 -2.333) 6.338 7.254 ( -7.625 0.549 -2.899) 8.176 7.341 ( -3.152 -4.882 5.179) 7.784 7.570 ( -0.122 -3.568 1.073) 3.728 7.743 ( -4.003 -2.008 1.546) 4.737 7.904 ( 2.274 5.199 1.532) 5.878 7.997 ( 4.951 -2.318 -0.493) 5.489 8.105 ( -1.517 -0.838 -0.890) 1.948 8.272 ( 0.721 -1.787 -0.341) 1.957 8.636 ( 2.248 -5.991 7.558) 9.903 9.028 ( 7.648 2.381 -0.909) 8.062 9.199 ( -18.337 5.841 -0.830) 19.263 13.090 ( 4.373 2.870 -2.668) 5.872 13.227 ( 1.954 -0.841 1.134) 2.411 14.531 ( 0.622 -1.719 -1.369) 2.284 14.882 ( -0.434 1.223 1.502) 1.985 17.336 ( 1.911 0.908 -0.320) 2.140 17.365 ( 0.176 0.914 0.087) 0.935 17.600 ( 2.238 -0.390 -1.897) 2.959 18.004 ( -5.958 -4.679 0.910) 7.630 21.170 ( -1.392 3.571 2.771) 4.729 21.478 ( -0.988 -2.165 -1.024) 2.590 21.783 ( -0.637 1.089 0.935) 1.570 21.872 ( 0.107 -0.689 0.011) 0.697 24.105 ( 2.378 -0.157 -0.662) 2.474 24.151 ( -0.389 -0.656 -0.319) 0.827 28.176 ( 0.044 -0.926 1.019) 1.377 28.267 ( -0.248 0.481 -0.278) 0.609 33.035 ( 5.943 2.299 2.394) 6.807 33.208 ( 10.125 0.035 -3.535) 10.725 36.365 ( -0.499 -1.540 1.768) 2.397 36.929 ( 1.425 -2.088 -4.527) 5.185 39.477 ( -4.917 -0.024 -3.072) 5.798 40.252 ( -0.437 5.462 2.384) 5.975 40.895 ( -5.731 -9.715 -6.192) 12.867 42.458 ( 14.445 7.952 -9.167) 18.866 ======================= Grid point 79 (33/165) ======================= q-point: ( 0.50 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( 2.597 0.569 8.727) 9.123 2.198 ( 2.733 5.190 -6.597) 8.827 2.809 ( 10.223 -9.531 5.038) 14.857 2.867 ( -1.308 8.498 5.654) 10.291 3.196 ( 0.446 -0.178 2.190) 2.242 3.399 ( -5.458 0.678 7.039) 8.933 3.659 ( -5.701 -0.599 0.460) 5.751 3.872 ( 2.306 -0.981 2.565) 3.586 4.045 ( -2.019 0.875 11.003) 11.221 4.244 ( -2.082 1.763 -2.321) 3.582 4.357 ( 8.390 -0.786 -8.331) 11.850 4.468 ( 7.205 3.693 -0.889) 8.145 4.508 ( 1.421 -5.563 -1.166) 5.858 4.901 ( 0.808 0.200 0.717) 1.098 4.998 ( -12.322 5.610 3.769) 14.053 5.070 ( 0.150 -11.797 1.900) 11.950 5.203 ( -2.657 -7.031 1.943) 7.763 5.401 ( 4.061 13.516 -0.909) 14.142 5.624 ( -10.732 9.048 -0.539) 14.048 5.810 ( -8.168 -7.109 -1.037) 10.877 5.891 ( -0.996 -11.118 -10.339) 15.214 6.005 ( -0.610 -1.909 -4.270) 4.717 6.139 ( 0.952 1.086 4.016) 4.268 6.246 ( -1.494 -3.290 1.203) 3.809 6.336 ( -3.373 6.103 0.588) 6.998 6.434 ( 3.788 1.759 -2.741) 4.995 6.687 ( 5.842 2.623 0.696) 6.442 6.808 ( -1.055 1.425 7.355) 7.566 6.910 ( 5.084 2.422 -6.763) 8.801 7.019 ( -2.297 -2.806 -1.758) 4.030 7.106 ( 0.760 2.557 4.508) 5.239 7.290 ( 4.706 -2.115 0.352) 5.172 7.445 ( 3.154 -6.450 -0.100) 7.181 7.590 ( -2.312 1.554 -0.489) 2.829 7.714 ( -0.777 -0.353 2.411) 2.557 7.850 ( -0.885 3.823 -1.249) 4.118 8.057 ( -1.697 0.590 -0.361) 1.833 8.112 ( 3.003 -2.425 -1.186) 4.038 8.272 ( -3.397 0.076 -0.821) 3.495 8.622 ( -15.720 -1.180 2.791) 16.009 8.852 ( -9.050 8.953 1.576) 12.828 9.295 ( 20.946 -7.006 -2.680) 22.249 13.086 ( 4.589 3.005 -1.626) 5.722 13.259 ( 2.326 0.529 0.461) 2.430 14.564 ( -0.188 -2.412 -0.229) 2.430 14.857 ( -1.370 1.344 1.699) 2.563 17.346 ( 2.146 0.718 -0.693) 2.367 17.356 ( 0.615 0.708 -0.052) 0.939 17.622 ( 0.828 -0.532 0.280) 1.023 17.998 ( -6.445 -3.738 -0.477) 7.466 21.118 ( -0.945 2.701 1.753) 3.356 21.494 ( -0.900 -1.713 -0.837) 2.108 21.759 ( -0.915 1.004 0.414) 1.420 21.882 ( 0.395 -0.386 -0.242) 0.603 24.130 ( 2.138 0.278 -0.249) 2.170 24.156 ( 0.337 -0.376 -0.862) 0.999 28.196 ( 0.035 -0.859 1.172) 1.453 28.251 ( -0.684 0.652 -0.058) 0.947 33.041 ( 1.820 4.011 2.172) 4.911 33.274 ( 1.604 0.339 2.760) 3.211 36.403 ( 1.763 -1.584 2.025) 3.117 36.961 ( 1.429 -2.058 -4.053) 4.764 39.450 ( -2.256 -3.071 -0.540) 3.849 40.200 ( 1.061 2.851 1.589) 3.432 40.894 ( -10.322 -5.759 -6.338) 13.412 42.448 ( 12.666 8.606 -9.223) 17.876 ======================= Grid point 80 (34/165) ======================= q-point: (-0.38 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( -6.952 19.285 3.741) 20.838 2.221 ( -17.546 5.247 8.835) 20.334 2.666 ( 7.144 10.597 1.300) 12.847 3.011 ( 6.100 2.274 3.003) 7.169 3.246 ( -7.408 -6.276 -4.687) 10.781 3.379 ( 3.356 -2.983 3.985) 6.004 3.642 ( -3.594 -0.057 3.487) 5.008 3.776 ( -11.513 8.549 7.915) 16.379 4.096 ( 2.379 8.718 0.001) 9.037 4.180 ( 4.563 0.354 6.883) 8.266 4.353 ( -6.785 -0.770 -2.415) 7.243 4.555 ( 9.115 -2.571 -2.262) 9.737 4.599 ( 7.571 1.011 -4.637) 8.936 4.715 ( -5.779 4.021 2.482) 7.465 4.971 ( 2.699 -7.589 2.906) 8.563 5.171 ( -5.014 5.802 4.217) 8.751 5.238 ( -1.027 -2.700 -0.645) 2.960 5.383 ( 7.044 -0.716 -1.752) 7.294 5.614 ( 0.847 -13.743 -1.350) 13.835 5.790 ( -8.549 -5.533 -2.861) 10.578 5.924 ( -6.122 -0.200 -4.848) 7.811 6.002 ( 7.775 0.701 -8.152) 11.287 6.166 ( 4.921 2.531 -1.099) 5.642 6.275 ( -2.737 -2.821 -0.337) 3.945 6.301 ( -2.532 -8.511 0.341) 8.886 6.506 ( 3.942 -1.615 0.595) 4.301 6.687 ( 4.000 6.173 4.992) 8.889 6.840 ( -2.466 -2.166 7.925) 8.577 6.907 ( 5.354 -0.455 -0.137) 5.375 7.029 ( -11.564 -9.472 -0.245) 14.950 7.103 ( 1.742 4.039 3.885) 5.869 7.366 ( 6.907 2.003 2.106) 7.494 7.445 ( -2.643 5.836 -5.162) 8.227 7.603 ( 5.803 -1.573 -0.289) 6.019 7.722 ( -3.721 2.789 4.364) 6.377 7.784 ( -0.687 -1.680 -2.278) 2.913 7.992 ( -1.978 3.260 -0.614) 3.862 8.164 ( -1.569 -0.192 -0.587) 1.686 8.174 ( -6.864 3.081 -1.340) 7.642 8.398 ( -14.537 2.002 -2.878) 14.954 8.748 ( -1.321 -0.762 2.947) 3.318 9.676 ( 23.943 -8.640 -5.020) 25.945 13.090 ( 3.528 2.129 -0.374) 4.137 13.267 ( 2.752 2.135 -0.594) 3.533 14.592 ( -2.231 -2.170 2.067) 3.736 14.830 ( -1.146 0.505 0.719) 1.444 17.353 ( 1.310 0.553 -0.132) 1.428 17.362 ( 1.743 0.381 -0.804) 1.957 17.636 ( -1.272 -0.572 2.476) 2.841 17.970 ( -5.232 -2.417 -2.074) 6.125 21.079 ( -0.667 1.934 1.546) 2.564 21.501 ( -0.920 -1.033 -0.698) 1.550 21.737 ( -0.658 0.536 -0.103) 0.855 21.892 ( 0.760 -0.220 -0.497) 0.934 24.140 ( 0.584 0.339 0.068) 0.679 24.166 ( 2.163 0.565 -1.293) 2.583 28.207 ( -0.036 0.427 1.098) 1.178 28.238 ( -0.829 -0.411 0.394) 1.006 32.976 ( -2.007 5.102 2.686) 6.105 33.254 ( -7.414 0.444 6.669) 9.982 36.476 ( 3.545 -2.573 1.713) 4.703 36.987 ( 1.007 -1.285 -3.381) 3.755 39.514 ( -0.136 -6.127 2.191) 6.508 40.201 ( 4.543 1.777 0.525) 4.906 40.780 ( -14.693 -2.049 -5.890) 15.962 42.402 ( 11.201 9.309 -12.681) 19.311 ======================= Grid point 81 (35/165) ======================= q-point: (-0.25 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( -6.276 24.117 7.421) 26.001 1.747 ( -27.286 21.061 14.933) 37.565 2.645 ( 10.967 15.716 3.779) 19.534 2.896 ( -1.882 22.995 4.272) 23.464 3.139 ( -4.961 7.064 -4.943) 9.947 3.264 ( -15.735 5.128 -0.458) 16.556 3.615 ( 3.111 -13.348 1.144) 13.753 3.792 ( 8.523 -2.996 2.904) 9.490 4.106 ( 3.204 -2.643 2.783) 5.000 4.204 ( -4.680 -0.970 0.783) 4.843 4.288 ( -8.947 -2.448 9.050) 12.959 4.560 ( 1.026 6.081 -3.528) 7.105 4.669 ( 6.672 -1.240 -0.432) 6.800 4.759 ( 2.385 -4.256 -1.126) 5.007 5.028 ( -0.208 6.090 1.563) 6.291 5.209 ( 5.735 -10.506 4.721) 12.866 5.312 ( -2.940 -9.696 -0.840) 10.166 5.517 ( 9.682 -4.197 -4.255) 11.378 5.673 ( -5.187 -2.216 -3.735) 6.765 5.842 ( 1.117 0.561 -2.726) 2.999 5.905 ( 0.621 -7.799 -2.206) 8.129 6.021 ( 5.020 -0.220 -2.964) 5.833 6.216 ( 5.046 0.440 0.109) 5.067 6.278 ( -0.183 -1.313 -3.502) 3.744 6.454 ( -1.148 -12.124 -0.177) 12.180 6.534 ( -4.555 -1.317 2.385) 5.308 6.663 ( 6.460 5.859 3.678) 9.466 6.832 ( -2.334 2.903 4.232) 5.638 6.937 ( -10.720 -1.743 8.658) 13.890 7.030 ( -2.271 4.031 -4.704) 6.598 7.139 ( 3.497 -9.345 2.782) 10.358 7.317 ( -3.715 1.386 -3.039) 4.996 7.392 ( 2.385 4.553 4.080) 6.562 7.600 ( -5.100 -0.356 0.226) 5.117 7.704 ( 4.820 2.309 3.039) 6.148 7.805 ( 1.867 0.474 -1.071) 2.204 7.889 ( -3.146 6.739 -1.679) 7.624 8.006 ( -9.720 6.545 -0.946) 11.756 8.073 ( -3.595 -0.654 0.073) 3.655 8.321 ( -0.906 -1.264 -0.488) 1.630 8.814 ( 0.810 -5.618 1.294) 5.822 10.038 ( 19.443 -7.671 -10.901) 23.573 13.094 ( 0.923 0.872 0.527) 1.375 13.258 ( 3.769 3.242 -1.605) 5.224 14.588 ( -4.679 -0.787 3.828) 6.097 14.831 ( 0.203 -1.223 -0.360) 1.291 17.359 ( 0.510 0.272 -0.290) 0.647 17.372 ( 1.803 0.410 -1.121) 2.163 17.625 ( -5.098 -0.793 4.002) 6.530 17.947 ( -0.797 -1.129 -2.324) 2.704 21.061 ( 0.161 0.806 2.804) 2.922 21.499 ( -0.799 -0.308 -0.644) 1.071 21.730 ( 0.086 -0.235 -0.393) 0.466 21.901 ( 0.873 -0.024 -0.817) 1.196 24.138 ( 0.344 0.522 -0.233) 0.668 24.171 ( 1.967 1.313 -1.241) 2.670 28.193 ( -0.265 1.212 0.799) 1.476 28.248 ( -0.470 -1.080 1.052) 1.579 32.873 ( -4.255 4.586 3.538) 7.187 33.143 ( -17.116 -0.023 9.446) 19.550 36.569 ( 2.598 -3.355 -0.147) 4.246 36.991 ( 0.191 0.047 -3.249) 3.255 39.638 ( -0.526 -7.611 3.941) 8.587 40.271 ( 12.359 1.460 0.583) 12.458 40.576 ( -16.667 0.903 -4.476) 17.281 42.296 ( 10.002 11.654 -19.870) 25.113 ======================= Grid point 82 (36/165) ======================= q-point: (-0.12 0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -5.916 23.868 14.323) 28.458 1.203 ( -7.834 26.116 18.383) 32.884 2.135 ( 3.886 52.356 17.138) 55.226 2.667 ( 1.582 7.625 6.136) 9.914 3.037 ( -3.118 3.460 5.776) 7.420 3.144 ( -4.794 -4.340 -17.915) 19.046 3.809 ( -0.187 -4.792 3.620) 6.008 3.962 ( 6.840 -2.874 -2.565) 7.850 4.133 ( -7.831 -7.318 3.748) 11.354 4.245 ( -6.621 -9.297 1.219) 11.479 4.319 ( 3.917 -3.463 4.825) 7.115 4.483 ( 1.406 1.628 -0.760) 2.281 4.729 ( -0.660 3.425 3.289) 4.794 4.799 ( 4.503 -3.430 -3.586) 6.701 5.057 ( 5.082 -4.113 3.780) 7.552 5.368 ( -2.496 -4.511 0.889) 5.232 5.456 ( 1.880 -8.701 -0.704) 8.930 5.644 ( 5.134 -1.853 -3.091) 6.272 5.657 ( 1.220 -2.253 -3.127) 4.043 5.908 ( 0.441 -3.319 -1.987) 3.893 5.952 ( 5.188 -3.359 -6.625) 9.060 6.131 ( 5.210 -0.907 5.218) 7.429 6.216 ( 1.032 2.181 -0.689) 2.509 6.304 ( 1.428 -1.271 -1.764) 2.601 6.493 ( -7.029 -1.680 6.678) 9.840 6.555 ( -5.324 0.502 -0.268) 5.354 6.702 ( 5.668 1.335 4.117) 7.132 6.759 ( 1.095 -2.712 -2.373) 3.766 6.879 ( -2.242 1.844 -1.433) 3.238 6.960 ( -14.390 -9.313 6.359) 18.282 7.203 ( -5.961 4.782 2.434) 8.021 7.320 ( 5.638 -2.577 1.793) 6.453 7.380 ( -5.837 -3.665 2.492) 7.329 7.557 ( -3.346 5.029 -0.745) 6.087 7.661 ( -2.916 0.325 -0.097) 2.935 7.761 ( 2.677 4.952 -2.799) 6.287 7.838 ( 8.738 4.223 3.035) 10.168 7.903 ( 4.086 0.994 4.524) 6.176 8.071 ( -2.753 -1.388 3.071) 4.351 8.327 ( -0.574 -0.246 -0.334) 0.709 8.926 ( 1.779 -5.566 0.645) 5.879 10.198 ( 4.245 -0.375 -20.375) 20.816 13.089 ( -1.102 -0.287 0.132) 1.146 13.239 ( 2.781 3.656 -1.426) 4.810 14.550 ( -4.336 0.308 2.914) 5.233 14.861 ( -0.184 -2.217 0.366) 2.255 17.347 ( -1.445 0.249 -0.976) 1.762 17.375 ( 1.040 0.740 -1.875) 2.269 17.574 ( -6.647 0.063 3.653) 7.585 17.979 ( 4.383 -0.482 -0.280) 4.419 21.104 ( 2.233 -3.037 6.408) 7.434 21.490 ( -0.146 0.175 -0.683) 0.720 21.743 ( 0.924 -0.866 -0.413) 1.332 21.900 ( 0.246 0.633 -1.441) 1.593 24.125 ( -0.216 1.341 -1.197) 1.811 24.160 ( 0.744 1.294 -0.999) 1.796 28.175 ( -0.439 0.980 0.832) 1.358 28.264 ( -0.155 -0.701 0.975) 1.211 32.775 ( -7.957 1.603 5.690) 9.912 32.939 ( -18.262 3.315 8.932) 20.597 36.593 ( -3.927 0.285 -5.064) 6.415 36.960 ( -0.105 1.526 -3.770) 4.069 39.746 ( -3.692 -6.773 2.912) 8.245 40.360 ( -9.785 1.946 1.094) 10.036 40.489 ( 22.390 -1.614 2.115) 22.548 42.088 ( 13.514 17.984 -29.843) 37.372 ======================= Grid point 85 (37/165) ======================= q-point: ( 0.25 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 20.809 -0.000 23.530) 31.412 1.995 ( 27.326 -0.000 5.856) 27.947 2.728 ( 6.181 -0.000 -7.440) 9.672 2.864 ( 1.308 -0.000 -3.993) 4.202 3.072 ( -0.146 0.000 14.875) 14.875 3.248 ( 29.095 -0.000 9.941) 30.747 3.692 ( -7.330 0.000 12.644) 14.615 3.804 ( 6.044 -0.000 9.019) 10.857 4.128 ( -0.793 0.000 -2.167) 2.308 4.176 ( 3.678 -0.000 -17.733) 18.111 4.358 ( 0.541 -0.000 -12.368) 12.380 4.477 ( -0.882 0.000 1.482) 1.724 4.636 ( -9.427 0.000 -11.704) 15.029 4.796 ( -15.949 0.000 -1.063) 15.984 4.911 ( -5.551 0.000 -2.186) 5.966 5.164 ( -4.351 0.000 -1.129) 4.495 5.175 ( -11.991 0.000 -1.800) 12.125 5.306 ( -3.431 0.000 6.736) 7.559 5.750 ( -7.046 0.000 7.493) 10.285 5.954 ( -6.111 0.000 9.913) 11.645 5.966 ( -9.304 0.000 7.171) 11.747 6.097 ( -10.263 0.000 -0.772) 10.292 6.243 ( 1.696 -0.000 -8.756) 8.919 6.404 ( -1.879 0.000 -4.807) 5.161 6.423 ( 3.760 -0.000 -3.125) 4.890 6.535 ( 6.558 -0.000 -0.394) 6.570 6.679 ( 7.292 -0.000 -6.355) 9.673 6.844 ( 2.678 -0.000 2.416) 3.607 6.896 ( -1.091 0.000 -14.544) 14.585 7.059 ( 7.128 -0.000 1.612) 7.308 7.121 ( -7.141 0.000 9.713) 12.056 7.221 ( 1.494 -0.000 2.277) 2.723 7.338 ( 1.723 -0.000 4.182) 4.523 7.493 ( -0.865 0.000 -4.545) 4.626 7.600 ( -6.879 0.000 2.185) 7.218 7.978 ( 5.465 -0.000 0.063) 5.465 8.076 ( -0.490 0.000 -1.851) 1.915 8.104 ( -3.763 0.000 1.669) 4.117 8.159 ( 5.949 -0.000 3.577) 6.941 8.503 ( 9.447 -0.000 7.338) 11.962 9.068 ( 1.130 -0.000 -1.451) 1.839 9.315 ( -20.873 0.000 3.071) 21.097 13.144 ( 6.197 -0.000 -3.195) 6.972 13.219 ( 4.241 -0.000 -0.424) 4.262 14.503 ( 0.491 -0.000 -1.799) 1.865 14.903 ( -0.007 0.000 1.016) 1.016 17.355 ( 0.935 -0.000 0.992) 1.363 17.387 ( 0.336 -0.000 0.503) 0.605 17.603 ( 4.278 -0.000 -5.791) 7.200 17.891 ( -7.302 0.000 3.599) 8.141 21.259 ( -2.846 0.000 3.512) 4.521 21.416 ( -1.239 0.000 -1.543) 1.979 21.802 ( -1.152 0.000 1.550) 1.931 21.855 ( 0.312 -0.000 0.571) 0.651 24.103 ( 3.230 -0.000 -0.914) 3.356 24.138 ( -0.501 0.000 -0.119) 0.515 28.160 ( 0.245 -0.000 0.875) 0.909 28.274 ( 0.172 -0.000 -0.815) 0.833 33.070 ( 5.173 -0.000 8.904) 10.298 33.238 ( 17.742 -0.000 -16.785) 24.424 36.328 ( 0.445 -0.000 2.718) 2.755 36.892 ( 1.359 -0.000 -4.645) 4.839 39.486 ( -6.246 0.000 -5.139) 8.088 40.460 ( -8.682 0.000 -1.521) 8.814 40.605 ( 3.946 -0.000 -1.625) 4.267 42.610 ( 13.795 -0.000 -10.951) 17.613 ======================= Grid point 86 (38/165) ======================= q-point: ( 0.38 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( 17.190 0.671 15.916) 23.436 2.379 ( 15.275 -7.884 5.260) 17.976 2.672 ( 7.765 11.205 -1.058) 13.674 2.901 ( 4.103 -2.647 -2.867) 5.662 3.229 ( -2.451 -8.442 14.476) 16.937 3.363 ( -3.174 2.077 9.419) 10.154 3.689 ( 2.056 5.212 -3.230) 6.468 3.948 ( 10.647 1.951 3.289) 11.313 4.130 ( -4.153 5.647 -4.018) 8.079 4.221 ( 6.642 -4.913 5.393) 9.866 4.248 ( -2.311 -2.980 -10.105) 10.786 4.450 ( 0.839 3.906 -2.588) 4.760 4.554 ( 2.695 -2.711 -2.212) 4.416 4.698 ( -4.488 -10.298 -3.255) 11.695 4.887 ( -11.574 -9.342 -5.930) 16.012 4.939 ( -4.008 11.238 1.348) 12.008 5.139 ( -3.795 -0.325 1.911) 4.262 5.451 ( -0.046 -11.910 2.493) 12.168 5.696 ( -7.405 -1.510 4.645) 8.871 5.837 ( -5.184 7.092 7.816) 11.759 5.891 ( -9.629 2.136 -2.498) 10.174 5.993 ( -6.227 6.382 -2.454) 9.248 6.091 ( -2.143 2.101 3.459) 4.579 6.408 ( 1.399 -0.942 0.382) 1.729 6.419 ( 4.823 4.266 -5.278) 8.325 6.633 ( -2.937 1.726 -9.860) 10.432 6.710 ( -0.072 -0.130 -2.698) 2.702 6.760 ( 6.250 -0.312 -3.960) 7.405 6.955 ( 1.259 -1.421 0.237) 1.913 7.054 ( -3.904 -4.565 2.929) 6.683 7.153 ( 5.979 5.624 4.101) 9.176 7.275 ( 2.213 8.298 -2.227) 8.872 7.292 ( 2.539 -1.792 3.774) 4.889 7.481 ( -1.596 -5.326 -1.365) 5.725 7.637 ( -2.673 -7.665 0.884) 8.166 8.000 ( -1.894 4.132 1.062) 4.668 8.044 ( 5.139 1.209 -0.328) 5.290 8.073 ( -0.766 -0.390 -1.410) 1.651 8.255 ( 1.985 -1.175 0.620) 2.389 8.620 ( -1.903 -1.131 9.422) 9.679 9.047 ( -21.068 2.670 3.111) 21.464 9.105 ( 7.454 -2.591 -3.939) 8.820 13.193 ( 7.399 2.526 -3.251) 8.467 13.271 ( 5.209 0.308 -0.460) 5.238 14.509 ( 0.387 -0.985 -1.551) 1.878 14.897 ( -0.846 0.891 1.281) 1.775 17.368 ( 1.261 0.507 0.693) 1.526 17.385 ( 0.340 0.816 0.311) 0.937 17.620 ( 2.858 0.568 -3.390) 4.470 17.852 ( -7.839 -4.266 2.322) 9.222 21.216 ( -1.710 2.972 2.303) 4.131 21.420 ( -1.143 -2.478 -1.246) 3.000 21.786 ( -1.761 0.563 1.431) 2.338 21.864 ( 0.158 -0.516 0.308) 0.621 24.131 ( 0.346 -0.089 -0.149) 0.387 24.142 ( 2.578 -0.322 -1.017) 2.790 28.171 ( 0.303 -0.461 0.950) 1.099 28.268 ( -0.224 0.271 -0.698) 0.782 33.142 ( 2.717 1.994 7.905) 8.594 33.339 ( 12.123 2.068 -9.270) 15.401 36.357 ( 0.810 -1.064 2.538) 2.869 36.902 ( 1.953 -1.282 -4.576) 5.138 39.406 ( -3.925 -0.286 -3.474) 5.249 40.317 ( -4.474 4.026 -0.061) 6.019 40.692 ( -1.228 -5.844 -2.893) 6.635 42.670 ( 10.749 4.433 -9.421) 14.965 ======================= Grid point 87 (39/165) ======================= q-point: ( 0.50 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.211 ( 5.768 0.939 10.679) 12.174 2.395 ( 4.069 13.759 -1.603) 14.438 2.753 ( 0.480 -5.894 6.409) 8.720 3.000 ( 8.071 -1.608 -0.140) 8.231 3.164 ( -8.980 4.341 6.903) 12.130 3.535 ( 8.792 -2.579 9.789) 13.407 3.564 ( -3.045 3.222 -3.643) 5.738 3.855 ( -11.710 7.132 1.308) 13.773 4.134 ( 9.284 -1.061 8.695) 12.764 4.184 ( -4.360 0.286 -2.812) 5.196 4.269 ( -1.121 -4.997 -6.781) 8.498 4.548 ( 8.790 -1.411 -2.640) 9.286 4.754 ( 4.732 4.822 0.703) 6.793 4.823 ( -4.174 -3.946 0.060) 5.744 4.850 ( 12.601 -14.342 4.435) 19.600 4.919 ( -7.133 -11.585 -4.802) 14.428 5.061 ( -6.734 2.018 0.195) 7.033 5.514 ( -11.049 0.915 -3.684) 11.683 5.624 ( -5.732 6.007 1.270) 8.400 5.660 ( -2.001 3.442 -0.968) 4.098 5.789 ( 1.631 2.515 1.234) 3.242 5.960 ( 3.713 -6.479 0.923) 7.524 6.104 ( -5.023 -4.079 4.864) 8.095 6.362 ( 6.013 9.342 -1.999) 11.288 6.388 ( -2.689 4.917 -1.872) 5.909 6.518 ( 5.937 2.538 -7.909) 10.210 6.690 ( -0.939 -0.117 0.840) 1.265 6.808 ( -7.605 -3.924 -0.273) 8.562 6.886 ( -4.971 3.084 4.002) 7.088 7.030 ( -0.900 7.112 0.163) 7.171 7.188 ( 4.433 -2.395 -2.701) 5.717 7.320 ( 4.878 -6.866 8.260) 11.797 7.396 ( 7.288 -1.489 -2.532) 7.857 7.544 ( -0.093 -3.436 -2.631) 4.329 7.704 ( 0.999 -2.084 -1.371) 2.687 7.903 ( -3.186 4.915 1.613) 6.075 8.050 ( -1.714 0.288 -1.400) 2.232 8.106 ( 3.837 -1.777 -1.357) 4.441 8.242 ( -1.739 2.315 -0.623) 2.961 8.499 ( -14.785 5.702 4.978) 16.610 8.829 ( -11.590 1.889 3.130) 12.153 9.330 ( 12.676 -11.409 -3.875) 17.489 13.207 ( 6.233 4.491 -1.696) 7.868 13.320 ( 5.232 1.131 -1.057) 5.456 14.529 ( 0.147 -1.684 -0.441) 1.747 14.867 ( -1.819 1.556 1.321) 2.734 17.374 ( 0.671 0.589 0.073) 0.895 17.379 ( 1.289 0.863 -0.168) 1.561 17.626 ( 0.160 0.122 0.406) 0.453 17.848 ( -5.931 -4.916 -0.236) 7.707 21.160 ( -1.049 3.078 1.531) 3.594 21.444 ( -0.894 -2.520 -1.045) 2.871 21.759 ( -1.773 0.731 0.958) 2.144 21.876 ( 0.120 -0.673 -0.117) 0.694 24.133 ( -0.413 -0.510 -0.151) 0.674 24.176 ( 3.197 0.047 -1.162) 3.402 28.188 ( 0.095 -0.773 1.021) 1.284 28.255 ( -0.395 0.647 -0.330) 0.827 33.133 ( -0.795 4.556 6.294) 7.811 33.375 ( 6.764 4.554 -2.256) 8.460 36.402 ( 1.180 -1.926 2.162) 3.127 36.933 ( 2.142 -1.832 -4.055) 4.938 39.386 ( -0.988 -2.130 -0.241) 2.361 40.245 ( -0.659 1.215 -0.160) 1.392 40.705 ( -5.563 -2.452 -3.066) 6.809 42.655 ( 8.708 6.480 -9.947) 14.723 ======================= Grid point 88 (40/165) ======================= q-point: (-0.38 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( -5.733 16.272 9.180) 19.542 2.265 ( -2.018 11.056 5.010) 12.305 2.783 ( -3.097 -1.222 5.202) 6.176 3.081 ( -3.599 -3.942 -9.343) 10.760 3.146 ( 11.401 1.609 7.041) 13.497 3.418 ( -0.101 4.895 -5.854) 7.631 3.567 ( -11.311 4.759 1.800) 12.402 3.797 ( -1.018 -5.113 18.783) 19.493 4.152 ( -0.841 -0.872 -4.187) 4.359 4.277 ( 5.313 0.089 7.349) 9.069 4.295 ( -1.744 0.283 -2.305) 2.904 4.592 ( 1.792 3.180 -7.798) 8.610 4.759 ( 0.043 4.516 -1.176) 4.667 4.796 ( 7.383 4.826 2.809) 9.257 4.918 ( 1.947 -3.756 4.657) 6.292 5.071 ( -5.619 -8.449 -1.379) 10.240 5.225 ( 3.007 -1.179 6.105) 6.907 5.322 ( -5.920 -11.206 -5.084) 13.655 5.549 ( 5.167 3.900 -1.668) 6.685 5.619 ( -1.362 -2.076 -1.905) 3.130 5.788 ( -3.255 -3.427 1.355) 4.917 6.092 ( 0.579 -2.626 -2.275) 3.523 6.160 ( -0.616 -5.443 1.698) 5.735 6.261 ( 1.703 8.427 -0.808) 8.636 6.288 ( 6.150 3.889 -5.954) 9.402 6.550 ( 4.084 0.821 -3.816) 5.650 6.698 ( -7.266 -7.802 -2.075) 10.862 6.784 ( -4.943 -1.948 7.474) 9.170 6.846 ( -2.991 -0.035 6.303) 6.976 6.980 ( 3.155 1.216 5.095) 6.115 7.175 ( -0.962 3.965 -1.892) 4.497 7.450 ( -0.624 0.724 -4.203) 4.310 7.495 ( 6.168 1.017 2.926) 6.902 7.586 ( 0.335 -4.887 -0.294) 4.908 7.733 ( 3.252 0.571 -3.180) 4.584 7.794 ( -2.146 2.786 0.959) 3.645 8.011 ( -1.276 1.590 -1.565) 2.570 8.140 ( -1.629 2.648 -1.019) 3.271 8.168 ( -3.266 2.265 1.257) 4.168 8.271 ( -8.076 1.940 -1.345) 8.414 8.729 ( -4.839 0.106 3.130) 5.764 9.658 ( 9.762 -14.792 -5.881) 18.673 13.186 ( 3.073 4.718 0.038) 5.630 13.345 ( 4.554 2.251 -1.714) 5.362 14.554 ( -0.611 -1.336 1.405) 2.032 14.827 ( -1.725 1.016 0.601) 2.090 17.370 ( 0.321 0.441 -0.482) 0.728 17.383 ( 1.127 0.490 -0.638) 1.384 17.617 ( -2.895 -0.056 2.834) 4.052 17.868 ( -1.397 -3.908 -1.463) 4.400 21.113 ( -0.698 2.402 1.523) 2.929 21.466 ( -0.472 -1.838 -1.015) 2.152 21.735 ( -1.185 0.462 0.417) 1.338 21.887 ( 0.163 -0.734 -0.498) 0.902 24.137 ( -0.211 -0.472 -0.259) 0.579 24.200 ( 2.300 0.438 -1.184) 2.624 28.206 ( -0.191 -0.898 1.160) 1.479 28.238 ( -0.257 0.889 0.105) 0.931 33.043 ( -3.978 6.196 5.485) 9.182 33.330 ( 2.340 7.943 1.787) 8.471 36.461 ( 0.681 -3.078 1.265) 3.397 36.967 ( 1.901 -1.400 -3.484) 4.209 39.445 ( 0.846 -4.328 3.143) 5.415 40.264 ( 4.220 -1.359 -0.782) 4.502 40.618 ( -7.844 1.506 -2.250) 8.299 42.584 ( 6.128 7.626 -12.454) 15.837 ======================= Grid point 89 (41/165) ======================= q-point: (-0.25 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -5.830 21.589 11.704) 25.240 1.987 ( -2.141 21.093 8.263) 22.755 2.835 ( 3.302 -0.936 3.517) 4.915 3.003 ( -9.312 -0.579 -10.165) 13.798 3.233 ( 6.749 7.672 3.748) 10.884 3.350 ( -6.302 9.787 2.614) 11.930 3.439 ( 2.329 -8.550 -4.849) 10.101 3.900 ( -0.087 2.343 15.324) 15.502 4.103 ( -8.194 5.618 0.430) 9.944 4.144 ( 1.440 3.798 1.860) 4.467 4.337 ( 4.645 2.419 5.802) 7.816 4.598 ( 1.050 -1.711 -9.615) 9.822 4.676 ( -2.092 0.317 -0.832) 2.274 4.786 ( -0.004 2.915 4.011) 4.959 5.049 ( -2.429 -4.818 0.385) 5.410 5.131 ( -0.998 2.688 1.624) 3.295 5.169 ( 3.579 -8.513 4.401) 10.230 5.515 ( -1.332 -9.250 -4.728) 10.473 5.666 ( 11.824 0.556 -2.565) 12.112 5.729 ( 6.408 -11.595 4.160) 13.886 5.809 ( -5.071 -2.389 2.255) 6.042 6.043 ( -0.320 0.383 -4.885) 4.910 6.209 ( -1.962 -2.624 -2.257) 3.979 6.277 ( 2.430 -8.267 -0.494) 8.631 6.342 ( 10.214 0.984 -7.171) 12.519 6.525 ( -0.379 4.963 1.281) 5.139 6.682 ( -16.625 -8.042 3.710) 18.837 6.781 ( 0.282 2.832 2.178) 3.584 6.860 ( -0.202 -1.004 3.289) 3.445 7.025 ( -9.069 4.496 -0.488) 10.134 7.130 ( 4.853 -5.007 6.306) 9.402 7.338 ( -0.352 5.747 -3.465) 6.720 7.521 ( -2.383 7.523 4.040) 8.865 7.563 ( 3.790 -0.836 -2.113) 4.419 7.721 ( -1.635 1.164 -2.464) 3.178 7.839 ( -1.811 -2.996 -0.686) 3.568 7.969 ( 6.873 3.469 -0.689) 7.730 8.020 ( -3.745 5.959 -1.190) 7.138 8.089 ( 2.638 2.773 0.236) 3.834 8.277 ( 0.374 -3.047 -0.129) 3.073 8.743 ( -1.094 -4.289 2.935) 5.311 9.921 ( 0.302 -13.981 -10.027) 17.207 13.135 ( -0.490 3.582 0.565) 3.659 13.341 ( 2.574 2.861 -1.316) 4.067 14.559 ( -1.602 0.269 2.696) 3.148 14.813 ( -0.231 -0.787 -0.214) 0.848 17.357 ( -0.952 0.397 -1.201) 1.583 17.384 ( 0.413 0.182 -1.019) 1.114 17.588 ( -3.254 0.423 2.959) 4.419 17.930 ( 3.485 -2.844 -0.233) 4.505 21.087 ( -0.265 1.050 2.436) 2.666 21.481 ( 0.232 -0.939 -1.028) 1.412 21.725 ( -0.192 -0.207 0.022) 0.283 21.897 ( 0.044 -0.624 -0.796) 1.012 24.139 ( -0.148 -0.152 -0.392) 0.446 24.202 ( 0.695 1.009 -1.153) 1.683 28.212 ( -0.332 0.826 0.934) 1.290 28.233 ( -0.049 -0.750 0.885) 1.161 32.910 ( -4.785 6.475 4.758) 9.353 33.205 ( 0.043 10.767 3.790) 11.415 36.513 ( -1.655 -3.528 -0.368) 3.914 36.985 ( 1.369 -0.147 -3.401) 3.669 39.546 ( -0.413 -5.265 4.541) 6.965 40.357 ( -0.945 -3.060 -0.696) 3.277 40.512 ( 5.804 3.150 -0.000) 6.603 42.449 ( 3.154 8.585 -16.436) 18.809 ======================= Grid point 90 (42/165) ======================= q-point: (-0.12 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( 5.530 22.693 10.286) 25.522 1.722 ( 11.240 22.929 9.986) 27.419 2.812 ( -10.558 5.800 3.674) 12.594 2.888 ( -1.861 -1.625 -6.889) 7.319 2.928 ( -1.282 26.781 7.509) 27.843 3.252 ( 15.701 14.372 2.715) 21.458 3.660 ( 2.728 -13.304 -5.060) 14.492 3.915 ( -2.589 -3.238 5.264) 6.700 4.039 ( -4.334 -4.386 1.843) 6.436 4.091 ( -6.860 2.295 9.742) 12.133 4.346 ( 0.908 3.425 -1.856) 4.000 4.507 ( -1.457 1.034 -2.608) 3.161 4.750 ( -4.618 1.369 4.819) 6.813 4.780 ( 5.321 -6.567 -2.675) 8.865 5.019 ( -5.082 -1.030 0.124) 5.187 5.193 ( 1.184 -6.479 0.182) 6.589 5.403 ( 3.286 -9.088 7.444) 12.198 5.569 ( -4.621 -6.002 -2.316) 7.920 5.756 ( 7.883 4.311 -0.335) 8.992 5.821 ( -0.998 -8.903 -4.578) 10.061 5.917 ( 6.462 -1.210 -2.616) 7.076 6.154 ( 4.717 -6.269 4.247) 8.921 6.236 ( 1.427 -2.273 -6.412) 6.951 6.363 ( 6.007 2.592 -6.600) 9.293 6.399 ( -9.182 4.061 8.027) 12.854 6.458 ( 0.022 -7.376 0.675) 7.407 6.643 ( -12.572 -7.829 3.641) 15.251 6.737 ( -2.882 0.273 -0.545) 2.946 6.802 ( -6.056 6.854 1.614) 9.287 6.870 ( -0.153 0.024 -5.828) 5.830 7.192 ( -2.280 -0.224 -0.264) 2.306 7.352 ( -1.446 1.010 5.163) 5.457 7.417 ( 6.619 3.060 1.632) 7.472 7.577 ( -7.796 5.218 -1.288) 9.469 7.644 ( 6.183 -2.053 -0.539) 6.537 7.862 ( 4.410 3.482 -2.396) 6.108 7.915 ( -2.825 -0.627 3.821) 4.793 8.042 ( 9.107 2.766 0.689) 9.542 8.116 ( 6.435 1.830 0.937) 6.755 8.329 ( 4.065 -0.105 0.016) 4.066 8.843 ( -0.096 -7.015 2.841) 7.569 9.968 ( -14.462 -8.196 -13.400) 21.351 13.081 ( -1.792 1.346 -0.147) 2.246 13.299 ( -1.183 3.351 0.285) 3.565 14.540 ( -0.900 1.203 1.787) 2.334 14.837 ( 0.511 -1.651 0.180) 1.737 17.326 ( -1.596 0.528 -1.731) 2.413 17.377 ( -0.389 0.084 -0.957) 1.037 17.564 ( -0.492 0.946 1.643) 1.958 18.024 ( 5.106 -1.535 0.919) 5.410 21.103 ( 0.100 -1.569 4.154) 4.441 21.493 ( 1.028 -0.133 -1.008) 1.446 21.738 ( 0.808 -0.985 -0.088) 1.277 21.897 ( -0.386 -0.046 -0.984) 1.059 24.128 ( -0.938 0.732 -0.801) 1.434 24.180 ( -0.295 1.232 -0.732) 1.463 28.193 ( -0.427 1.311 0.897) 1.645 28.253 ( 0.003 -1.036 1.035) 1.465 32.798 ( 0.331 5.324 2.533) 5.905 33.058 ( 1.793 10.537 4.326) 11.531 36.511 ( -5.028 -1.398 -2.068) 5.614 36.972 ( 1.005 1.365 -3.829) 4.188 39.620 ( -3.383 -4.770 2.573) 6.389 40.271 ( -8.052 0.700 1.779) 8.275 40.738 ( 22.059 -3.022 1.379) 22.308 42.264 ( 3.392 8.297 -19.947) 21.868 ======================= Grid point 94 (43/165) ======================= q-point: ( 0.38 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( 7.067 -0.000 18.766) 20.053 2.510 ( 13.054 -0.000 3.364) 13.481 2.818 ( 2.271 -0.000 -14.293) 14.472 2.969 ( 11.025 -0.000 3.686) 11.625 3.221 ( 2.175 -0.000 19.376) 19.498 3.291 ( -11.266 0.000 9.379) 14.659 3.757 ( -1.245 0.000 -4.451) 4.622 4.094 ( 6.241 -0.000 -0.546) 6.265 4.196 ( 5.435 -0.000 -4.292) 6.925 4.222 ( -0.740 0.000 3.987) 4.055 4.251 ( 3.501 -0.000 -10.755) 11.310 4.338 ( -4.084 0.000 -0.144) 4.086 4.376 ( -10.724 0.000 -0.905) 10.763 4.640 ( -7.168 0.000 -7.297) 10.229 4.680 ( 0.788 -0.000 4.658) 4.724 5.096 ( -5.193 0.000 1.163) 5.321 5.195 ( 17.738 -0.000 2.637) 17.932 5.320 ( -0.034 0.000 0.351) 0.353 5.617 ( -6.498 0.000 5.135) 8.282 5.801 ( -5.806 0.000 -1.549) 6.009 5.892 ( -8.475 0.000 6.340) 10.584 5.916 ( -3.948 0.000 6.997) 8.034 6.199 ( 3.321 -0.000 -15.644) 15.992 6.319 ( -4.126 0.000 2.037) 4.602 6.448 ( -0.643 0.000 0.707) 0.956 6.618 ( -0.465 0.000 -6.410) 6.427 6.619 ( -0.274 0.000 -9.926) 9.930 6.861 ( -1.345 0.000 -0.253) 1.368 6.901 ( 4.111 -0.000 7.544) 8.592 7.025 ( -4.512 0.000 7.299) 8.582 7.314 ( 5.224 -0.000 1.504) 5.436 7.362 ( 8.978 -0.000 -0.722) 9.007 7.388 ( -1.198 0.000 -2.677) 2.933 7.446 ( -5.342 0.000 3.975) 6.659 7.461 ( 6.706 -0.000 -5.625) 8.753 7.991 ( -3.699 0.000 -1.607) 4.033 8.062 ( -0.178 0.000 -1.057) 1.072 8.112 ( 3.630 -0.000 -0.887) 3.737 8.291 ( 3.197 -0.000 1.230) 3.425 8.620 ( -5.352 0.000 9.137) 10.589 8.807 ( -23.052 0.000 3.312) 23.288 9.133 ( 6.181 -0.000 -5.369) 8.187 13.296 ( 8.147 -0.000 -3.049) 8.699 13.335 ( 5.374 -0.000 -0.979) 5.462 14.500 ( 0.534 -0.000 -0.980) 1.116 14.898 ( -1.210 0.000 0.966) 1.548 17.388 ( 0.867 -0.000 0.801) 1.180 17.394 ( 0.013 -0.000 0.270) 0.270 17.650 ( 3.517 -0.000 -3.747) 5.139 17.731 ( -8.089 0.000 3.224) 8.708 21.231 ( -1.759 0.000 1.666) 2.423 21.382 ( -0.444 0.000 -1.316) 1.389 21.773 ( -2.129 0.000 1.337) 2.514 21.862 ( -0.036 0.000 0.144) 0.148 24.123 ( -0.519 0.000 -0.214) 0.561 24.175 ( 3.155 -0.000 -1.085) 3.336 28.175 ( 0.240 -0.000 0.867) 0.899 28.265 ( -0.160 0.000 -0.720) 0.738 33.215 ( 0.132 -0.000 8.291) 8.292 33.454 ( 10.215 -0.000 -6.264) 11.983 36.369 ( 0.700 -0.000 2.467) 2.564 36.899 ( 2.547 -0.000 -4.079) 4.809 39.359 ( -1.390 0.000 -1.408) 1.978 40.270 ( -6.164 0.000 0.139) 6.166 40.658 ( 1.843 -0.000 -2.585) 3.175 42.765 ( 7.290 -0.000 -10.150) 12.497 ======================= Grid point 95 (44/165) ======================= q-point: ( 0.50 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.333 ( -1.727 2.996 12.202) 12.682 2.613 ( 3.419 4.343 1.491) 5.725 2.739 ( -0.419 2.711 -5.124) 5.812 3.014 ( 1.258 3.348 2.070) 4.132 3.206 ( -1.673 1.476 4.179) 4.737 3.489 ( 3.533 -12.286 17.032) 21.296 3.636 ( -5.474 7.476 -1.025) 9.323 3.959 ( -3.173 14.241 -6.803) 16.098 4.167 ( -0.584 2.728 -0.051) 2.790 4.184 ( 0.804 -2.253 -1.426) 2.785 4.229 ( 3.792 -2.413 3.970) 5.997 4.485 ( -3.597 -13.096 -3.737) 14.086 4.542 ( -1.785 -14.208 -0.191) 14.320 4.625 ( 7.380 -3.704 -1.899) 8.473 4.755 ( 1.031 -6.917 3.657) 7.892 5.013 ( -2.120 3.927 2.179) 4.966 5.199 ( 8.029 9.182 1.317) 12.268 5.434 ( -1.087 -2.050 -0.400) 2.355 5.588 ( -1.790 4.210 0.755) 4.637 5.736 ( -5.106 3.582 2.444) 6.699 5.855 ( 0.642 -0.529 5.450) 5.513 5.910 ( 1.449 -4.097 1.012) 4.462 6.059 ( -1.654 4.132 -4.750) 6.510 6.355 ( -4.257 -4.299 -9.037) 10.876 6.425 ( -2.069 -0.424 -3.124) 3.771 6.570 ( 5.419 2.122 -6.375) 8.632 6.655 ( 1.187 -4.005 2.443) 4.839 6.812 ( -1.774 2.759 3.676) 4.926 6.927 ( -3.872 9.501 3.615) 10.878 7.082 ( 2.635 -7.291 6.779) 10.298 7.146 ( -4.774 8.168 3.223) 9.995 7.354 ( 0.273 2.143 1.166) 2.455 7.439 ( 1.574 -1.580 -1.577) 2.732 7.525 ( 11.058 -2.803 -7.881) 13.865 7.642 ( 2.943 -8.486 0.908) 9.027 7.916 ( -4.983 2.032 -0.136) 5.384 8.039 ( 0.337 2.271 -2.479) 3.379 8.143 ( 4.216 0.542 -2.490) 4.926 8.290 ( 0.405 3.475 -0.653) 3.559 8.457 ( -14.161 7.018 4.959) 16.565 8.675 ( -11.522 -5.264 4.221) 13.352 9.243 ( 5.334 -8.715 -5.678) 11.689 13.336 ( 5.174 3.714 -1.373) 6.515 13.389 ( 4.770 0.352 -1.395) 4.982 14.514 ( 0.897 -0.904 0.194) 1.288 14.874 ( -1.573 1.316 0.571) 2.128 17.387 ( -0.002 0.616 -0.001) 0.616 17.397 ( 0.308 0.193 0.134) 0.387 17.631 ( -2.497 1.378 1.264) 3.119 17.728 ( -0.666 -4.326 -0.913) 4.471 21.196 ( -1.346 2.326 0.859) 2.821 21.395 ( -0.022 -2.135 -1.020) 2.366 21.751 ( -1.820 0.403 0.901) 2.070 21.864 ( -0.221 -0.530 -0.283) 0.641 24.120 ( -0.303 -0.385 -0.293) 0.571 24.202 ( 2.127 -0.116 -1.108) 2.401 28.183 ( -0.083 -0.392 0.792) 0.888 28.259 ( 0.060 0.348 -0.403) 0.536 33.207 ( -2.640 3.252 6.549) 7.774 33.520 ( 7.855 3.366 -0.705) 8.575 36.392 ( -0.130 -1.187 1.932) 2.271 36.923 ( 2.767 -0.983 -3.214) 4.353 39.369 ( 1.649 -0.903 2.258) 2.938 40.222 ( -2.491 -0.870 0.679) 2.724 40.654 ( -0.376 0.643 -3.400) 3.480 42.762 ( 4.657 3.201 -11.470) 12.786 ======================= Grid point 96 (45/165) ======================= q-point: (-0.38 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( -5.714 7.529 9.223) 13.206 2.485 ( 0.102 11.696 1.067) 11.745 2.722 ( -3.767 -2.438 6.868) 8.204 2.949 ( -3.730 0.365 -7.649) 8.518 3.235 ( -3.574 -5.434 -1.691) 6.720 3.446 ( 1.573 10.309 2.316) 10.682 3.689 ( -1.918 6.796 2.992) 7.669 3.767 ( 0.244 -1.734 12.387) 12.510 4.125 ( -2.165 0.776 -1.711) 2.867 4.246 ( 1.255 -3.346 4.538) 5.776 4.344 ( 1.905 -3.856 4.057) 5.912 4.498 ( -1.450 -4.193 -10.489) 11.388 4.741 ( -5.051 -5.405 -1.945) 7.649 4.808 ( 3.236 -10.630 -2.602) 11.412 4.922 ( 5.222 -5.265 3.905) 8.381 5.010 ( 8.257 4.009 8.222) 12.323 5.178 ( -1.809 -2.355 2.412) 3.826 5.384 ( 4.708 8.782 1.468) 10.072 5.505 ( -0.544 -0.291 -1.772) 1.877 5.659 ( -2.818 0.022 1.108) 3.028 5.809 ( 2.486 4.508 2.964) 5.940 5.990 ( -5.524 -3.566 -2.978) 7.218 6.106 ( 3.293 -6.235 1.889) 7.300 6.310 ( -6.684 -5.027 -10.983) 13.804 6.420 ( 3.216 -0.994 -4.716) 5.794 6.504 ( 1.171 16.260 -0.643) 16.314 6.684 ( 4.353 2.187 1.405) 5.070 6.802 ( -2.943 -0.287 6.797) 7.413 6.833 ( 4.484 -0.194 5.063) 6.766 7.011 ( -4.664 2.543 4.243) 6.799 7.194 ( -0.798 0.361 -2.760) 2.895 7.396 ( -1.706 -5.137 2.730) 6.063 7.468 ( -0.865 -4.766 0.634) 4.885 7.605 ( 5.680 1.049 -6.131) 8.423 7.753 ( 1.455 -0.421 -1.031) 1.832 7.828 ( -2.141 3.185 1.174) 4.014 8.001 ( 0.185 0.288 -3.023) 3.042 8.158 ( 0.608 0.443 -0.873) 1.152 8.202 ( -1.270 5.313 -0.342) 5.473 8.272 ( -1.737 4.536 -0.389) 4.873 8.657 ( -4.980 -3.324 2.403) 6.451 9.444 ( 0.107 -14.524 -6.751) 16.017 13.295 ( 1.047 5.672 0.018) 5.768 13.412 ( 2.348 1.520 -1.049) 2.987 14.547 ( 1.187 -1.028 1.760) 2.359 14.831 ( -1.286 1.764 -0.141) 2.187 17.373 ( -0.492 0.652 -0.685) 1.066 17.393 ( -0.212 0.322 -0.470) 0.608 17.595 ( -2.517 0.185 1.754) 3.073 17.807 ( 2.560 -4.523 -0.351) 5.209 21.146 ( -1.062 2.414 0.728) 2.736 21.429 ( 0.538 -2.232 -1.006) 2.507 21.730 ( -1.039 0.398 0.368) 1.172 21.871 ( -0.259 -0.893 -0.673) 1.148 24.125 ( -0.056 -0.589 -0.394) 0.711 24.216 ( 0.630 -0.027 -1.071) 1.243 28.193 ( -0.407 -0.785 0.842) 1.221 28.252 ( 0.338 0.743 0.060) 0.819 33.117 ( -4.265 5.731 4.723) 8.564 33.518 ( 5.325 7.992 3.729) 10.302 36.417 ( -1.464 -2.290 1.021) 2.904 36.960 ( 2.516 -1.104 -2.504) 3.718 39.438 ( 3.014 -1.692 5.791) 6.744 40.250 ( 0.932 -3.017 0.762) 3.249 40.604 ( 0.070 2.304 -3.563) 4.243 42.676 ( 1.675 5.620 -13.632) 14.840 ======================= Grid point 97 (46/165) ======================= q-point: (-0.25 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( -1.822 14.318 8.741) 16.874 2.304 ( 2.128 13.648 4.759) 14.610 2.748 ( -7.293 -2.365 -3.467) 8.414 2.886 ( -4.695 -4.049 0.339) 6.209 3.238 ( -4.081 -6.371 0.075) 7.566 3.450 ( 7.868 3.672 -1.037) 8.744 3.508 ( 4.941 12.373 -1.294) 13.386 3.845 ( -11.534 -5.701 17.634) 21.829 4.067 ( -6.326 -1.134 -1.390) 6.575 4.317 ( 2.922 2.411 4.621) 5.975 4.460 ( 6.531 0.043 5.358) 8.448 4.516 ( 2.134 -1.996 -7.197) 7.768 4.634 ( -5.630 3.842 -2.098) 7.132 4.879 ( -3.881 7.628 0.501) 8.573 4.957 ( -1.130 -4.219 -2.611) 5.088 5.108 ( 3.185 -5.013 4.546) 7.479 5.200 ( 0.804 -0.933 3.450) 3.664 5.448 ( 7.205 2.276 4.164) 8.627 5.512 ( -4.963 -5.888 -2.440) 8.077 5.741 ( 3.413 -8.224 4.134) 9.817 5.894 ( 13.160 -3.728 0.577) 13.690 5.988 ( -2.457 -3.610 -2.323) 4.946 6.182 ( -2.344 2.690 2.934) 4.619 6.224 ( -1.463 -0.345 -6.097) 6.280 6.315 ( -5.270 -1.372 -2.676) 6.067 6.471 ( 3.249 -1.931 -4.526) 5.897 6.686 ( 1.866 6.813 3.139) 7.730 6.800 ( -4.087 2.025 0.635) 4.606 6.851 ( 1.051 0.524 2.440) 2.707 7.001 ( 0.232 1.610 2.580) 3.049 7.138 ( -3.212 0.447 2.728) 4.238 7.357 ( -3.303 1.136 -2.195) 4.126 7.566 ( 0.920 -0.308 -0.418) 1.057 7.635 ( 1.389 -1.645 0.301) 2.174 7.714 ( -2.413 1.649 -1.953) 3.515 7.770 ( 2.138 1.626 -1.833) 3.252 8.025 ( 0.352 -1.689 0.240) 1.742 8.115 ( 2.604 5.156 -0.841) 5.837 8.160 ( 2.913 1.317 -1.038) 3.362 8.274 ( 6.984 -1.514 -0.629) 7.174 8.687 ( -0.197 -2.856 1.696) 3.328 9.591 ( -9.257 -14.146 -9.037) 19.169 13.194 ( -2.362 5.697 0.222) 6.171 13.387 ( -1.185 2.225 0.230) 2.532 14.577 ( 1.043 0.537 2.720) 2.962 14.804 ( 0.009 0.169 -0.662) 0.683 17.348 ( -1.000 0.845 -1.496) 1.988 17.380 ( -0.883 0.153 -0.770) 1.181 17.582 ( -0.481 0.183 1.253) 1.354 17.924 ( 4.756 -4.572 0.978) 6.670 21.107 ( -0.910 1.407 1.249) 2.089 21.466 ( 1.317 -1.629 -1.052) 2.344 21.721 ( -0.061 -0.085 -0.074) 0.128 21.879 ( -0.233 -0.937 -0.874) 1.302 24.131 ( -0.102 -0.387 -0.569) 0.696 24.207 ( -0.878 0.383 -0.863) 1.289 28.205 ( -0.674 -0.965 1.041) 1.572 28.244 ( 0.539 0.946 0.444) 1.176 32.990 ( -3.079 6.276 2.974) 7.597 33.427 ( 2.653 12.046 6.243) 13.824 36.433 ( -3.000 -2.681 0.017) 4.024 36.988 ( 1.966 -0.305 -2.473) 3.174 39.520 ( 1.172 -1.454 6.570) 6.830 40.280 ( -4.793 -0.798 1.017) 4.964 40.645 ( 13.123 -2.201 -2.062) 13.465 42.508 ( -1.621 7.255 -16.103) 17.736 ======================= Grid point 98 (47/165) ======================= q-point: (-0.12 0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( 8.091 16.735 6.652) 19.743 2.190 ( 11.860 12.924 5.122) 18.274 2.592 ( -12.735 -0.882 -10.468) 16.509 2.935 ( -1.650 -2.346 5.900) 6.561 3.181 ( -4.646 13.814 5.928) 15.733 3.480 ( 4.959 -10.173 -2.761) 11.649 3.588 ( 13.833 -0.737 -0.539) 13.864 3.838 ( -13.554 -2.726 13.513) 19.332 4.015 ( -5.500 -0.845 0.639) 5.601 4.221 ( 3.922 16.211 6.753) 17.994 4.411 ( -4.697 4.396 0.076) 6.434 4.455 ( -3.266 3.074 -7.195) 8.479 4.679 ( 3.531 -7.934 1.351) 8.788 4.775 ( -1.238 1.915 4.417) 4.971 5.015 ( 3.594 1.985 -0.875) 4.198 5.179 ( 0.508 -2.910 3.186) 4.345 5.309 ( 0.203 -5.416 1.698) 5.679 5.394 ( -9.560 -2.250 1.399) 9.920 5.597 ( -1.695 -10.821 0.274) 10.956 5.894 ( 5.678 -0.737 -1.844) 6.015 5.999 ( 1.229 0.856 -1.300) 1.983 6.144 ( -4.025 -6.712 -1.463) 7.962 6.164 ( 13.863 -3.608 -0.360) 14.329 6.251 ( -4.514 -3.159 -4.902) 7.375 6.320 ( 0.374 -7.077 1.206) 7.188 6.528 ( -0.429 -2.284 4.215) 4.813 6.558 ( -0.174 9.539 5.148) 10.841 6.686 ( -6.977 2.368 -7.157) 10.272 6.808 ( 0.088 5.353 -3.521) 6.408 6.912 ( -0.932 4.629 -0.798) 4.788 7.165 ( -0.102 -2.191 3.109) 3.805 7.361 ( 0.586 -2.270 3.721) 4.398 7.504 ( -5.766 7.176 -1.955) 9.411 7.572 ( -0.057 0.439 0.074) 0.449 7.710 ( 4.997 0.921 -0.833) 5.149 7.855 ( 0.186 -4.272 1.841) 4.656 7.975 ( 1.561 4.866 -0.865) 5.183 8.135 ( 2.819 -0.274 -1.591) 3.249 8.191 ( 5.743 0.694 -1.040) 5.877 8.455 ( 16.691 -1.954 0.567) 16.814 8.749 ( -0.936 -4.822 3.269) 5.900 9.563 ( -19.738 -9.412 -10.172) 24.117 13.087 ( -2.830 3.194 -0.456) 4.291 13.322 ( -3.697 2.682 1.700) 4.873 14.576 ( 0.981 2.098 1.579) 2.804 14.821 ( 0.778 -1.461 0.222) 1.670 17.317 ( -0.309 0.803 -1.822) 2.015 17.364 ( -1.068 -0.128 -0.695) 1.281 17.585 ( 1.020 0.481 0.516) 1.241 18.049 ( 4.210 -2.978 1.231) 5.302 21.097 ( -0.793 -0.456 2.188) 2.372 21.498 ( 1.604 -0.678 -0.964) 1.990 21.732 ( 0.779 -0.873 -0.257) 1.198 21.884 ( -0.247 -0.516 -0.846) 1.021 24.123 ( -0.806 0.431 -0.853) 1.250 24.183 ( -0.967 0.532 -0.376) 1.167 28.207 ( -0.807 0.426 1.104) 1.432 28.246 ( 0.431 -0.279 0.643) 0.823 32.902 ( 1.768 4.163 0.754) 4.586 33.281 ( 1.352 12.112 6.741) 13.927 36.427 ( -3.761 -1.664 -0.385) 4.131 36.991 ( 1.449 0.996 -3.154) 3.611 39.557 ( -1.836 -0.820 3.813) 4.311 40.208 ( -5.874 0.538 2.103) 6.262 40.913 ( 18.113 -5.063 -0.933) 18.830 42.300 ( -1.453 5.870 -16.816) 17.870 ======================= Grid point 103 (48/165) ======================= q-point: (-0.50 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( -10.532 0.000 9.491) 14.177 2.655 ( -3.571 0.000 7.800) 8.579 2.686 ( -0.802 0.000 -17.490) 17.509 3.122 ( -6.967 0.000 0.084) 6.967 3.183 ( 0.304 -0.000 1.147) 1.186 3.426 ( -4.074 0.000 18.870) 19.305 3.709 ( 3.162 -0.000 4.607) 5.588 4.036 ( -5.597 0.000 -5.454) 7.815 4.055 ( -0.249 0.000 -8.614) 8.617 4.164 ( -0.487 0.000 -2.982) 3.021 4.301 ( 1.027 -0.000 2.134) 2.368 4.434 ( 7.602 -0.000 6.748) 10.165 4.467 ( 10.365 -0.000 5.647) 11.804 4.690 ( 6.643 -0.000 -2.837) 7.223 4.703 ( -1.901 0.000 8.390) 8.602 5.068 ( 4.329 -0.000 4.977) 6.596 5.294 ( -0.895 0.000 -2.578) 2.729 5.391 ( -3.973 0.000 3.477) 5.280 5.690 ( -4.301 0.000 5.332) 6.850 5.740 ( 4.309 -0.000 -0.111) 4.310 5.833 ( 0.607 -0.000 1.424) 1.548 5.857 ( -8.473 0.000 2.611) 8.866 6.075 ( 1.678 -0.000 -14.603) 14.700 6.208 ( -3.322 0.000 -3.643) 4.931 6.369 ( 1.043 -0.000 -9.024) 9.084 6.650 ( 6.414 -0.000 -3.399) 7.259 6.671 ( 7.160 -0.000 6.539) 9.697 6.828 ( -0.602 0.000 3.203) 3.259 6.958 ( -5.985 0.000 3.886) 7.136 7.072 ( -0.550 0.000 12.432) 12.444 7.288 ( -2.961 0.000 -4.833) 5.669 7.299 ( -1.680 0.000 0.601) 1.784 7.455 ( -1.278 0.000 0.407) 1.341 7.541 ( 4.118 -0.000 5.639) 6.983 7.620 ( 7.720 -0.000 -9.504) 12.245 7.875 ( -3.053 0.000 -2.100) 3.705 8.076 ( 1.904 -0.000 -2.227) 2.930 8.183 ( 4.484 -0.000 -4.362) 6.255 8.313 ( -1.523 0.000 -0.739) 1.693 8.418 ( -6.459 0.000 -0.382) 6.470 8.492 ( -10.161 0.000 6.698) 12.170 9.182 ( 1.497 -0.000 -6.659) 6.825 13.415 ( 1.384 -0.000 -0.473) 1.463 13.422 ( 3.012 -0.000 -0.782) 3.111 14.524 ( 1.548 -0.000 1.264) 1.998 14.871 ( -1.055 0.000 -0.187) 1.071 17.390 ( -0.416 0.000 -0.231) 0.476 17.396 ( -0.695 0.000 0.041) 0.696 17.606 ( -3.191 0.000 0.665) 3.260 17.712 ( 3.223 -0.000 -0.329) 3.240 21.199 ( -1.558 0.000 -0.146) 1.565 21.378 ( 0.857 -0.000 -0.622) 1.059 21.739 ( -1.261 0.000 0.493) 1.354 21.853 ( -0.477 0.000 -0.654) 0.809 24.113 ( -0.035 0.000 -0.386) 0.388 24.213 ( 0.595 -0.000 -1.014) 1.176 28.180 ( -0.417 0.000 0.575) 0.710 28.264 ( 0.536 -0.000 -0.234) 0.585 33.215 ( -4.786 0.000 4.870) 6.827 33.650 ( 7.982 -0.000 4.120) 8.982 36.380 ( -1.483 0.000 1.499) 2.109 36.938 ( 2.902 -0.000 -1.914) 3.477 39.418 ( 4.566 -0.000 6.086) 7.608 40.199 ( -0.310 0.000 1.599) 1.629 40.642 ( -0.195 0.000 -5.229) 5.233 42.770 ( 1.692 -0.000 -13.332) 13.439 ======================= Grid point 104 (49/165) ======================= q-point: (-0.38 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( -17.346 -2.110 5.460) 18.307 2.562 ( -5.278 3.615 -1.507) 6.572 2.673 ( -1.280 -2.603 -2.393) 3.760 2.943 ( -7.785 5.604 -5.945) 11.285 3.142 ( -1.484 3.622 4.825) 6.212 3.523 ( -9.246 -9.901 13.016) 18.786 3.714 ( 6.518 8.893 3.295) 11.508 3.899 ( -5.344 3.392 -3.667) 7.315 4.029 ( 0.678 1.707 -5.351) 5.657 4.262 ( 4.056 -2.811 5.360) 7.286 4.385 ( 6.032 -5.674 0.264) 8.285 4.465 ( 8.782 4.239 6.369) 11.647 4.641 ( 1.204 -0.687 4.447) 4.658 4.776 ( 5.801 -5.249 1.151) 7.907 4.845 ( -0.438 -10.906 4.141) 11.674 5.135 ( -0.047 2.678 1.078) 2.887 5.164 ( -4.266 6.162 4.214) 8.598 5.420 ( -1.897 -7.227 -0.172) 7.474 5.591 ( -0.296 8.255 -1.432) 8.383 5.722 ( 1.617 1.247 4.128) 4.605 5.783 ( -7.724 -4.540 1.724) 9.123 5.915 ( 0.238 -4.808 1.282) 4.982 6.005 ( -0.548 5.576 -4.567) 7.228 6.193 ( 4.437 -1.181 -7.297) 8.621 6.432 ( 6.641 -4.741 -10.071) 12.961 6.691 ( 0.541 4.532 -2.956) 5.438 6.796 ( 9.991 1.001 4.615) 11.050 6.842 ( 1.410 3.254 7.182) 8.010 6.877 ( -4.099 0.405 1.364) 4.339 7.091 ( 0.462 9.060 1.152) 9.145 7.137 ( -3.529 -2.755 7.642) 8.857 7.335 ( -2.697 -0.282 2.026) 3.385 7.388 ( -3.624 -2.297 -2.002) 4.735 7.615 ( -0.895 0.445 -6.056) 6.137 7.720 ( -0.236 -9.301 4.036) 10.142 7.831 ( 1.944 3.295 -3.263) 5.028 8.050 ( 1.468 3.575 -2.860) 4.808 8.178 ( 1.273 2.836 -4.486) 5.458 8.248 ( -1.968 2.451 -1.154) 3.349 8.344 ( 0.985 3.498 2.470) 4.394 8.542 ( 1.549 -7.516 -0.863) 7.722 9.211 ( -2.895 -7.496 -7.191) 10.783 13.375 ( -1.398 4.349 0.235) 4.574 13.432 ( -1.379 0.503 0.446) 1.534 14.561 ( 1.883 -0.898 2.560) 3.303 14.847 ( -0.327 1.570 -0.920) 1.849 17.374 ( -0.876 0.691 -0.568) 1.252 17.384 ( -1.257 0.027 -0.466) 1.340 17.587 ( 0.364 0.309 -0.499) 0.691 17.779 ( 3.211 -3.527 1.129) 4.902 21.164 ( -1.453 1.619 -0.652) 2.271 21.404 ( 1.374 -1.710 -0.486) 2.247 21.727 ( -0.458 0.292 -0.001) 0.543 21.849 ( -0.478 -0.710 -0.972) 1.295 24.116 ( 0.209 -0.358 -0.515) 0.661 24.208 ( -0.929 -0.134 -0.845) 1.263 28.179 ( -0.665 -0.471 0.528) 0.971 28.268 ( 0.788 0.418 0.080) 0.896 33.143 ( -5.981 2.825 2.989) 7.258 33.728 ( 7.179 5.750 9.123) 12.955 36.371 ( -2.481 -1.101 0.931) 2.869 36.970 ( 2.489 -0.521 -0.870) 2.688 39.513 ( 5.423 0.419 9.507) 10.953 40.233 ( 2.120 -1.380 1.444) 2.913 40.612 ( 0.965 -0.258 -6.213) 6.293 42.685 ( -1.097 3.308 -15.706) 16.088 ======================= Grid point 105 (50/165) ======================= q-point: (-0.25 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( -14.320 -5.316 5.435) 16.213 2.431 ( -9.145 0.416 -3.168) 9.687 2.629 ( -5.762 2.847 0.180) 6.430 2.845 ( 5.067 1.751 -2.507) 5.918 3.141 ( 1.560 -2.888 4.593) 5.646 3.562 ( -8.924 4.004 3.356) 10.341 3.640 ( -7.188 -6.103 2.175) 9.677 3.804 ( 7.232 10.266 7.336) 14.543 3.971 ( -1.840 1.639 -1.703) 2.995 4.346 ( 1.837 -0.820 4.448) 4.882 4.473 ( -1.553 -0.730 1.413) 2.223 4.615 ( 9.669 -0.060 6.057) 11.409 4.680 ( -3.486 8.311 -1.492) 9.135 4.753 ( -2.542 -8.986 2.216) 9.598 4.990 ( -4.776 3.824 -3.604) 7.100 4.996 ( -3.852 -7.058 2.335) 8.373 5.175 ( 0.063 -1.069 5.007) 5.120 5.511 ( 1.776 2.025 -2.259) 3.515 5.555 ( -0.890 -10.980 -2.626) 11.325 5.747 ( 8.083 10.948 3.676) 14.096 5.840 ( -0.552 -7.856 2.672) 8.316 5.911 ( 2.677 -2.808 -3.346) 5.123 6.066 ( 3.157 -9.412 5.010) 11.120 6.242 ( 4.475 0.633 -1.893) 4.900 6.460 ( -3.984 10.768 -1.691) 11.606 6.509 ( 5.995 5.506 -7.171) 10.848 6.776 ( -6.374 4.349 -1.331) 7.831 6.791 ( 2.021 4.768 2.946) 5.958 6.962 ( 9.398 0.284 2.294) 9.678 7.042 ( -3.656 2.579 -2.369) 5.062 7.121 ( -0.402 0.881 6.265) 6.339 7.306 ( -3.273 -2.220 0.438) 3.979 7.496 ( -1.205 -8.597 5.547) 10.301 7.547 ( -3.017 -0.908 -4.108) 5.177 7.785 ( 1.117 2.362 0.058) 2.613 7.808 ( -0.576 1.355 -1.972) 2.461 7.996 ( 0.841 0.784 -2.728) 2.960 8.173 ( 0.322 -0.488 0.115) 0.596 8.203 ( 1.919 1.130 -1.231) 2.545 8.357 ( 6.680 -0.548 -0.465) 6.719 8.681 ( 8.368 -2.354 -2.839) 9.145 9.242 ( -9.979 -9.196 -8.011) 15.758 13.255 ( -3.976 6.507 0.176) 7.628 13.385 ( -4.618 1.328 1.741) 5.111 14.610 ( 1.617 -0.538 3.711) 4.083 14.816 ( 0.643 1.532 -1.467) 2.216 17.348 ( -0.599 0.930 -1.227) 1.652 17.363 ( -1.579 0.096 -0.710) 1.734 17.595 ( 1.917 0.405 -0.556) 2.036 17.904 ( 4.287 -5.545 1.658) 7.202 21.119 ( -1.420 1.490 -0.380) 2.093 21.452 ( 1.904 -2.032 -0.633) 2.856 21.721 ( 0.262 0.131 -0.451) 0.538 21.856 ( -0.191 -1.135 -1.043) 1.553 24.122 ( 0.102 -0.322 -0.735) 0.809 24.189 ( -1.875 -0.110 -0.521) 1.949 28.185 ( -0.749 -0.945 0.704) 1.396 28.268 ( 0.657 0.855 0.376) 1.141 33.033 ( -4.934 3.535 1.445) 6.239 33.696 ( 3.642 12.809 12.222) 18.075 36.367 ( -2.458 -1.791 0.512) 3.084 36.999 ( 1.788 -0.255 -0.798) 1.974 39.588 ( 3.071 2.342 9.500) 10.255 40.240 ( -3.067 1.421 0.278) 3.392 40.709 ( 11.676 -6.978 -3.970) 14.170 42.504 ( -4.135 6.107 -18.070) 19.518 ======================= Grid point 106 (51/165) ======================= q-point: (-0.12 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( -10.616 -4.427 4.743) 12.442 2.324 ( -2.370 1.604 -7.461) 7.991 2.576 ( 5.905 2.824 2.098) 6.874 2.844 ( -5.250 -0.609 1.811) 5.587 3.308 ( -0.126 0.801 7.551) 7.595 3.394 ( -0.290 -4.102 4.618) 6.184 3.652 ( -11.516 -5.982 2.930) 13.304 3.800 ( 12.580 7.221 2.348) 14.694 3.951 ( -1.510 0.439 3.410) 3.755 4.320 ( -16.239 2.807 1.416) 16.540 4.377 ( -3.501 -0.881 2.971) 4.676 4.527 ( 1.548 4.695 -2.796) 5.679 4.687 ( 1.508 7.634 -3.745) 8.636 4.819 ( 2.829 -1.186 5.922) 6.669 4.962 ( -3.108 -10.508 2.411) 11.220 5.087 ( -0.559 -4.054 0.524) 4.126 5.241 ( -4.105 -6.208 2.715) 7.922 5.419 ( 2.339 10.506 -1.601) 10.881 5.624 ( 4.428 8.164 2.850) 9.715 5.741 ( -1.212 -11.647 -9.331) 14.973 6.005 ( 3.049 -3.257 0.033) 4.462 6.006 ( 3.586 -5.068 1.124) 6.309 6.223 ( -1.433 -1.184 -0.105) 1.862 6.270 ( 3.893 0.796 0.931) 4.082 6.366 ( 9.231 4.226 2.472) 10.449 6.468 ( 0.566 -4.623 2.462) 5.269 6.599 ( -9.369 3.476 -9.489) 13.781 6.742 ( 3.189 8.274 6.104) 10.765 6.919 ( -2.448 4.519 -2.786) 5.846 6.963 ( 0.968 6.849 -0.410) 6.929 7.172 ( 3.694 -0.856 3.373) 5.075 7.343 ( 1.426 -1.898 1.597) 2.861 7.483 ( -6.371 -2.000 0.616) 6.706 7.565 ( -3.818 2.551 -0.126) 4.593 7.769 ( 1.076 2.429 -1.004) 2.840 7.796 ( 0.645 -4.298 0.683) 4.400 8.022 ( 2.209 -1.554 -0.909) 2.850 8.142 ( -1.298 1.256 0.334) 1.836 8.253 ( 4.323 -0.538 -2.154) 4.860 8.552 ( 10.203 -9.495 0.586) 13.950 8.779 ( 11.712 2.680 -1.304) 12.085 9.175 ( -15.637 -6.379 -8.501) 18.907 13.111 ( -3.547 4.921 -0.604) 6.096 13.311 ( -5.225 1.454 2.569) 6.001 14.630 ( 0.758 1.813 2.968) 3.559 14.814 ( 0.997 -0.541 -0.436) 1.215 17.325 ( 0.384 0.903 -1.530) 1.818 17.344 ( -1.132 -0.291 -0.609) 1.317 17.609 ( 1.798 0.505 -0.135) 1.873 18.040 ( 3.154 -4.271 0.975) 5.398 21.088 ( -1.317 0.195 0.450) 1.405 21.499 ( 1.733 -1.269 -0.649) 2.244 21.727 ( 0.728 -0.541 -0.720) 1.158 21.869 ( 0.198 -0.946 -0.870) 1.301 24.116 ( -0.546 0.208 -0.858) 1.038 24.171 ( -1.135 -0.266 -0.218) 1.186 28.195 ( -0.759 -0.929 0.968) 1.541 28.261 ( 0.242 0.923 0.485) 1.070 32.953 ( -1.498 1.609 0.132) 2.202 33.529 ( -2.001 15.363 12.063) 19.635 36.375 ( -0.922 -1.443 0.722) 1.858 37.008 ( 1.193 0.623 -1.808) 2.254 39.589 ( -0.121 3.759 5.587) 6.735 40.167 ( -4.227 0.914 1.240) 4.498 40.991 ( 13.338 -7.645 -2.714) 15.611 42.278 ( -3.233 4.616 -17.971) 18.833 ======================= Grid point 112 (52/165) ======================= q-point: (-0.38 -0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( -26.837 0.000 0.279) 26.838 2.386 ( -25.312 0.000 -2.915) 25.479 2.669 ( 7.636 -0.000 -6.104) 9.776 2.937 ( 2.431 -0.000 -2.172) 3.260 3.235 ( 1.183 -0.000 5.656) 5.779 3.347 ( -11.980 0.000 15.190) 19.346 3.692 ( -12.000 0.000 -10.941) 16.239 3.946 ( 7.984 -0.000 7.968) 11.280 4.156 ( 2.355 -0.000 -1.500) 2.792 4.332 ( -1.025 0.000 5.282) 5.380 4.365 ( 13.331 -0.000 3.289) 13.730 4.675 ( -0.421 0.000 10.639) 10.647 4.694 ( -3.669 0.000 1.357) 3.912 4.750 ( 10.359 -0.000 1.371) 10.449 4.776 ( 3.755 -0.000 5.540) 6.692 5.129 ( -18.275 0.000 0.007) 18.275 5.175 ( 0.332 -0.000 1.565) 1.600 5.305 ( 3.991 -0.000 1.790) 4.374 5.595 ( -0.854 0.000 1.483) 1.711 5.690 ( -4.562 0.000 -3.216) 5.582 5.691 ( -2.215 0.000 -3.193) 3.886 5.955 ( 9.740 -0.000 7.079) 12.041 6.186 ( 8.732 -0.000 -7.637) 11.600 6.231 ( 8.132 -0.000 -1.985) 8.371 6.358 ( 3.225 -0.000 -8.342) 8.943 6.740 ( 4.258 -0.000 -4.646) 6.302 6.780 ( -10.118 0.000 -1.652) 10.252 6.922 ( 5.296 -0.000 4.918) 7.227 6.957 ( 7.232 -0.000 4.722) 8.636 7.096 ( -4.549 0.000 11.984) 12.818 7.168 ( -5.065 0.000 -3.078) 5.927 7.284 ( -11.853 0.000 -0.088) 11.853 7.364 ( 7.686 -0.000 1.184) 7.777 7.546 ( -5.697 0.000 -3.868) 6.886 7.649 ( 0.599 -0.000 6.278) 6.307 7.898 ( 5.521 -0.000 -5.069) 7.495 8.068 ( 0.124 -0.000 -1.422) 1.428 8.208 ( -4.753 0.000 -2.519) 5.379 8.238 ( 1.770 -0.000 -3.054) 3.530 8.287 ( -9.485 0.000 0.816) 9.520 8.616 ( 19.435 -0.000 -3.504) 19.749 9.094 ( -2.890 0.000 -7.056) 7.625 13.386 ( -3.464 0.000 0.326) 3.479 13.403 ( -4.850 0.000 2.156) 5.307 14.586 ( 1.480 -0.000 3.317) 3.632 14.858 ( 0.610 -0.000 -1.354) 1.485 17.359 ( -1.870 0.000 -0.592) 1.961 17.371 ( -0.817 0.000 -0.561) 0.991 17.612 ( 4.219 -0.000 -2.685) 5.001 17.788 ( 2.036 -0.000 2.794) 3.457 21.153 ( -1.577 0.000 -1.964) 2.519 21.408 ( 1.735 -0.000 0.074) 1.736 21.727 ( 0.221 -0.000 -0.355) 0.418 21.832 ( -0.476 0.000 -1.231) 1.320 24.115 ( 0.474 -0.000 -0.643) 0.799 24.185 ( -2.080 0.000 -0.562) 2.155 28.169 ( -0.745 0.000 0.398) 0.844 28.282 ( 0.819 -0.000 0.162) 0.835 33.092 ( -7.524 0.000 1.366) 7.647 33.931 ( 9.157 -0.000 16.036) 18.466 36.335 ( -2.725 0.000 0.838) 2.851 36.992 ( 1.808 -0.000 0.671) 1.929 39.641 ( 5.959 -0.000 13.045) 14.342 40.280 ( 6.114 -0.000 0.769) 6.162 40.566 ( -0.944 0.000 -8.561) 8.613 42.613 ( -2.979 0.000 -19.029) 19.261 ======================= Grid point 113 (53/165) ======================= q-point: (-0.25 -0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( -24.925 -14.071 1.657) 28.671 2.072 ( -28.592 -6.703 -9.294) 30.803 2.714 ( 4.550 3.105 0.433) 5.526 2.977 ( 8.863 3.313 -1.781) 9.628 3.200 ( -1.533 2.826 12.632) 13.035 3.392 ( -7.926 -7.636 8.131) 13.684 3.511 ( -8.925 2.350 -6.758) 11.439 3.935 ( -22.011 -2.269 2.914) 22.318 4.071 ( 3.853 4.964 7.325) 9.651 4.358 ( 3.654 4.914 1.562) 6.319 4.510 ( 4.794 5.008 2.809) 7.480 4.636 ( -3.516 1.100 5.461) 6.588 4.699 ( 1.153 0.709 3.692) 3.933 4.797 ( 3.894 -3.885 3.238) 6.383 4.913 ( 4.289 -2.589 -1.392) 5.199 5.032 ( 4.859 4.036 -1.694) 6.540 5.161 ( -4.722 1.141 2.743) 5.579 5.367 ( 3.332 -3.140 -0.904) 4.667 5.573 ( 2.805 0.454 -3.296) 4.352 5.725 ( 3.938 -9.825 4.508) 11.505 5.789 ( -1.496 -8.514 -5.085) 10.029 6.050 ( 4.430 11.317 -2.216) 12.354 6.124 ( 11.670 0.442 6.819) 13.524 6.304 ( 4.140 0.910 -0.530) 4.272 6.494 ( 5.038 -2.866 -9.543) 11.166 6.586 ( -7.159 4.315 -3.373) 9.014 6.729 ( -3.345 4.713 -4.784) 7.502 6.950 ( -0.763 1.629 0.608) 1.899 7.004 ( 1.593 5.588 5.673) 8.121 7.076 ( -2.704 0.674 0.367) 2.811 7.141 ( 1.271 -1.761 4.741) 5.215 7.194 ( -3.823 -7.130 2.494) 8.466 7.456 ( -2.740 2.490 0.781) 3.784 7.497 ( 4.739 -2.879 2.019) 5.901 7.721 ( -2.266 -4.287 4.607) 6.688 7.880 ( 2.188 4.779 -4.066) 6.645 8.044 ( -2.173 5.849 -1.481) 6.413 8.115 ( -1.610 -4.911 -2.559) 5.767 8.209 ( -2.706 -0.453 1.564) 3.157 8.314 ( -1.099 -6.839 -3.294) 7.670 8.835 ( 20.792 1.069 -5.065) 21.426 9.042 ( -4.570 -1.597 -6.702) 8.267 13.297 ( -4.732 4.956 0.280) 6.859 13.340 ( -6.833 0.433 2.853) 7.418 14.625 ( 0.441 -1.298 4.245) 4.461 14.848 ( 1.336 1.690 -1.613) 2.691 17.336 ( -1.374 -0.096 -0.786) 1.586 17.354 ( -0.631 0.622 -0.741) 1.155 17.643 ( 4.713 1.796 -2.276) 5.534 17.869 ( 2.800 -5.223 2.570) 6.460 21.115 ( -1.649 1.009 -2.178) 2.912 21.444 ( 1.930 -1.618 0.002) 2.519 21.727 ( 0.614 0.352 -0.659) 0.967 21.832 ( -0.061 -1.067 -1.211) 1.615 24.118 ( 0.320 0.005 -0.809) 0.869 24.158 ( -2.350 -0.363 -0.231) 2.389 28.167 ( -0.615 -0.561 0.521) 0.982 28.287 ( 0.372 0.488 0.265) 0.668 32.997 ( -7.235 0.864 0.296) 7.293 34.030 ( 7.190 12.391 21.612) 25.929 36.322 ( -1.553 -1.517 0.884) 2.344 37.013 ( 0.877 -0.083 1.141) 1.442 39.732 ( 3.697 3.707 12.958) 13.975 40.273 ( 0.069 6.774 -2.657) 7.277 40.656 ( 8.280 -12.267 -5.623) 15.832 42.440 ( -5.287 3.979 -23.367) 24.285 ======================= Grid point 114 (54/165) ======================= q-point: (-0.12 -0.38 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.683 ( -22.649 -13.663 -0.097) 26.451 2.002 ( -14.293 -25.730 -5.691) 29.978 2.686 ( -2.415 5.633 4.523) 7.617 2.901 ( -3.178 7.899 -0.336) 8.521 3.300 ( -7.608 -7.605 9.474) 14.334 3.337 ( -3.323 -0.736 13.693) 14.110 3.485 ( 3.760 -4.326 -6.999) 9.046 3.773 ( -22.820 -11.324 2.336) 25.582 4.092 ( 7.386 5.922 6.766) 11.636 4.218 ( -2.381 12.552 -0.009) 12.776 4.442 ( 3.411 7.730 2.619) 8.846 4.584 ( -2.563 2.991 4.254) 5.797 4.778 ( -7.461 -4.665 4.382) 9.831 4.844 ( 4.267 8.950 -11.785) 15.402 4.894 ( 3.211 0.923 2.958) 4.462 5.039 ( 3.141 -4.990 1.608) 6.112 5.160 ( 3.016 0.540 0.231) 3.073 5.523 ( 5.844 -6.558 -0.549) 8.801 5.623 ( 6.169 2.314 -7.131) 9.709 5.805 ( 4.040 3.446 -2.497) 5.868 5.959 ( 4.617 -9.590 5.933) 12.185 5.998 ( 2.866 -0.859 -1.845) 3.516 6.222 ( -6.903 5.358 -2.867) 9.196 6.368 ( 8.465 -5.102 7.274) 12.272 6.375 ( -1.186 1.927 0.065) 2.263 6.505 ( -6.346 5.408 -7.305) 11.085 6.569 ( 3.305 5.718 -4.304) 7.883 6.903 ( -3.738 1.041 2.546) 4.641 6.936 ( 2.371 7.590 6.616) 10.344 7.052 ( -1.361 0.891 -1.147) 1.991 7.219 ( 3.980 -1.635 0.388) 4.320 7.332 ( -6.027 -4.511 1.771) 7.734 7.385 ( 5.865 -0.117 -0.139) 5.867 7.552 ( -4.748 2.116 3.442) 6.234 7.753 ( 0.220 -2.158 0.681) 2.274 7.803 ( -1.155 2.619 -0.731) 2.954 7.985 ( -2.985 -2.521 0.294) 3.919 8.136 ( -1.454 -0.121 0.299) 1.489 8.246 ( 0.324 -2.868 -0.669) 2.962 8.425 ( -1.724 -10.422 -2.802) 10.929 8.946 ( -4.132 2.843 -3.676) 6.218 9.063 ( 23.908 -0.948 -6.784) 24.870 13.150 ( -3.847 5.802 -0.736) 7.000 13.269 ( -5.881 0.186 3.005) 6.607 14.660 ( -1.067 -0.432 4.925) 5.058 14.830 ( 1.487 1.500 -1.536) 2.612 17.326 ( -0.503 -0.386 -0.535) 0.830 17.337 ( 0.398 0.647 -0.961) 1.225 17.649 ( 2.448 1.857 -0.228) 3.081 18.002 ( 2.545 -5.108 0.435) 5.723 21.075 ( -1.646 0.445 -1.102) 2.030 21.493 ( 1.594 -1.675 -0.285) 2.329 21.727 ( 0.679 0.059 -0.977) 1.191 21.852 ( 0.745 -1.438 -0.908) 1.857 24.109 ( -0.677 0.116 -0.545) 0.877 24.150 ( -0.634 -0.822 -0.356) 1.098 28.176 ( -0.467 -0.968 0.779) 1.327 28.278 ( -0.267 0.891 0.378) 1.004 32.920 ( -4.796 -0.694 -0.219) 4.851 33.852 ( -4.972 23.491 21.142) 31.993 36.364 ( 2.480 -2.215 1.582) 3.682 37.021 ( 0.260 0.344 -0.050) 0.434 39.714 ( 0.858 7.531 7.539) 10.690 40.152 ( -2.836 2.742 -1.295) 4.152 40.961 ( 8.460 -10.805 -3.715) 14.217 42.204 ( -3.770 2.452 -24.717) 25.122 ======================= Grid point 121 (55/165) ======================= q-point: (-0.25 -0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( -29.619 0.000 1.225) 29.644 1.588 ( -33.857 0.000 -12.471) 36.081 2.755 ( -3.157 0.000 0.647) 3.222 3.122 ( 10.593 -0.000 0.170) 10.594 3.185 ( -10.757 0.000 10.660) 15.144 3.334 ( -27.718 0.000 14.678) 31.364 3.404 ( -24.124 0.000 3.096) 24.322 3.501 ( 5.024 -0.000 -4.557) 6.783 4.211 ( 5.433 -0.000 7.275) 9.079 4.535 ( 10.487 -0.000 -4.913) 11.581 4.579 ( -1.421 0.000 2.455) 2.836 4.656 ( -10.807 0.000 5.531) 12.140 4.763 ( 12.767 -0.000 -2.768) 13.064 4.833 ( 4.489 -0.000 7.819) 9.016 4.835 ( -0.221 0.000 -8.335) 8.338 5.183 ( -0.780 0.000 3.813) 3.892 5.236 ( 15.836 -0.000 2.807) 16.083 5.441 ( 7.193 -0.000 2.697) 7.682 5.555 ( -1.901 0.000 -6.822) 7.082 5.665 ( 4.124 -0.000 0.133) 4.126 5.734 ( 7.867 -0.000 0.620) 7.891 6.200 ( 7.043 -0.000 2.969) 7.643 6.219 ( -2.862 0.000 -5.499) 6.199 6.334 ( -4.655 0.000 -5.217) 6.992 6.481 ( 9.564 -0.000 -1.149) 9.632 6.509 ( -4.426 0.000 -4.313) 6.180 6.779 ( 0.863 -0.000 -3.004) 3.126 6.948 ( -4.187 0.000 4.207) 5.936 6.960 ( -6.735 0.000 -4.670) 8.196 7.027 ( -8.355 0.000 6.581) 10.635 7.155 ( 5.035 -0.000 -0.022) 5.035 7.171 ( 3.069 -0.000 4.906) 5.787 7.440 ( -1.542 0.000 1.962) 2.496 7.591 ( 6.866 -0.000 2.605) 7.344 7.685 ( -2.378 0.000 5.339) 5.845 7.950 ( -1.020 0.000 -4.598) 4.710 7.985 ( -5.964 0.000 -2.673) 6.535 8.037 ( -7.949 0.000 0.818) 7.991 8.170 ( 2.860 -0.000 1.246) 3.119 8.232 ( -1.214 0.000 -1.398) 1.852 8.982 ( -0.708 0.000 -6.181) 6.221 9.078 ( 21.060 -0.000 -5.876) 21.864 13.271 ( -7.321 0.000 3.186) 7.984 13.285 ( -4.701 0.000 0.030) 4.701 14.625 ( -1.398 0.000 4.228) 4.453 14.877 ( 1.944 -0.000 -1.130) 2.249 17.319 ( -0.689 0.000 -0.810) 1.063 17.350 ( -0.449 0.000 -0.483) 0.660 17.732 ( 7.908 -0.000 -4.261) 8.983 17.848 ( 0.318 -0.000 4.760) 4.770 21.091 ( -1.726 0.000 -3.310) 3.733 21.452 ( 1.622 -0.000 0.362) 1.662 21.738 ( 0.897 -0.000 -0.486) 1.021 21.816 ( 0.061 -0.000 -1.275) 1.277 24.122 ( 0.723 -0.000 -0.888) 1.145 24.123 ( -2.672 0.000 0.057) 2.673 28.160 ( -0.307 0.000 0.552) 0.632 28.292 ( -0.212 0.000 0.141) 0.254 32.910 ( -7.742 0.000 -0.269) 7.747 34.403 ( 14.304 -0.000 33.114) 36.072 36.291 ( -1.385 0.000 1.001) 1.709 37.024 ( -0.321 0.000 2.509) 2.529 39.860 ( 1.591 -0.000 14.260) 14.349 40.464 ( 0.121 -0.000 -11.581) 11.582 40.477 ( 9.740 -0.000 -0.575) 9.757 42.277 ( -7.655 0.000 -34.056) 34.906 ======================= Grid point 122 (56/165) ======================= q-point: (-0.12 -0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.153 ( -24.497 -18.520 2.310) 30.796 1.290 ( -24.982 -27.507 -8.369) 38.089 2.633 ( -35.588 3.513 8.996) 36.875 2.744 ( -29.065 -4.813 6.255) 30.118 3.110 ( -7.415 -1.319 5.754) 9.478 3.292 ( 2.613 -6.136 -1.662) 6.873 3.499 ( 7.167 -0.515 10.442) 12.676 3.612 ( 12.046 -1.172 -1.678) 12.219 4.254 ( 2.636 4.082 6.912) 8.449 4.400 ( -2.533 10.890 -6.280) 12.824 4.569 ( -6.563 1.869 4.499) 8.173 4.643 ( -3.895 -1.645 2.915) 5.136 4.720 ( 4.009 9.536 2.336) 10.605 4.845 ( 1.066 -2.540 -8.815) 9.235 4.948 ( 1.583 1.749 -3.691) 4.380 5.095 ( 6.515 5.957 -0.901) 8.873 5.390 ( 16.612 5.825 4.017) 18.056 5.532 ( 7.004 -0.195 -0.321) 7.014 5.621 ( 3.545 -6.566 -6.406) 9.835 5.817 ( 9.191 -7.234 -3.292) 12.151 5.900 ( 4.402 -6.611 7.815) 11.143 6.074 ( -5.899 5.788 -1.400) 8.382 6.151 ( -5.862 4.991 -4.796) 9.070 6.334 ( 2.364 -3.878 0.036) 4.542 6.443 ( -1.570 3.041 0.005) 3.422 6.550 ( 2.057 1.652 -3.455) 4.347 6.671 ( -0.682 7.062 0.794) 7.139 6.892 ( -0.826 -0.527 -1.196) 1.546 6.955 ( -4.391 -2.814 0.309) 5.225 7.050 ( -3.449 -1.804 5.111) 6.424 7.160 ( 1.930 -0.394 4.431) 4.849 7.319 ( 5.957 -5.133 0.381) 7.873 7.425 ( 0.870 1.466 3.587) 3.972 7.589 ( -2.892 5.376 1.061) 6.196 7.719 ( -0.040 -3.856 2.473) 4.581 7.818 ( -5.980 3.289 -2.249) 7.185 7.873 ( -9.485 -0.667 0.829) 9.544 8.086 ( -1.808 -4.855 -1.996) 5.552 8.202 ( -0.372 -0.526 2.498) 2.580 8.276 ( 0.589 -4.612 0.576) 4.685 8.944 ( 0.809 2.184 -4.932) 5.454 9.313 ( 24.290 -4.062 -7.347) 25.700 13.185 ( -3.943 4.266 -1.114) 5.915 13.212 ( -5.489 -0.144 2.821) 6.173 14.636 ( -2.891 -1.943 4.619) 5.785 14.878 ( 2.054 2.341 -0.773) 3.209 17.316 ( 0.303 -0.437 -0.552) 0.766 17.344 ( 0.212 0.160 -0.332) 0.425 17.734 ( 3.271 5.096 0.311) 6.064 17.948 ( 2.507 -5.569 0.168) 6.109 21.053 ( -1.766 0.248 -2.005) 2.683 21.484 ( 1.239 -1.472 0.027) 1.925 21.738 ( 0.725 0.772 -0.624) 1.229 21.832 ( 1.018 -1.946 -0.886) 2.368 24.095 ( -1.464 -0.193 0.085) 1.479 24.133 ( 0.445 -0.690 -0.800) 1.146 28.164 ( -0.122 -0.480 0.717) 0.871 28.284 ( -0.716 0.445 0.165) 0.859 32.835 ( -5.924 -1.370 -0.209) 6.084 34.406 ( 0.454 38.072 35.197) 51.851 36.358 ( 4.911 -6.179 2.295) 8.220 37.024 ( -1.084 0.264 1.741) 2.068 39.879 ( -0.289 6.208 10.345) 12.068 40.203 ( -1.129 11.130 -7.735) 13.601 40.825 ( 5.651 -14.800 -3.507) 16.226 41.997 ( -8.559 -3.943 -44.100) 45.096 ======================= Grid point 130 (57/165) ======================= q-point: (-0.12 -0.12 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.629 ( -23.444 0.000 12.588) 26.609 0.680 ( -32.324 0.000 -5.315) 32.758 1.961 ( -69.925 0.000 22.344) 73.408 2.577 ( -8.210 0.000 1.534) 8.352 3.051 ( -7.358 0.000 8.225) 11.036 3.283 ( 5.963 -0.000 -11.018) 12.528 3.660 ( 9.340 -0.000 11.475) 14.796 3.763 ( 13.549 -0.000 0.582) 13.561 4.310 ( -6.719 0.000 5.247) 8.526 4.399 ( -3.801 0.000 -5.348) 6.562 4.484 ( -5.986 0.000 -0.114) 5.987 4.677 ( -5.246 0.000 -7.496) 9.149 4.677 ( 1.278 -0.000 0.603) 1.413 4.892 ( -2.893 0.000 1.371) 3.202 5.012 ( 7.383 -0.000 -1.760) 7.590 5.241 ( 6.796 -0.000 -2.146) 7.126 5.480 ( 3.485 -0.000 2.102) 4.070 5.604 ( 8.152 -0.000 -7.680) 11.199 5.768 ( 15.089 -0.000 -6.118) 16.282 5.821 ( 5.674 -0.000 2.994) 6.415 5.956 ( 8.462 -0.000 10.525) 13.505 5.988 ( -2.594 0.000 -3.426) 4.297 6.194 ( -3.719 0.000 0.777) 3.799 6.291 ( -2.383 0.000 -2.142) 3.204 6.454 ( -4.287 0.000 2.344) 4.886 6.542 ( 3.577 -0.000 -1.623) 3.928 6.711 ( -4.120 0.000 -5.106) 6.561 6.863 ( -4.811 0.000 2.214) 5.296 6.889 ( 2.005 -0.000 -4.484) 4.912 7.085 ( 6.472 -0.000 16.803) 18.006 7.211 ( 0.831 -0.000 1.058) 1.345 7.373 ( 11.239 -0.000 8.732) 14.232 7.464 ( -2.349 0.000 4.842) 5.382 7.589 ( -7.214 0.000 0.119) 7.215 7.682 ( 0.397 -0.000 2.562) 2.592 7.685 ( -9.211 0.000 -4.672) 10.328 7.806 ( -7.750 0.000 -0.293) 7.756 8.024 ( 1.257 -0.000 -2.401) 2.710 8.227 ( -1.417 0.000 8.207) 8.328 8.280 ( 3.962 -0.000 0.497) 3.993 8.967 ( 2.928 -0.000 -4.238) 5.151 9.404 ( 9.743 -0.000 -9.308) 13.474 13.152 ( -4.384 0.000 2.054) 4.842 13.179 ( -3.280 0.000 -2.372) 4.048 14.592 ( -3.925 0.000 3.647) 5.358 14.933 ( 3.384 -0.000 0.094) 3.386 17.314 ( 0.608 -0.000 -0.605) 0.858 17.347 ( 0.293 -0.000 0.266) 0.396 17.879 ( 6.870 -0.000 -3.290) 7.617 17.890 ( -0.191 0.000 2.311) 2.318 21.032 ( -0.644 0.000 0.968) 1.162 21.483 ( 0.706 -0.000 0.142) 0.720 21.759 ( 0.900 -0.000 0.367) 0.973 21.814 ( 0.587 -0.000 -0.888) 1.064 24.072 ( -1.695 0.000 0.293) 1.720 24.132 ( 0.731 -0.000 -0.879) 1.143 28.165 ( 0.193 -0.000 0.706) 0.732 28.277 ( -0.880 0.000 -0.087) 0.884 32.758 ( -4.477 0.000 0.308) 4.488 35.279 ( 31.733 -0.000 35.702) 47.766 36.287 ( -0.141 0.000 1.511) 1.517 37.017 ( -2.383 0.000 1.738) 2.949 39.946 ( -2.986 0.000 8.991) 9.474 40.366 ( 0.840 -0.000 -18.662) 18.681 40.677 ( 6.724 -0.000 -0.659) 6.756 41.360 ( -42.596 0.000 -77.292) 88.252 ======================= Grid point 131 (58/165) ======================= q-point: ( 0.00 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( 2.085 -0.000 28.653) 28.728 1.366 ( -11.167 0.000 35.427) 37.145 1.661 ( 0.343 -0.000 39.234) 39.235 2.645 ( 4.173 -0.000 5.916) 7.240 2.936 ( -9.799 0.000 -11.214) 14.892 3.189 ( -5.585 0.000 14.158) 15.220 3.854 ( 1.057 -0.000 -4.838) 4.952 3.949 ( 0.350 -0.000 0.410) 0.539 4.249 ( 1.327 -0.000 -18.756) 18.803 4.287 ( -3.241 0.000 -14.109) 14.476 4.357 ( -2.559 0.000 -6.019) 6.540 4.411 ( 13.674 -0.000 -5.829) 14.865 4.746 ( -13.168 0.000 19.314) 23.375 5.016 ( 4.711 -0.000 -5.005) 6.874 5.102 ( 1.665 -0.000 5.100) 5.365 5.358 ( 4.940 -0.000 -2.601) 5.583 5.535 ( -5.854 0.000 -12.455) 13.762 5.568 ( -1.676 0.000 1.365) 2.161 5.750 ( 17.897 -0.000 -1.438) 17.955 5.881 ( -0.003 0.000 2.165) 2.165 6.038 ( -0.633 0.000 -5.319) 5.356 6.138 ( 5.698 -0.000 1.300) 5.844 6.279 ( -0.763 0.000 0.698) 1.034 6.358 ( -1.551 0.000 -4.825) 5.068 6.493 ( -5.139 0.000 -0.573) 5.170 6.613 ( -4.494 0.000 14.815) 15.482 6.690 ( 12.271 -0.000 -7.579) 14.423 6.835 ( 0.234 -0.000 3.573) 3.581 6.863 ( 7.033 -0.000 1.777) 7.254 7.177 ( -11.409 0.000 -0.390) 11.415 7.305 ( -4.287 0.000 -4.342) 6.102 7.313 ( 2.074 -0.000 2.997) 3.645 7.402 ( -7.388 0.000 -0.533) 7.407 7.548 ( -5.551 0.000 -4.968) 7.450 7.623 ( -1.071 0.000 1.070) 1.514 7.757 ( 13.641 -0.000 -0.069) 13.641 7.916 ( -4.682 0.000 5.011) 6.859 8.003 ( -1.001 0.000 0.647) 1.191 8.301 ( -3.290 0.000 -1.305) 3.539 8.359 ( -5.944 0.000 3.142) 6.723 9.027 ( 4.248 -0.000 2.265) 4.814 9.527 ( 11.937 -0.000 -1.544) 12.036 13.099 ( -3.323 0.000 0.370) 3.344 13.150 ( 4.668 -0.000 -0.133) 4.670 14.578 ( -4.823 0.000 3.081) 5.723 14.918 ( 0.321 -0.000 -2.240) 2.263 17.321 ( 0.994 -0.000 -0.319) 1.044 17.327 ( -2.020 0.000 -0.855) 2.193 17.653 ( -10.251 0.000 3.220) 10.745 17.958 ( 5.128 -0.000 -1.500) 5.343 21.351 ( 7.393 -0.000 0.890) 7.447 21.471 ( -0.867 0.000 -0.929) 1.271 21.770 ( -0.792 0.000 0.117) 0.801 21.818 ( 1.262 -0.000 -0.465) 1.345 24.048 ( -0.838 0.000 0.047) 0.839 24.125 ( 0.990 -0.000 -1.019) 1.421 28.179 ( -0.529 0.000 0.878) 1.025 28.255 ( -0.124 0.000 -0.484) 0.500 32.806 ( 3.490 -0.000 4.995) 6.094 33.279 ( -66.121 0.000 -1.927) 66.149 36.353 ( -0.597 0.000 3.602) 3.651 36.857 ( 0.907 -0.000 -5.076) 5.156 39.936 ( -12.083 0.000 3.886) 12.692 40.394 ( 2.624 -0.000 -4.267) 5.010 40.721 ( -0.807 0.000 -1.813) 1.984 40.856 ( 54.630 -0.000 -2.336) 54.680 ======================= Grid point 132 (59/165) ======================= q-point: ( 0.12 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( 2.954 -2.512 24.653) 24.956 1.477 ( 2.514 -12.798 28.769) 31.587 2.291 ( 20.684 -25.762 29.099) 44.026 2.725 ( -1.754 1.917 -2.939) 3.923 2.803 ( 0.446 -3.203 0.859) 3.346 3.213 ( -1.839 -1.688 15.445) 15.645 3.793 ( 2.412 7.967 -10.179) 13.149 3.930 ( -7.515 -3.927 1.391) 8.593 4.103 ( -2.893 0.473 -7.780) 8.314 4.217 ( 7.954 7.567 -17.768) 20.886 4.315 ( -7.649 -4.353 -3.945) 9.645 4.545 ( 7.777 -1.809 -5.866) 9.908 4.688 ( -13.669 -0.593 15.756) 20.867 4.964 ( 5.579 5.269 -4.330) 8.811 5.156 ( -2.070 -1.709 3.956) 4.781 5.289 ( -10.816 5.959 -2.053) 12.518 5.491 ( 6.472 -2.746 -7.097) 9.990 5.549 ( -4.204 -2.241 -4.412) 6.493 5.839 ( 1.645 1.489 -0.972) 2.422 5.904 ( 11.352 7.529 2.364) 13.826 6.030 ( 0.462 0.836 -6.695) 6.763 6.098 ( 3.836 6.321 -1.817) 7.614 6.231 ( 2.856 2.954 -1.486) 4.370 6.390 ( -5.646 -4.294 -1.869) 7.335 6.449 ( -4.787 -0.371 2.095) 5.239 6.580 ( -7.254 -0.133 9.785) 12.181 6.667 ( 2.368 7.560 -10.115) 12.848 6.803 ( -1.672 3.426 -0.856) 3.907 6.898 ( -4.354 -0.290 8.227) 9.313 7.142 ( -7.973 1.744 -1.813) 8.360 7.190 ( -8.778 1.696 1.038) 9.001 7.266 ( 0.602 2.480 6.401) 6.891 7.391 ( 3.532 -4.421 0.994) 5.745 7.510 ( -2.826 -0.467 0.192) 2.870 7.640 ( 3.240 -1.668 -0.227) 3.651 7.812 ( 4.761 6.298 2.534) 8.292 7.995 ( 9.992 -3.821 3.010) 11.113 8.031 ( 5.012 -2.433 -0.109) 5.573 8.219 ( -7.387 4.196 2.973) 9.001 8.281 ( -1.117 -0.661 -0.621) 1.439 9.046 ( 1.705 2.968 2.547) 4.267 9.680 ( -0.429 -5.480 -9.731) 11.177 13.065 ( -2.283 0.138 -0.568) 2.356 13.210 ( 1.927 -2.040 0.889) 2.943 14.547 ( -3.855 -0.912 2.314) 4.588 14.897 ( 0.090 1.408 -0.065) 1.413 17.300 ( -0.700 0.697 -1.039) 1.434 17.343 ( 1.162 -0.890 -0.688) 1.617 17.582 ( -5.058 -0.699 3.430) 6.151 18.012 ( 3.394 -1.319 -0.705) 3.709 21.340 ( -0.382 5.687 2.550) 6.245 21.462 ( -0.053 -0.543 -1.421) 1.522 21.766 ( 1.584 0.760 -0.232) 1.772 21.846 ( 0.546 -1.468 -0.860) 1.787 24.057 ( -0.490 -1.760 -0.550) 1.908 24.136 ( 0.792 -0.527 -0.855) 1.279 28.181 ( -0.535 -0.604 1.221) 1.464 28.263 ( 0.053 -0.882 -0.506) 1.018 32.802 ( -14.924 -0.435 7.309) 16.623 32.927 ( 4.077 -4.170 7.166) 9.239 36.403 ( -2.276 -4.425 1.725) 5.267 36.845 ( 0.682 -0.389 -5.256) 5.314 39.782 ( -11.502 2.466 1.854) 11.908 40.375 ( 0.536 3.705 0.569) 3.787 40.728 ( 4.574 -3.387 -4.253) 7.105 41.506 ( 38.648 -7.931 -17.870) 43.311 ======================= Grid point 133 (60/165) ======================= q-point: ( 0.25 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( 10.109 -10.866 13.012) 19.738 1.937 ( 17.138 -14.027 18.590) 28.915 2.515 ( -8.571 1.983 -5.672) 10.467 2.895 ( 2.211 -5.910 5.765) 8.547 3.061 ( 9.024 -13.610 17.966) 24.279 3.391 ( 9.766 -7.694 9.868) 15.873 3.653 ( 6.227 3.964 -5.345) 9.114 3.925 ( -7.636 -6.537 0.453) 10.063 4.036 ( -1.131 9.807 -4.760) 10.960 4.151 ( 6.122 -3.145 -6.575) 9.518 4.318 ( -6.177 -5.945 2.590) 8.956 4.550 ( -12.214 -0.264 2.030) 12.384 4.585 ( -0.976 2.226 5.706) 6.202 4.984 ( 0.752 3.291 -1.625) 3.746 5.034 ( -3.756 6.454 -0.316) 7.474 5.154 ( -5.029 -2.655 2.486) 6.207 5.457 ( -7.925 0.137 -5.289) 9.529 5.600 ( 0.713 -1.908 -2.563) 3.274 5.861 ( 6.206 1.569 3.332) 7.216 5.902 ( 3.146 2.206 -0.507) 3.875 5.946 ( 6.331 10.071 -3.563) 12.418 6.037 ( -4.619 -1.131 -9.768) 10.864 6.234 ( 3.352 3.229 -2.706) 5.384 6.349 ( -4.642 -2.934 -3.249) 6.381 6.371 ( -1.136 6.608 1.368) 6.843 6.482 ( -3.473 4.819 -0.884) 6.006 6.582 ( -7.727 1.083 -2.013) 8.058 6.721 ( -0.954 4.685 0.961) 4.877 6.811 ( -6.204 -0.878 4.668) 7.814 7.047 ( -0.658 7.681 11.444) 13.798 7.087 ( -5.658 -5.706 -2.972) 8.568 7.337 ( 1.756 0.315 1.746) 2.496 7.464 ( -3.880 -1.522 2.183) 4.705 7.537 ( 4.499 -3.527 1.202) 5.842 7.742 ( 6.801 -2.795 0.129) 7.355 7.804 ( 6.071 3.541 -2.010) 7.310 8.016 ( -5.982 2.185 1.796) 6.617 8.118 ( -0.190 0.039 -0.084) 0.212 8.183 ( 6.434 0.014 -0.283) 6.441 8.405 ( 13.509 -5.604 1.806) 14.736 9.001 ( -1.148 4.430 2.548) 5.238 9.553 ( -13.063 4.428 -10.295) 17.211 13.036 ( -1.521 0.288 -1.183) 1.948 13.262 ( -0.654 -2.817 1.920) 3.471 14.539 ( -2.134 -1.637 1.653) 3.157 14.886 ( 1.042 1.263 0.894) 1.866 17.282 ( 0.684 0.827 -1.367) 1.738 17.356 ( 0.496 0.188 -0.762) 0.929 17.575 ( -1.711 -1.571 1.860) 2.976 18.067 ( 1.723 -1.838 -0.421) 2.554 21.250 ( -2.252 4.700 3.408) 6.227 21.470 ( 0.702 -0.750 -1.526) 1.839 21.769 ( 1.549 1.299 -0.176) 2.030 21.863 ( 0.275 -0.614 -0.992) 1.199 24.074 ( -0.395 -1.364 -0.778) 1.620 24.150 ( 0.331 -0.759 -0.712) 1.092 28.196 ( -0.422 -1.176 1.467) 1.927 28.270 ( -0.242 -0.270 -0.174) 0.402 32.817 ( 3.103 -3.432 3.052) 5.543 33.111 ( 6.038 -6.264 8.631) 12.255 36.427 ( -2.955 -1.908 1.403) 3.787 36.847 ( 1.184 -1.583 -5.500) 5.844 39.633 ( -9.368 1.143 1.437) 9.547 40.319 ( -2.440 2.926 4.198) 5.669 40.838 ( 4.912 -5.631 -8.128) 11.041 41.840 ( 24.021 0.200 -19.219) 30.764 ======================= Grid point 134 (61/165) ======================= q-point: ( 0.38 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( 11.424 -12.800 3.016) 17.420 2.307 ( -1.255 3.040 5.378) 6.303 2.461 ( 12.852 -7.417 8.378) 17.041 2.972 ( -2.848 -1.398 2.721) 4.180 3.216 ( -0.698 -3.455 2.192) 4.151 3.575 ( 10.001 1.964 -0.927) 10.234 3.789 ( 7.648 1.510 1.471) 7.933 3.883 ( -16.365 -6.112 10.092) 20.175 3.996 ( 4.236 -5.270 -5.156) 8.503 4.178 ( -3.420 5.946 3.545) 7.721 4.412 ( 1.731 -6.807 8.791) 11.252 4.503 ( -5.491 2.536 8.536) 10.461 4.549 ( -6.637 -9.173 -3.292) 11.791 4.882 ( 1.466 -0.237 4.609) 4.842 5.049 ( 5.675 -0.255 0.492) 5.702 5.170 ( -4.235 -4.325 -0.365) 6.064 5.332 ( -4.822 2.062 -2.419) 5.775 5.462 ( -8.303 12.746 1.604) 15.296 5.777 ( -2.515 6.276 -8.100) 10.551 5.852 ( 0.622 9.282 2.245) 9.570 5.955 ( -1.677 -4.644 1.240) 5.091 6.097 ( -4.656 -2.749 -0.177) 5.410 6.159 ( -3.834 -10.061 -6.952) 12.816 6.230 ( -0.962 7.327 -1.556) 7.552 6.316 ( 3.506 4.775 -8.207) 10.122 6.410 ( 8.141 3.270 -6.642) 11.004 6.522 ( -5.198 -2.140 3.400) 6.570 6.663 ( 2.630 1.326 2.003) 3.562 6.871 ( -0.013 -5.129 1.957) 5.490 6.979 ( 3.230 8.768 9.990) 13.679 7.134 ( -0.461 -5.415 -1.792) 5.722 7.311 ( -5.963 -2.134 -0.423) 6.348 7.488 ( -0.249 -1.925 3.961) 4.411 7.597 ( 1.817 1.875 -1.350) 2.939 7.777 ( 4.536 3.961 -0.503) 6.043 7.861 ( -5.287 -3.340 1.512) 6.434 7.949 ( 4.929 -0.382 -1.400) 5.138 8.124 ( -0.638 -0.360 -0.712) 1.021 8.240 ( 4.793 0.685 -0.776) 4.903 8.685 ( 19.211 -3.304 1.300) 19.536 8.915 ( -2.091 5.038 2.583) 6.036 9.205 ( -18.241 9.122 -9.568) 22.528 13.014 ( -0.705 -0.056 -1.536) 1.691 13.297 ( -2.098 -2.338 2.578) 4.064 14.565 ( -0.536 -2.869 0.941) 3.066 14.884 ( 0.941 1.361 1.763) 2.418 17.279 ( 1.687 0.426 -1.637) 2.389 17.346 ( -0.058 0.716 -0.671) 0.983 17.596 ( 0.129 -1.315 0.818) 1.554 18.096 ( -0.532 -0.975 -0.238) 1.136 21.177 ( -2.064 3.191 2.785) 4.712 21.486 ( 0.909 -0.726 -1.451) 1.860 21.759 ( 0.774 1.585 -0.017) 1.764 21.866 ( 0.411 0.050 -1.022) 1.103 24.085 ( 0.257 -0.636 -0.868) 1.106 24.158 ( -0.263 -0.522 -0.617) 0.850 28.217 ( -0.453 -1.174 1.638) 2.066 28.265 ( -0.426 0.295 0.132) 0.535 32.925 ( 4.709 -1.692 1.868) 5.341 33.320 ( 2.970 -8.377 9.117) 12.732 36.421 ( -1.500 -0.247 2.158) 2.640 36.873 ( 1.733 -2.434 -5.571) 6.322 39.554 ( -6.364 -2.065 1.931) 6.964 40.267 ( -3.634 1.722 5.194) 6.569 40.923 ( 2.085 -4.453 -9.663) 10.842 41.946 ( 16.568 5.236 -18.149) 25.126 ======================= Grid point 135 (62/165) ======================= q-point: (-0.50 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( -6.068 6.405 -2.974) 9.311 2.267 ( 5.060 -5.626 9.873) 12.439 2.777 ( 14.901 -2.676 4.798) 15.881 2.862 ( -8.919 8.303 4.259) 12.908 3.348 ( 0.736 -9.905 1.301) 10.017 3.507 ( 2.006 7.015 -7.603) 10.538 3.726 ( -16.651 -1.077 11.294) 20.149 3.977 ( -0.251 6.922 0.882) 6.982 4.058 ( 8.639 -7.572 8.086) 14.048 4.161 ( 8.968 -4.356 -9.510) 13.778 4.341 ( -14.372 7.463 10.793) 19.461 4.501 ( -4.779 -2.792 7.451) 9.282 4.647 ( -3.013 -8.004 1.457) 8.676 4.942 ( 1.961 -0.190 4.848) 5.233 5.055 ( -13.795 13.143 1.866) 19.145 5.130 ( 1.285 3.145 -1.897) 3.891 5.261 ( 4.267 -1.840 0.962) 4.745 5.360 ( 0.304 -5.949 4.866) 7.692 5.606 ( -6.762 3.795 -3.366) 8.453 5.721 ( 5.300 2.847 -2.877) 6.669 5.970 ( -3.669 -1.643 -2.872) 4.940 6.052 ( -10.950 -6.513 -7.407) 14.738 6.141 ( 0.974 3.961 -0.537) 4.114 6.250 ( 3.067 -1.027 -0.918) 3.362 6.333 ( 1.509 -4.840 -0.613) 5.107 6.422 ( 3.253 4.201 0.918) 5.392 6.608 ( 10.975 -7.912 -10.414) 17.073 6.713 ( -1.108 -1.462 5.074) 5.395 6.945 ( -1.649 -2.932 3.087) 4.566 6.975 ( 10.151 3.812 5.578) 12.194 7.224 ( 2.001 -4.643 1.563) 5.292 7.270 ( -4.279 -0.324 -2.755) 5.100 7.494 ( -3.918 3.293 -1.144) 5.244 7.551 ( 0.626 -0.055 2.265) 2.350 7.748 ( 1.301 4.122 -1.629) 4.619 7.864 ( -4.013 -4.802 4.589) 7.760 8.037 ( 4.064 -0.520 -1.224) 4.276 8.108 ( -1.403 -0.671 -0.275) 1.579 8.254 ( 1.146 1.585 -1.803) 2.660 8.762 ( -12.909 12.463 -3.426) 18.267 8.844 ( -7.680 -1.138 1.603) 7.927 8.995 ( 25.209 0.591 -5.932) 25.904 13.011 ( 0.339 -0.850 -1.732) 1.959 13.304 ( -3.229 -1.035 2.759) 4.371 14.621 ( 0.301 -3.946 0.526) 3.992 14.874 ( -0.275 1.749 2.428) 3.005 17.294 ( 2.216 -0.141 -1.609) 2.742 17.332 ( 0.227 0.689 -0.632) 0.961 17.624 ( 1.455 -0.743 0.375) 1.676 18.081 ( -2.792 0.250 -0.309) 2.821 21.125 ( -1.595 2.150 2.343) 3.558 21.499 ( 0.740 -0.426 -1.278) 1.537 21.741 ( 0.152 1.342 0.055) 1.352 21.864 ( 0.808 0.476 -1.045) 1.404 24.094 ( 1.108 0.002 -0.938) 1.452 24.155 ( -0.576 -0.020 -0.567) 0.808 28.227 ( -0.539 0.361 1.356) 1.504 28.261 ( -0.484 -0.596 0.617) 0.985 32.974 ( 1.365 1.352 2.054) 2.812 33.517 ( -3.465 -12.134 9.477) 15.781 36.432 ( 1.398 -0.044 2.681) 3.024 36.910 ( 1.656 -2.610 -5.293) 6.129 39.568 ( -2.913 -5.382 2.515) 6.616 40.226 ( -3.766 0.910 5.249) 6.524 40.931 ( -2.978 -2.403 -9.747) 10.471 41.923 ( 13.198 9.530 -19.509) 25.408 ======================= Grid point 136 (63/165) ======================= q-point: (-0.38 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( -12.398 19.024 4.517) 23.152 2.415 ( 5.536 17.664 7.328) 19.909 2.575 ( -17.558 -2.752 6.652) 18.976 2.902 ( 3.482 3.409 1.902) 5.231 3.366 ( -3.455 -0.230 -5.070) 6.139 3.533 ( -9.256 -1.731 1.299) 9.506 3.620 ( 6.855 0.280 7.464) 10.138 3.901 ( -24.961 19.075 12.556) 33.832 3.982 ( 0.206 -3.272 -2.453) 4.094 4.203 ( 3.535 -5.631 -6.106) 9.027 4.382 ( 9.808 -5.328 4.623) 12.081 4.570 ( 0.589 -5.955 5.272) 7.976 4.715 ( -11.501 -3.638 6.151) 13.541 4.761 ( -2.008 3.110 4.434) 5.776 5.072 ( -1.100 4.884 3.105) 5.891 5.126 ( 9.470 -2.481 -2.858) 10.199 5.195 ( -1.896 1.999 3.359) 4.344 5.367 ( 3.478 -3.794 -6.945) 8.644 5.685 ( 3.635 1.648 0.587) 4.034 5.786 ( 2.490 -5.843 -0.786) 6.400 5.910 ( -6.306 -0.225 -3.138) 7.048 5.998 ( -4.124 -4.636 -5.230) 8.115 6.144 ( 1.794 -3.305 1.541) 4.064 6.299 ( -0.614 -1.897 0.358) 2.026 6.396 ( 7.520 2.470 -1.347) 8.029 6.466 ( 3.797 -4.767 0.048) 6.095 6.671 ( -0.448 4.027 0.269) 4.061 6.808 ( 2.007 -4.997 -4.396) 6.951 7.012 ( 3.155 -4.665 1.203) 5.759 7.060 ( 3.543 3.191 2.364) 5.322 7.193 ( -0.692 -0.406 -1.460) 1.666 7.324 ( 0.773 0.661 0.347) 1.075 7.380 ( -3.831 -0.913 1.946) 4.393 7.593 ( 2.755 -0.443 1.496) 3.166 7.702 ( -1.184 0.750 0.560) 1.509 7.906 ( -3.413 -1.524 4.644) 5.962 7.986 ( -6.241 2.736 0.219) 6.818 8.132 ( 1.171 0.756 -1.216) 1.850 8.223 ( -4.431 -1.507 -0.034) 4.680 8.417 ( -11.353 6.717 -3.782) 13.723 8.816 ( -0.682 -0.763 0.074) 1.026 9.294 ( 29.772 1.098 -6.772) 30.552 13.032 ( 1.298 -1.491 -1.841) 2.701 13.277 ( -4.090 0.392 2.418) 4.767 14.693 ( -0.032 -4.282 0.946) 4.386 14.842 ( -1.441 2.180 1.873) 3.215 17.315 ( 1.816 0.083 -1.539) 2.382 17.330 ( 1.149 0.001 -0.185) 1.164 17.662 ( 2.785 -0.904 0.424) 2.958 18.024 ( -4.523 1.101 -0.843) 4.730 21.094 ( -0.684 1.278 2.792) 3.146 21.503 ( 0.304 0.033 -1.081) 1.123 21.726 ( -0.042 0.536 0.166) 0.562 21.862 ( 1.330 0.806 -1.082) 1.894 24.102 ( 1.561 0.587 -0.870) 1.881 24.143 ( -0.411 0.457 -0.576) 0.842 28.211 ( -0.438 1.214 1.012) 1.640 28.272 ( -0.548 -0.868 0.866) 1.343 32.937 ( -1.714 3.796 2.161) 4.692 33.710 ( -13.429 -20.291 9.515) 26.126 36.478 ( 4.287 -0.003 2.055) 4.755 36.941 ( 0.594 -2.228 -5.010) 5.515 39.669 ( 0.628 -7.462 2.702) 7.961 40.195 ( -3.304 0.587 4.907) 5.945 40.840 ( -9.027 -0.330 -8.913) 12.690 41.778 ( 11.582 16.097 -23.663) 30.874 ======================= Grid point 137 (64/165) ======================= q-point: (-0.25 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.253 ( -9.983 22.980 10.581) 27.198 1.932 ( -9.772 32.692 15.879) 37.635 2.533 ( -20.172 3.930 13.839) 24.776 2.781 ( -6.623 8.848 2.850) 11.413 3.160 ( -17.431 4.987 6.360) 19.214 3.403 ( -12.285 7.985 8.177) 16.779 3.604 ( 6.681 -6.375 -10.387) 13.898 3.789 ( 9.066 -1.422 4.355) 10.158 4.066 ( 3.728 -5.271 -7.935) 10.230 4.306 ( -2.629 -5.815 -0.687) 6.419 4.499 ( -2.893 -0.965 -1.131) 3.253 4.605 ( 0.052 -1.381 -5.098) 5.282 4.709 ( -4.485 -4.051 9.725) 11.450 4.818 ( -2.838 -1.719 13.327) 13.734 4.924 ( 3.763 3.030 0.426) 4.850 5.234 ( 8.432 0.397 1.799) 8.631 5.407 ( 10.745 -9.542 -2.558) 14.596 5.464 ( 7.682 -2.868 -8.777) 12.012 5.622 ( -4.621 1.878 0.812) 5.054 5.845 ( -5.387 -5.950 0.534) 8.044 5.870 ( 2.541 0.400 -5.078) 5.692 6.061 ( 1.840 -4.981 3.660) 6.449 6.241 ( -0.121 0.541 0.831) 0.999 6.290 ( 1.652 -1.348 1.239) 2.466 6.495 ( 10.697 -0.910 -0.804) 10.765 6.586 ( 0.855 5.223 1.879) 5.616 6.595 ( 1.578 -5.532 -0.924) 5.826 6.779 ( -1.706 1.127 -8.746) 8.982 6.911 ( -9.132 6.705 -1.878) 11.484 7.162 ( 6.222 -4.665 1.322) 7.888 7.273 ( 1.636 1.658 0.466) 2.375 7.308 ( 0.527 -6.934 6.482) 9.506 7.442 ( 1.150 -3.441 1.004) 3.764 7.621 ( 5.964 3.715 1.149) 7.120 7.681 ( -6.794 -0.993 -0.202) 6.869 7.831 ( -7.583 1.823 1.623) 7.966 7.868 ( -5.051 3.668 3.511) 7.162 8.040 ( -11.876 2.511 -1.084) 12.187 8.190 ( -1.927 -4.281 0.638) 4.738 8.352 ( -1.476 -1.958 4.240) 4.897 8.852 ( 4.047 -1.570 -1.387) 4.557 9.550 ( 26.978 6.082 -10.818) 29.695 13.067 ( 1.947 -1.306 -1.785) 2.947 13.221 ( -4.282 1.388 1.628) 4.787 14.721 ( -4.949 0.258 3.920) 6.318 14.826 ( 2.109 -1.618 -1.933) 3.286 17.320 ( 1.600 0.745 -1.359) 2.228 17.349 ( 0.707 -0.365 0.010) 0.796 17.726 ( 2.822 -2.487 1.157) 3.935 17.941 ( -4.620 1.432 -1.899) 5.196 21.104 ( 1.727 -0.198 4.514) 4.837 21.496 ( -0.179 0.340 -0.864) 0.946 21.728 ( 0.125 -0.624 0.309) 0.708 21.859 ( 1.615 1.346 -1.178) 2.410 24.101 ( 0.989 1.248 -0.556) 1.687 24.128 ( 0.274 0.700 -0.897) 1.170 28.193 ( -0.292 1.003 0.931) 1.399 28.278 ( -0.431 -0.163 0.455) 0.648 32.854 ( -2.273 4.370 2.367) 5.465 33.917 ( -30.579 -33.840 4.806) 45.862 36.530 ( 4.866 1.867 -0.797) 5.272 36.937 ( -1.818 -0.706 -5.802) 6.121 39.828 ( 3.541 -7.693 3.491) 9.160 40.174 ( -0.591 1.384 3.903) 4.183 40.658 ( -13.696 1.503 -6.988) 15.449 41.466 ( 11.140 27.052 -26.002) 39.141 ======================= Grid point 138 (65/165) ======================= q-point: (-0.12 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( -1.033 9.996 24.119) 26.129 1.449 ( -1.674 28.591 27.766) 39.890 2.027 ( -40.439 16.613 31.250) 53.739 2.641 ( -1.367 4.750 4.756) 6.859 3.051 ( -6.309 -2.724 -5.902) 9.058 3.232 ( -9.553 2.712 11.182) 14.955 3.785 ( 7.794 -7.499 -10.173) 14.848 3.902 ( 7.545 0.501 -0.837) 7.608 4.182 ( 10.596 -4.626 -9.558) 15.000 4.296 ( -6.756 -3.502 -5.738) 9.531 4.409 ( -3.549 1.953 -3.514) 5.363 4.519 ( -5.464 5.988 -2.020) 8.355 4.797 ( -2.996 -0.231 10.702) 11.116 4.876 ( -1.643 -9.625 6.193) 11.563 5.048 ( 7.745 -1.847 1.120) 8.041 5.318 ( 7.889 2.832 -0.724) 8.413 5.536 ( 10.040 -2.423 -5.394) 11.652 5.555 ( -1.092 -1.059 2.017) 2.527 5.622 ( 0.030 -3.575 -5.371) 6.453 5.863 ( 0.554 -0.824 -3.051) 3.209 5.973 ( 4.893 -8.633 2.281) 10.182 6.123 ( -2.403 4.620 -3.625) 6.344 6.196 ( 0.285 -6.384 0.846) 6.446 6.415 ( 7.616 1.891 4.842) 9.221 6.536 ( 1.719 0.369 3.158) 3.614 6.562 ( 2.963 2.302 -1.624) 4.088 6.632 ( 0.008 5.445 2.442) 5.967 6.762 ( 3.177 -3.376 -6.315) 7.834 6.801 ( -3.819 -5.756 0.122) 6.908 7.267 ( 2.771 -1.322 -0.697) 3.148 7.289 ( 2.275 -0.281 2.543) 3.424 7.349 ( -9.483 -0.484 0.035) 9.495 7.531 ( -5.219 1.014 0.809) 5.377 7.561 ( 1.028 -0.671 -2.024) 2.367 7.647 ( 5.672 2.837 0.897) 6.405 7.726 ( -7.966 2.395 -1.934) 8.540 7.873 ( -1.395 -10.607 6.883) 12.721 7.925 ( -3.320 -0.525 3.333) 4.733 8.269 ( 0.255 -5.123 2.316) 5.628 8.364 ( -5.609 -1.905 5.394) 8.012 8.937 ( 5.800 -1.914 -0.082) 6.108 9.583 ( 16.258 16.288 -10.324) 25.223 13.100 ( 2.535 -0.483 -1.047) 2.785 13.155 ( -3.124 1.727 0.765) 3.651 14.643 ( -5.885 2.030 3.602) 7.192 14.889 ( 2.425 -2.815 -2.826) 4.668 17.319 ( 1.352 0.909 -0.973) 1.898 17.350 ( -0.992 -0.057 -0.452) 1.091 17.757 ( -8.878 -2.256 1.623) 9.303 17.901 ( 5.043 0.647 -2.483) 5.658 21.201 ( 7.082 -3.030 5.213) 9.301 21.484 ( -0.514 0.235 -0.719) 0.914 21.750 ( 0.106 -1.783 0.398) 1.830 21.842 ( 1.119 2.427 -1.229) 2.941 24.076 ( -0.514 1.825 -0.314) 1.922 24.122 ( 0.981 0.490 -1.131) 1.575 28.182 ( -0.258 0.412 0.825) 0.958 28.269 ( -0.340 0.716 -0.262) 0.834 32.791 ( -0.096 2.813 3.218) 4.275 33.942 ( -64.601 -33.589 -12.252) 73.835 36.462 ( -0.980 9.420 -2.875) 9.898 36.880 ( -1.195 0.699 -5.560) 5.729 39.984 ( -5.443 -6.724 6.777) 10.989 40.243 ( 22.378 1.421 2.638) 22.578 40.462 ( -8.652 0.991 -1.651) 8.864 41.027 ( 12.156 31.166 -14.647) 36.519 ======================= Grid point 140 (66/165) ======================= q-point: ( 0.12 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( 14.067 -0.000 21.217) 25.457 1.535 ( 15.046 -0.000 28.091) 31.867 2.457 ( 15.907 -0.000 4.888) 16.641 2.781 ( 13.017 -0.000 15.351) 20.127 2.833 ( 4.286 -0.000 4.016) 5.874 3.243 ( -1.745 0.000 18.224) 18.308 3.810 ( -3.795 0.000 -6.384) 7.427 3.880 ( 3.751 -0.000 -6.284) 7.318 4.041 ( -5.867 0.000 -8.070) 9.977 4.078 ( -1.357 0.000 -8.642) 8.748 4.419 ( 9.863 -0.000 -18.663) 21.109 4.431 ( -11.921 0.000 1.607) 12.028 4.657 ( -4.920 0.000 10.915) 11.973 4.978 ( -3.733 0.000 -7.437) 8.321 5.124 ( -6.457 0.000 8.100) 10.359 5.231 ( -6.205 0.000 -2.496) 6.688 5.422 ( -9.983 0.000 -3.035) 10.434 5.485 ( 1.425 -0.000 -2.033) 2.483 5.873 ( 1.287 -0.000 2.049) 2.420 6.028 ( 8.598 -0.000 -14.613) 16.955 6.053 ( 0.690 -0.000 -4.244) 4.300 6.252 ( 3.255 -0.000 0.976) 3.398 6.257 ( -3.628 0.000 -1.242) 3.835 6.285 ( 2.803 -0.000 -2.205) 3.566 6.346 ( -8.028 0.000 3.850) 8.903 6.567 ( -6.136 0.000 12.674) 14.081 6.638 ( -10.742 0.000 -4.862) 11.791 6.763 ( 0.195 -0.000 -11.328) 11.330 6.885 ( -5.741 0.000 5.671) 8.070 7.019 ( -1.980 0.000 1.254) 2.343 7.244 ( -2.973 0.000 -1.969) 3.566 7.364 ( 4.651 -0.000 8.271) 9.489 7.418 ( -8.618 0.000 4.965) 9.946 7.418 ( 6.686 -0.000 -0.683) 6.720 7.663 ( 2.508 -0.000 2.850) 3.796 7.942 ( -1.570 0.000 2.830) 3.236 8.004 ( 7.273 -0.000 2.769) 7.782 8.149 ( -5.865 0.000 -1.631) 6.088 8.169 ( 17.013 -0.000 -1.836) 17.112 8.229 ( -4.628 0.000 1.401) 4.835 9.089 ( -0.805 0.000 2.029) 2.183 9.606 ( -3.689 0.000 -5.058) 6.260 13.048 ( -0.167 0.000 -1.484) 1.493 13.208 ( -0.304 0.000 2.588) 2.606 14.513 ( -2.293 0.000 1.279) 2.625 14.908 ( 0.080 -0.000 0.603) 0.608 17.322 ( 2.959 -0.000 -2.411) 3.817 17.342 ( 0.918 -0.000 0.359) 0.985 17.543 ( -2.610 0.000 1.881) 3.217 18.013 ( -0.416 0.000 0.627) 0.752 21.378 ( -3.375 0.000 1.972) 3.909 21.430 ( -1.456 0.000 -1.785) 2.303 21.793 ( 2.088 -0.000 -0.491) 2.145 21.843 ( 0.968 -0.000 -0.063) 0.970 24.045 ( 0.884 -0.000 -0.394) 0.968 24.136 ( 0.437 -0.000 -0.701) 0.826 28.175 ( -0.443 0.000 1.406) 1.474 28.256 ( 0.469 -0.000 -0.743) 0.878 32.759 ( 5.598 -0.000 1.865) 5.901 33.017 ( 7.925 -0.000 10.152) 12.879 36.368 ( -0.774 0.000 3.835) 3.913 36.824 ( 0.293 -0.000 -5.354) 5.362 39.664 ( -11.592 0.000 -0.168) 11.594 40.465 ( 5.336 -0.000 -2.739) 5.998 40.612 ( -5.978 0.000 -3.095) 6.732 41.863 ( 36.121 -0.000 -18.809) 40.725 ======================= Grid point 141 (67/165) ======================= q-point: ( 0.25 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( 19.150 3.862 15.188) 24.745 2.040 ( 20.872 -14.212 19.474) 31.888 2.507 ( 3.321 5.169 -2.421) 6.604 2.879 ( -0.758 -2.354 2.604) 3.592 3.157 ( 18.155 -3.294 12.321) 22.187 3.383 ( 1.698 -9.075 14.152) 16.897 3.764 ( 2.475 7.988 -4.066) 9.299 3.815 ( 6.584 -4.136 -6.837) 10.354 4.063 ( -8.507 -0.715 7.684) 11.486 4.125 ( 4.084 -6.589 -3.843) 8.653 4.216 ( 0.504 1.449 -7.926) 8.073 4.442 ( -5.990 1.198 -5.480) 8.206 4.610 ( -5.512 1.307 5.596) 7.962 4.893 ( -7.959 -3.523 -4.232) 9.678 5.071 ( -7.611 5.075 0.839) 9.187 5.111 ( -5.401 0.119 3.975) 6.707 5.304 ( -9.202 -1.972 -2.398) 9.712 5.528 ( -2.025 -4.540 2.394) 5.517 5.896 ( -0.074 -0.022 4.458) 4.458 5.911 ( -2.696 4.825 -7.807) 9.566 6.073 ( -1.744 5.151 -3.451) 6.441 6.151 ( 3.451 6.074 -4.271) 8.188 6.247 ( 0.345 -2.032 -7.534) 7.811 6.284 ( -3.166 4.501 -1.542) 5.715 6.325 ( -9.875 -3.710 7.157) 12.747 6.475 ( 2.900 2.183 -0.474) 3.660 6.634 ( -0.176 4.234 -9.852) 10.724 6.673 ( -1.279 -5.211 1.870) 5.682 6.896 ( 0.958 6.982 1.374) 7.180 6.934 ( -0.862 -1.174 -0.713) 1.622 7.196 ( 1.359 3.081 5.694) 6.615 7.346 ( -6.761 1.306 1.535) 7.056 7.434 ( 0.013 -0.526 7.322) 7.341 7.501 ( -0.147 -4.402 -0.861) 4.488 7.736 ( 0.556 -4.377 4.221) 6.107 7.926 ( 3.072 2.659 -0.385) 4.081 8.037 ( 0.388 6.328 1.926) 6.626 8.078 ( -1.648 -1.742 -1.351) 2.752 8.205 ( 1.366 -2.374 -2.350) 3.609 8.470 ( 16.144 -8.204 2.611) 18.296 9.046 ( -2.692 3.171 0.603) 4.203 9.457 ( -12.237 5.001 -4.814) 14.069 13.044 ( 2.069 1.090 -2.056) 3.114 13.230 ( -0.241 -1.470 2.954) 3.309 14.504 ( -1.203 -0.996 0.612) 1.678 14.911 ( 0.513 0.421 0.958) 1.165 17.323 ( 2.747 2.083 -1.473) 3.749 17.365 ( 1.136 -0.000 -0.433) 1.216 17.542 ( -0.352 -1.568 0.144) 1.614 18.018 ( -3.062 -2.681 1.036) 4.199 21.300 ( -3.112 4.152 2.185) 5.630 21.435 ( -1.223 -2.439 -1.463) 3.096 21.804 ( 1.137 0.944 -0.255) 1.500 21.857 ( 0.591 -0.421 -0.239) 0.764 24.064 ( 1.661 -0.517 -0.681) 1.868 24.140 ( -0.012 -0.459 -0.586) 0.745 28.184 ( -0.210 -0.663 1.573) 1.720 28.261 ( 0.132 -0.372 -0.745) 0.844 32.889 ( 13.068 -0.540 -1.871) 13.213 33.173 ( 6.787 -1.891 11.802) 13.745 36.389 ( -0.856 -1.272 3.474) 3.797 36.814 ( 0.904 -1.059 -5.497) 5.670 39.533 ( -9.207 0.189 -0.405) 9.218 40.391 ( -1.242 6.746 0.747) 6.900 40.674 ( -1.226 -10.066 -6.263) 11.919 42.110 ( 25.012 3.704 -18.641) 31.413 ======================= Grid point 142 (68/165) ======================= q-point: ( 0.38 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( 17.641 -1.212 6.477) 18.832 2.414 ( -0.306 8.144 5.808) 10.007 2.561 ( 19.121 -11.036 10.865) 24.606 2.932 ( 0.041 -3.424 3.114) 4.628 3.257 ( 6.013 5.670 -3.308) 8.902 3.626 ( -5.031 -11.775 9.964) 16.225 3.730 ( 10.154 2.709 -2.828) 10.883 3.812 ( -16.823 5.819 4.529) 18.368 3.999 ( 11.441 -4.143 -5.777) 13.469 4.265 ( -5.398 4.380 -4.172) 8.107 4.326 ( -1.252 -7.720 3.665) 8.637 4.416 ( 14.577 -6.259 9.462) 18.471 4.526 ( -7.632 3.718 7.262) 11.172 4.895 ( -4.705 0.007 1.917) 5.081 4.907 ( -4.895 -8.995 -2.193) 10.473 5.115 ( -6.437 -6.000 2.096) 9.046 5.245 ( -5.160 -0.701 0.745) 5.261 5.535 ( 0.205 2.846 -6.055) 6.693 5.786 ( -7.753 3.862 -1.462) 8.784 5.845 ( -9.504 8.071 1.183) 12.524 5.944 ( -3.815 -2.202 -1.433) 4.632 5.964 ( -13.418 2.277 1.798) 13.728 6.170 ( 8.353 7.296 -0.718) 11.114 6.281 ( 0.180 4.603 -0.126) 4.608 6.345 ( 0.704 -4.825 -2.932) 5.690 6.483 ( -3.020 4.465 -4.736) 7.175 6.532 ( 11.706 0.260 -6.841) 13.561 6.766 ( -0.795 -1.764 -0.912) 2.139 6.853 ( 11.086 3.139 1.688) 11.645 6.981 ( -2.592 -3.776 -1.232) 4.743 7.204 ( -3.923 0.966 1.635) 4.359 7.242 ( 3.368 3.284 5.696) 7.387 7.447 ( -4.572 -2.055 5.493) 7.437 7.566 ( -1.757 -5.253 -1.676) 5.787 7.779 ( -4.982 -1.153 2.252) 5.587 7.904 ( 3.612 6.814 -2.021) 7.973 7.992 ( 4.119 -0.870 0.554) 4.247 8.092 ( -1.538 -1.304 -0.402) 2.056 8.251 ( 0.753 -2.078 -1.751) 2.820 8.773 ( 6.532 -5.428 6.129) 10.473 8.969 ( 3.753 1.430 -4.923) 6.354 9.148 ( -14.519 9.845 -4.304) 18.063 13.044 ( 3.956 2.186 -2.109) 4.987 13.265 ( 0.060 -1.278 2.724) 3.010 14.522 ( -0.267 -2.223 0.337) 2.264 14.911 ( -0.214 0.708 1.507) 1.678 17.319 ( 2.886 1.733 -1.416) 3.652 17.361 ( 0.478 1.069 -0.357) 1.224 17.578 ( 1.239 -2.081 -0.423) 2.459 18.022 ( -5.425 -3.394 0.844) 6.454 21.217 ( -2.155 3.627 2.104) 4.714 21.454 ( -0.870 -2.331 -1.401) 2.855 21.790 ( 0.064 1.500 -0.023) 1.501 21.866 ( 0.443 -0.252 -0.570) 0.765 24.090 ( 2.318 -0.238 -0.916) 2.504 24.143 ( -0.422 -0.573 -0.539) 0.893 28.203 ( -0.151 -1.053 1.716) 2.019 28.260 ( -0.382 -0.051 -0.444) 0.588 33.023 ( 10.833 1.600 -0.603) 10.967 33.317 ( 2.797 -2.456 10.956) 11.571 36.414 ( -0.082 -0.938 3.345) 3.475 36.832 ( 1.785 -2.161 -5.614) 6.275 39.457 ( -5.480 -1.767 0.887) 5.825 40.291 ( -2.696 3.664 1.803) 4.893 40.765 ( -2.685 -7.478 -6.919) 10.536 42.195 ( 18.243 7.132 -17.817) 26.479 ======================= Grid point 143 (69/165) ======================= q-point: (-0.50 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.130 ( 8.343 4.565 -0.439) 9.521 2.334 ( 0.838 3.400 13.108) 13.567 2.830 ( 2.514 -1.657 -0.762) 3.106 3.040 ( 8.886 1.310 10.821) 14.063 3.227 ( 0.735 -0.817 -2.112) 2.380 3.479 ( -19.153 6.533 3.764) 20.584 3.672 ( 0.614 -0.117 0.767) 0.989 3.933 ( 5.616 -7.179 -4.727) 10.267 4.170 ( 0.639 -0.265 -4.664) 4.715 4.216 ( 11.522 -3.615 3.279) 12.513 4.281 ( -11.999 4.029 11.103) 16.837 4.481 ( 0.354 -1.227 1.721) 2.143 4.565 ( 4.397 0.302 6.799) 8.103 4.948 ( -0.225 -2.497 4.188) 4.881 5.062 ( -14.671 7.026 4.497) 16.876 5.136 ( 4.396 -14.315 3.628) 15.408 5.238 ( -3.879 -7.832 1.614) 8.888 5.395 ( 4.520 11.396 -0.005) 12.259 5.570 ( -16.123 5.333 -4.349) 17.530 5.660 ( 2.551 -3.194 -11.385) 12.096 5.818 ( -9.652 -3.711 -0.412) 10.349 5.976 ( 2.003 4.149 1.486) 4.841 6.181 ( 0.822 2.198 0.341) 2.372 6.253 ( 3.110 -1.055 0.323) 3.300 6.327 ( -3.275 4.267 -0.928) 5.458 6.427 ( -0.559 -4.401 0.286) 4.446 6.690 ( 15.244 -1.692 -7.223) 16.954 6.755 ( 2.451 1.773 -1.962) 3.606 6.915 ( -0.203 0.970 2.580) 2.764 7.018 ( -1.298 -5.810 2.102) 6.313 7.163 ( -2.513 -1.171 1.617) 3.210 7.334 ( 9.764 1.916 3.276) 10.476 7.456 ( -3.066 -2.255 0.500) 3.839 7.572 ( -2.190 0.627 -0.898) 2.448 7.739 ( -3.853 -2.600 0.435) 4.669 7.838 ( 1.230 3.969 -0.328) 4.168 8.047 ( -2.333 1.097 0.146) 2.582 8.097 ( 3.304 -2.381 -0.179) 4.077 8.250 ( -3.135 0.237 -1.471) 3.471 8.639 ( -18.794 6.391 -1.727) 19.926 8.879 ( -4.978 6.229 1.307) 8.081 9.203 ( 20.966 -6.988 -6.383) 23.003 13.053 ( 5.354 2.455 -1.695) 6.129 13.285 ( -0.327 0.101 2.083) 2.110 14.568 ( 0.227 -3.314 0.571) 3.370 14.892 ( -1.893 1.136 1.932) 2.934 17.325 ( 2.832 1.017 -1.391) 3.315 17.349 ( 0.740 0.947 -0.562) 1.327 17.626 ( 2.030 -1.658 0.125) 2.624 17.998 ( -7.179 -2.613 0.425) 7.652 21.156 ( -1.353 2.674 2.207) 3.722 21.472 ( -0.820 -1.935 -1.382) 2.516 21.763 ( -0.530 1.511 0.076) 1.603 21.871 ( 0.570 -0.103 -0.863) 1.039 24.116 ( 2.865 0.234 -1.180) 3.107 24.143 ( -0.527 -0.393 -0.481) 0.815 28.225 ( -0.173 -0.890 1.728) 1.951 28.251 ( -0.712 0.150 0.047) 0.729 33.074 ( 5.638 4.671 1.958) 7.579 33.401 ( -3.257 -2.844 9.111) 10.085 36.452 ( 1.422 -1.200 3.097) 3.613 36.868 ( 2.125 -2.393 -5.618) 6.466 39.475 ( -1.367 -4.583 3.050) 5.672 40.228 ( -1.953 1.769 1.308) 2.942 40.773 ( -6.399 -3.843 -5.719) 9.403 42.173 ( 14.339 9.759 -18.913) 25.662 ======================= Grid point 144 (70/165) ======================= q-point: (-0.38 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( -2.266 19.356 8.270) 21.170 2.396 ( -9.038 -0.905 8.156) 12.208 2.759 ( 4.048 11.432 7.400) 14.207 3.043 ( 2.375 7.957 1.669) 8.470 3.238 ( -14.069 -0.595 0.081) 14.082 3.327 ( -0.647 -9.351 -3.156) 9.891 3.699 ( -0.082 -1.300 1.907) 2.310 4.004 ( -12.550 16.505 10.192) 23.104 4.024 ( 5.256 -0.810 -5.228) 7.458 4.170 ( 3.096 1.160 -6.242) 7.064 4.460 ( 7.718 -2.809 8.298) 11.675 4.527 ( -2.848 -4.293 5.148) 7.283 4.632 ( 1.534 3.137 4.868) 5.991 4.795 ( -4.405 3.127 8.079) 9.719 5.053 ( 2.805 -7.175 3.871) 8.622 5.218 ( -6.120 7.067 0.694) 9.375 5.230 ( 2.663 -0.487 -0.449) 2.744 5.348 ( 2.354 1.040 -0.720) 2.673 5.536 ( -2.263 -12.110 -6.759) 14.052 5.769 ( -6.662 -6.515 -0.005) 9.318 5.826 ( 6.747 -9.606 -6.284) 13.315 5.907 ( 2.401 7.724 0.857) 8.134 6.154 ( 1.886 1.280 -0.381) 2.311 6.270 ( -2.864 -1.255 -0.264) 3.138 6.311 ( -2.735 -6.159 0.632) 6.768 6.495 ( 2.242 -2.864 -1.272) 3.853 6.746 ( 3.090 3.225 -1.724) 4.787 6.831 ( 6.279 2.555 -1.153) 6.876 6.949 ( 1.278 -7.695 -4.070) 8.798 7.089 ( -1.567 -4.006 6.727) 7.985 7.164 ( -2.468 0.371 2.934) 3.852 7.350 ( -3.915 4.682 -2.665) 6.660 7.424 ( 6.646 2.648 3.217) 7.844 7.594 ( 2.428 -1.678 -0.480) 2.990 7.749 ( 1.526 0.612 -0.486) 1.714 7.810 ( -6.271 -2.036 3.478) 7.455 7.974 ( -2.795 2.292 -1.049) 3.764 8.142 ( -6.281 1.020 -0.843) 6.419 8.161 ( -1.773 3.518 -0.565) 3.980 8.331 ( -11.327 2.313 -3.799) 12.169 8.809 ( -1.389 0.047 2.945) 3.257 9.528 ( 20.984 -6.549 -9.819) 24.075 13.078 ( 5.591 2.061 -0.888) 6.025 13.270 ( -0.797 1.652 0.894) 2.040 14.630 ( -0.488 -3.734 1.594) 4.089 14.850 ( -2.826 1.345 1.383) 3.422 17.338 ( 2.180 0.562 -1.367) 2.634 17.346 ( 1.024 0.392 -0.706) 1.304 17.677 ( 1.823 -1.282 1.642) 2.769 17.944 ( -6.762 -1.384 -0.482) 6.919 21.123 ( -0.428 1.472 2.971) 3.343 21.482 ( -0.952 -1.320 -1.364) 2.123 21.737 ( -0.473 0.961 0.142) 1.080 21.876 ( 0.790 -0.028 -1.139) 1.387 24.137 ( 2.772 0.738 -1.536) 3.254 24.139 ( -0.230 0.026 -0.282) 0.365 28.227 ( -0.324 0.908 0.904) 1.322 28.254 ( -0.574 -1.137 1.226) 1.768 33.034 ( 1.282 6.692 3.454) 7.639 33.405 ( -11.400 -3.828 8.128) 14.515 36.509 ( 2.069 -1.836 1.794) 3.297 36.899 ( 1.646 -1.665 -5.648) 6.114 39.589 ( 1.633 -6.898 5.518) 8.983 40.204 ( 1.413 0.826 -0.176) 1.646 40.686 ( -9.954 -0.137 -3.237) 10.468 42.059 ( 11.620 13.007 -22.109) 28.160 ======================= Grid point 145 (71/165) ======================= q-point: (-0.25 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( -2.233 24.025 11.266) 26.629 2.091 ( -25.044 15.079 19.112) 34.926 2.768 ( 11.439 9.524 8.411) 17.097 2.920 ( 0.404 7.425 -5.458) 9.224 3.065 ( -11.417 9.554 4.846) 15.656 3.431 ( -13.311 10.560 6.548) 18.209 3.477 ( -2.200 -5.411 -3.651) 6.888 3.849 ( 4.697 0.045 0.954) 4.794 4.078 ( 4.617 -1.584 -4.844) 6.877 4.206 ( 3.673 -2.121 -1.041) 4.367 4.488 ( -1.813 1.955 -1.867) 3.255 4.593 ( -2.932 -0.456 6.408) 7.062 4.627 ( -2.691 -2.832 8.573) 9.421 4.852 ( 2.281 -0.996 9.697) 10.012 5.031 ( 1.225 5.886 -1.437) 6.182 5.276 ( -3.259 -13.321 0.229) 13.716 5.307 ( 5.692 -3.581 1.490) 6.888 5.463 ( 9.666 -4.820 -0.204) 10.803 5.556 ( -1.011 -0.726 -7.519) 7.622 5.805 ( 0.501 -2.035 -3.881) 4.411 5.841 ( 0.447 1.181 -0.978) 1.597 6.048 ( 6.309 -7.031 2.602) 9.799 6.197 ( 0.877 -3.525 -0.523) 3.670 6.249 ( -2.859 -1.363 0.048) 3.168 6.435 ( 0.538 -11.199 -1.630) 11.330 6.565 ( 0.241 -4.612 -0.079) 4.619 6.701 ( 2.599 5.371 -3.784) 7.066 6.750 ( -2.587 4.827 -3.893) 6.719 6.980 ( -3.192 10.010 -0.964) 10.551 7.127 ( -4.185 -8.148 2.529) 9.503 7.195 ( 0.798 -3.077 4.385) 5.416 7.306 ( 0.229 -3.332 4.636) 5.713 7.461 ( 2.351 3.143 3.343) 5.155 7.601 ( -3.369 -0.886 -0.698) 3.553 7.748 ( -5.309 0.389 1.083) 5.432 7.789 ( 6.098 2.164 -0.690) 6.507 7.850 ( -6.869 5.719 -1.538) 9.070 8.000 ( -4.865 4.906 0.455) 6.924 8.093 ( -2.454 -3.844 1.219) 4.721 8.313 ( -0.684 -2.417 0.127) 2.515 8.853 ( 1.813 -3.240 2.755) 4.624 9.777 ( 15.221 -3.526 -15.100) 21.729 13.104 ( 2.864 1.245 0.430) 3.153 13.232 ( 0.897 2.776 -0.906) 3.055 14.662 ( -4.545 -1.621 3.649) 6.050 14.820 ( 0.143 -0.450 -0.685) 0.832 17.344 ( 1.639 0.609 -1.560) 2.343 17.347 ( -0.365 -0.026 -0.887) 0.959 17.704 ( -3.879 -0.971 4.015) 5.667 17.909 ( 0.774 -0.584 -1.735) 1.988 21.134 ( 1.097 -0.658 4.447) 4.627 21.480 ( -0.947 -0.647 -1.320) 1.748 21.727 ( 0.102 0.039 0.169) 0.201 21.879 ( 0.778 0.220 -1.462) 1.671 24.131 ( -0.064 0.753 -0.459) 0.884 24.143 ( 1.983 1.103 -1.553) 2.750 28.211 ( -0.313 1.170 0.992) 1.565 28.270 ( -0.305 -0.784 1.046) 1.342 32.947 ( -0.405 6.506 4.294) 7.806 33.316 ( -21.682 -4.861 7.596) 23.483 36.556 ( 0.236 -1.248 -0.766) 1.483 36.901 ( 0.590 0.068 -5.940) 5.970 39.746 ( -0.944 -7.538 7.326) 10.554 40.260 ( 11.408 -0.306 -2.015) 11.589 40.535 ( -10.361 2.500 0.618) 10.677 41.842 ( 10.345 17.858 -25.617) 32.896 ======================= Grid point 146 (72/165) ======================= q-point: (-0.12 0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.310 ( 0.022 19.166 15.644) 24.740 1.669 ( -17.656 16.413 27.892) 36.866 2.557 ( 7.778 39.563 24.769) 47.320 2.765 ( 0.755 6.738 0.237) 6.784 2.881 ( -7.589 -2.053 -5.796) 9.767 3.218 ( -6.619 2.518 13.086) 14.880 3.658 ( 4.870 -11.129 -13.301) 18.013 3.945 ( 6.358 -4.209 -3.681) 8.467 4.117 ( -2.987 -4.306 -3.477) 6.289 4.194 ( -3.442 3.518 -3.750) 6.187 4.453 ( 4.102 1.236 -2.901) 5.174 4.530 ( -7.032 3.826 5.232) 9.564 4.723 ( -2.226 -7.926 3.733) 9.039 4.852 ( 0.573 3.396 7.102) 7.893 5.103 ( 5.814 -4.083 2.208) 7.440 5.338 ( -11.245 -6.964 -1.923) 13.365 5.452 ( 7.401 -0.829 -2.230) 7.774 5.569 ( 5.108 -1.921 -4.179) 6.873 5.648 ( 9.617 -4.079 1.896) 10.617 5.825 ( 0.159 -0.708 -4.600) 4.657 5.895 ( 3.389 -7.850 -1.092) 8.619 6.135 ( 0.321 2.096 -5.873) 6.244 6.172 ( 1.841 0.489 -0.141) 1.910 6.379 ( -1.401 -10.131 4.935) 11.356 6.545 ( -5.108 1.415 1.678) 5.559 6.598 ( -3.441 -4.584 -9.799) 11.352 6.629 ( -1.206 1.585 0.482) 2.049 6.714 ( 2.486 -4.985 -1.948) 5.902 6.841 ( 6.662 5.796 7.252) 11.427 7.161 ( -11.797 -6.807 5.469) 14.677 7.255 ( -5.458 -2.916 0.907) 6.254 7.331 ( 0.000 3.428 0.665) 3.492 7.467 ( -6.789 -4.133 5.378) 9.597 7.541 ( -4.996 6.875 -0.710) 8.528 7.630 ( 1.508 0.246 -3.177) 3.526 7.721 ( -0.396 0.531 0.138) 0.676 7.892 ( 12.621 3.427 2.130) 13.250 7.984 ( 5.094 0.233 3.417) 6.138 8.156 ( -4.027 -6.627 4.568) 9.000 8.317 ( -2.145 -0.166 -0.558) 2.223 8.953 ( 2.986 -3.687 2.555) 5.389 9.823 ( 4.375 3.655 -17.463) 18.370 13.097 ( -2.300 0.291 0.710) 2.425 13.212 ( 4.329 3.112 -1.299) 5.487 14.611 ( -5.903 1.065 3.379) 6.884 14.858 ( 1.409 -2.443 -0.776) 2.925 17.325 ( -2.355 0.090 -1.238) 2.662 17.345 ( 1.265 0.670 -1.292) 1.928 17.650 ( -7.644 0.207 4.229) 8.738 17.964 ( 6.466 -0.198 -1.315) 6.602 21.217 ( 2.528 -4.425 5.097) 7.208 21.471 ( -0.433 -0.125 -1.298) 1.374 21.739 ( 0.815 -0.748 0.075) 1.109 21.870 ( 0.365 1.007 -1.658) 1.974 24.103 ( -0.616 2.030 -1.009) 2.349 24.140 ( 1.155 0.824 -1.097) 1.794 28.194 ( -0.352 1.015 1.103) 1.540 28.276 ( -0.171 0.211 0.182) 0.327 32.879 ( -0.751 3.738 5.661) 6.825 33.106 ( -26.990 -1.282 6.911) 27.891 36.517 ( -3.469 3.244 -2.274) 5.266 36.870 ( 0.777 1.015 -5.569) 5.714 39.824 ( -8.207 -5.490 5.262) 11.189 40.376 ( -3.956 0.315 0.223) 3.975 40.527 ( 20.768 -2.452 1.740) 20.984 41.553 ( 15.383 21.510 -24.714) 36.196 ======================= Grid point 149 (73/165) ======================= q-point: ( 0.25 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( 21.419 -0.000 5.666) 22.156 2.190 ( 18.373 -0.000 25.888) 31.745 2.691 ( 14.414 -0.000 2.341) 14.603 2.786 ( -7.897 0.000 -4.158) 8.925 3.357 ( 0.888 -0.000 10.356) 10.394 3.395 ( 15.143 -0.000 0.848) 15.167 3.841 ( 7.994 -0.000 -10.227) 12.981 3.882 ( -7.687 0.000 6.748) 10.229 3.971 ( 6.087 -0.000 5.172) 7.988 4.105 ( -6.722 0.000 0.674) 6.756 4.253 ( 13.982 -0.000 4.521) 14.695 4.374 ( 0.093 -0.000 -13.698) 13.698 4.529 ( -10.242 0.000 -0.585) 10.259 4.774 ( -9.793 0.000 4.458) 10.760 4.912 ( -14.512 0.000 2.284) 14.691 5.155 ( -8.042 0.000 -0.265) 8.047 5.172 ( 0.294 -0.000 1.387) 1.418 5.457 ( -6.330 0.000 8.950) 10.962 5.896 ( -8.032 0.000 4.211) 9.069 5.921 ( 2.806 -0.000 -10.495) 10.863 5.997 ( -11.806 0.000 -3.101) 12.206 6.130 ( -4.202 0.000 -0.454) 4.226 6.163 ( -8.366 0.000 1.268) 8.462 6.317 ( 5.708 -0.000 -1.763) 5.974 6.382 ( 6.992 -0.000 -1.541) 7.160 6.529 ( 5.465 -0.000 -9.363) 10.841 6.576 ( -2.381 0.000 4.673) 5.244 6.611 ( 1.414 -0.000 -13.983) 14.054 6.918 ( 0.956 -0.000 4.971) 5.062 7.057 ( 4.599 -0.000 0.025) 4.599 7.201 ( 0.533 -0.000 -2.633) 2.686 7.322 ( -3.847 0.000 8.986) 9.775 7.408 ( -1.969 0.000 -3.139) 3.705 7.478 ( -3.291 0.000 7.109) 7.834 7.673 ( -6.374 0.000 5.460) 8.393 7.975 ( 2.000 -0.000 -1.018) 2.244 8.054 ( 0.718 -0.000 -0.216) 0.750 8.114 ( -2.245 0.000 -0.263) 2.261 8.202 ( 5.329 -0.000 0.854) 5.397 8.588 ( 14.685 -0.000 0.881) 14.711 9.032 ( -3.628 0.000 -1.459) 3.911 9.316 ( -16.772 0.000 -2.836) 17.010 13.090 ( 5.406 -0.000 -2.436) 5.930 13.241 ( 1.900 -0.000 2.499) 3.139 14.487 ( -0.491 0.000 0.114) 0.504 14.922 ( 0.113 -0.000 0.796) 0.804 17.372 ( 1.158 -0.000 0.771) 1.391 17.376 ( 2.367 -0.000 -1.782) 2.963 17.530 ( 1.564 -0.000 -1.796) 2.382 17.947 ( -6.066 0.000 2.237) 6.465 21.314 ( -3.354 0.000 2.430) 4.142 21.380 ( -1.060 0.000 -2.261) 2.497 21.817 ( -0.167 0.000 0.029) 0.170 21.859 ( 0.391 -0.000 -0.080) 0.399 24.085 ( 2.895 -0.000 -0.952) 3.047 24.132 ( -0.321 0.000 -0.483) 0.580 28.184 ( 0.023 -0.000 1.601) 1.601 28.256 ( 0.139 -0.000 -0.990) 0.999 33.054 ( 16.227 -0.000 -4.226) 16.768 33.287 ( 4.470 -0.000 13.919) 14.619 36.393 ( 0.037 -0.000 4.135) 4.136 36.794 ( 1.576 -0.000 -5.497) 5.718 39.436 ( -6.672 0.000 -0.241) 6.676 40.427 ( -7.047 0.000 -1.785) 7.269 40.557 ( 3.993 -0.000 -3.030) 5.012 42.317 ( 18.765 -0.000 -19.112) 26.784 ======================= Grid point 150 (74/165) ======================= q-point: ( 0.38 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.256 ( 18.712 7.329 7.276) 21.373 2.565 ( 1.526 2.971 12.969) 13.393 2.621 ( 7.012 -5.075 -2.134) 8.915 2.916 ( 7.923 -3.504 3.997) 9.540 3.443 ( 6.622 3.089 0.527) 7.326 3.527 ( 6.713 -3.315 7.205) 10.391 3.709 ( -16.795 4.426 9.338) 19.719 3.851 ( 3.286 4.750 -9.192) 10.856 4.049 ( 10.244 -4.890 -1.163) 11.410 4.167 ( -2.415 -1.041 -5.045) 5.689 4.309 ( 0.205 0.912 4.089) 4.194 4.432 ( -5.305 -5.340 -1.876) 7.757 4.554 ( 5.861 -12.467 6.747) 15.339 4.708 ( 1.790 -0.332 4.781) 5.116 4.843 ( -13.467 -8.812 1.876) 16.203 4.977 ( -0.333 11.161 3.041) 11.573 5.191 ( -5.777 -0.297 3.341) 6.680 5.491 ( -3.328 -6.492 1.550) 7.458 5.753 ( -6.309 6.278 -3.953) 9.739 5.823 ( -9.740 2.534 -3.081) 10.526 5.903 ( -2.623 1.697 -0.373) 3.147 5.963 ( -2.390 6.542 3.655) 7.866 6.180 ( -7.797 -5.885 2.725) 10.141 6.321 ( 5.973 4.177 -1.427) 7.427 6.436 ( -3.144 3.252 -8.621) 9.735 6.455 ( 0.066 1.818 0.602) 1.916 6.632 ( 7.492 -6.477 -6.692) 11.952 6.678 ( 7.272 -0.658 -4.519) 8.587 6.953 ( 1.827 0.227 0.851) 2.028 7.079 ( 9.477 5.478 1.016) 10.993 7.170 ( -2.452 3.767 -2.150) 4.982 7.306 ( -4.252 -1.899 6.359) 7.881 7.408 ( -0.968 -0.277 2.395) 2.598 7.451 ( -2.077 -2.501 1.392) 3.537 7.684 ( -5.220 -5.585 3.263) 8.312 7.984 ( -1.486 -1.389 -2.146) 2.957 8.049 ( 3.620 4.785 0.711) 6.042 8.065 ( -1.658 0.877 0.348) 1.907 8.244 ( 2.304 1.052 -1.452) 2.919 8.775 ( 0.419 -2.626 6.353) 6.887 8.982 ( 3.374 -1.483 -8.288) 9.071 9.060 ( -16.770 3.250 -1.955) 17.194 13.140 ( 7.423 2.092 -2.354) 8.063 13.284 ( 2.970 -0.115 1.767) 3.458 14.496 ( 0.308 -1.228 0.209) 1.283 14.918 ( -0.936 0.478 0.833) 1.341 17.374 ( 1.992 1.568 -0.478) 2.580 17.383 ( 0.501 0.901 -0.178) 1.046 17.565 ( 3.084 -1.705 -2.027) 4.066 17.897 ( -7.908 -2.703 2.184) 8.638 21.254 ( -2.298 3.179 1.610) 4.240 21.392 ( -1.037 -2.873 -1.663) 3.478 21.802 ( -1.178 0.782 0.277) 1.441 21.863 ( 0.109 -0.259 -0.383) 0.475 24.118 ( 3.274 -0.048 -1.269) 3.512 24.128 ( -0.498 -0.367 -0.405) 0.740 28.196 ( -0.028 -0.566 1.593) 1.691 28.253 ( -0.100 -0.067 -0.824) 0.833 33.201 ( 13.572 2.741 -1.673) 13.947 33.378 ( 0.770 0.014 12.346) 12.370 36.419 ( 0.253 -0.698 4.047) 4.114 36.806 ( 2.687 -1.221 -5.374) 6.132 39.390 ( -2.646 -1.089 1.638) 3.297 40.314 ( -4.196 3.212 0.056) 5.284 40.623 ( -0.038 -4.629 -4.009) 6.123 42.391 ( 13.759 3.820 -19.253) 23.971 ======================= Grid point 151 (75/165) ======================= q-point: ( 0.50 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.355 ( 11.980 7.029 0.657) 13.906 2.454 ( -2.665 5.408 7.940) 9.969 2.817 ( 2.204 -3.326 3.746) 5.473 3.056 ( 2.115 -4.525 5.691) 7.572 3.371 ( -11.547 8.285 12.904) 19.196 3.443 ( -1.026 10.393 -4.275) 11.285 3.673 ( 3.294 1.251 0.294) 3.536 3.903 ( 6.758 -7.225 -2.176) 10.129 4.085 ( -1.824 -1.017 -4.532) 4.990 4.204 ( -0.744 -1.775 4.456) 4.853 4.366 ( 0.321 -1.792 12.204) 12.339 4.451 ( 4.658 -2.757 -4.326) 6.929 4.763 ( 5.803 0.261 0.225) 5.813 4.850 ( -12.371 -12.946 0.507) 17.914 4.926 ( 4.893 -10.254 3.417) 11.864 4.927 ( -0.051 -3.454 6.652) 7.495 5.108 ( -2.588 1.185 4.708) 5.501 5.454 ( -9.236 2.954 -3.017) 10.155 5.596 ( 5.056 6.494 -5.510) 9.904 5.637 ( -9.573 5.597 1.439) 11.182 5.823 ( 3.244 6.435 0.907) 7.263 5.991 ( 0.728 -3.886 2.116) 4.484 6.167 ( -7.503 -3.687 1.032) 8.423 6.314 ( -5.756 2.460 -1.744) 6.498 6.350 ( 7.490 3.415 -1.906) 8.450 6.410 ( 2.147 0.888 -2.183) 3.188 6.712 ( -0.242 1.556 0.098) 1.578 6.801 ( 4.881 -5.597 -2.390) 7.801 6.904 ( -0.155 3.221 -1.863) 3.724 7.034 ( 1.865 3.783 0.314) 4.230 7.168 ( 3.757 1.281 0.213) 3.975 7.360 ( -2.080 -4.868 1.190) 5.426 7.468 ( 4.826 -1.847 1.997) 5.540 7.490 ( -0.180 -5.181 0.966) 5.273 7.692 ( -1.892 -0.105 -0.189) 1.904 7.919 ( -1.914 5.458 -0.028) 5.784 8.023 ( -3.551 -0.405 -1.026) 3.718 8.090 ( 3.394 -2.491 -0.100) 4.211 8.216 ( -1.503 1.954 -1.731) 3.012 8.564 ( -17.169 9.980 1.139) 19.892 8.868 ( -8.745 1.725 0.923) 8.961 9.209 ( 12.252 -12.231 -8.295) 19.197 13.176 ( 7.700 3.555 -1.505) 8.614 13.316 ( 2.548 1.114 0.679) 2.863 14.534 ( 0.990 -2.263 0.882) 2.623 14.889 ( -2.546 1.137 0.905) 2.932 17.369 ( 0.991 1.191 -0.762) 1.727 17.371 ( 1.239 1.250 -0.474) 1.822 17.626 ( 3.005 -1.856 -0.285) 3.543 17.859 ( -7.995 -3.515 1.225) 8.819 21.191 ( -1.514 2.719 1.750) 3.570 21.418 ( -0.826 -2.635 -1.674) 3.229 21.772 ( -1.516 1.069 0.401) 1.898 21.867 ( 0.023 -0.436 -0.788) 0.901 24.127 ( -0.403 -0.521 -0.547) 0.857 24.150 ( 3.095 0.062 -1.386) 3.391 28.214 ( -0.299 -0.976 1.558) 1.863 28.248 ( -0.159 0.182 -0.312) 0.394 33.248 ( 5.047 6.495 4.644) 9.446 33.414 ( 0.581 1.567 6.655) 6.861 36.454 ( 0.123 -1.403 3.421) 3.700 36.843 ( 3.335 -1.675 -5.253) 6.444 39.429 ( 1.465 -3.114 4.591) 5.738 40.243 ( -1.021 1.804 0.191) 2.082 40.641 ( -4.133 -2.560 -3.264) 5.855 42.362 ( 10.081 6.661 -20.309) 23.631 ======================= Grid point 152 (76/165) ======================= q-point: (-0.38 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.256 ( -1.000 14.392 6.786) 15.943 2.406 ( -2.627 6.339 8.435) 10.874 2.894 ( 3.243 -4.078 1.772) 5.503 3.014 ( -17.054 4.004 7.786) 19.170 3.267 ( 3.954 1.421 -0.835) 4.284 3.279 ( 2.356 7.214 -1.195) 7.683 3.608 ( -9.954 0.790 2.356) 10.259 4.048 ( 8.033 0.533 -7.648) 11.105 4.162 ( 1.404 -1.219 14.432) 14.552 4.197 ( 6.746 0.204 -6.306) 9.236 4.424 ( -5.597 -2.981 7.426) 9.765 4.533 ( -1.512 -1.560 5.739) 6.136 4.741 ( -4.531 4.596 0.118) 6.455 4.882 ( 8.056 3.635 5.914) 10.634 5.008 ( 0.699 -1.647 2.964) 3.462 5.047 ( -7.977 -14.244 -3.032) 16.605 5.259 ( -3.906 4.055 0.086) 5.631 5.310 ( 5.874 -5.298 4.115) 8.917 5.541 ( 10.214 3.103 -1.120) 10.734 5.592 ( -4.206 -6.111 1.164) 7.509 5.794 ( 2.416 0.509 -1.518) 2.898 6.036 ( 1.819 0.632 -3.013) 3.576 6.160 ( -1.771 -3.171 -2.303) 4.301 6.201 ( -3.583 1.825 -0.636) 4.071 6.292 ( 0.441 8.054 3.028) 8.616 6.490 ( 4.651 -3.054 -2.558) 6.124 6.674 ( -7.920 -5.788 -1.438) 9.914 6.866 ( 0.199 0.612 0.794) 1.022 6.932 ( 3.560 -1.327 0.983) 3.924 7.074 ( 5.362 -2.116 2.806) 6.411 7.139 ( -4.521 0.915 -0.466) 4.636 7.364 ( -0.784 1.510 -3.838) 4.198 7.499 ( 0.475 -0.453 0.585) 0.879 7.640 ( 5.783 -1.288 1.291) 6.064 7.682 ( -1.203 -2.266 0.106) 2.568 7.807 ( -3.223 3.266 0.409) 4.607 7.976 ( -1.078 1.653 -1.696) 2.602 8.123 ( -2.274 2.976 -0.544) 3.784 8.187 ( -0.403 -0.285 0.587) 0.767 8.235 ( -9.763 5.692 -2.244) 11.521 8.786 ( -4.342 -0.655 2.555) 5.081 9.494 ( 8.196 -12.949 -10.793) 18.744 13.190 ( 4.559 4.001 0.263) 6.072 13.316 ( 2.826 2.412 -1.173) 3.896 14.590 ( 0.773 -2.363 2.179) 3.306 14.837 ( -3.129 1.174 0.443) 3.371 17.356 ( -0.150 0.639 -0.878) 1.096 17.366 ( 1.253 0.937 -1.048) 1.884 17.674 ( -1.034 -1.165 2.815) 3.217 17.847 ( -2.090 -3.355 -0.744) 4.022 21.152 ( -0.956 1.556 2.530) 3.120 21.439 ( -0.452 -1.967 -1.814) 2.714 21.742 ( -1.156 0.796 0.450) 1.474 21.871 ( 0.087 -0.561 -1.149) 1.281 24.129 ( -0.225 -0.494 -0.512) 0.746 24.173 ( 2.328 0.449 -1.628) 2.876 28.233 ( -0.502 -1.163 1.538) 1.993 28.242 ( -0.031 0.510 0.297) 0.591 33.169 ( -3.212 7.456 7.352) 10.953 33.391 ( 0.986 5.869 4.209) 7.289 36.491 ( -0.829 -2.139 2.000) 3.044 36.882 ( 3.168 -1.062 -5.329) 6.290 39.549 ( 2.880 -4.670 7.594) 9.369 40.246 ( 4.644 -0.233 -1.012) 4.758 40.581 ( -6.885 0.265 -1.200) 6.994 42.244 ( 6.869 9.164 -22.470) 25.221 ======================= Grid point 153 (77/165) ======================= q-point: (-0.25 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -4.161 20.258 9.455) 22.740 2.208 ( -7.860 14.916 13.994) 21.911 2.804 ( -12.505 1.334 -3.655) 13.097 2.996 ( 3.675 3.884 7.154) 8.931 3.232 ( 10.413 -2.974 -8.159) 13.559 3.347 ( 3.690 -0.491 -0.005) 3.722 3.463 ( -14.013 3.157 8.663) 16.775 4.067 ( -1.342 11.738 3.723) 12.388 4.081 ( 7.366 7.221 -0.412) 10.324 4.293 ( 10.402 -1.437 -0.805) 10.531 4.466 ( -5.161 -0.181 1.871) 5.493 4.513 ( -10.411 -2.122 17.171) 20.193 4.644 ( -1.044 1.078 -3.150) 3.489 4.882 ( -2.963 0.334 5.328) 6.105 5.063 ( -0.662 -6.441 1.809) 6.722 5.132 ( -1.305 6.300 -0.129) 6.435 5.235 ( 3.923 -12.627 -0.594) 13.235 5.482 ( 5.364 -3.582 2.425) 6.891 5.582 ( 5.924 -0.176 -4.795) 7.623 5.767 ( 7.978 -3.830 -1.806) 9.032 5.831 ( -3.514 -1.626 -0.065) 3.872 6.000 ( 2.635 -3.656 1.125) 4.645 6.185 ( -1.633 -2.082 -1.764) 3.181 6.219 ( 2.386 2.412 -3.160) 4.636 6.275 ( 2.552 -10.538 -0.115) 10.843 6.542 ( 3.135 2.228 -1.231) 4.039 6.657 ( -8.226 -4.284 -3.895) 10.060 6.794 ( -3.382 4.572 -1.786) 5.961 6.968 ( -5.604 -1.888 6.389) 8.705 7.028 ( -9.678 1.831 1.369) 9.944 7.197 ( 4.125 -0.654 -0.525) 4.209 7.333 ( 4.699 0.335 2.500) 5.333 7.524 ( 0.235 -3.020 -1.086) 3.218 7.577 ( -3.939 7.115 1.453) 8.261 7.681 ( -3.046 0.430 -1.153) 3.285 7.824 ( -0.502 -2.237 -0.890) 2.460 7.944 ( 7.117 3.659 -1.136) 8.083 8.022 ( -2.427 4.345 1.182) 5.116 8.085 ( 2.441 1.184 -0.687) 2.799 8.269 ( 1.182 -2.989 -0.693) 3.288 8.814 ( -0.877 -4.397 4.231) 6.165 9.679 ( 0.015 -10.571 -14.429) 17.887 13.151 ( -1.378 3.443 1.066) 3.858 13.310 ( 4.328 2.918 -1.893) 5.553 14.622 ( -1.982 -0.232 3.646) 4.156 14.806 ( -0.360 -0.709 -0.486) 0.932 17.332 ( -1.690 0.486 -1.303) 2.189 17.361 ( 0.636 0.532 -1.273) 1.519 17.656 ( -5.087 -0.148 3.944) 6.438 17.920 ( 5.726 -2.823 -0.930) 6.452 21.147 ( -0.518 -0.417 3.678) 3.737 21.453 ( 0.292 -1.131 -1.880) 2.213 21.728 ( -0.310 0.065 0.412) 0.520 21.875 ( 0.106 -0.453 -1.437) 1.511 24.129 ( -0.373 -0.095 -0.586) 0.701 24.174 ( 1.154 0.986 -1.632) 2.229 28.230 ( -0.095 1.043 0.962) 1.422 28.254 ( -0.392 -1.260 1.201) 1.784 33.028 ( -6.946 6.392 7.269) 11.913 33.291 ( 0.433 10.013 4.617) 11.034 36.511 ( -2.687 -2.013 0.291) 3.370 36.897 ( 2.411 0.363 -5.611) 6.118 39.668 ( -1.678 -3.943 8.043) 9.113 40.352 ( 5.579 -2.234 -0.010) 6.009 40.506 ( 2.255 0.579 -0.263) 2.343 42.046 ( 4.842 11.365 -24.611) 27.537 ======================= Grid point 154 (78/165) ======================= q-point: (-0.12 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( -0.922 20.254 10.732) 22.940 1.979 ( 3.180 17.130 17.509) 24.701 2.637 ( -11.380 -1.488 -8.049) 14.018 2.958 ( 2.442 6.597 3.788) 7.990 3.218 ( -7.335 15.452 16.887) 24.036 3.353 ( 11.572 8.000 5.538) 15.119 3.492 ( 9.347 -8.939 -7.947) 15.180 3.934 ( 3.553 2.431 0.543) 4.339 4.072 ( -1.039 2.790 1.043) 3.154 4.250 ( -3.979 8.970 -2.093) 10.034 4.423 ( -8.954 -2.785 7.201) 11.823 4.526 ( -2.741 -1.707 11.295) 11.747 4.650 ( 2.152 -0.361 -7.580) 7.888 4.895 ( -3.078 -3.838 6.749) 8.352 5.027 ( -6.535 -0.880 1.015) 6.672 5.187 ( 2.493 -2.127 0.623) 3.336 5.457 ( 1.627 -9.793 -5.121) 11.170 5.558 ( 2.412 -2.273 2.470) 4.133 5.707 ( 8.914 -4.624 -2.242) 10.289 5.779 ( -1.852 -3.042 -1.215) 3.763 5.854 ( 6.966 0.652 -3.072) 7.641 6.138 ( -1.683 -2.237 -4.216) 5.061 6.213 ( 5.522 3.040 -8.625) 10.682 6.244 ( 3.516 -7.614 3.669) 9.154 6.430 ( -5.503 -4.834 -6.487) 9.784 6.490 ( -5.835 0.413 -0.226) 5.854 6.575 ( -1.179 -3.234 -1.259) 3.665 6.720 ( -3.440 0.615 1.395) 3.763 6.899 ( -8.807 1.464 6.173) 10.854 6.953 ( -8.735 -4.720 9.186) 13.526 7.191 ( -1.114 1.991 -0.271) 2.297 7.403 ( -2.325 6.960 -1.456) 7.481 7.446 ( 3.491 -2.081 2.416) 4.728 7.571 ( -3.505 1.010 0.080) 3.648 7.638 ( 5.153 -1.359 0.566) 5.359 7.797 ( 4.719 5.574 -3.185) 7.967 8.000 ( -1.396 -4.573 3.275) 5.795 8.050 ( 6.629 -0.543 1.063) 6.735 8.121 ( 5.934 1.025 -0.450) 6.039 8.324 ( 6.052 0.286 -0.521) 6.081 8.912 ( -0.031 -5.522 4.378) 7.047 9.682 ( -9.856 -5.963 -15.405) 19.236 13.080 ( -3.337 1.720 0.055) 3.755 13.298 ( 2.111 3.044 -0.308) 3.717 14.588 ( -3.255 1.630 2.960) 4.692 14.841 ( 1.557 -1.949 0.212) 2.504 17.295 ( -1.920 0.353 -1.384) 2.393 17.355 ( 0.282 0.132 -1.181) 1.221 17.614 ( -3.552 0.854 3.218) 4.868 18.026 ( 6.155 -1.162 -0.664) 6.299 21.186 ( -0.768 -3.111 4.321) 5.380 21.466 ( 1.256 -0.321 -1.771) 2.195 21.738 ( 0.716 -0.790 0.199) 1.085 21.873 ( 0.048 0.067 -1.502) 1.504 24.110 ( -1.135 1.012 -0.956) 1.796 24.162 ( 0.625 0.973 -1.061) 1.569 28.214 ( -0.299 1.300 1.267) 1.840 28.270 ( -0.361 -0.657 0.625) 0.976 32.888 ( -5.896 5.010 6.265) 9.956 33.161 ( 2.797 10.563 6.018) 12.475 36.487 ( -4.098 -0.043 -0.300) 4.109 36.880 ( 1.763 1.547 -5.661) 6.127 39.692 ( -6.922 -2.310 4.875) 8.776 40.330 ( -5.930 0.199 4.589) 7.501 40.715 ( 19.692 -3.538 -3.770) 20.360 41.829 ( 8.925 10.351 -24.004) 27.622 ======================= Grid point 158 (79/165) ======================= q-point: ( 0.38 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( -4.656 0.000 -14.562) 15.288 2.580 ( 15.859 -0.000 4.474) 16.478 2.681 ( 1.099 -0.000 21.266) 21.294 3.041 ( 10.536 -0.000 1.485) 10.641 3.513 ( -15.693 0.000 11.669) 19.556 3.549 ( 6.816 -0.000 12.290) 14.053 3.698 ( 1.328 -0.000 0.474) 1.411 3.941 ( 9.260 -0.000 -6.356) 11.232 4.038 ( 0.691 -0.000 -9.115) 9.141 4.140 ( 0.079 -0.000 -5.386) 5.387 4.259 ( -2.179 0.000 -0.222) 2.191 4.438 ( 10.640 -0.000 3.968) 11.356 4.449 ( -6.879 0.000 7.299) 10.030 4.581 ( -13.802 0.000 5.404) 14.823 4.797 ( 2.161 -0.000 7.438) 7.746 5.140 ( -5.629 0.000 2.762) 6.270 5.249 ( 15.609 -0.000 2.813) 15.860 5.328 ( -5.787 0.000 0.709) 5.830 5.731 ( -6.276 0.000 4.187) 7.544 5.781 ( -0.308 0.000 -0.481) 0.571 5.892 ( 1.822 -0.000 -13.274) 13.399 6.002 ( -9.736 0.000 4.930) 10.914 6.020 ( -5.903 0.000 3.379) 6.802 6.319 ( -7.678 0.000 -4.073) 8.692 6.443 ( -7.222 0.000 -0.207) 7.225 6.470 ( 6.223 -0.000 -3.448) 7.115 6.551 ( 6.289 -0.000 -1.252) 6.412 6.808 ( 9.022 -0.000 -5.850) 10.752 6.999 ( 1.743 -0.000 3.442) 3.858 7.179 ( 5.001 -0.000 -12.052) 13.048 7.213 ( 4.782 -0.000 10.330) 11.383 7.331 ( 0.260 -0.000 -4.271) 4.279 7.351 ( -0.377 0.000 3.190) 3.212 7.500 ( 1.955 -0.000 4.575) 4.975 7.532 ( -7.359 0.000 4.798) 8.785 7.930 ( -2.849 0.000 -4.154) 5.037 8.052 ( -1.612 0.000 0.152) 1.619 8.118 ( 0.547 -0.000 0.820) 0.986 8.296 ( 2.427 -0.000 -0.444) 2.467 8.764 ( -4.581 0.000 5.651) 7.275 8.827 ( -21.738 0.000 -1.343) 21.780 8.979 ( 5.784 -0.000 -10.395) 11.895 13.244 ( 8.623 -0.000 -2.271) 8.917 13.333 ( 3.999 -0.000 0.809) 4.080 14.496 ( 1.220 -0.000 0.628) 1.373 14.910 ( -1.608 0.000 0.201) 1.621 17.393 ( 0.190 -0.000 -0.392) 0.436 17.401 ( 0.525 -0.000 0.541) 0.754 17.588 ( 4.917 -0.000 -2.673) 5.597 17.787 ( -8.673 0.000 2.584) 9.050 21.260 ( -2.887 0.000 1.497) 3.252 21.350 ( 0.253 -0.000 -2.039) 2.055 21.791 ( -1.924 0.000 0.519) 1.993 21.858 ( -0.306 0.000 -0.543) 0.623 24.117 ( -0.503 0.000 -0.381) 0.631 24.150 ( 3.100 -0.000 -1.506) 3.446 28.197 ( -0.208 0.000 1.377) 1.393 28.250 ( 0.173 -0.000 -0.846) 0.864 33.390 ( 14.496 -0.000 -1.156) 14.542 33.415 ( -3.821 0.000 12.657) 13.221 36.431 ( -0.386 0.000 4.126) 4.144 36.813 ( 3.928 -0.000 -4.834) 6.229 39.385 ( 1.462 -0.000 3.839) 4.108 40.289 ( -4.377 0.000 2.339) 4.963 40.579 ( 0.784 -0.000 -5.389) 5.446 42.469 ( 9.430 -0.000 -20.471) 22.539 ======================= Grid point 159 (80/165) ======================= q-point: (-0.50 -0.62 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( 0.728 -0.167 -10.916) 10.942 2.615 ( -1.187 6.895 11.681) 13.616 2.796 ( -1.912 -3.249 8.087) 8.922 3.117 ( 5.078 3.738 4.006) 7.471 3.302 ( -18.977 2.508 7.387) 20.518 3.616 ( 2.351 11.498 0.023) 11.736 3.789 ( 7.083 -10.069 10.672) 16.293 3.837 ( -3.205 8.429 -5.293) 10.456 4.091 ( 4.955 -2.827 -3.389) 6.636 4.209 ( 1.951 -8.498 0.053) 8.719 4.306 ( 2.364 1.017 2.865) 3.851 4.423 ( -7.267 -1.712 3.515) 8.253 4.567 ( 2.428 -9.795 1.870) 10.264 4.638 ( 3.340 -6.727 2.777) 8.008 4.884 ( 0.653 -5.081 8.161) 9.635 5.076 ( 1.652 3.561 3.105) 5.005 5.229 ( 6.065 5.458 2.637) 8.575 5.421 ( 2.997 1.666 -1.458) 3.727 5.641 ( -6.151 6.123 4.595) 9.820 5.726 ( 2.842 6.463 -4.753) 8.511 5.913 ( -3.592 2.293 -0.266) 4.269 5.932 ( -0.336 -4.375 1.709) 4.709 5.992 ( -5.038 -7.939 0.889) 9.444 6.219 ( -7.370 -1.763 -5.555) 9.396 6.350 ( -4.716 0.234 -2.616) 5.398 6.512 ( 8.081 2.221 -0.190) 8.383 6.689 ( 3.763 -5.149 -0.463) 6.395 6.856 ( 2.767 -0.555 0.899) 2.962 6.945 ( -1.603 7.925 0.234) 8.089 7.184 ( -0.579 9.760 1.020) 9.830 7.214 ( 4.562 1.503 -7.559) 8.956 7.311 ( 2.983 -1.085 4.031) 5.131 7.406 ( 0.998 -3.959 -0.783) 4.157 7.480 ( -0.463 -3.057 4.975) 5.857 7.664 ( 3.615 -5.663 0.307) 6.726 7.887 ( -4.324 -2.160 -2.234) 5.325 8.005 ( -1.870 3.412 -1.031) 4.025 8.119 ( 1.866 0.593 0.032) 1.959 8.261 ( -0.007 4.673 -1.934) 5.057 8.512 ( -16.228 7.102 0.629) 17.725 8.746 ( -10.025 -3.401 2.928) 10.983 9.085 ( 5.815 -9.838 -10.640) 15.614 13.311 ( 7.105 2.710 -1.287) 7.712 13.371 ( 3.308 0.946 -0.364) 3.459 14.530 ( 2.134 -1.189 1.523) 2.879 14.879 ( -2.417 1.043 -0.260) 2.645 17.384 ( -0.220 0.876 -0.326) 0.961 17.398 ( 0.099 0.773 -0.065) 0.782 17.642 ( 2.879 -0.397 -0.197) 2.913 17.728 ( -5.469 -3.294 0.898) 6.448 21.214 ( -2.311 1.907 1.120) 3.199 21.368 ( 0.524 -2.039 -1.749) 2.737 21.766 ( -1.947 0.515 0.645) 2.115 21.853 ( -0.513 -0.433 -0.864) 1.094 24.113 ( -0.349 -0.360 -0.407) 0.646 24.175 ( 2.273 -0.091 -1.661) 2.817 28.203 ( -0.551 -0.544 1.189) 1.419 28.250 ( 0.471 0.053 -0.484) 0.677 33.367 ( -6.133 4.065 9.956) 12.380 33.538 ( 12.009 2.529 2.032) 12.439 36.443 ( -1.531 -0.803 3.571) 3.967 36.851 ( 4.637 -0.652 -4.291) 6.351 39.459 ( 5.340 -1.266 6.876) 8.797 40.257 ( -1.405 0.675 3.324) 3.672 40.561 ( -1.881 -0.976 -5.988) 6.352 42.440 ( 5.805 3.256 -21.880) 22.870 ======================= Grid point 160 (81/165) ======================= q-point: (-0.38 -0.62 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( 0.480 5.176 1.044) 5.302 2.516 ( -6.130 3.932 7.026) 10.119 2.814 ( -3.499 -2.974 1.908) 4.973 2.981 ( -14.934 6.888 10.476) 19.499 3.205 ( -5.870 -4.869 -1.113) 7.707 3.462 ( 6.281 12.469 -1.056) 14.002 3.666 ( 0.951 8.739 -0.193) 8.793 4.087 ( 1.379 -12.569 10.717) 16.575 4.115 ( -3.953 -0.055 2.733) 4.806 4.289 ( 0.939 1.083 -7.752) 7.883 4.371 ( 6.991 -0.503 8.222) 10.804 4.451 ( -0.457 -6.425 7.000) 9.513 4.671 ( -3.762 -3.688 -4.607) 6.998 4.792 ( 2.947 -6.708 0.773) 7.368 4.997 ( 0.812 0.690 3.385) 3.549 5.123 ( 6.476 2.005 4.443) 8.106 5.245 ( -3.958 -4.004 3.018) 6.388 5.402 ( 6.394 4.682 -1.054) 7.994 5.539 ( 1.452 1.561 7.009) 7.326 5.688 ( 6.458 2.670 0.969) 7.055 5.803 ( -3.977 2.449 -1.473) 4.897 5.951 ( -4.644 -4.961 -1.325) 6.924 6.092 ( 0.010 -1.925 -6.195) 6.487 6.207 ( -1.703 -3.277 2.890) 4.689 6.328 ( -2.655 -7.027 -4.299) 8.655 6.522 ( 3.090 11.942 2.174) 12.525 6.688 ( 4.061 5.809 -1.980) 7.359 6.840 ( -0.824 -1.514 -0.965) 1.975 6.920 ( -0.877 -0.849 3.302) 3.521 7.110 ( -3.598 1.366 4.879) 6.214 7.163 ( 3.760 3.675 -2.762) 5.939 7.334 ( 1.206 -0.979 -6.865) 7.039 7.471 ( -0.172 -2.468 -1.663) 2.981 7.590 ( -0.230 -6.823 5.872) 9.005 7.721 ( 1.990 1.870 -2.369) 3.615 7.839 ( -2.769 4.846 -0.034) 5.581 7.960 ( 0.146 -2.264 -1.298) 2.614 8.136 ( 0.330 -0.310 -0.926) 1.031 8.182 ( -0.493 2.415 -1.122) 2.708 8.275 ( -2.880 7.890 0.576) 8.419 8.705 ( -6.123 -3.275 2.222) 7.290 9.269 ( -0.095 -13.808 -11.143) 17.744 13.297 ( 1.109 5.067 0.206) 5.191 13.386 ( 3.808 1.801 -1.548) 4.488 14.592 ( 2.556 -1.560 2.765) 4.076 14.824 ( -2.490 1.573 -0.739) 3.037 17.359 ( -0.935 1.171 -0.727) 1.666 17.383 ( -0.338 0.771 -0.604) 1.036 17.636 ( -4.217 -0.888 2.435) 4.949 17.796 ( 4.412 -4.504 -0.744) 6.349 21.168 ( -1.970 1.377 1.565) 2.868 21.402 ( 1.023 -1.972 -1.822) 2.873 21.740 ( -1.408 0.538 0.686) 1.656 21.853 ( -0.422 -0.813 -1.159) 1.478 24.116 ( -0.188 -0.565 -0.498) 0.776 24.189 ( 1.044 0.017 -1.697) 1.992 28.213 ( -0.759 -1.094 1.143) 1.755 28.253 ( 0.651 0.344 0.084) 0.741 33.239 ( -8.165 5.974 7.839) 12.798 33.600 ( 10.069 8.275 4.300) 13.725 36.450 ( -2.780 -1.495 2.454) 3.998 36.895 ( 4.413 -0.274 -4.197) 6.096 39.588 ( 5.527 -1.251 9.558) 11.112 40.283 ( 2.986 -1.501 2.732) 4.317 40.513 ( -2.555 -0.345 -5.281) 5.877 42.315 ( 2.328 6.001 -23.629) 24.490 ======================= Grid point 161 (82/165) ======================= q-point: (-0.25 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( -3.405 13.718 6.672) 15.630 2.405 ( -1.655 8.529 7.193) 11.279 2.671 ( -16.032 3.314 -1.861) 16.477 2.985 ( -1.974 -8.708 7.602) 11.727 3.211 ( 0.587 -4.546 -3.290) 5.642 3.388 ( 4.518 5.215 -3.826) 7.890 3.580 ( 7.098 10.057 7.479) 14.403 4.079 ( -4.838 -0.782 4.090) 6.384 4.186 ( -14.443 -4.167 12.130) 19.316 4.324 ( 4.728 -4.219 -6.060) 8.768 4.481 ( 5.752 2.757 9.402) 11.362 4.519 ( -0.547 2.458 0.979) 2.702 4.622 ( -1.316 3.559 -0.076) 3.796 4.898 ( -3.994 3.629 2.402) 5.907 4.950 ( 2.709 -9.780 0.405) 10.156 5.158 ( 0.297 0.700 3.772) 3.848 5.241 ( 3.386 2.932 0.043) 4.479 5.437 ( -6.312 -7.180 -4.389) 10.519 5.603 ( 5.776 5.726 10.346) 13.160 5.757 ( -0.273 -5.802 -2.805) 6.450 5.871 ( 11.887 -4.707 -2.292) 12.989 5.979 ( -0.838 -2.856 0.240) 2.986 6.093 ( -2.750 -5.394 -3.854) 7.177 6.218 ( 4.210 1.399 -1.568) 4.705 6.307 ( -1.113 9.526 1.231) 9.670 6.467 ( -1.116 -9.339 3.784) 10.138 6.663 ( 4.217 5.269 -4.720) 8.236 6.809 ( -4.174 7.836 -4.507) 9.956 6.860 ( -6.985 -2.085 2.507) 7.708 7.017 ( -3.201 4.166 1.191) 5.387 7.228 ( 1.331 -1.460 2.518) 3.200 7.349 ( 0.457 -3.506 0.612) 3.589 7.476 ( 1.419 -0.914 -5.170) 5.439 7.657 ( -2.509 4.850 1.218) 5.595 7.682 ( -0.629 1.309 -1.600) 2.160 7.766 ( 2.521 -2.593 1.061) 3.769 8.024 ( 2.395 -2.749 -0.482) 3.677 8.104 ( 1.451 3.770 -1.271) 4.235 8.141 ( 2.077 4.719 0.311) 5.165 8.264 ( 7.501 -2.578 -0.057) 7.932 8.739 ( -1.856 -5.065 3.433) 6.394 9.379 ( -8.195 -12.195 -12.627) 19.373 13.196 ( -3.265 5.504 -0.087) 6.400 13.384 ( 1.746 2.293 -0.539) 2.932 14.639 ( 0.836 0.916 3.482) 3.696 14.790 ( -0.013 -0.629 -0.742) 0.973 17.320 ( -1.495 1.243 -1.265) 2.319 17.363 ( -0.736 0.415 -0.907) 1.240 17.617 ( -2.823 -0.681 2.254) 3.676 17.933 ( 6.317 -4.472 -0.116) 7.740 21.142 ( -1.865 -0.024 2.365) 3.012 21.437 ( 1.857 -1.466 -1.873) 3.018 21.726 ( -0.589 0.038 0.623) 0.858 21.858 ( -0.157 -0.892 -1.349) 1.625 24.118 ( -0.426 -0.318 -0.730) 0.903 24.184 ( -0.041 0.322 -1.420) 1.457 28.228 ( -0.909 -1.275 1.189) 1.967 28.254 ( 0.650 0.653 0.595) 1.097 33.078 ( -7.053 6.305 5.945) 11.173 33.551 ( 6.773 13.268 6.118) 16.104 36.446 ( -3.494 -1.730 1.415) 4.148 36.919 ( 3.454 0.844 -4.655) 5.857 39.669 ( -0.050 0.903 8.589) 8.637 40.332 ( -4.908 -0.625 5.034) 7.059 40.570 ( 14.011 -4.937 -5.814) 15.953 42.111 ( -0.183 7.510 -24.757) 25.872 ======================= Grid point 162 (83/165) ======================= q-point: (-0.12 0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.011 ( 3.373 17.278 3.965) 18.045 2.309 ( 1.655 7.436 9.189) 11.936 2.476 ( -7.485 1.505 -0.695) 7.667 3.016 ( -5.428 -0.747 3.165) 6.328 3.305 ( 1.067 5.909 -0.909) 6.073 3.417 ( 6.033 -8.487 -0.081) 10.414 3.611 ( 13.532 3.492 5.667) 15.081 4.045 ( -1.926 2.287 1.834) 3.508 4.121 ( -15.358 -1.908 12.687) 20.012 4.228 ( -8.437 6.744 -5.148) 11.965 4.445 ( 0.886 4.064 5.566) 6.948 4.513 ( -3.822 2.354 12.908) 13.666 4.645 ( 6.005 -3.317 -5.335) 8.690 4.856 ( 0.386 2.929 4.431) 5.326 5.042 ( -0.685 5.135 2.445) 5.729 5.192 ( 1.571 -6.181 -1.043) 6.462 5.285 ( 1.192 -3.965 -1.322) 4.346 5.434 ( -11.170 -6.874 1.280) 13.178 5.638 ( 2.369 -4.098 2.920) 5.562 5.817 ( 1.681 -1.558 -4.796) 5.315 5.986 ( 7.066 4.481 -1.179) 8.450 6.049 ( 0.655 -10.591 -5.594) 11.996 6.151 ( -1.808 -2.074 -0.203) 2.759 6.234 ( 2.747 -1.774 0.569) 3.319 6.322 ( 4.479 -4.337 -2.643) 6.772 6.490 ( -6.968 11.820 -7.457) 15.617 6.558 ( -1.136 1.202 -5.059) 5.322 6.686 ( 2.261 1.084 7.156) 7.583 6.806 ( -6.856 -3.802 4.332) 8.957 6.935 ( -0.721 4.038 2.241) 4.674 7.219 ( -2.347 2.094 2.014) 3.735 7.415 ( -3.576 -1.200 -0.676) 3.832 7.487 ( 1.196 2.158 0.042) 2.467 7.543 ( 1.022 0.030 -0.954) 1.398 7.688 ( 3.828 -0.626 -0.329) 3.892 7.880 ( 4.332 -3.285 -0.141) 5.438 7.982 ( -3.184 5.949 1.708) 6.960 8.107 ( 4.131 -0.314 -1.173) 4.306 8.164 ( 4.676 -0.883 -1.398) 4.960 8.458 ( 17.108 -2.539 -0.297) 17.298 8.828 ( -1.627 -6.141 4.758) 7.937 9.339 ( -16.191 -8.551 -12.719) 22.295 13.075 ( -3.868 3.382 -0.789) 5.198 13.350 ( -1.200 2.529 1.160) 3.030 14.613 ( -0.711 2.986 1.974) 3.650 14.832 ( 1.830 -2.114 1.077) 2.996 17.283 ( -0.451 0.823 -1.571) 1.830 17.348 ( -0.667 -0.121 -0.916) 1.139 17.608 ( -1.035 0.229 1.695) 1.999 18.058 ( 4.556 -2.610 -0.218) 5.255 21.147 ( -1.892 -1.834 2.946) 3.952 21.472 ( 2.236 -0.667 -1.720) 2.899 21.732 ( 0.271 -0.825 0.361) 0.941 21.864 ( 0.140 -0.561 -1.341) 1.461 24.105 ( -0.894 0.442 -1.002) 1.414 24.171 ( -0.216 0.409 -0.848) 0.966 28.231 ( -0.757 0.387 1.370) 1.612 28.259 ( 0.096 -0.349 0.631) 0.727 32.952 ( -2.413 4.800 4.168) 6.800 33.423 ( 3.800 13.570 7.533) 15.979 36.435 ( -3.022 -1.031 1.267) 3.435 36.909 ( 2.384 1.960 -5.246) 6.087 39.641 ( -4.806 2.041 4.752) 7.060 40.284 ( -5.960 -0.116 6.248) 8.635 40.841 ( 16.571 -4.923 -6.532) 18.479 41.910 ( 3.491 4.431 -22.990) 23.672 ======================= Grid point 167 (84/165) ======================= q-point: (-0.50 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.411 ( 4.958 -0.000 -10.266) 11.401 2.558 ( -20.591 0.000 12.744) 24.216 2.820 ( 0.795 -0.000 7.244) 7.288 3.058 ( -22.249 0.000 -4.552) 22.710 3.246 ( 1.744 -0.000 3.899) 4.271 3.751 ( -3.880 0.000 14.563) 15.071 3.865 ( 13.561 -0.000 9.328) 16.459 3.912 ( -13.028 0.000 -7.590) 15.078 3.915 ( -0.309 0.000 -2.918) 2.934 4.142 ( 7.927 -0.000 2.107) 8.202 4.360 ( 0.302 -0.000 3.622) 3.634 4.538 ( 8.614 -0.000 2.783) 9.053 4.579 ( 11.888 -0.000 6.319) 13.463 4.636 ( 5.084 -0.000 -2.053) 5.483 4.882 ( -0.163 0.000 9.291) 9.293 5.122 ( 2.474 -0.000 0.177) 2.480 5.292 ( -1.323 0.000 2.381) 2.723 5.482 ( -2.270 0.000 5.546) 5.993 5.765 ( 1.642 -0.000 0.652) 1.767 5.771 ( -5.269 0.000 -9.153) 10.561 5.785 ( -4.922 0.000 3.667) 6.138 5.870 ( -0.752 0.000 -6.344) 6.388 5.897 ( 2.018 -0.000 5.603) 5.955 6.129 ( -2.621 0.000 -3.587) 4.443 6.283 ( -4.324 0.000 0.877) 4.412 6.584 ( 4.784 -0.000 -3.770) 6.091 6.749 ( 9.721 -0.000 0.682) 9.744 6.861 ( 2.571 -0.000 -0.100) 2.573 6.977 ( -5.268 0.000 0.894) 5.343 7.220 ( 0.604 -0.000 -2.520) 2.591 7.298 ( -4.045 0.000 1.521) 4.322 7.373 ( 9.622 -0.000 -14.891) 17.730 7.388 ( -2.963 0.000 15.614) 15.893 7.460 ( -1.999 0.000 -0.137) 2.003 7.644 ( 5.622 -0.000 4.235) 7.038 7.812 ( -3.123 0.000 -4.034) 5.102 8.038 ( 1.629 -0.000 -1.357) 2.120 8.132 ( 1.291 -0.000 -1.175) 1.746 8.275 ( -4.935 0.000 -2.887) 5.717 8.426 ( -5.532 0.000 1.328) 5.690 8.598 ( -11.001 0.000 4.102) 11.741 9.003 ( 2.829 -0.000 -11.836) 12.170 13.404 ( 5.104 -0.000 -1.039) 5.208 13.404 ( 1.295 -0.000 -0.679) 1.462 14.559 ( 2.875 -0.000 2.396) 3.743 14.859 ( -1.928 0.000 -1.254) 2.300 17.386 ( -0.546 0.000 -0.147) 0.565 17.397 ( -1.184 0.000 0.031) 1.184 17.623 ( -5.732 0.000 1.046) 5.827 17.703 ( 5.720 -0.000 -0.563) 5.748 21.200 ( -2.932 0.000 0.329) 2.951 21.360 ( 1.757 -0.000 -1.311) 2.192 21.751 ( -1.691 0.000 0.761) 1.854 21.837 ( -0.804 0.000 -1.025) 1.303 24.105 ( -0.173 0.000 -0.437) 0.470 24.187 ( 1.015 -0.000 -1.653) 1.940 28.194 ( -0.845 0.000 0.873) 1.215 28.257 ( 0.993 -0.000 -0.400) 1.071 33.342 ( -9.491 0.000 8.153) 12.512 33.739 ( 14.676 -0.000 4.548) 15.364 36.426 ( -2.910 0.000 3.370) 4.453 36.889 ( 5.258 -0.000 -3.153) 6.130 39.572 ( 8.966 -0.000 9.549) 13.099 40.265 ( -1.152 0.000 6.076) 6.185 40.500 ( -1.794 0.000 -9.508) 9.676 42.412 ( 2.090 -0.000 -23.738) 23.830 ======================= Grid point 168 (85/165) ======================= q-point: (-0.38 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( -23.103 -6.118 8.049) 25.218 2.493 ( 6.371 1.790 -0.713) 6.656 2.741 ( -27.497 -3.576 -2.176) 27.813 2.829 ( 1.938 4.315 1.701) 5.027 3.237 ( 2.094 5.111 4.293) 6.995 3.641 ( -7.893 5.225 -7.799) 12.265 3.783 ( -3.607 -0.724 13.551) 14.041 3.965 ( -0.274 -3.519 -0.029) 3.530 4.035 ( 5.756 2.411 13.037) 14.454 4.352 ( 3.005 4.364 0.893) 5.373 4.387 ( 10.399 -9.884 5.040) 15.206 4.589 ( 9.024 4.916 4.215) 11.107 4.666 ( 6.367 0.688 -3.249) 7.181 4.771 ( 3.125 -2.890 0.567) 4.293 4.959 ( -3.396 -6.726 6.661) 10.057 5.145 ( -3.155 3.727 1.320) 5.058 5.220 ( -0.355 2.768 1.082) 2.993 5.463 ( -10.274 -6.237 4.613) 12.874 5.566 ( -2.293 8.969 -2.253) 9.528 5.747 ( -2.894 -7.672 0.314) 8.205 5.838 ( -1.347 -2.463 1.482) 3.175 5.874 ( 6.542 3.856 -5.200) 9.204 6.006 ( -0.557 0.142 5.686) 5.715 6.115 ( 6.513 -4.576 -1.048) 8.029 6.300 ( 2.780 -1.563 -3.250) 4.554 6.621 ( 1.268 0.406 -3.995) 4.211 6.793 ( 1.734 2.792 -4.794) 5.812 6.891 ( -0.016 0.612 0.865) 1.060 6.926 ( 2.223 4.172 1.839) 5.073 7.144 ( -0.858 3.508 3.629) 5.119 7.238 ( -2.615 4.764 1.619) 5.671 7.328 ( -1.129 2.773 -5.304) 6.090 7.423 ( 0.925 -1.662 -4.042) 4.467 7.502 ( -0.996 -6.526 7.145) 9.728 7.754 ( 2.454 1.498 -3.410) 4.461 7.803 ( -0.643 -6.259 2.776) 6.877 7.998 ( 1.870 6.003 -2.144) 6.643 8.119 ( -1.700 0.354 -1.709) 2.436 8.202 ( -0.404 1.014 -2.565) 2.788 8.406 ( 4.299 5.246 3.847) 7.797 8.555 ( -6.184 -6.972 1.370) 9.420 9.030 ( -1.359 -7.418 -11.420) 13.685 13.368 ( -1.320 4.012 -0.988) 4.337 13.434 ( 1.205 0.782 -0.230) 1.455 14.618 ( 3.108 -1.249 3.378) 4.757 14.821 ( -1.137 1.464 -1.936) 2.680 17.365 ( -1.143 1.264 -0.332) 1.736 17.377 ( -1.579 0.303 -0.278) 1.631 17.585 ( -2.314 -0.932 0.242) 2.506 17.794 ( 5.376 -3.196 0.416) 6.268 21.160 ( -2.778 0.679 0.291) 2.875 21.389 ( 2.161 -1.201 -1.157) 2.729 21.735 ( -1.077 0.358 0.795) 1.386 21.829 ( -0.668 -0.718 -1.163) 1.522 24.105 ( -0.011 -0.319 -0.582) 0.664 24.185 ( -0.257 -0.111 -1.476) 1.502 28.192 ( -0.939 -0.680 0.774) 1.394 28.268 ( 1.123 0.177 -0.089) 1.141 33.231 ( -10.132 2.795 5.922) 12.064 33.892 ( 14.664 6.713 7.299) 17.702 36.406 ( -3.592 -0.684 2.798) 4.604 36.936 ( 4.829 0.317 -2.594) 5.491 39.723 ( 8.593 1.654 11.660) 14.579 40.295 ( -0.181 -1.084 5.998) 6.098 40.448 ( 0.176 -2.346 -10.673) 10.929 42.282 ( -1.675 3.026 -25.935) 26.165 ======================= Grid point 169 (86/165) ======================= q-point: (-0.25 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.257 ( -18.618 -8.295 11.246) 23.279 2.351 ( -20.118 0.101 -5.545) 20.868 2.624 ( 3.992 3.713 0.537) 5.479 2.867 ( 1.771 -4.001 4.122) 6.011 3.202 ( 3.183 2.557 0.767) 4.154 3.493 ( -1.604 2.911 -4.573) 5.653 3.834 ( -1.209 -0.840 12.682) 12.767 3.963 ( -6.662 0.545 3.541) 7.565 4.055 ( -1.018 3.765 14.454) 14.971 4.336 ( 4.348 2.306 -5.121) 7.102 4.529 ( -3.070 3.561 2.419) 5.288 4.664 ( 2.534 -1.621 -1.255) 3.260 4.702 ( 9.163 7.335 4.225) 12.475 4.829 ( -1.114 -5.959 4.897) 7.793 4.932 ( -7.156 4.653 -0.758) 8.570 5.060 ( -6.831 -9.634 4.111) 12.505 5.245 ( 2.900 -0.142 3.417) 4.484 5.460 ( 3.621 5.865 -3.884) 7.911 5.524 ( -10.803 -13.077 0.883) 16.985 5.755 ( -3.426 4.530 -4.486) 7.238 5.882 ( 5.274 1.635 1.243) 5.660 5.888 ( 2.239 -8.561 2.116) 9.099 6.142 ( 14.898 -0.669 2.920) 15.196 6.270 ( 1.115 -0.270 2.242) 2.518 6.318 ( 3.649 -5.234 -5.526) 8.441 6.506 ( -1.905 9.435 1.135) 9.692 6.669 ( -9.721 2.965 -6.386) 12.003 6.868 ( 3.830 4.736 2.671) 6.651 6.952 ( 8.894 2.890 -3.655) 10.040 7.030 ( -6.172 6.737 0.632) 9.159 7.213 ( -1.707 -1.261 1.906) 2.852 7.301 ( 0.764 -2.421 -0.738) 2.644 7.433 ( -0.875 -2.592 -6.289) 6.858 7.632 ( 0.225 -4.286 7.969) 9.051 7.723 ( 1.780 3.500 -3.356) 5.165 7.826 ( 0.319 2.799 1.162) 3.047 7.972 ( 0.599 -2.536 0.068) 2.607 8.152 ( 3.230 -2.835 -1.710) 4.625 8.179 ( 0.986 1.249 -0.794) 1.778 8.391 ( 5.595 2.732 3.434) 7.110 8.653 ( 2.891 -5.348 -0.393) 6.093 9.060 ( -7.516 -8.060 -10.525) 15.239 13.243 ( -4.291 6.412 -1.374) 7.837 13.412 ( -2.109 1.379 1.021) 2.719 14.685 ( 2.253 -0.027 3.860) 4.470 14.785 ( 0.445 0.514 -1.766) 1.892 17.325 ( -0.829 1.617 -1.015) 2.082 17.351 ( -1.555 0.302 -0.513) 1.665 17.591 ( 0.114 -1.007 0.175) 1.029 17.926 ( 5.088 -4.996 0.639) 7.160 21.124 ( -2.523 0.084 0.990) 2.712 21.434 ( 2.566 -1.529 -1.280) 3.250 21.724 ( -0.506 0.240 0.724) 0.916 21.834 ( -0.122 -1.171 -1.228) 1.701 24.106 ( -0.188 -0.212 -0.876) 0.921 24.173 ( -0.990 -0.179 -1.059) 1.461 28.201 ( -0.875 -1.261 0.886) 1.772 28.275 ( 0.779 0.528 0.320) 0.994 33.089 ( -8.345 3.488 4.207) 9.975 33.907 ( 10.359 15.374 8.964) 20.592 36.393 ( -2.804 -1.299 2.278) 3.839 36.961 ( 3.550 1.387 -3.118) 4.924 39.769 ( 1.677 5.949 8.252) 10.310 40.284 ( -6.081 0.058 5.622) 8.282 40.596 ( 14.181 -9.646 -7.437) 18.694 42.062 ( -4.807 4.412 -27.279) 28.048 ======================= Grid point 170 (87/165) ======================= q-point: (-0.12 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( -20.396 -5.989 -3.392) 21.527 2.266 ( 0.229 1.973 7.160) 7.431 2.646 ( 10.599 4.713 4.842) 12.569 2.891 ( -9.673 -2.998 3.246) 10.634 3.330 ( 8.989 -8.604 -5.398) 13.564 3.444 ( 2.698 5.052 1.333) 5.881 3.835 ( -17.650 -6.241 14.258) 23.532 3.898 ( 5.578 6.270 5.288) 9.919 4.073 ( 1.744 3.101 9.977) 10.592 4.261 ( -0.311 6.179 -12.530) 13.975 4.389 ( -13.413 0.021 5.546) 14.515 4.586 ( -5.687 4.926 8.108) 11.061 4.675 ( 2.520 0.584 1.523) 3.002 4.929 ( 4.578 -1.815 5.102) 7.091 4.992 ( -5.126 -7.571 0.072) 9.143 5.105 ( -5.227 -3.986 2.354) 6.983 5.280 ( -0.899 1.560 -1.848) 2.580 5.377 ( 3.763 4.473 0.878) 5.911 5.601 ( -7.293 -11.121 -3.471) 13.745 5.685 ( 2.297 4.440 1.646) 5.263 5.934 ( 5.282 -2.625 -4.755) 7.576 6.053 ( 4.800 -3.529 1.660) 6.185 6.199 ( 1.628 1.678 -2.442) 3.380 6.308 ( 4.025 -0.209 0.357) 4.046 6.341 ( 1.982 8.396 -0.078) 8.627 6.400 ( -8.351 -0.431 -7.766) 11.413 6.624 ( 3.963 -7.626 7.589) 11.466 6.785 ( 0.870 12.170 -9.229) 15.299 6.863 ( 5.196 7.465 6.347) 11.091 6.980 ( 0.241 1.635 0.488) 1.723 7.227 ( 0.006 -0.670 1.171) 1.349 7.329 ( -1.842 -1.661 -3.993) 4.701 7.470 ( -0.895 -4.787 -0.362) 4.883 7.593 ( -3.609 5.796 1.855) 7.075 7.696 ( 1.954 -0.629 -1.284) 2.421 7.888 ( 2.257 -1.901 4.908) 5.727 8.006 ( 0.741 -0.712 -0.811) 1.309 8.149 ( -1.058 2.487 0.494) 2.748 8.208 ( 4.672 -0.197 -2.285) 5.205 8.579 ( 10.899 -9.701 2.005) 14.728 8.763 ( 7.758 -2.454 -1.476) 8.269 8.996 ( -12.765 -4.460 -8.837) 16.153 13.089 ( -4.019 4.924 -1.630) 6.562 13.358 ( -3.946 1.497 2.246) 4.781 14.674 ( 0.650 3.726 1.060) 3.928 14.823 ( 1.437 -2.451 1.708) 3.315 17.295 ( 0.617 1.211 -1.510) 2.032 17.332 ( -0.871 -0.164 -0.618) 1.080 17.611 ( 1.066 -0.260 0.346) 1.150 18.049 ( 2.575 -3.793 0.011) 4.584 21.111 ( -2.082 -1.104 1.878) 3.013 21.479 ( 2.378 -1.056 -1.357) 2.935 21.724 ( -0.059 -0.459 0.447) 0.643 21.849 ( 0.509 -1.035 -1.197) 1.662 24.097 ( -0.331 0.179 -1.043) 1.108 24.163 ( -0.775 -0.270 -0.637) 1.040 28.216 ( -0.808 -1.250 1.074) 1.836 28.272 ( 0.164 0.816 0.660) 1.062 32.985 ( -4.103 1.878 2.966) 5.400 33.742 ( 1.982 18.681 9.440) 21.024 36.404 ( -0.461 -1.185 2.290) 2.619 36.949 ( 2.204 2.305 -4.315) 5.366 39.682 ( -2.688 6.347 3.640) 7.795 40.243 ( -5.511 -0.251 7.360) 9.198 40.888 ( 12.472 -6.987 -7.854) 16.311 41.856 ( -0.651 -0.257 -24.994) 25.004 ======================= Grid point 176 (88/165) ======================= q-point: (-0.38 -0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( -29.919 0.000 7.938) 30.954 2.302 ( -34.165 0.000 -6.412) 34.762 2.644 ( 12.295 -0.000 2.923) 12.638 2.925 ( 5.175 -0.000 1.778) 5.472 3.330 ( 2.660 -0.000 4.471) 5.203 3.463 ( -13.343 0.000 -7.830) 15.470 3.710 ( -12.233 0.000 17.494) 21.347 4.017 ( 6.911 -0.000 -0.471) 6.927 4.292 ( 4.833 -0.000 14.633) 15.411 4.416 ( 11.155 -0.000 1.960) 11.326 4.483 ( 3.723 -0.000 8.419) 9.205 4.621 ( -1.823 0.000 -6.136) 6.401 4.735 ( 4.775 -0.000 -4.502) 6.562 4.808 ( 3.281 -0.000 1.952) 3.818 4.896 ( -3.119 0.000 7.780) 8.382 5.175 ( -20.403 0.000 6.223) 21.331 5.195 ( 3.464 -0.000 0.466) 3.495 5.333 ( 6.313 -0.000 -0.239) 6.317 5.611 ( -5.114 0.000 -3.633) 6.274 5.652 ( -5.100 0.000 -1.096) 5.217 5.656 ( -2.750 0.000 3.514) 4.462 6.025 ( 11.211 -0.000 -7.530) 13.505 6.080 ( 6.533 -0.000 4.265) 7.802 6.226 ( 9.488 -0.000 2.787) 9.889 6.296 ( 4.414 -0.000 0.362) 4.428 6.641 ( 4.197 -0.000 -5.498) 6.917 6.684 ( -12.682 0.000 -6.667) 14.328 6.976 ( 2.959 -0.000 0.413) 2.988 6.991 ( 7.000 -0.000 -0.771) 7.042 7.143 ( -6.614 0.000 -0.810) 6.663 7.225 ( -4.144 0.000 -0.203) 4.149 7.302 ( -8.590 0.000 1.935) 8.805 7.405 ( 2.939 -0.000 -9.181) 9.640 7.498 ( 3.953 -0.000 13.121) 13.703 7.760 ( 0.817 -0.000 1.372) 1.596 7.809 ( 5.231 -0.000 -0.661) 5.273 8.053 ( -0.752 0.000 0.384) 0.845 8.138 ( -1.537 0.000 -4.686) 4.931 8.170 ( 2.424 -0.000 -0.671) 2.515 8.348 ( -11.962 0.000 2.169) 12.157 8.608 ( 14.789 -0.000 2.658) 15.026 8.920 ( -0.470 0.000 -10.912) 10.922 13.370 ( -3.028 0.000 -1.966) 3.610 13.434 ( -2.624 0.000 1.055) 2.828 14.655 ( 2.331 -0.000 3.909) 4.551 14.820 ( 0.412 -0.000 -2.785) 2.815 17.350 ( -2.309 0.000 -0.296) 2.328 17.367 ( -0.977 0.000 0.168) 0.992 17.569 ( 1.667 -0.000 -1.763) 2.426 17.828 ( 4.127 -0.000 1.473) 4.383 21.130 ( -2.901 0.000 -0.298) 2.917 21.403 ( 2.429 -0.000 -0.591) 2.500 21.733 ( -0.402 0.000 0.884) 0.971 21.809 ( -0.616 0.000 -1.153) 1.308 24.101 ( 0.240 -0.000 -0.731) 0.770 24.169 ( -1.290 0.000 -1.124) 1.710 28.179 ( -0.849 0.000 0.615) 1.048 28.282 ( 1.038 -0.000 -0.129) 1.046 33.147 ( -10.951 0.000 4.062) 11.680 34.192 ( 19.024 -0.000 10.134) 21.555 36.370 ( -3.589 0.000 2.839) 4.576 36.986 ( 4.228 -0.000 -1.330) 4.432 39.918 ( 9.587 -0.000 15.105) 17.890 40.320 ( 1.767 -0.000 4.604) 4.931 40.346 ( -2.147 0.000 -14.166) 14.328 42.139 ( -6.188 0.000 -29.601) 30.241 ======================= Grid point 177 (89/165) ======================= q-point: (-0.25 -0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( -26.269 -15.650 10.048) 32.186 1.912 ( -32.848 -7.490 -6.947) 34.400 2.772 ( 6.751 2.334 5.474) 8.999 2.957 ( 5.858 4.471 -0.138) 7.371 3.299 ( 1.525 2.942 -5.301) 6.252 3.411 ( -0.855 -3.488 3.606) 5.089 3.673 ( -15.156 -4.211 16.831) 23.038 3.995 ( -9.585 1.904 3.322) 10.321 4.285 ( -0.285 5.190 12.762) 13.780 4.439 ( -0.711 6.716 3.493) 7.604 4.513 ( -5.119 5.746 -2.204) 8.005 4.617 ( 4.145 -4.565 -2.890) 6.810 4.745 ( 0.137 -2.923 0.059) 2.927 4.824 ( -7.108 -2.599 -3.793) 8.466 4.949 ( 6.646 1.791 7.595) 10.250 5.053 ( 5.217 7.587 4.094) 10.077 5.223 ( -8.346 -0.734 4.870) 9.691 5.349 ( 5.953 -0.430 -1.347) 6.119 5.531 ( 3.277 -0.652 -0.998) 3.487 5.693 ( -2.965 -4.592 -4.670) 7.189 5.789 ( 6.820 -10.138 0.267) 12.222 6.031 ( 6.240 7.034 1.771) 9.568 6.220 ( 4.434 -5.066 1.854) 6.983 6.329 ( 4.930 0.959 2.889) 5.795 6.349 ( 5.854 2.479 -5.402) 8.343 6.503 ( -9.568 -0.663 -3.909) 10.357 6.636 ( 1.459 4.558 -4.478) 6.554 6.909 ( -3.900 3.145 -4.500) 6.734 7.054 ( 1.991 -0.067 -0.785) 2.142 7.095 ( 1.767 1.543 0.519) 2.403 7.201 ( -2.256 1.068 2.060) 3.236 7.225 ( -2.453 -4.183 0.343) 4.861 7.393 ( 1.114 1.564 -4.647) 5.028 7.639 ( 3.311 -3.017 10.585) 11.494 7.773 ( 0.266 1.574 -2.161) 2.686 7.837 ( 0.151 0.520 1.607) 1.696 8.015 ( -0.236 4.941 -1.084) 5.064 8.079 ( 0.034 -4.982 -0.250) 4.988 8.236 ( 2.579 1.437 2.083) 3.613 8.309 ( -7.666 -8.637 1.039) 11.595 8.773 ( 15.900 3.043 -2.548) 16.388 8.897 ( -0.321 -2.335 -7.021) 7.406 13.274 ( -4.735 4.946 -2.601) 7.324 13.388 ( -5.285 0.397 2.045) 5.680 14.709 ( 1.074 -1.783 4.456) 4.918 14.805 ( 1.641 1.647 -3.067) 3.849 17.323 ( -1.541 0.179 -0.646) 1.680 17.348 ( -0.632 1.053 0.113) 1.234 17.600 ( 3.929 -0.158 -2.045) 4.432 17.908 ( 3.144 -3.768 1.438) 5.114 21.096 ( -2.549 -0.042 0.349) 2.573 21.438 ( 2.414 -1.071 -0.583) 2.704 21.730 ( -0.037 0.590 0.856) 1.040 21.809 ( 0.020 -1.181 -1.074) 1.596 24.101 ( 0.204 0.070 -0.964) 0.988 24.149 ( -1.628 -0.386 -0.677) 1.805 28.179 ( -0.599 -0.748 0.704) 1.189 28.289 ( 0.441 0.241 0.002) 0.503 33.029 ( -9.715 0.768 2.769) 10.131 34.356 ( 17.306 15.195 11.084) 25.559 36.357 ( -1.896 -1.434 2.732) 3.621 37.012 ( 2.715 1.441 -1.531) 3.434 39.960 ( 2.447 10.833 6.662) 12.951 40.241 ( -5.245 0.379 3.291) 6.204 40.529 ( 11.445 -13.967 -6.567) 19.214 41.885 ( -11.177 1.067 -32.810) 34.678 ======================= Grid point 178 (90/165) ======================= q-point: (-0.12 -0.38 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( -25.800 -12.991 -1.289) 28.915 2.031 ( -10.859 -27.529 8.418) 30.767 2.780 ( -3.359 3.779 5.532) 7.494 2.878 ( -0.211 6.429 -1.198) 6.543 3.343 ( 9.485 -1.608 -7.873) 12.431 3.502 ( 1.998 -3.853 6.408) 7.740 3.588 ( -15.662 -1.927 15.261) 21.952 3.895 ( -20.918 -10.127 9.854) 25.243 4.215 ( -12.457 9.116 -0.130) 15.437 4.266 ( 1.900 5.943 5.444) 8.280 4.387 ( 8.971 10.479 -4.210) 14.423 4.669 ( -1.861 6.938 5.308) 8.932 4.710 ( 3.233 -0.549 -2.770) 4.292 4.821 ( -6.885 -4.895 1.055) 8.513 5.000 ( -1.280 -0.367 7.004) 7.129 5.061 ( 5.304 -0.617 0.833) 5.404 5.174 ( -3.076 -1.588 1.772) 3.889 5.430 ( 4.636 1.733 -8.455) 9.797 5.582 ( 5.119 0.678 3.012) 5.978 5.764 ( 6.773 -3.410 -2.071) 7.861 5.979 ( 4.068 4.159 -0.107) 5.819 6.055 ( 6.784 -6.702 3.552) 10.176 6.144 ( -11.519 1.294 -5.239) 12.721 6.331 ( 2.027 3.852 -5.105) 6.708 6.384 ( 0.346 2.644 0.365) 2.691 6.505 ( 2.141 4.700 -1.397) 5.350 6.548 ( 3.530 -4.675 5.268) 7.879 6.859 ( -0.515 -1.355 -6.443) 6.604 7.028 ( 0.273 3.155 2.526) 4.051 7.068 ( 2.394 5.997 -0.197) 6.460 7.190 ( 1.227 0.136 -0.776) 1.458 7.325 ( -2.658 -5.025 -2.530) 6.223 7.365 ( 4.626 0.126 -0.517) 4.657 7.626 ( -5.415 3.988 2.141) 7.058 7.738 ( 0.927 3.341 1.318) 3.709 7.877 ( -0.739 -4.148 5.347) 6.808 7.994 ( -1.274 -1.490 0.451) 2.012 8.140 ( -1.827 -0.894 0.212) 2.045 8.252 ( 2.125 0.681 1.686) 2.797 8.394 ( -5.348 -10.053 -0.576) 11.401 8.836 ( 1.352 -1.129 -8.342) 8.526 8.980 ( 20.075 1.074 -0.903) 20.124 13.117 ( -3.894 5.499 -2.542) 7.202 13.325 ( -5.746 0.318 2.679) 6.348 14.741 ( 0.408 2.153 2.127) 3.054 14.804 ( 0.957 -1.565 0.019) 1.834 17.308 ( 0.180 0.030 -1.206) 1.220 17.329 ( 0.281 0.919 0.021) 0.962 17.636 ( 3.612 0.469 -0.908) 3.754 18.005 ( 0.766 -4.090 -0.026) 4.161 21.081 ( -1.665 -0.724 1.750) 2.522 21.482 ( 1.965 -1.274 -0.893) 2.506 21.724 ( -0.078 0.360 0.573) 0.681 21.833 ( 1.007 -1.476 -1.007) 2.051 24.094 ( 0.053 0.136 -0.929) 0.940 24.142 ( -0.864 -0.775 -0.499) 1.263 28.193 ( -0.454 -1.203 0.906) 1.573 28.285 ( -0.222 0.527 0.356) 0.673 32.941 ( -6.270 -0.768 2.129) 6.666 34.162 ( 1.002 28.281 10.124) 30.055 36.404 ( 2.587 -2.174 2.537) 4.226 36.990 ( 0.975 2.514 -3.325) 4.281 39.798 ( -1.041 9.773 0.197) 9.831 40.211 ( -5.360 -0.269 8.799) 10.306 40.846 ( 8.229 -9.405 -7.931) 14.801 41.647 ( -6.249 -6.942 -30.818) 32.203 ======================= Grid point 185 (91/165) ======================= q-point: (-0.25 -0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.372 ( -28.208 0.000 13.428) 31.241 1.419 ( -34.374 0.000 -3.947) 34.600 2.817 ( -6.560 0.000 5.201) 8.371 3.057 ( 3.569 -0.000 -4.100) 5.436 3.292 ( 4.364 -0.000 -1.751) 4.703 3.492 ( 5.154 -0.000 5.227) 7.341 3.553 ( -8.587 0.000 11.255) 14.157 3.661 ( -43.958 0.000 18.185) 47.571 4.362 ( 2.817 -0.000 7.174) 7.707 4.537 ( -7.258 0.000 -0.333) 7.266 4.555 ( 1.970 -0.000 -6.838) 7.117 4.617 ( 4.116 -0.000 -5.388) 6.780 4.659 ( 2.007 -0.000 -4.149) 4.609 4.774 ( 4.253 -0.000 -1.418) 4.483 5.010 ( -4.375 0.000 13.316) 14.016 5.239 ( -3.986 0.000 1.634) 4.308 5.294 ( 15.756 -0.000 1.914) 15.871 5.414 ( 9.594 -0.000 -3.355) 10.163 5.486 ( -1.903 0.000 1.126) 2.211 5.652 ( 2.228 -0.000 -1.872) 2.910 5.789 ( 12.175 -0.000 2.097) 12.355 6.199 ( 4.836 -0.000 2.748) 5.562 6.225 ( -13.895 0.000 -5.015) 14.773 6.242 ( 5.272 -0.000 1.409) 5.457 6.441 ( 5.019 -0.000 -2.354) 5.543 6.470 ( 3.324 -0.000 0.544) 3.368 6.663 ( 2.598 -0.000 -7.934) 8.348 6.878 ( -8.049 0.000 -6.017) 10.049 6.980 ( -1.979 0.000 -0.691) 2.096 7.121 ( -1.157 0.000 2.255) 2.534 7.171 ( 4.548 -0.000 2.545) 5.212 7.258 ( 2.095 -0.000 4.157) 4.654 7.415 ( 2.891 -0.000 -3.482) 4.526 7.697 ( 2.401 -0.000 8.642) 8.969 7.746 ( -6.368 0.000 0.414) 6.381 7.851 ( 0.884 -0.000 -5.604) 5.673 7.970 ( -5.262 0.000 0.772) 5.319 8.071 ( -9.203 0.000 3.144) 9.725 8.170 ( 4.713 -0.000 -1.075) 4.834 8.304 ( 3.274 -0.000 8.002) 8.646 8.839 ( 1.778 -0.000 -8.498) 8.682 9.011 ( 16.738 -0.000 -1.158) 16.778 13.246 ( -4.852 0.000 -3.807) 6.168 13.325 ( -6.939 0.000 2.494) 7.374 14.709 ( -1.334 0.000 4.521) 4.713 14.834 ( 3.017 -0.000 -3.521) 4.637 17.306 ( -0.835 0.000 -0.618) 1.038 17.352 ( -0.429 0.000 0.639) 0.770 17.658 ( 7.220 -0.000 -3.506) 8.026 17.907 ( 1.172 -0.000 1.866) 2.204 21.072 ( -1.852 0.000 1.189) 2.201 21.453 ( 1.913 -0.000 -0.215) 1.925 21.746 ( 0.641 -0.000 1.128) 1.298 21.793 ( 0.126 -0.000 -1.032) 1.040 24.103 ( 0.629 -0.000 -1.099) 1.266 24.120 ( -2.024 0.000 -0.273) 2.042 28.171 ( -0.232 0.000 0.683) 0.721 28.292 ( -0.230 0.000 -0.211) 0.313 32.928 ( -9.199 0.000 1.891) 9.391 34.813 ( 25.584 -0.000 8.196) 26.865 36.329 ( -1.800 0.000 2.959) 3.463 37.044 ( 1.042 -0.000 -1.434) 1.772 40.167 ( -1.007 0.000 -18.498) 18.525 40.167 ( -2.913 0.000 18.026) 18.260 40.462 ( 9.547 -0.000 -0.906) 9.590 41.540 ( -21.415 0.000 -37.912) 43.542 ======================= Grid point 186 (92/165) ======================= q-point: (-0.12 -0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( -25.860 -12.328 3.846) 28.905 1.428 ( -15.507 -31.101 16.280) 38.377 2.739 ( -10.149 -0.938 4.719) 11.232 2.890 ( -23.159 5.259 2.199) 23.850 3.266 ( -24.150 -4.125 14.844) 28.645 3.366 ( -6.449 -6.175 6.887) 11.276 3.584 ( 4.908 -0.753 -0.477) 4.989 3.653 ( 9.487 -0.560 5.912) 11.192 4.263 ( -6.835 9.268 -9.676) 15.041 4.390 ( 1.124 5.111 3.454) 6.270 4.584 ( -5.125 -0.224 -2.700) 5.797 4.627 ( 0.850 -2.223 -8.606) 8.930 4.710 ( 3.477 -2.289 1.843) 4.553 4.817 ( 5.073 4.852 4.969) 8.601 4.962 ( -8.150 4.528 9.301) 13.169 5.141 ( 4.158 3.342 3.020) 6.130 5.388 ( 14.534 6.268 -3.554) 16.222 5.475 ( 4.530 3.218 -6.028) 8.198 5.576 ( 0.194 -5.522 3.110) 6.341 5.762 ( 9.234 -5.275 -2.707) 10.974 6.018 ( -3.371 -0.799 1.505) 3.777 6.045 ( 4.958 -4.435 -0.249) 6.657 6.161 ( 0.781 9.556 5.154) 10.885 6.323 ( -3.062 -3.416 -1.654) 4.877 6.432 ( 4.445 1.934 -1.845) 5.187 6.518 ( 1.869 -0.992 1.764) 2.755 6.653 ( 1.179 3.854 -2.419) 4.700 6.775 ( 0.580 -1.605 -8.526) 8.695 6.963 ( -6.605 -2.341 -1.013) 7.080 7.144 ( 2.514 0.810 3.015) 4.008 7.230 ( 1.868 0.021 2.519) 3.136 7.331 ( 8.082 1.839 1.511) 8.425 7.431 ( 4.596 1.134 -1.592) 4.994 7.612 ( -6.931 2.422 0.331) 7.349 7.781 ( -5.582 0.059 -1.620) 5.813 7.799 ( -0.511 -2.593 6.193) 6.733 7.910 ( -8.803 -1.068 2.455) 9.201 8.070 ( -2.909 -6.018 0.398) 6.696 8.226 ( 2.192 -0.305 -1.310) 2.572 8.361 ( 0.747 1.520 9.021) 9.179 8.834 ( 4.086 0.764 -6.342) 7.583 9.206 ( 18.930 -2.817 -3.589) 19.473 13.136 ( -3.644 3.918 -3.575) 6.435 13.262 ( -6.360 -0.592 2.437) 6.837 14.723 ( -3.330 -2.524 4.510) 6.148 14.839 ( 3.440 2.231 -3.322) 5.277 17.302 ( 0.429 -0.400 -0.861) 1.042 17.348 ( 0.294 0.552 0.563) 0.841 17.711 ( 6.513 2.253 -2.094) 7.202 17.946 ( -1.059 -3.077 -0.282) 3.266 21.072 ( 0.071 -0.269 3.264) 3.276 21.480 ( 1.280 -0.958 -0.442) 1.659 21.741 ( 0.246 1.428 0.745) 1.629 21.816 ( 1.249 -2.011 -0.750) 2.483 24.092 ( -0.548 0.180 -0.432) 0.720 24.117 ( -0.130 -0.971 -0.764) 1.243 28.178 ( -0.098 -0.629 0.784) 1.010 28.285 ( -0.660 0.016 -0.089) 0.666 32.851 ( -6.367 -1.494 1.733) 6.765 34.748 ( 3.208 38.381 0.789) 38.523 36.397 ( 3.960 -5.891 1.815) 7.327 37.009 ( -1.875 1.953 -4.226) 5.019 39.943 ( -0.372 10.609 -7.691) 13.109 40.181 ( -6.486 -0.365 10.850) 12.646 40.730 ( 5.676 -11.099 -5.979) 13.826 41.186 ( -18.185 -15.364 -33.558) 41.145 ======================= Grid point 194 (93/165) ======================= q-point: (-0.12 -0.12 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( -7.260 0.000 25.737) 26.742 0.995 ( -15.756 0.000 23.476) 28.273 2.430 ( -56.182 0.000 23.991) 61.090 2.635 ( -7.223 0.000 4.090) 8.301 3.155 ( -3.976 0.000 -1.402) 4.216 3.253 ( -9.472 0.000 12.477) 15.665 3.728 ( 15.854 -0.000 -6.085) 16.982 3.793 ( 9.946 -0.000 3.324) 10.486 4.211 ( -3.561 0.000 -12.860) 13.344 4.450 ( -8.387 0.000 -3.841) 9.225 4.456 ( -1.549 0.000 1.103) 1.901 4.519 ( -3.232 0.000 -6.828) 7.555 4.787 ( 1.205 -0.000 6.833) 6.939 4.964 ( -5.019 0.000 9.528) 10.769 4.980 ( 8.828 -0.000 -1.158) 8.904 5.216 ( 4.207 -0.000 -0.589) 4.248 5.460 ( 6.133 -0.000 -4.830) 7.807 5.543 ( 1.450 -0.000 2.954) 3.291 5.653 ( 7.583 -0.000 -5.534) 9.388 5.818 ( 9.255 -0.000 -2.132) 9.498 6.005 ( -1.538 0.000 3.643) 3.955 6.089 ( 7.159 -0.000 0.216) 7.163 6.249 ( 1.071 -0.000 -0.556) 1.207 6.280 ( -0.857 0.000 5.407) 5.474 6.464 ( 5.095 -0.000 -5.327) 7.371 6.541 ( -0.117 0.000 7.286) 7.287 6.635 ( -4.181 0.000 -2.761) 5.010 6.760 ( 4.555 -0.000 -8.883) 9.983 6.898 ( -4.750 0.000 1.547) 4.996 7.209 ( 5.961 -0.000 0.275) 5.968 7.260 ( 0.922 -0.000 3.427) 3.549 7.485 ( -0.799 0.000 -7.580) 7.622 7.503 ( 11.003 -0.000 2.691) 11.328 7.522 ( -2.093 0.000 1.717) 2.707 7.672 ( -13.564 0.000 0.488) 13.573 7.810 ( 0.989 -0.000 7.587) 7.651 7.821 ( -4.977 0.000 2.907) 5.764 8.001 ( 0.563 -0.000 -0.004) 0.563 8.273 ( 3.812 -0.000 -0.724) 3.880 8.412 ( -2.282 0.000 9.232) 9.510 8.888 ( 6.431 -0.000 -2.992) 7.093 9.299 ( 8.932 -0.000 -2.486) 9.271 13.114 ( -2.047 0.000 -3.603) 4.144 13.192 ( -5.635 0.000 2.110) 6.017 14.668 ( -4.994 0.000 4.288) 6.583 14.890 ( 4.056 -0.000 -3.938) 5.653 17.302 ( 0.812 -0.000 -0.689) 1.065 17.356 ( -0.049 0.000 0.396) 0.399 17.816 ( 8.177 -0.000 -3.235) 8.794 17.881 ( -5.381 0.000 -0.830) 5.445 21.117 ( 4.864 -0.000 5.554) 7.383 21.481 ( 0.533 -0.000 -0.296) 0.609 21.774 ( 0.614 -0.000 1.013) 1.185 21.797 ( 0.914 -0.000 -0.846) 1.246 24.077 ( -1.640 0.000 0.194) 1.652 24.112 ( 0.958 -0.000 -1.225) 1.555 28.177 ( 0.060 -0.000 0.687) 0.690 28.273 ( -0.909 0.000 -0.369) 0.981 32.783 ( -3.921 0.000 2.053) 4.426 35.088 ( -18.481 0.000 -35.489) 40.013 36.333 ( -0.447 0.000 3.311) 3.341 36.946 ( -5.902 0.000 -7.332) 9.412 39.999 ( 4.737 -0.000 -8.759) 9.958 40.132 ( -9.362 0.000 10.354) 13.959 40.645 ( -21.545 0.000 -13.963) 25.674 40.665 ( 6.300 -0.000 -0.197) 6.303 ======================= Grid point 195 (94/165) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( 3.102 -0.000 27.771) 27.944 2.019 ( -15.372 0.000 32.719) 36.150 2.275 ( 3.415 -0.000 22.740) 22.995 2.744 ( 4.836 -0.000 4.573) 6.656 2.827 ( -10.860 0.000 0.635) 10.879 3.484 ( -2.836 0.000 15.336) 15.596 3.714 ( 1.962 -0.000 -8.538) 8.761 3.766 ( 20.319 -0.000 -22.650) 30.429 3.966 ( -16.690 0.000 -8.985) 18.955 4.021 ( -0.577 0.000 -10.093) 10.110 4.279 ( -8.487 0.000 0.972) 8.543 4.311 ( 5.936 -0.000 -5.269) 7.937 4.857 ( 6.888 -0.000 -9.204) 11.496 5.083 ( 10.632 -0.000 -20.421) 23.023 5.167 ( -13.966 0.000 20.282) 24.625 5.289 ( 0.221 -0.000 9.110) 9.113 5.435 ( -8.697 0.000 1.218) 8.782 5.617 ( -6.477 0.000 3.183) 7.217 5.734 ( 11.485 -0.000 0.922) 11.522 5.925 ( 7.504 -0.000 2.008) 7.768 5.983 ( -3.385 0.000 -0.703) 3.458 6.183 ( 2.260 -0.000 3.421) 4.100 6.239 ( -1.717 0.000 -4.535) 4.849 6.259 ( -1.214 0.000 -5.896) 6.020 6.445 ( 0.049 -0.000 -4.518) 4.519 6.470 ( 6.273 -0.000 -13.825) 15.182 6.879 ( -7.801 0.000 11.182) 13.634 6.904 ( 7.455 -0.000 1.777) 7.664 6.935 ( 7.559 -0.000 7.819) 10.875 7.174 ( -1.837 0.000 -0.051) 1.838 7.201 ( -6.862 0.000 -5.663) 8.898 7.335 ( -1.181 0.000 -2.175) 2.475 7.433 ( -5.966 0.000 3.763) 7.053 7.471 ( -5.412 0.000 -2.783) 6.086 7.661 ( 2.116 -0.000 2.470) 3.253 7.743 ( 12.862 -0.000 -1.101) 12.909 8.000 ( -1.953 0.000 3.797) 4.270 8.031 ( -0.798 0.000 2.022) 2.174 8.271 ( -4.415 0.000 -1.860) 4.790 8.348 ( -4.729 0.000 -3.698) 6.003 9.117 ( 2.125 -0.000 6.825) 7.148 9.479 ( 7.735 -0.000 -3.600) 8.532 13.109 ( -4.982 0.000 0.640) 5.023 13.145 ( 6.143 -0.000 -0.359) 6.154 14.645 ( -6.070 0.000 3.897) 7.213 14.866 ( 3.400 -0.000 -3.204) 4.672 17.314 ( -2.263 0.000 -0.531) 2.325 17.314 ( 1.491 -0.000 -0.338) 1.529 17.721 ( -8.672 0.000 3.859) 9.492 17.921 ( 6.803 -0.000 -2.472) 7.238 21.371 ( 4.790 -0.000 1.232) 4.946 21.450 ( -1.480 0.000 -1.268) 1.949 21.775 ( -1.175 0.000 0.338) 1.223 21.808 ( 1.590 -0.000 -0.633) 1.711 24.051 ( -1.156 0.000 0.366) 1.213 24.104 ( 1.283 -0.000 -1.226) 1.775 28.197 ( -0.200 0.000 0.985) 1.005 28.244 ( -0.175 0.000 -0.638) 0.661 32.914 ( 7.225 -0.000 6.275) 9.570 33.228 ( -37.909 0.000 -3.508) 38.071 36.432 ( -0.853 0.000 4.646) 4.724 36.750 ( 1.085 -0.000 -6.021) 6.118 40.026 ( -16.093 0.000 5.381) 16.969 40.313 ( 6.491 -0.000 -4.248) 7.757 40.690 ( -3.509 0.000 -1.262) 3.729 40.795 ( 35.925 -0.000 -3.878) 36.134 ======================= Grid point 196 (95/165) ======================= q-point: ( 0.12 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 1.863 5.854 24.175) 24.943 2.040 ( -6.459 -9.422 29.344) 31.489 2.485 ( -3.566 -4.389 -2.686) 6.261 2.851 ( 7.544 -4.332 6.971) 11.148 2.944 ( 9.900 -9.604 11.605) 18.026 3.513 ( -0.535 2.614 12.471) 12.753 3.628 ( 2.094 2.985 0.128) 3.648 3.764 ( -1.192 -4.031 -20.547) 20.973 3.951 ( 4.061 -0.315 -7.875) 8.866 4.000 ( 1.256 -3.757 -3.059) 5.005 4.259 ( -7.994 -8.252 1.619) 11.602 4.388 ( 8.988 -3.247 -8.956) 13.097 4.809 ( 2.357 5.692 -8.866) 10.796 5.078 ( -9.132 1.388 15.163) 17.755 5.169 ( 1.381 -4.601 -11.367) 12.340 5.329 ( -6.260 0.477 7.218) 9.566 5.341 ( 2.683 1.321 3.298) 4.451 5.515 ( -9.516 1.561 0.048) 9.643 5.780 ( 2.630 3.514 -3.482) 5.603 5.946 ( -0.428 1.306 -0.291) 1.405 5.980 ( 3.475 3.421 1.983) 5.264 6.079 ( 0.241 7.286 -0.459) 7.305 6.195 ( 2.883 2.845 -2.009) 4.521 6.327 ( -0.614 -3.797 -4.267) 5.745 6.409 ( -0.741 1.622 -5.777) 6.046 6.448 ( 1.897 2.187 -11.853) 12.202 6.757 ( -9.558 4.683 6.968) 12.721 6.849 ( -4.441 3.052 5.333) 7.582 7.055 ( -5.439 -0.428 7.415) 9.206 7.067 ( -11.593 -3.204 -4.933) 13.000 7.213 ( 2.904 2.196 1.036) 3.785 7.371 ( 3.407 3.866 2.647) 5.793 7.385 ( 4.889 -7.198 0.025) 8.701 7.502 ( 0.105 -2.129 0.316) 2.155 7.682 ( 5.023 2.300 3.315) 6.443 7.848 ( 2.289 7.355 0.753) 7.739 7.993 ( 9.977 -3.007 -1.688) 10.556 8.051 ( -0.304 -0.456 0.928) 1.078 8.219 ( -7.849 -0.731 -1.787) 8.082 8.279 ( 1.383 -0.427 0.402) 1.502 9.124 ( -0.783 2.888 5.418) 6.190 9.520 ( 0.185 0.562 -7.932) 7.954 13.059 ( -3.937 -0.087 -0.154) 3.941 13.221 ( 4.508 -1.386 0.209) 4.721 14.602 ( -5.306 -0.923 3.361) 6.349 14.882 ( 2.587 0.786 -1.487) 3.086 17.285 ( -1.386 0.545 -0.491) 1.568 17.333 ( 1.429 -0.205 -0.342) 1.483 17.651 ( -6.716 -0.685 3.721) 7.709 17.987 ( 5.041 -0.960 -1.916) 5.478 21.375 ( -0.771 3.351 1.240) 3.655 21.433 ( 0.119 -0.388 -1.467) 1.522 21.765 ( 0.640 0.507 0.222) 0.846 21.829 ( 1.160 -0.582 -0.959) 1.614 24.052 ( -0.742 -1.192 0.034) 1.405 24.118 ( 1.116 -0.562 -1.055) 1.635 28.205 ( -0.179 -0.701 1.257) 1.450 28.251 ( 0.031 -1.026 -0.742) 1.266 32.914 ( -15.170 -1.129 4.024) 15.735 33.080 ( 9.726 -2.885 9.003) 13.564 36.458 ( -1.574 -1.845 3.848) 4.549 36.738 ( 0.922 -0.414 -5.923) 6.008 39.843 ( -15.141 1.534 4.441) 15.854 40.380 ( 3.636 -1.503 -0.105) 3.935 40.637 ( -1.335 -0.831 -4.657) 4.915 41.217 ( 31.799 -3.174 -13.604) 34.732 ======================= Grid point 197 (96/165) ======================= q-point: ( 0.25 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( 3.560 -1.562 15.357) 15.841 2.326 ( 7.175 -8.453 21.291) 24.005 2.465 ( 1.159 -0.449 -1.348) 1.834 2.984 ( 1.178 -3.646 4.681) 6.049 3.121 ( -0.489 -3.241 -8.536) 9.143 3.564 ( 3.606 2.407 5.575) 7.062 3.742 ( 1.260 -7.383 -7.902) 10.888 3.760 ( 4.274 -1.999 2.541) 5.358 4.008 ( -5.803 -2.196 0.160) 6.207 4.098 ( 14.038 -9.771 3.187) 17.398 4.351 ( -0.506 -8.287 5.471) 9.943 4.526 ( 2.715 -4.161 -2.593) 5.604 4.739 ( -3.872 -3.452 0.471) 5.209 5.003 ( -5.364 3.958 6.420) 9.255 5.085 ( -7.220 4.478 8.943) 12.335 5.253 ( -9.324 2.692 2.756) 10.088 5.392 ( -5.686 -3.182 -4.204) 7.754 5.458 ( 10.129 0.122 -7.038) 12.335 5.715 ( 1.482 0.503 -10.561) 10.677 5.910 ( 1.111 1.665 0.574) 2.082 5.925 ( 2.635 11.075 -2.572) 11.671 6.007 ( -2.798 0.041 4.858) 5.606 6.192 ( 4.175 3.570 -1.508) 5.697 6.262 ( -5.784 1.751 -5.791) 8.370 6.325 ( 0.091 4.105 -7.291) 8.368 6.380 ( 1.177 4.902 -2.983) 5.858 6.651 ( -12.654 -2.606 4.062) 13.543 6.786 ( -0.326 5.178 5.206) 7.350 6.905 ( -9.538 1.067 4.515) 10.606 7.029 ( -4.987 -5.963 -3.087) 8.364 7.233 ( 0.685 5.155 7.227) 8.904 7.343 ( -1.273 0.963 -0.611) 1.709 7.512 ( 1.282 0.957 0.669) 1.734 7.556 ( 2.773 -3.819 2.619) 5.398 7.762 ( 7.263 2.327 0.031) 7.627 7.763 ( 5.033 1.274 0.197) 5.195 8.013 ( -2.907 3.045 -1.741) 4.556 8.106 ( -2.479 -0.359 -0.803) 2.631 8.163 ( 5.267 -2.475 -1.957) 6.140 8.429 ( 13.496 -3.857 0.862) 14.063 9.066 ( -3.825 3.511 4.312) 6.749 9.364 ( -9.065 7.212 -9.667) 15.088 13.017 ( -2.832 0.020 -0.730) 2.925 13.290 ( 2.006 -2.165 1.018) 3.121 14.580 ( -3.735 -1.545 2.556) 4.782 14.897 ( 2.404 0.639 0.203) 2.495 17.262 ( -0.179 0.749 -0.616) 0.986 17.343 ( 0.791 0.499 -0.503) 1.062 17.618 ( -4.066 -1.417 2.462) 4.960 18.049 ( 3.124 -1.470 -1.503) 3.766 21.298 ( -2.921 3.599 1.562) 4.891 21.442 ( 1.011 -0.446 -1.264) 1.679 21.768 ( 1.013 0.769 0.193) 1.287 21.841 ( 0.874 -0.058 -1.290) 1.559 24.063 ( -0.483 -1.048 -0.357) 1.208 24.135 ( 0.608 -0.779 -0.836) 1.294 28.225 ( -0.128 -1.194 1.511) 1.930 28.262 ( -0.220 -0.802 -0.608) 1.030 32.892 ( -1.407 -4.087 3.903) 5.824 33.295 ( 9.324 -3.958 10.543) 14.620 36.474 ( -1.856 -0.831 3.491) 4.040 36.740 ( 1.305 -1.499 -5.678) 6.016 39.686 ( -12.136 -0.131 3.934) 12.759 40.410 ( -3.616 -0.466 5.466) 6.570 40.661 ( 3.975 -4.028 -9.939) 11.437 41.488 ( 23.844 1.445 -17.891) 29.844 ======================= Grid point 198 (97/165) ======================= q-point: ( 0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( 5.289 -4.694 5.642) 9.046 2.475 ( -0.685 -1.435 9.872) 9.999 2.656 ( 13.447 -3.731 10.432) 17.423 3.001 ( -2.642 1.855 -1.176) 3.436 3.167 ( 2.968 -7.061 -1.316) 7.771 3.497 ( -0.212 7.098 -5.931) 9.252 3.795 ( 1.103 -7.037 -13.072) 14.886 3.919 ( 6.363 0.871 7.247) 9.683 3.987 ( -4.976 -9.284 -0.256) 10.536 4.286 ( -7.060 3.405 4.855) 9.220 4.524 ( 5.684 -4.390 6.790) 9.883 4.568 ( -3.649 -4.990 6.886) 9.254 4.764 ( -10.364 -0.663 12.083) 15.933 4.973 ( 1.409 -1.370 5.785) 6.109 5.100 ( 5.228 -6.621 3.823) 9.262 5.123 ( -1.263 1.973 -3.659) 4.345 5.354 ( -3.530 0.781 4.700) 5.929 5.443 ( -4.667 -0.460 -3.230) 5.694 5.635 ( -7.851 10.979 -4.694) 14.291 5.845 ( 14.661 1.205 -8.419) 16.949 5.942 ( -9.480 3.534 -1.948) 10.303 6.014 ( 7.179 -8.040 -5.551) 12.124 6.116 ( -10.618 2.858 -0.336) 11.001 6.176 ( -1.756 3.445 -2.756) 4.748 6.197 ( 3.216 1.975 -0.563) 3.816 6.324 ( 2.302 3.465 -1.120) 4.308 6.563 ( -4.666 1.185 0.576) 4.849 6.763 ( 0.940 -0.719 6.360) 6.469 6.904 ( -2.399 -4.374 1.153) 5.120 7.100 ( 6.252 11.245 -0.454) 12.874 7.104 ( -3.824 -6.823 0.030) 7.822 7.327 ( -5.225 -0.271 2.235) 5.690 7.514 ( 1.308 0.318 -1.215) 1.813 7.591 ( 0.705 1.190 2.772) 3.097 7.760 ( 1.444 1.185 -1.542) 2.423 7.880 ( -1.329 -3.388 0.830) 3.733 7.944 ( 4.956 0.295 0.544) 4.995 8.116 ( 0.459 -0.832 -0.003) 0.950 8.225 ( 3.255 0.484 -0.795) 3.386 8.658 ( 18.850 -0.647 -4.248) 19.333 8.975 ( -6.108 2.318 3.652) 7.485 9.034 ( -13.766 11.067 -7.899) 19.349 12.988 ( -1.474 -0.140 -1.117) 1.855 13.339 ( -0.361 -1.896 1.764) 2.615 14.587 ( -1.688 -2.369 1.357) 3.210 14.917 ( 1.705 0.627 1.519) 2.368 17.254 ( 1.001 0.420 -0.904) 1.412 17.334 ( 0.083 0.873 -0.602) 1.063 17.616 ( -1.422 -1.273 1.182) 2.245 18.085 ( 0.590 -0.785 -0.950) 1.366 21.222 ( -2.514 2.800 1.829) 4.184 21.457 ( 1.147 -0.562 -1.370) 1.873 21.763 ( 0.312 1.050 0.511) 1.209 21.843 ( 0.851 0.313 -1.435) 1.697 24.070 ( 0.108 -0.458 -0.643) 0.797 24.146 ( -0.050 -0.522 -0.654) 0.839 28.247 ( -0.259 -0.871 1.388) 1.659 28.265 ( -0.370 -0.391 -0.046) 0.541 32.978 ( 2.158 -2.830 3.108) 4.725 33.498 ( 4.735 -5.732 9.234) 11.855 36.478 ( -0.787 0.083 3.868) 3.948 36.764 ( 1.746 -2.421 -5.664) 6.402 39.606 ( -7.650 -2.677 3.451) 8.809 40.378 ( -7.143 -1.003 6.047) 9.412 40.735 ( 4.179 -3.433 -9.022) 10.519 41.586 ( 17.232 6.164 -19.222) 26.541 ======================= Grid point 199 (98/165) ======================= q-point: (-0.50 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( 0.820 3.104 2.501) 4.070 2.511 ( -1.344 0.853 14.660) 14.746 2.829 ( 0.163 -1.870 0.040) 1.877 2.955 ( 5.770 4.379 3.990) 8.269 3.305 ( -4.794 6.077 -3.202) 8.377 3.389 ( 10.211 -7.705 -3.508) 13.264 3.815 ( -8.828 -2.126 -8.358) 12.342 3.880 ( -3.528 -1.674 -6.327) 7.435 4.098 ( -6.298 5.422 8.111) 11.613 4.232 ( 11.474 -8.450 4.993) 15.099 4.527 ( -13.066 0.343 6.483) 14.590 4.648 ( -1.457 2.084 8.156) 8.544 4.755 ( -1.327 -8.729 8.573) 12.307 5.003 ( 6.413 6.538 2.103) 9.396 5.063 ( -4.428 2.384 -0.419) 5.047 5.219 ( -13.138 7.026 9.489) 17.664 5.252 ( 3.705 9.440 0.329) 10.147 5.481 ( -1.883 -5.566 6.488) 8.753 5.508 ( 1.984 -6.777 -5.230) 8.787 5.668 ( -8.431 -1.061 -3.793) 9.306 5.905 ( 2.571 2.270 -1.836) 3.890 5.968 ( -8.434 -0.049 -2.991) 8.949 6.130 ( 1.106 0.526 -1.541) 1.969 6.269 ( 1.451 -7.876 -1.590) 8.165 6.284 ( 13.807 1.448 -7.579) 15.817 6.334 ( 3.941 -6.743 -0.190) 7.813 6.508 ( -0.533 0.414 -0.004) 0.675 6.820 ( -1.929 -0.797 4.863) 5.292 6.932 ( -1.200 1.121 -6.149) 6.364 7.012 ( 8.437 2.453 -2.334) 9.091 7.208 ( -0.288 -1.594 -0.382) 1.664 7.272 ( 2.388 -0.402 2.381) 3.396 7.502 ( -4.114 1.016 1.831) 4.616 7.595 ( 0.114 0.074 2.530) 2.534 7.729 ( 0.419 1.427 -0.477) 1.562 7.928 ( -3.048 -5.807 1.999) 6.856 8.048 ( 5.984 -0.544 2.509) 6.512 8.113 ( -2.887 -0.476 0.960) 3.080 8.223 ( 1.010 1.618 -1.231) 2.270 8.610 ( -13.210 8.675 -11.411) 19.492 8.843 ( 5.102 4.738 -1.415) 7.105 8.968 ( 10.809 -1.392 1.914) 11.065 12.980 ( 0.186 -0.621 -1.391) 1.535 13.352 ( -2.626 -0.795 2.144) 3.483 14.624 ( 0.291 -3.006 -0.085) 3.021 14.922 ( -0.260 1.162 2.323) 2.610 17.265 ( 1.905 -0.186 -1.257) 2.290 17.320 ( 0.260 0.520 -0.555) 0.804 17.631 ( 0.933 -0.541 0.351) 1.134 18.075 ( -2.197 0.439 -0.245) 2.254 21.171 ( -1.440 1.832 2.347) 3.307 21.472 ( 0.926 -0.447 -1.470) 1.794 21.750 ( -0.377 0.859 0.932) 1.322 21.841 ( 1.016 0.509 -1.414) 1.814 24.076 ( 0.902 0.009 -0.874) 1.256 24.145 ( -0.402 -0.026 -0.468) 0.617 28.246 ( -0.491 0.692 0.636) 1.061 28.276 ( -0.250 -0.891 0.895) 1.287 33.025 ( 0.414 0.930 2.882) 3.057 33.668 ( -2.113 -9.965 6.077) 11.862 36.492 ( 1.015 0.367 3.706) 3.860 36.801 ( 1.604 -2.793 -5.954) 6.769 39.619 ( -2.132 -4.358 2.627) 5.518 40.336 ( -8.456 -2.273 5.590) 10.388 40.767 ( 0.542 -0.984 -5.971) 6.076 41.538 ( 12.388 11.150 -19.995) 26.030 ======================= Grid point 200 (99/165) ======================= q-point: (-0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( -6.289 17.551 9.817) 21.070 2.595 ( 7.144 3.840 9.744) 12.678 2.674 ( -14.671 7.486 4.684) 17.124 2.947 ( -1.977 4.505 1.246) 5.075 3.192 ( 5.426 0.906 -7.918) 9.641 3.577 ( -13.051 -1.698 0.567) 13.174 3.700 ( 4.098 -5.827 -0.828) 7.172 3.856 ( 3.070 -0.838 -9.279) 9.809 4.087 ( -1.795 -2.677 0.136) 3.226 4.234 ( -23.003 13.306 17.550) 31.846 4.491 ( 4.479 -4.209 4.807) 7.803 4.631 ( -8.030 0.555 0.535) 8.067 4.778 ( -4.116 1.815 6.947) 8.276 4.938 ( 6.302 -1.440 3.632) 7.415 5.075 ( 7.935 0.970 -2.158) 8.280 5.124 ( -2.046 5.785 -0.209) 6.139 5.244 ( 1.497 -5.421 6.642) 8.703 5.313 ( 0.082 3.434 2.584) 4.299 5.679 ( -9.314 -8.069 -4.578) 13.146 5.760 ( 5.404 -1.574 0.074) 5.629 5.866 ( -2.062 1.979 -0.722) 2.948 5.971 ( 2.466 -7.479 1.044) 7.944 6.174 ( 2.497 -5.975 1.463) 6.639 6.307 ( 3.730 1.713 -6.245) 7.473 6.321 ( 0.952 0.769 0.666) 1.393 6.493 ( 3.714 -3.838 2.265) 5.801 6.583 ( 1.518 -3.825 -6.181) 7.426 6.755 ( -0.172 5.814 -6.608) 8.804 6.885 ( 1.881 -3.830 -5.504) 6.965 7.090 ( 4.838 0.640 0.904) 4.963 7.279 ( 1.012 -2.287 0.857) 2.643 7.290 ( 2.896 1.796 0.910) 3.527 7.448 ( -0.118 0.613 4.391) 4.435 7.614 ( 1.811 0.526 1.263) 2.270 7.729 ( -1.999 -0.989 1.568) 2.727 7.965 ( -4.868 -2.251 1.169) 5.490 7.990 ( -6.299 3.335 -0.118) 7.129 8.110 ( -0.829 0.991 -0.624) 1.435 8.215 ( -7.870 0.098 -1.768) 8.067 8.385 ( -3.736 -3.092 1.415) 5.052 8.811 ( 3.204 2.998 -0.334) 4.400 9.185 ( 20.687 -0.364 -4.505) 21.175 12.999 ( 1.858 -0.907 -1.548) 2.583 13.321 ( -4.577 0.470 2.097) 5.057 14.684 ( 1.955 -3.194 -1.477) 4.026 14.889 ( -2.915 2.109 2.578) 4.426 17.285 ( 1.702 -0.028 -1.547) 2.300 17.326 ( 1.021 -0.546 -0.249) 1.184 17.663 ( 3.647 -0.267 -0.257) 3.666 18.020 ( -4.687 1.398 0.435) 4.910 21.155 ( 0.190 0.696 3.324) 3.402 21.479 ( 0.432 -0.200 -1.445) 1.522 21.740 ( -0.638 0.179 1.232) 1.399 21.839 ( 1.201 0.644 -1.344) 1.914 24.083 ( 1.394 0.362 -1.002) 1.754 24.134 ( -0.414 0.514 -0.296) 0.724 28.229 ( -0.373 1.144 0.867) 1.483 28.286 ( -0.300 -0.282 0.476) 0.629 32.986 ( -1.699 4.076 2.652) 5.151 33.813 ( -11.504 -16.306 1.398) 20.004 36.519 ( 2.306 0.797 2.380) 3.408 36.827 ( 0.340 -2.147 -6.708) 7.052 39.711 ( 4.499 -4.432 1.549) 6.502 40.297 ( -9.786 -3.347 4.900) 11.445 40.722 ( -3.901 1.905 -2.161) 4.850 41.357 ( 9.026 16.725 -19.583) 27.289 ======================= Grid point 201 (100/165) ======================= q-point: (-0.25 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( -5.483 16.542 18.032) 25.077 2.281 ( -4.684 25.478 19.976) 32.713 2.685 ( -4.628 -1.037 0.891) 4.826 2.822 ( -5.206 4.971 4.038) 8.253 3.293 ( 10.708 -6.337 -13.530) 18.381 3.341 ( -26.061 1.608 6.671) 26.949 3.699 ( -20.740 12.121 15.030) 28.336 3.838 ( -2.382 1.455 -1.750) 3.295 3.883 ( 10.627 -0.439 -5.043) 11.771 4.261 ( 2.012 -9.995 -3.677) 10.839 4.444 ( -6.068 2.978 -4.942) 8.374 4.525 ( -5.146 2.534 -1.169) 5.854 4.819 ( -1.740 7.028 1.099) 7.323 4.935 ( 6.756 -3.011 4.004) 8.411 5.141 ( 0.384 -2.781 8.923) 9.354 5.257 ( 8.675 -6.173 -1.818) 10.801 5.315 ( 0.242 0.094 3.645) 3.654 5.422 ( 12.501 -4.485 1.629) 13.381 5.653 ( -7.671 -2.260 2.128) 8.275 5.780 ( 0.439 0.328 -3.624) 3.665 5.871 ( -1.259 -6.557 1.182) 6.780 6.080 ( 0.625 -5.115 -2.676) 5.806 6.192 ( -3.288 4.483 -2.782) 6.216 6.335 ( 8.441 2.130 -1.730) 8.876 6.450 ( 9.793 -8.061 -1.671) 12.793 6.514 ( -2.117 1.890 -9.257) 9.683 6.620 ( 3.334 -4.780 2.311) 6.270 6.692 ( 0.806 1.663 2.145) 2.831 6.891 ( -5.993 3.478 0.827) 6.979 7.148 ( 4.452 -5.748 -1.477) 7.419 7.224 ( 4.281 1.955 -4.645) 6.613 7.444 ( -1.161 3.018 0.970) 3.375 7.476 ( 5.369 -6.032 6.076) 10.106 7.613 ( 2.390 3.709 -0.929) 4.509 7.689 ( -3.733 1.276 1.229) 4.132 7.848 ( -9.594 1.089 -0.230) 9.658 7.937 ( -6.286 -0.876 3.065) 7.048 8.036 ( -8.949 1.258 1.188) 9.115 8.156 ( 1.901 -4.468 -3.473) 5.970 8.455 ( -4.928 -4.251 4.070) 7.676 8.861 ( 7.732 -0.641 3.503) 8.513 9.377 ( 17.655 2.533 -7.373) 19.300 13.035 ( 3.417 -0.501 -1.431) 3.738 13.254 ( -5.662 1.195 1.751) 6.046 14.751 ( 2.139 -2.722 -1.909) 3.954 14.815 ( -4.021 2.680 2.066) 5.255 17.294 ( 1.490 0.302 -1.316) 2.011 17.345 ( 0.001 -0.727 -0.351) 0.807 17.729 ( 6.291 -1.009 -0.756) 6.416 17.932 ( -6.278 1.705 0.934) 6.572 21.188 ( 2.729 -0.830 4.185) 5.065 21.476 ( -0.173 -0.074 -1.233) 1.247 21.743 ( -0.448 -0.734 1.184) 1.464 21.835 ( 1.068 0.945 -1.296) 1.927 24.087 ( 1.219 0.655 -0.868) 1.634 24.116 ( -0.405 1.032 -0.399) 1.178 28.211 ( -0.228 1.098 1.005) 1.506 28.280 ( -0.339 0.567 -0.196) 0.689 32.905 ( -1.213 4.750 2.688) 5.591 33.884 ( -26.050 -20.337 -6.623) 33.706 36.525 ( 1.380 2.816 0.713) 3.216 36.808 ( -1.225 -0.147 -7.307) 7.410 39.882 ( 12.739 -4.013 1.431) 13.432 40.247 ( -10.457 -3.027 3.451) 11.420 40.608 ( -6.106 4.342 2.059) 7.771 41.083 ( 7.210 19.498 -14.714) 25.469 ======================= Grid point 202 (101/165) ======================= q-point: (-0.12 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( -1.124 0.821 25.948) 25.985 2.013 ( 3.785 19.660 30.882) 36.804 2.497 ( -20.100 9.606 13.647) 26.125 2.722 ( -1.941 3.375 4.632) 6.051 3.029 ( -22.286 1.093 4.786) 22.821 3.480 ( -2.698 0.399 10.434) 10.784 3.521 ( 9.419 -7.694 -13.192) 17.943 3.777 ( 2.215 2.115 -11.702) 12.096 3.996 ( 9.254 -0.820 -6.327) 11.240 4.247 ( -14.021 3.748 -0.508) 14.522 4.315 ( -3.725 0.465 -6.186) 7.236 4.422 ( -2.687 4.741 -5.563) 7.788 4.766 ( 4.756 -3.008 -7.145) 9.095 5.055 ( 8.473 1.690 -3.789) 9.434 5.197 ( -5.711 -3.000 13.587) 15.041 5.290 ( -1.261 3.351 2.680) 4.472 5.457 ( 4.494 -6.190 -0.335) 7.656 5.582 ( 4.690 0.282 1.613) 4.968 5.635 ( -2.857 -2.905 6.119) 7.351 5.804 ( 4.903 -3.392 -3.000) 6.674 6.017 ( 0.771 -7.451 -0.086) 7.491 6.068 ( -0.639 0.764 0.694) 1.214 6.184 ( -0.038 -5.470 -1.944) 5.806 6.390 ( 4.477 3.656 -6.079) 8.388 6.402 ( 3.608 1.930 -8.864) 9.763 6.542 ( -0.404 3.825 -8.744) 9.552 6.742 ( 12.649 -2.230 5.047) 13.801 6.768 ( 2.044 -2.882 7.982) 8.729 6.864 ( -3.598 -5.818 7.395) 10.073 7.224 ( 3.335 0.232 -2.944) 4.455 7.296 ( 2.495 -1.508 -3.702) 4.712 7.321 ( -4.583 3.429 -0.709) 5.767 7.521 ( -8.127 1.182 -2.247) 8.515 7.582 ( -0.790 -0.815 4.862) 4.993 7.665 ( -6.995 3.192 -3.758) 8.558 7.685 ( 1.089 2.928 2.567) 4.043 7.961 ( -4.307 -6.360 3.452) 8.421 7.998 ( 1.780 -0.662 3.265) 3.777 8.257 ( 2.167 -4.859 -2.323) 5.805 8.421 ( -6.437 -0.408 -0.914) 6.514 9.006 ( 5.765 -3.182 7.458) 9.949 9.443 ( 10.932 5.736 -5.593) 13.554 13.082 ( 5.059 0.149 -0.881) 5.137 13.176 ( -5.506 0.984 1.265) 5.734 14.714 ( -6.416 1.582 3.809) 7.627 14.825 ( 4.192 -1.363 -3.766) 5.798 17.302 ( 1.469 0.282 -0.825) 1.708 17.340 ( -1.716 -0.231 -0.551) 1.817 17.799 ( -3.806 -1.049 2.163) 4.502 17.856 ( 3.315 1.284 -1.807) 3.988 21.278 ( 5.412 -1.869 3.290) 6.603 21.467 ( -0.809 -0.112 -1.038) 1.321 21.762 ( -0.230 -1.554 0.770) 1.750 21.820 ( 0.552 1.584 -1.083) 1.997 24.075 ( -0.854 1.124 0.096) 1.415 24.100 ( 0.994 0.612 -1.209) 1.680 28.200 ( -0.155 0.624 0.963) 1.158 28.261 ( -0.413 0.981 -0.617) 1.230 32.860 ( 2.327 2.924 3.762) 5.303 33.697 ( -42.753 -11.525 -12.554) 46.025 36.465 ( -1.006 4.563 2.370) 5.240 36.767 ( 0.360 0.224 -6.240) 6.254 40.115 ( -1.844 -6.108 5.983) 8.747 40.208 ( 9.140 -0.004 -3.972) 9.966 40.512 ( 2.734 3.227 4.908) 6.479 40.838 ( 5.284 14.322 -6.202) 16.477 ======================= Grid point 204 (102/165) ======================= q-point: ( 0.12 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( -1.875 0.000 22.861) 22.938 2.059 ( 13.675 -0.000 26.239) 29.589 2.450 ( 4.401 -0.000 0.459) 4.425 2.922 ( 2.788 -0.000 5.729) 6.372 3.071 ( 13.358 -0.000 2.517) 13.593 3.373 ( -12.606 0.000 -20.862) 24.375 3.677 ( 7.725 -0.000 12.356) 14.572 3.807 ( 8.974 -0.000 8.069) 12.068 3.963 ( 6.436 -0.000 -4.710) 7.975 4.071 ( -7.625 0.000 -1.935) 7.866 4.086 ( 10.258 -0.000 -6.417) 12.100 4.381 ( 0.082 -0.000 -5.345) 5.346 4.797 ( -8.756 0.000 -2.797) 9.192 5.066 ( -8.106 0.000 19.818) 21.411 5.120 ( 5.299 -0.000 -12.729) 13.788 5.263 ( -7.732 0.000 3.258) 8.390 5.392 ( -12.321 0.000 -0.070) 12.321 5.440 ( 9.292 -0.000 2.586) 9.645 5.819 ( -1.727 0.000 -7.269) 7.472 5.850 ( -4.441 0.000 -3.085) 5.407 6.043 ( -1.120 0.000 3.400) 3.579 6.198 ( -0.304 0.000 -4.949) 4.958 6.226 ( 2.363 -0.000 -4.159) 4.783 6.266 ( 2.199 -0.000 1.110) 2.463 6.351 ( -2.872 0.000 -4.045) 4.961 6.459 ( 1.062 -0.000 -11.764) 11.812 6.676 ( -16.150 0.000 0.779) 16.169 6.785 ( -7.330 0.000 9.248) 11.800 6.918 ( -3.997 0.000 -1.486) 4.265 7.090 ( -1.121 0.000 6.589) 6.684 7.194 ( -2.456 0.000 -3.249) 4.073 7.408 ( 2.053 -0.000 -0.327) 2.079 7.456 ( -0.470 0.000 0.605) 0.766 7.516 ( 7.993 -0.000 7.147) 10.722 7.776 ( 3.233 -0.000 7.068) 7.772 7.971 ( -1.873 0.000 -2.068) 2.790 8.040 ( 2.314 -0.000 1.162) 2.589 8.065 ( 9.838 -0.000 -5.987) 11.517 8.125 ( -3.175 0.000 -0.503) 3.215 8.266 ( 2.968 -0.000 1.901) 3.525 9.141 ( -3.568 0.000 3.213) 4.801 9.487 ( -3.303 0.000 -7.426) 8.128 13.025 ( -1.397 0.000 -0.903) 1.664 13.250 ( 1.957 -0.000 1.688) 2.584 14.553 ( -4.064 0.000 2.961) 5.028 14.907 ( 1.663 -0.000 -0.782) 1.837 17.287 ( 1.142 -0.000 -1.243) 1.688 17.348 ( 1.407 -0.000 0.254) 1.429 17.589 ( -5.143 0.000 2.775) 5.844 18.009 ( 1.661 -0.000 -0.959) 1.918 21.391 ( -1.948 0.000 -2.365) 3.064 21.409 ( -1.877 0.000 1.417) 2.352 21.783 ( 1.679 -0.000 -0.551) 1.767 21.838 ( 1.221 -0.000 -0.473) 1.309 24.041 ( 0.313 -0.000 0.057) 0.318 24.120 ( 0.776 -0.000 -0.923) 1.206 28.203 ( -0.100 0.000 1.447) 1.451 28.241 ( 0.265 -0.000 -0.840) 0.881 32.822 ( -0.838 0.000 3.453) 3.554 33.245 ( 11.725 -0.000 13.795) 18.104 36.451 ( -0.896 0.000 4.869) 4.951 36.715 ( 0.527 -0.000 -5.924) 5.947 39.693 ( -14.196 0.000 3.172) 14.546 40.424 ( 5.232 -0.000 -1.542) 5.454 40.547 ( -5.796 0.000 -3.597) 6.822 41.520 ( 30.627 -0.000 -17.808) 35.428 ======================= Grid point 205 (103/165) ======================= q-point: ( 0.25 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 9.180 6.789 14.748) 18.651 2.419 ( 12.444 -7.046 16.062) 21.506 2.530 ( 9.133 1.469 4.136) 10.133 2.936 ( -5.474 -3.788 3.714) 7.623 3.117 ( 8.940 2.791 -9.823) 13.573 3.394 ( 1.495 -13.563 -15.263) 20.473 3.750 ( 4.467 9.410 -1.559) 10.532 3.860 ( 2.316 -1.085 14.028) 14.259 4.044 ( 1.027 2.760 -5.780) 6.487 4.148 ( 8.084 -4.634 1.404) 9.423 4.248 ( 12.850 -11.265 14.727) 22.559 4.407 ( -3.905 -7.990 -1.777) 9.070 4.637 ( -11.829 0.893 1.198) 11.923 5.038 ( -8.519 1.962 15.395) 17.704 5.088 ( -6.720 4.691 1.080) 8.266 5.176 ( -9.366 -1.679 0.551) 9.531 5.275 ( -3.342 -0.691 0.259) 3.423 5.566 ( 4.705 2.420 1.207) 5.427 5.674 ( 3.120 1.423 -14.742) 15.135 5.893 ( 2.475 -4.958 -5.521) 7.822 6.028 ( -3.099 1.442 2.598) 4.294 6.081 ( 0.717 7.061 -2.807) 7.632 6.152 ( -9.664 3.959 -4.515) 11.378 6.248 ( -1.705 2.836 -2.596) 4.206 6.368 ( -1.520 3.037 -7.579) 8.306 6.416 ( 2.649 -4.858 -2.299) 5.992 6.512 ( -6.519 0.514 1.940) 6.821 6.785 ( -6.996 -4.298 6.520) 10.484 6.912 ( 2.525 1.027 -0.965) 2.891 6.969 ( -1.593 8.936 4.680) 10.213 7.227 ( -2.614 -4.374 0.019) 5.096 7.390 ( -0.038 3.913 0.304) 3.925 7.477 ( -2.474 -4.228 0.768) 4.959 7.587 ( -0.401 1.733 6.882) 7.108 7.828 ( -1.146 -0.544 1.927) 2.307 7.899 ( 5.080 4.460 -0.448) 6.775 8.041 ( -2.347 5.933 -1.165) 6.485 8.065 ( 1.099 -1.678 -0.003) 2.006 8.150 ( 4.257 -2.792 -2.292) 5.583 8.480 ( 13.786 -9.232 -1.220) 16.636 9.074 ( -5.749 2.803 2.190) 6.761 9.332 ( -9.502 6.070 -8.165) 13.921 13.013 ( 1.255 0.978 -1.154) 1.965 13.285 ( 0.688 -1.206 2.616) 2.961 14.532 ( -2.734 -0.975 2.366) 3.745 14.922 ( 1.178 -0.090 0.006) 1.182 17.291 ( 2.446 1.440 -1.508) 3.214 17.362 ( 1.124 0.537 0.019) 1.246 17.561 ( -3.019 -1.549 1.529) 3.722 18.025 ( -1.203 -1.943 -0.333) 2.309 21.321 ( -2.566 3.192 -0.315) 4.108 21.415 ( -1.590 -2.102 -0.323) 2.655 21.794 ( 1.330 0.649 -0.652) 1.617 21.848 ( 0.804 0.043 -0.730) 1.087 24.054 ( 1.104 -0.411 -0.303) 1.216 24.127 ( 0.269 -0.465 -0.718) 0.897 28.215 ( -0.026 -0.709 1.664) 1.809 28.245 ( 0.038 -0.650 -0.881) 1.095 32.899 ( 8.038 -1.620 1.735) 8.381 33.436 ( 8.528 0.114 15.833) 17.984 36.468 ( -0.578 -0.453 4.919) 4.974 36.706 ( 1.031 -1.092 -5.685) 5.881 39.561 ( -10.383 -0.417 3.103) 10.845 40.404 ( -3.073 3.023 0.778) 4.380 40.563 ( 1.307 -6.391 -5.057) 8.253 41.735 ( 23.573 2.737 -20.759) 31.530 ======================= Grid point 206 (104/165) ======================= q-point: ( 0.38 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( 11.494 3.940 5.957) 13.532 2.520 ( 1.977 -0.226 1.882) 2.739 2.765 ( 8.540 -3.476 9.385) 13.157 3.047 ( 4.395 -6.422 10.232) 12.855 3.144 ( 9.227 4.385 -4.786) 11.282 3.554 ( 5.520 -6.983 -15.361) 17.753 3.618 ( -0.215 3.761 -4.906) 6.185 3.854 ( -5.415 2.227 -1.935) 6.166 4.109 ( 11.711 -0.822 9.652) 15.198 4.237 ( -10.610 0.913 4.558) 11.583 4.425 ( -4.328 -9.099 6.055) 11.755 4.605 ( 8.122 -4.736 7.197) 11.840 4.671 ( -4.835 -0.829 8.994) 10.245 4.920 ( -6.909 -10.115 1.828) 12.385 4.991 ( -1.596 0.867 7.868) 8.075 5.137 ( -6.453 -5.359 -0.850) 8.431 5.283 ( 1.153 1.112 3.925) 4.239 5.450 ( -6.093 3.924 0.017) 7.247 5.720 ( 2.192 5.495 -6.315) 8.653 5.839 ( -15.280 6.348 -2.478) 16.731 5.867 ( -8.846 1.805 -4.330) 10.013 6.028 ( -0.019 -3.830 1.192) 4.011 6.108 ( 17.292 5.263 -8.738) 20.077 6.187 ( 1.470 0.257 -1.223) 1.929 6.283 ( -0.150 1.962 -3.522) 4.034 6.433 ( 2.057 5.448 -1.321) 5.971 6.498 ( -3.618 -2.739 3.078) 5.483 6.784 ( -4.428 -1.138 1.871) 4.940 6.913 ( 7.802 3.328 2.810) 8.935 6.963 ( -1.260 -5.524 0.082) 5.666 7.212 ( -6.770 -0.069 -0.807) 6.818 7.333 ( 5.073 4.581 1.812) 7.072 7.514 ( -1.248 -0.493 -0.176) 1.354 7.559 ( -6.239 -3.838 4.007) 8.350 7.778 ( -2.031 1.001 -3.647) 4.292 7.886 ( 1.183 7.216 1.706) 7.509 8.010 ( 4.573 -2.267 1.123) 5.227 8.098 ( -0.745 -0.934 1.232) 1.716 8.218 ( 0.810 -2.648 -1.400) 3.103 8.779 ( 15.304 -7.020 -6.992) 18.231 8.928 ( -11.092 5.659 1.933) 12.601 9.046 ( -8.971 8.184 -5.882) 13.493 13.012 ( 3.583 2.029 -1.147) 4.274 13.320 ( -0.182 -1.094 2.845) 3.054 14.542 ( -1.119 -2.032 1.692) 2.871 14.934 ( -0.051 -0.171 0.764) 0.785 17.290 ( 2.920 1.668 -1.395) 3.641 17.354 ( 0.509 1.417 -0.421) 1.563 17.580 ( -0.285 -2.487 0.497) 2.552 18.032 ( -3.958 -2.647 0.126) 4.763 21.246 ( -1.977 2.859 0.751) 3.556 21.430 ( -1.130 -2.163 -1.033) 2.650 21.787 ( 0.308 1.182 -0.234) 1.244 21.850 ( 0.620 0.134 -1.134) 1.300 24.073 ( 1.718 -0.173 -0.770) 1.891 24.133 ( -0.181 -0.572 -0.475) 0.765 28.236 ( -0.117 -1.042 1.696) 1.994 28.251 ( -0.323 -0.603 -0.561) 0.884 33.033 ( 9.546 -0.313 1.200) 9.626 33.557 ( 2.047 0.914 13.826) 14.007 36.492 ( 0.061 -0.263 4.925) 4.933 36.724 ( 1.814 -2.028 -5.541) 6.173 39.505 ( -5.023 -2.428 3.927) 6.822 40.324 ( -5.004 1.579 1.842) 5.561 40.656 ( 0.736 -5.565 -3.998) 6.891 41.811 ( 17.456 6.132 -22.022) 28.762 ======================= Grid point 207 (105/165) ======================= q-point: (-0.50 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( 9.645 3.451 2.482) 10.540 2.553 ( -3.215 -0.643 7.230) 7.939 2.844 ( 2.927 3.448 5.072) 6.796 3.120 ( 3.161 5.361 -5.905) 8.579 3.263 ( 5.067 -6.160 10.382) 13.092 3.491 ( 3.844 8.603 -2.547) 9.761 3.687 ( -0.242 -1.560 -12.291) 12.392 3.741 ( -6.840 -3.390 -0.147) 7.636 4.122 ( -4.552 -0.638 2.707) 5.334 4.336 ( 14.359 -3.658 4.903) 15.608 4.453 ( -9.946 8.816 5.057) 14.221 4.555 ( -5.271 -6.528 5.562) 10.066 4.746 ( 2.189 -5.359 10.362) 11.869 5.034 ( 0.522 0.857 3.821) 3.950 5.165 ( 5.910 -4.866 1.648) 7.831 5.227 ( -7.614 -6.716 6.455) 12.031 5.261 ( -13.665 -2.898 5.419) 14.983 5.377 ( 5.458 -3.523 -2.157) 6.845 5.475 ( -14.319 6.910 -3.920) 16.375 5.542 ( 3.084 10.019 -1.185) 10.550 5.803 ( -8.619 -3.426 0.272) 9.279 6.032 ( -0.876 4.370 2.840) 5.285 6.151 ( 4.933 2.850 -3.935) 6.924 6.247 ( 6.242 -1.501 -2.309) 6.822 6.327 ( -1.100 2.164 1.754) 2.995 6.394 ( 6.939 -3.690 -5.764) 9.746 6.510 ( 6.386 0.998 -4.117) 7.663 6.776 ( -2.848 -4.149 -0.053) 5.032 6.931 ( -0.798 2.901 0.138) 3.012 7.054 ( 2.093 -2.991 -0.455) 3.679 7.156 ( -0.588 -2.821 -2.083) 3.556 7.377 ( 8.819 2.001 1.303) 9.137 7.455 ( -5.747 0.611 0.074) 5.780 7.597 ( -2.297 -1.931 3.496) 4.608 7.739 ( -0.820 -0.508 -1.193) 1.534 7.841 ( -0.232 -0.316 1.775) 1.818 8.070 ( -5.073 1.051 1.729) 5.462 8.107 ( 4.341 -2.247 1.255) 5.047 8.225 ( -2.620 0.213 -0.734) 2.729 8.550 ( -15.808 11.499 -7.331) 20.877 8.885 ( -3.145 2.739 -1.416) 4.404 9.086 ( 15.659 -6.750 -5.046) 17.783 13.026 ( 5.574 2.381 -1.066) 6.154 13.331 ( -1.626 0.145 2.530) 3.010 14.583 ( 0.499 -2.905 1.019) 3.119 14.924 ( -2.353 0.331 1.286) 2.702 17.297 ( 3.040 1.130 -1.434) 3.546 17.337 ( 0.676 1.087 -0.682) 1.451 17.628 ( 2.032 -2.100 0.106) 2.925 18.010 ( -6.413 -1.995 0.690) 6.751 21.196 ( -0.932 1.918 1.817) 2.801 21.444 ( -1.071 -1.963 -1.500) 2.693 21.766 ( -0.424 1.244 0.343) 1.358 21.850 ( 0.643 0.109 -1.428) 1.570 24.092 ( 2.126 0.147 -1.235) 2.464 24.136 ( -0.214 -0.345 -0.219) 0.461 28.248 ( -0.300 -0.001 0.229) 0.377 28.260 ( -0.428 -1.171 1.270) 1.780 33.115 ( 6.849 3.583 2.043) 7.995 33.582 ( -5.005 -0.231 9.487) 10.729 36.521 ( 0.604 -0.281 4.144) 4.198 36.757 ( 2.146 -2.146 -5.799) 6.545 39.556 ( 0.827 -4.643 5.118) 6.960 40.256 ( -4.988 0.672 2.010) 5.420 40.703 ( -2.642 -3.041 -1.233) 4.213 41.767 ( 12.789 9.588 -23.043) 28.045 ======================= Grid point 208 (106/165) ======================= q-point: (-0.38 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.118 ( 0.886 14.925 7.554) 16.751 2.513 ( -7.468 0.163 4.226) 8.582 2.877 ( 8.898 2.114 2.853) 9.580 3.002 ( -1.074 6.679 -5.038) 8.434 3.283 ( -11.063 9.942 9.905) 17.871 3.382 ( -7.937 -0.676 4.162) 8.988 3.676 ( 8.822 -4.692 -6.405) 11.869 3.825 ( 2.556 -6.693 -8.851) 11.387 4.077 ( -0.764 3.978 0.006) 4.050 4.264 ( -9.888 8.127 10.112) 16.312 4.541 ( 5.536 -0.690 2.513) 6.119 4.628 ( 1.587 1.363 3.533) 4.106 4.767 ( -6.307 2.949 9.144) 11.493 4.991 ( 2.038 0.118 4.252) 4.716 5.148 ( -3.928 -5.322 9.491) 11.569 5.191 ( -4.115 5.038 -1.112) 6.599 5.239 ( 2.421 3.938 1.487) 4.856 5.365 ( 2.710 -2.406 -1.933) 4.107 5.432 ( -3.351 -6.824 0.953) 7.662 5.676 ( 1.554 -5.256 -4.551) 7.124 5.858 ( 2.937 -11.890 4.382) 13.008 5.946 ( -0.885 5.897 2.231) 6.367 6.141 ( 1.137 -0.218 -1.537) 1.924 6.257 ( -2.061 -1.482 -1.843) 3.137 6.325 ( -2.129 -1.148 0.897) 2.579 6.459 ( -0.595 -4.197 -2.790) 5.074 6.632 ( 12.827 1.611 -6.441) 14.443 6.778 ( -2.901 1.597 -11.195) 11.675 6.859 ( 3.276 -0.973 1.182) 3.616 7.156 ( 5.777 -1.084 0.917) 5.948 7.214 ( -1.602 -5.877 1.386) 6.247 7.341 ( -4.611 3.193 0.242) 5.613 7.493 ( 6.565 -0.430 3.312) 7.366 7.602 ( -2.080 -1.559 2.067) 3.321 7.745 ( 1.823 0.562 -0.730) 2.043 7.850 ( -6.677 -1.915 0.871) 7.001 7.967 ( -6.120 3.160 0.445) 6.902 8.134 ( -6.167 2.517 -0.970) 6.731 8.145 ( -3.234 5.477 -0.364) 6.371 8.282 ( -4.703 -3.295 -0.674) 5.782 8.850 ( 0.467 -0.576 1.387) 1.573 9.336 ( 15.354 -5.401 -9.765) 18.981 13.060 ( 6.854 2.172 -0.871) 7.242 13.297 ( -3.364 1.518 1.773) 4.094 14.649 ( 1.603 -3.320 0.559) 3.729 14.878 ( -4.454 1.142 1.333) 4.787 17.309 ( 2.360 0.788 -1.588) 2.951 17.333 ( 0.723 0.208 -0.688) 1.019 17.695 ( 4.271 -1.589 0.298) 4.567 17.952 ( -7.620 -0.795 1.114) 7.742 21.183 ( 0.332 0.572 3.089) 3.159 21.451 ( -1.212 -1.568 -1.796) 2.675 21.746 ( -0.574 0.785 0.851) 1.292 21.849 ( 0.702 0.085 -1.653) 1.798 24.107 ( 2.108 0.405 -1.431) 2.580 24.136 ( -0.067 0.198 -0.154) 0.260 28.242 ( -0.268 0.584 0.673) 0.930 28.276 ( -0.400 -0.823 0.941) 1.312 33.100 ( 3.547 7.155 3.165) 8.590 33.536 ( -12.212 -2.553 5.318) 13.562 36.548 ( 0.390 -0.423 2.404) 2.472 36.782 ( 1.698 -1.315 -6.407) 6.757 39.708 ( 5.791 -6.206 6.385) 10.621 40.204 ( -3.297 0.308 0.882) 3.427 40.677 ( -6.092 -0.054 2.382) 6.542 41.614 ( 9.395 13.255 -23.757) 28.781 ======================= Grid point 209 (107/165) ======================= q-point: (-0.25 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( -3.967 19.423 11.904) 23.124 2.390 ( -12.129 4.759 9.540) 16.149 2.814 ( -5.739 8.299 -3.637) 10.725 2.960 ( 5.217 8.973 11.614) 15.577 3.146 ( -4.142 -4.123 0.813) 5.901 3.293 ( 2.413 3.197 -4.131) 5.754 3.715 ( -12.580 4.645 8.393) 15.820 3.862 ( 0.025 5.669 -0.599) 5.700 3.990 ( 1.861 5.703 1.621) 6.214 4.169 ( 8.125 -4.600 -0.994) 9.390 4.463 ( 0.218 6.181 -8.589) 10.584 4.511 ( -6.536 5.069 3.090) 8.829 4.923 ( -0.947 5.092 7.655) 9.243 4.990 ( 7.503 -2.310 0.628) 7.876 5.088 ( -6.205 -4.411 11.020) 13.394 5.268 ( 2.968 -3.060 -0.769) 4.331 5.324 ( 2.995 -6.937 2.016) 7.820 5.452 ( -3.840 -4.688 -1.783) 6.317 5.509 ( 7.546 -3.752 3.625) 9.174 5.714 ( 0.107 -3.301 -3.326) 4.687 5.856 ( -2.578 2.748 0.437) 3.793 6.026 ( 2.709 -1.586 -4.571) 5.545 6.198 ( 0.487 -2.363 -0.460) 2.456 6.289 ( -5.874 -5.028 2.916) 8.264 6.381 ( 6.189 -10.308 -4.600) 12.873 6.465 ( -1.793 -1.054 -8.303) 8.560 6.630 ( 0.822 0.097 -0.626) 1.038 6.727 ( 1.541 2.523 -0.569) 3.011 6.974 ( 8.078 1.635 0.069) 8.242 7.123 ( 0.114 0.329 0.417) 0.543 7.245 ( -3.889 -0.372 0.211) 3.912 7.404 ( 2.661 -8.232 2.375) 8.972 7.503 ( -3.046 4.733 0.338) 5.639 7.599 ( -3.882 -1.431 1.668) 4.461 7.740 ( -9.489 2.266 -1.170) 9.826 7.777 ( 5.390 1.607 -0.727) 5.672 7.858 ( -3.788 2.037 2.059) 4.769 8.019 ( -1.946 2.379 1.002) 3.232 8.096 ( 0.333 -2.818 -0.335) 2.858 8.331 ( -4.451 -4.707 1.237) 6.596 8.921 ( 3.783 -2.878 4.586) 6.605 9.507 ( 10.219 -2.914 -12.791) 16.629 13.107 ( 6.207 1.701 -0.189) 6.439 13.228 ( -3.635 2.221 0.464) 4.285 14.715 ( -0.721 -2.393 1.616) 2.976 14.811 ( -2.518 1.104 -0.071) 2.750 17.315 ( 1.612 0.571 -1.445) 2.239 17.331 ( -0.746 -0.133 -0.805) 1.105 17.768 ( 1.244 -1.101 2.331) 2.862 17.886 ( -2.426 0.073 -0.399) 2.460 21.216 ( 1.771 -1.370 4.062) 4.638 21.449 ( -1.264 -1.105 -1.867) 2.511 21.739 ( -0.238 0.016 1.077) 1.103 21.847 ( 0.613 0.269 -1.851) 1.968 24.115 ( 1.928 0.854 -1.307) 2.481 24.123 ( -0.548 0.824 -0.343) 1.047 28.230 ( -0.177 1.033 1.070) 1.498 28.282 ( -0.261 -0.051 0.199) 0.333 33.030 ( 2.708 7.544 4.178) 9.039 33.410 ( -19.929 -3.034 2.328) 20.293 36.554 ( -1.138 0.453 0.753) 1.438 36.778 ( 1.170 0.206 -6.648) 6.754 39.905 ( 0.932 -6.756 8.865) 11.185 40.203 ( 7.447 0.040 -3.292) 8.142 40.598 ( -6.915 1.762 5.760) 9.170 41.380 ( 8.140 16.071 -22.402) 28.747 ======================= Grid point 210 (108/165) ======================= q-point: (-0.12 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -1.529 9.550 17.737) 20.203 2.192 ( -14.293 8.981 25.270) 30.390 2.624 ( -7.090 1.945 -7.777) 10.702 2.888 ( 1.947 9.145 7.189) 11.794 3.041 ( 4.189 18.963 13.667) 23.747 3.431 ( 7.189 -8.814 -7.599) 13.679 3.512 ( -5.936 3.450 16.686) 18.044 3.795 ( 5.563 2.692 -8.988) 10.907 4.002 ( 0.338 -1.502 -7.274) 7.435 4.205 ( -8.323 8.185 2.538) 11.946 4.361 ( 4.286 4.382 -5.856) 8.477 4.427 ( 2.473 0.659 -8.463) 8.842 4.765 ( 0.397 4.376 -3.666) 5.723 5.098 ( -8.719 -2.361 12.210) 15.188 5.201 ( 8.854 -1.861 5.459) 10.566 5.302 ( -7.806 -1.465 -1.329) 8.053 5.380 ( -1.831 0.421 -0.319) 1.906 5.521 ( -0.786 -7.807 -0.494) 7.862 5.672 ( 9.319 -2.482 -0.380) 9.651 5.769 ( 3.200 -4.608 -0.901) 5.682 5.886 ( 1.040 -7.556 0.239) 7.631 6.055 ( 0.295 -2.470 -1.819) 3.081 6.162 ( -1.344 2.165 -0.338) 2.570 6.360 ( 0.777 -6.818 -8.789) 11.151 6.387 ( -1.355 -0.316 -6.191) 6.346 6.514 ( -4.832 0.863 -8.477) 9.795 6.687 ( 0.201 -8.493 7.516) 11.344 6.781 ( 1.628 -2.649 5.619) 6.422 6.996 ( 9.991 4.436 8.616) 13.919 7.193 ( -4.026 -1.698 -2.142) 4.866 7.233 ( -3.963 -6.124 -1.416) 7.431 7.342 ( -5.907 5.320 -0.008) 7.950 7.487 ( 1.270 2.891 -2.449) 3.996 7.543 ( -8.407 1.148 -0.670) 8.511 7.612 ( 0.764 1.006 2.986) 3.243 7.766 ( -3.068 -2.671 3.381) 5.289 7.915 ( 10.060 1.633 0.478) 10.202 8.021 ( 2.773 -0.696 0.202) 2.866 8.200 ( 2.748 -5.712 0.697) 6.377 8.311 ( -6.693 -1.224 -0.575) 6.828 9.036 ( 2.448 -3.342 6.310) 7.548 9.549 ( 3.160 0.091 -11.852) 12.266 13.115 ( -3.628 0.736 1.144) 3.874 13.188 ( 5.212 2.334 -1.266) 5.849 14.675 ( -6.400 1.228 3.393) 7.347 14.833 ( 3.441 -1.616 -1.812) 4.211 17.306 ( -2.103 -0.107 -0.653) 2.205 17.324 ( 1.201 0.274 -0.982) 1.576 17.731 ( -7.746 0.481 4.226) 8.837 17.929 ( 7.444 0.053 -2.352) 7.807 21.297 ( 2.200 -3.352 3.532) 5.343 21.442 ( -0.849 -0.588 -1.813) 2.087 21.748 ( 0.190 -0.631 0.908) 1.122 21.838 ( 0.542 0.726 -1.755) 1.975 24.089 ( -0.980 1.740 -0.370) 2.031 24.119 ( 1.359 0.736 -1.115) 1.906 28.216 ( -0.166 1.105 1.205) 1.643 28.272 ( -0.174 0.923 -0.513) 1.070 32.991 ( 3.629 4.498 6.083) 8.391 33.185 ( -21.812 0.523 1.579) 21.875 36.510 ( -2.462 2.504 1.320) 3.751 36.757 ( 1.392 0.610 -6.069) 6.256 39.943 ( -12.403 -3.746 7.240) 14.842 40.349 ( 11.552 0.690 -3.586) 12.116 40.573 ( 3.410 -1.964 3.882) 5.528 41.158 ( 13.584 14.697 -17.415) 26.529 ======================= Grid point 213 (109/165) ======================= q-point: ( 0.25 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( 13.765 -0.000 10.146) 17.101 2.467 ( -1.110 0.000 -6.673) 6.764 2.725 ( 14.766 -0.000 -1.537) 14.846 2.859 ( 1.364 -0.000 20.411) 20.457 3.294 ( 13.046 -0.000 -10.729) 16.891 3.295 ( 14.781 -0.000 -6.787) 16.265 3.886 ( -5.880 0.000 5.292) 7.911 3.911 ( 0.827 -0.000 -2.102) 2.259 4.003 ( 7.522 -0.000 -0.673) 7.552 4.209 ( -12.925 0.000 5.453) 14.028 4.242 ( 9.691 -0.000 3.094) 10.173 4.441 ( 10.972 -0.000 9.079) 14.241 4.499 ( -8.298 0.000 6.616) 10.613 4.972 ( -14.050 0.000 10.569) 17.582 4.986 ( -12.623 0.000 4.661) 13.456 5.183 ( -3.490 0.000 5.298) 6.344 5.199 ( -0.459 0.000 1.336) 1.413 5.632 ( -1.279 0.000 -14.527) 14.583 5.642 ( -4.093 0.000 9.859) 10.675 5.865 ( 1.244 -0.000 -11.369) 11.437 5.990 ( 0.389 -0.000 -10.096) 10.104 6.006 ( -5.340 0.000 2.427) 5.866 6.163 ( -3.244 0.000 0.537) 3.288 6.331 ( -1.275 0.000 -2.561) 2.860 6.336 ( 6.453 -0.000 -10.286) 12.142 6.372 ( 6.201 -0.000 0.503) 6.221 6.456 ( -3.489 0.000 0.612) 3.543 6.672 ( -8.789 0.000 3.949) 9.635 6.979 ( 3.964 -0.000 1.313) 4.176 7.121 ( 3.077 -0.000 7.133) 7.769 7.136 ( -1.319 0.000 -4.251) 4.451 7.337 ( -4.556 0.000 -4.181) 6.184 7.459 ( -1.487 0.000 5.979) 6.161 7.603 ( -4.895 0.000 5.004) 7.000 7.769 ( -7.471 0.000 3.275) 8.157 7.920 ( 0.365 -0.000 -4.401) 4.416 8.077 ( 1.850 -0.000 2.449) 3.069 8.111 ( 1.133 -0.000 0.189) 1.149 8.206 ( 4.572 -0.000 0.776) 4.638 8.527 ( 14.331 -0.000 -6.721) 15.829 9.031 ( -6.709 0.000 1.044) 6.790 9.214 ( -13.636 0.000 -7.707) 15.663 13.055 ( 4.896 -0.000 -1.080) 5.014 13.299 ( 1.077 -0.000 3.193) 3.370 14.508 ( -1.576 0.000 2.150) 2.666 14.928 ( 0.271 -0.000 -0.281) 0.390 17.334 ( 3.511 -0.000 -2.183) 4.134 17.383 ( 1.279 -0.000 0.388) 1.337 17.522 ( -1.550 0.000 0.497) 1.628 17.974 ( -4.459 0.000 0.662) 4.508 21.330 ( -0.920 0.000 -3.007) 3.144 21.356 ( -3.413 0.000 2.028) 3.970 21.808 ( 0.551 -0.000 -0.837) 1.002 21.852 ( 0.343 -0.000 -0.708) 0.787 24.070 ( 2.185 -0.000 -0.612) 2.269 24.121 ( -0.075 0.000 -0.535) 0.540 28.217 ( -0.019 0.000 1.729) 1.729 28.237 ( 0.103 -0.000 -1.017) 1.022 33.025 ( 13.562 -0.000 0.062) 13.562 33.594 ( 3.694 -0.000 18.292) 18.661 36.486 ( -0.037 0.000 5.711) 5.711 36.689 ( 1.876 -0.000 -5.565) 5.873 39.471 ( -6.259 0.000 3.618) 7.229 40.405 ( -4.008 0.000 -0.043) 4.009 40.501 ( 2.284 -0.000 -2.749) 3.574 41.910 ( 18.578 -0.000 -23.395) 29.875 ======================= Grid point 214 (110/165) ======================= q-point: ( 0.38 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 4.522 5.161 -8.313) 10.779 2.498 ( 6.173 -2.364 2.177) 6.959 2.894 ( 12.365 -2.251 0.974) 12.606 3.032 ( 0.862 -2.089 17.681) 17.825 3.375 ( 14.053 4.307 -4.304) 15.315 3.516 ( 14.553 -4.440 -8.095) 17.234 3.734 ( 2.782 8.767 0.842) 9.237 3.866 ( -5.944 8.249 -1.482) 10.275 4.080 ( -4.443 -6.660 4.260) 9.069 4.193 ( -8.648 -6.047 11.300) 15.461 4.321 ( 0.940 -1.741 -1.824) 2.691 4.481 ( 3.954 -9.445 7.954) 12.966 4.695 ( -6.078 -7.452 5.092) 10.881 4.853 ( 4.666 1.687 8.491) 9.835 4.916 ( -11.529 -2.708 4.364) 12.622 5.084 ( 0.547 5.767 8.122) 9.976 5.255 ( -5.935 -1.557 3.169) 6.906 5.481 ( -0.718 4.117 -3.276) 5.310 5.611 ( -15.411 0.505 -6.175) 16.610 5.787 ( 2.001 -1.685 -1.005) 2.802 5.922 ( -4.312 5.319 -0.229) 6.851 6.010 ( 2.464 1.967 0.750) 3.240 6.170 ( -1.015 -3.120 -1.231) 3.504 6.266 ( -2.553 1.303 -3.845) 4.796 6.343 ( 10.416 4.991 -6.597) 13.301 6.454 ( 9.022 -2.321 -1.981) 9.524 6.496 ( -0.254 1.866 0.004) 1.884 6.657 ( -4.210 -8.727 1.469) 9.800 6.966 ( 0.713 4.510 -0.180) 4.570 7.058 ( -1.125 3.488 -4.239) 5.604 7.170 ( 3.483 2.019 1.993) 4.492 7.362 ( -0.797 -6.222 -1.442) 6.437 7.450 ( -2.981 1.055 6.898) 7.588 7.529 ( -2.572 2.742 2.911) 4.755 7.717 ( -5.181 -1.680 -0.422) 5.463 7.943 ( -2.101 -4.625 -1.467) 5.287 8.060 ( 0.681 6.134 0.043) 6.172 8.099 ( 0.484 0.926 3.567) 3.717 8.217 ( 2.183 2.180 -0.711) 3.166 8.753 ( 11.569 -10.181 -10.312) 18.542 8.895 ( -12.638 6.204 0.074) 14.079 8.987 ( -11.041 1.802 -4.585) 12.090 13.108 ( 7.172 1.967 -0.895) 7.491 13.330 ( 1.245 -0.125 2.829) 3.094 14.517 ( -0.061 -1.177 1.993) 2.316 14.924 ( -1.147 -0.140 -0.312) 1.196 17.350 ( 3.048 1.579 -1.581) 3.779 17.383 ( 0.622 1.569 -0.059) 1.689 17.544 ( 1.489 -2.613 -0.370) 3.030 17.929 ( -6.872 -2.150 1.153) 7.292 21.271 ( -1.419 2.799 -0.103) 3.140 21.365 ( -1.948 -2.908 -0.779) 3.586 21.800 ( -0.431 0.666 -0.444) 0.910 21.850 ( 0.037 -0.028 -1.020) 1.021 24.094 ( 2.498 0.061 -1.102) 2.731 24.121 ( -0.219 -0.441 -0.286) 0.570 28.228 ( -0.282 -0.625 1.640) 1.777 28.238 ( 0.065 -0.410 -0.828) 0.926 33.188 ( 14.446 1.076 -0.070) 14.486 33.655 ( -2.886 2.598 16.211) 16.670 36.512 ( -0.221 -0.188 5.856) 5.864 36.704 ( 3.111 -1.060 -5.310) 6.245 39.457 ( -0.882 -1.512 5.128) 5.418 40.333 ( -2.408 3.796 2.220) 5.013 40.556 ( -0.602 -5.369 -2.621) 6.005 41.967 ( 13.684 3.259 -24.814) 28.524 ======================= Grid point 215 (111/165) ======================= q-point: (-0.50 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 5.273 -1.983 -7.007) 8.991 2.578 ( 4.910 4.208 6.091) 8.883 3.001 ( 0.154 5.596 12.172) 13.398 3.116 ( 1.880 -4.895 0.617) 5.280 3.350 ( 2.348 7.013 -4.012) 8.414 3.609 ( -3.747 -0.079 -3.262) 4.968 3.691 ( -2.634 11.337 9.367) 14.940 3.719 ( 7.482 1.486 -6.768) 10.198 4.046 ( 1.570 -4.426 1.434) 4.911 4.350 ( -2.264 -2.749 5.178) 6.284 4.412 ( -1.342 -8.934 1.723) 9.197 4.588 ( 4.467 0.476 7.537) 8.774 4.770 ( 2.897 -3.965 1.478) 5.129 4.872 ( -8.375 -10.320 1.707) 13.400 5.051 ( -1.036 -6.761 9.353) 11.587 5.068 ( -9.110 -0.158 8.446) 12.424 5.206 ( 4.159 -2.607 4.802) 6.867 5.394 ( -7.411 2.528 -3.140) 8.436 5.468 ( 5.869 4.542 -6.904) 10.136 5.720 ( -5.700 5.617 7.578) 11.021 5.811 ( 5.217 9.247 -1.844) 10.776 6.023 ( -3.113 -1.152 1.110) 3.500 6.160 ( -6.369 -1.921 -1.126) 6.747 6.280 ( 4.634 -2.396 -3.145) 6.092 6.327 ( -5.409 -1.283 1.184) 5.684 6.438 ( 3.304 5.245 2.364) 6.635 6.636 ( 17.272 -0.781 -8.603) 19.311 6.710 ( -0.827 1.110 -3.665) 3.918 6.903 ( -3.210 0.239 1.665) 3.623 7.003 ( -1.762 -3.719 -4.476) 6.081 7.176 ( 3.086 2.954 0.661) 4.323 7.386 ( -5.156 0.182 -0.843) 5.228 7.454 ( 0.994 -4.107 1.812) 4.598 7.566 ( 5.065 -0.490 1.772) 5.388 7.694 ( -2.397 -1.874 1.440) 3.366 7.912 ( -0.878 4.998 -0.372) 5.088 8.016 ( -4.604 -1.248 0.234) 4.776 8.114 ( 1.467 -0.868 2.588) 3.098 8.195 ( -1.570 0.916 0.065) 1.819 8.529 ( -15.463 11.505 -4.776) 19.856 8.854 ( -5.037 0.652 -3.022) 5.910 9.048 ( 8.344 -12.241 -7.523) 16.615 13.154 ( 8.238 3.237 -0.744) 8.882 13.342 ( 0.001 1.184 1.899) 2.238 14.561 ( 1.530 -2.168 1.924) 3.278 14.897 ( -3.233 0.283 -0.148) 3.249 17.349 ( 2.337 1.617 -1.144) 3.064 17.361 ( 0.486 1.593 -0.555) 1.756 17.620 ( 3.785 -3.001 -0.305) 4.840 17.886 ( -8.257 -2.883 1.389) 8.855 21.223 ( -0.928 1.910 1.405) 2.546 21.383 ( -1.380 -2.615 -1.769) 3.446 21.777 ( -0.959 0.960 0.187) 1.370 21.846 ( -0.013 -0.195 -1.360) 1.374 24.111 ( 1.185 -0.030 -1.104) 1.620 24.131 ( 1.037 -0.394 -0.549) 1.238 28.241 ( -0.341 -0.745 0.416) 0.919 28.245 ( -0.132 -0.683 0.702) 0.989 33.303 ( 11.717 5.006 1.568) 12.838 33.595 ( -7.473 4.201 11.188) 14.095 36.533 ( -1.020 -0.334 4.886) 5.002 36.741 ( 3.791 -1.166 -5.386) 6.689 39.545 ( 4.227 -3.680 7.184) 9.112 40.262 ( -1.292 3.387 1.806) 4.050 40.604 ( -3.804 -4.364 0.308) 5.798 41.917 ( 9.518 6.353 -25.799) 28.223 ======================= Grid point 216 (112/165) ======================= q-point: (-0.38 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.318 ( 1.419 5.203 0.063) 5.393 2.527 ( -1.896 6.466 3.645) 7.661 2.954 ( -0.128 0.002 5.844) 5.846 3.108 ( 0.616 8.986 -4.202) 9.939 3.263 ( -8.086 4.594 9.258) 13.123 3.417 ( -11.579 4.426 11.115) 16.650 3.631 ( -4.115 -4.295 -1.025) 6.036 3.801 ( 17.278 1.484 -15.710) 23.399 4.151 ( 6.165 1.729 1.971) 6.699 4.331 ( -0.695 1.553 4.355) 4.676 4.525 ( -0.850 -5.734 2.534) 6.326 4.706 ( 1.218 -1.304 4.185) 4.550 4.799 ( -4.106 2.301 7.650) 8.982 4.948 ( -4.410 -11.850 -3.457) 13.109 5.017 ( -1.876 0.916 4.793) 5.228 5.105 ( -6.787 -2.737 11.049) 13.253 5.277 ( -3.116 4.954 1.255) 5.985 5.400 ( 7.233 -4.020 2.829) 8.745 5.483 ( 13.109 2.114 -2.983) 13.609 5.659 ( -5.468 0.020 3.029) 6.251 5.797 ( 7.271 -1.130 5.128) 8.969 5.985 ( -2.398 0.267 -1.775) 2.995 6.121 ( -2.945 -2.124 -3.306) 4.911 6.206 ( -4.834 1.326 0.912) 5.095 6.353 ( -1.912 8.222 2.160) 8.713 6.435 ( 7.787 -1.426 -3.941) 8.843 6.619 ( -7.419 -3.767 -4.076) 9.265 6.796 ( 8.531 1.549 -7.852) 11.698 6.896 ( 5.332 -0.141 -2.367) 5.835 7.079 ( -2.902 -7.019 -0.250) 7.600 7.176 ( -0.461 -1.558 2.714) 3.163 7.326 ( -2.137 0.485 -0.397) 2.227 7.544 ( -1.452 -3.809 2.555) 4.811 7.587 ( 4.534 2.508 -4.061) 6.583 7.731 ( -0.713 -2.113 1.781) 2.854 7.817 ( -3.901 3.776 0.938) 5.510 7.960 ( -2.118 1.911 0.178) 2.858 8.114 ( -3.568 2.506 -1.186) 4.519 8.196 ( 0.793 -2.925 0.290) 3.045 8.205 ( -7.020 8.743 0.552) 11.226 8.820 ( -1.807 -2.800 1.133) 3.519 9.277 ( 5.386 -11.237 -11.433) 16.912 13.192 ( 7.118 3.513 -0.089) 7.938 13.307 ( -1.283 2.646 0.280) 2.953 14.632 ( 2.446 -2.500 2.135) 4.098 14.840 ( -4.497 0.744 -0.153) 4.561 17.340 ( -0.320 0.940 -0.662) 1.193 17.345 ( 1.561 1.293 -1.200) 2.356 17.714 ( 3.482 -2.439 1.221) 4.423 17.844 ( -5.760 -2.651 0.544) 6.364 21.204 ( -0.535 0.513 2.877) 2.971 21.398 ( -0.776 -2.076 -2.375) 3.249 21.754 ( -0.885 0.764 0.784) 1.408 21.844 ( 0.079 -0.338 -1.644) 1.680 24.119 ( 0.334 -0.324 -0.585) 0.748 24.144 ( 1.397 0.254 -1.257) 1.896 28.248 ( 0.237 -0.035 0.345) 0.420 28.259 ( -0.693 -1.128 1.093) 1.716 33.299 ( 3.208 9.025 5.558) 11.074 33.476 ( -5.222 5.045 4.689) 8.643 36.540 ( -2.122 -0.646 3.205) 3.897 36.773 ( 3.654 -0.362 -5.901) 6.950 39.717 ( 5.438 -4.972 9.476) 12.004 40.226 ( 3.029 1.700 -1.214) 3.679 40.600 ( -6.639 -1.797 4.216) 8.067 41.772 ( 6.202 9.140 -26.362) 28.583 ======================= Grid point 217 (113/165) ======================= q-point: (-0.25 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( -5.150 16.485 5.178) 18.030 2.415 ( -2.709 5.517 4.540) 7.642 2.824 ( -16.822 10.382 5.918) 20.635 3.055 ( 4.989 1.200 -3.761) 6.362 3.191 ( 4.378 -1.261 8.848) 9.952 3.344 ( -1.214 1.748 -0.434) 2.172 3.620 ( -7.881 -1.567 6.164) 10.127 3.934 ( 13.108 -0.501 -10.892) 17.050 4.192 ( 4.888 6.376 0.651) 8.061 4.307 ( 8.256 6.085 9.451) 13.946 4.502 ( -8.846 2.207 2.737) 9.519 4.544 ( -3.624 9.364 -5.699) 11.545 4.941 ( -5.304 -7.452 19.091) 21.169 4.976 ( -6.766 -2.252 6.829) 9.874 5.059 ( 3.300 -0.358 -1.290) 3.562 5.163 ( -0.488 -8.936 -4.074) 9.833 5.212 ( -1.044 -1.173 6.586) 6.771 5.497 ( 5.775 6.325 -2.992) 9.073 5.550 ( 6.032 -4.148 0.806) 7.365 5.718 ( 8.605 -1.637 -1.836) 8.950 5.823 ( -8.520 -0.133 0.584) 8.541 6.031 ( 3.494 -3.315 -0.745) 4.874 6.109 ( -1.106 -0.065 -3.725) 3.886 6.218 ( -2.183 0.156 -0.486) 2.242 6.277 ( 1.689 -7.579 0.837) 7.810 6.446 ( 3.601 2.056 -6.543) 7.746 6.597 ( -4.123 1.166 -3.444) 5.498 6.755 ( -1.384 -1.848 -1.358) 2.678 7.021 ( 6.330 -2.836 -0.729) 6.975 7.068 ( -10.747 -3.980 1.606) 11.572 7.200 ( -2.203 -0.080 3.423) 4.071 7.378 ( 6.357 -1.328 1.506) 6.667 7.508 ( -7.299 -1.005 -1.279) 7.478 7.558 ( 1.553 4.755 -2.983) 5.824 7.692 ( -6.120 1.665 1.790) 6.590 7.802 ( 1.899 -1.954 -1.641) 3.181 7.943 ( 6.021 3.019 1.038) 6.815 8.049 ( 1.894 1.625 -0.235) 2.506 8.084 ( -2.330 1.601 2.630) 3.861 8.252 ( 1.268 -2.273 -1.167) 2.852 8.900 ( 0.510 -5.467 5.018) 7.438 9.408 ( -0.873 -8.667 -13.559) 16.116 13.175 ( -2.682 3.252 1.429) 4.451 13.273 ( 5.090 2.891 -1.938) 6.166 14.688 ( -1.342 -0.515 3.160) 3.472 14.794 ( -0.372 -0.623 -0.850) 1.118 17.313 ( -1.840 0.646 -0.669) 2.062 17.337 ( 0.864 0.724 -1.169) 1.624 17.731 ( -5.997 -0.771 3.796) 7.139 17.894 ( 6.645 -2.545 -1.788) 7.337 21.220 ( -0.621 -1.393 3.905) 4.192 21.411 ( 0.298 -1.369 -2.573) 2.929 21.742 ( -0.379 0.196 1.111) 1.190 21.844 ( 0.209 -0.268 -1.869) 1.900 24.119 ( -0.688 0.025 -0.437) 0.815 24.145 ( 1.335 0.779 -1.425) 2.102 28.248 ( 0.181 0.696 0.939) 1.182 28.272 ( -0.546 -0.906 0.530) 1.183 33.170 ( -6.852 7.026 7.354) 12.263 33.359 ( 1.761 9.332 2.147) 9.736 36.530 ( -3.122 -0.577 1.886) 3.693 36.783 ( 3.000 0.795 -6.176) 6.912 39.840 ( -4.344 -2.652 9.780) 11.025 40.319 ( 15.126 -1.972 -4.342) 15.860 40.554 ( -6.834 -0.229 6.689) 9.566 41.564 ( 5.171 10.628 -25.280) 27.907 ======================= Grid point 218 (114/165) ======================= q-point: (-0.12 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( -2.724 13.303 9.506) 16.576 2.341 ( -0.360 7.749 16.528) 18.258 2.544 ( -8.692 5.050 -0.829) 10.087 3.022 ( 1.755 5.263 2.928) 6.273 3.224 ( -4.077 0.252 -6.316) 7.522 3.460 ( 10.922 -4.668 -1.302) 11.949 3.582 ( 0.648 2.491 13.397) 13.642 3.936 ( -3.566 3.714 -4.970) 7.156 4.092 ( 13.870 14.669 6.717) 21.277 4.271 ( -10.427 11.168 -0.088) 15.279 4.418 ( 1.839 3.076 -4.896) 6.068 4.468 ( 9.107 -2.437 -0.173) 9.430 4.866 ( -6.380 7.212 8.627) 12.928 4.983 ( -5.931 -4.219 5.144) 8.912 5.094 ( -11.630 -4.153 9.466) 15.560 5.264 ( -0.704 -3.303 5.929) 6.823 5.342 ( 1.460 -7.896 -5.366) 9.657 5.490 ( 8.712 3.681 -9.201) 13.195 5.680 ( 4.311 -5.167 -4.324) 7.998 5.751 ( -0.517 -2.776 -0.494) 2.867 5.833 ( 5.504 -2.037 1.377) 6.029 6.034 ( 2.057 1.093 -5.144) 5.647 6.114 ( -3.816 -3.739 -1.433) 5.531 6.248 ( 2.350 -4.012 -4.922) 6.771 6.312 ( -3.542 -2.601 -1.288) 4.580 6.434 ( -6.563 3.224 -6.536) 9.807 6.603 ( 3.167 -9.228 4.348) 10.681 6.797 ( -1.622 0.425 4.162) 4.487 6.990 ( -11.351 -2.570 2.428) 11.889 7.085 ( -6.161 -6.353 2.657) 9.240 7.201 ( 1.071 3.570 3.661) 5.225 7.362 ( -1.684 4.446 -2.556) 5.398 7.455 ( 2.142 -2.477 -0.744) 3.359 7.587 ( 0.058 0.475 1.528) 1.601 7.647 ( 4.615 -0.571 0.127) 4.652 7.773 ( 0.938 5.410 0.429) 5.508 7.989 ( 2.735 -1.493 -2.501) 3.996 8.099 ( 7.404 0.695 -1.154) 7.526 8.117 ( -1.961 -4.253 3.246) 5.698 8.310 ( 8.272 -0.157 -0.853) 8.318 9.008 ( -0.890 -4.720 5.816) 7.543 9.413 ( -7.448 -6.404 -12.769) 16.110 13.083 ( -5.175 1.894 0.239) 5.516 13.288 ( 4.776 2.591 -0.776) 5.489 14.643 ( -4.624 1.547 2.717) 5.581 14.843 ( 3.382 -1.654 -0.035) 3.765 17.277 ( -2.185 0.234 -0.475) 2.248 17.335 ( 0.611 0.063 -0.926) 1.112 17.677 ( -5.537 0.491 3.317) 6.473 18.001 ( 6.999 -0.826 -1.908) 7.301 21.261 ( -1.750 -3.186 3.477) 5.030 21.428 ( 1.676 -0.615 -2.142) 2.789 21.748 ( 0.266 -0.425 0.959) 1.082 21.841 ( 0.462 -0.005 -1.839) 1.896 24.095 ( -1.329 0.987 -0.632) 1.771 24.142 ( 1.057 0.782 -0.979) 1.639 28.239 ( -0.050 1.180 1.303) 1.759 28.275 ( -0.378 0.001 -0.134) 0.401 33.009 ( -8.614 5.025 5.878) 11.576 33.269 ( 6.804 9.331 5.183) 12.657 36.503 ( -3.129 0.298 2.001) 3.726 36.768 ( 2.185 1.463 -5.907) 6.466 39.799 ( -10.895 -0.587 6.327) 12.612 40.443 ( -1.254 2.005 6.539) 6.953 40.605 ( 11.830 -3.411 -6.685) 14.010 41.398 ( 11.500 7.357 -20.926) 24.985 ======================= Grid point 222 (115/165) ======================= q-point: ( 0.38 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( -0.665 0.000 -13.297) 13.314 2.682 ( 14.552 -0.000 5.851) 15.684 2.978 ( 11.279 -0.000 -7.712) 13.663 3.083 ( -8.695 0.000 17.942) 19.938 3.514 ( -0.413 0.000 -8.051) 8.062 3.606 ( 16.743 -0.000 -1.846) 16.845 3.924 ( -13.342 0.000 17.495) 22.002 3.935 ( 8.207 -0.000 -3.131) 8.784 3.983 ( -1.783 0.000 4.288) 4.644 4.029 ( -0.408 0.000 0.473) 0.625 4.270 ( 4.881 -0.000 1.623) 5.144 4.531 ( 3.026 -0.000 6.807) 7.449 4.578 ( -7.795 0.000 5.874) 9.760 4.752 ( -10.549 0.000 9.534) 14.219 4.933 ( 1.802 -0.000 5.113) 5.421 5.182 ( -5.668 0.000 1.102) 5.774 5.288 ( 8.766 -0.000 0.918) 8.814 5.351 ( -8.308 0.000 1.887) 8.519 5.593 ( 5.568 -0.000 -9.804) 11.275 5.790 ( 3.955 -0.000 1.308) 4.165 5.891 ( -5.973 0.000 5.702) 8.257 6.054 ( -5.048 0.000 -1.300) 5.212 6.073 ( -7.868 0.000 3.533) 8.625 6.213 ( -4.729 0.000 -2.787) 5.489 6.464 ( 2.548 -0.000 -0.044) 2.548 6.482 ( -8.165 0.000 3.630) 8.935 6.536 ( 7.643 -0.000 -0.430) 7.655 6.640 ( 22.301 -0.000 -10.618) 24.700 6.948 ( -5.860 0.000 -11.888) 13.254 7.039 ( 0.256 -0.000 1.059) 1.090 7.268 ( 0.527 -0.000 -2.456) 2.512 7.328 ( 5.608 -0.000 2.629) 6.194 7.475 ( -2.044 0.000 6.749) 7.052 7.552 ( 1.227 -0.000 0.043) 1.228 7.633 ( -5.080 0.000 7.294) 8.889 7.859 ( -2.969 0.000 -2.512) 3.889 8.066 ( -3.355 0.000 1.004) 3.502 8.132 ( -0.297 0.000 0.508) 0.588 8.296 ( 1.673 -0.000 1.313) 2.126 8.721 ( 9.182 -0.000 -12.918) 15.849 8.757 ( -18.521 0.000 -5.809) 19.411 8.862 ( -8.481 0.000 1.050) 8.545 13.215 ( 8.388 -0.000 -0.714) 8.418 13.362 ( 1.884 -0.000 1.972) 2.728 14.525 ( 1.432 -0.000 2.344) 2.747 14.901 ( -2.085 0.000 -1.207) 2.409 17.380 ( 1.213 -0.000 -0.890) 1.505 17.407 ( 0.367 -0.000 0.090) 0.378 17.551 ( 4.614 -0.000 -1.277) 4.787 17.827 ( -8.375 0.000 1.601) 8.526 21.290 ( -3.631 0.000 1.661) 3.993 21.305 ( 0.987 -0.000 -2.741) 2.914 21.794 ( -1.115 0.000 -0.158) 1.126 21.842 ( -0.435 0.000 -1.081) 1.165 24.111 ( -0.452 0.000 -0.152) 0.477 24.121 ( 2.613 -0.000 -1.419) 2.973 28.225 ( -0.637 0.000 1.421) 1.557 28.233 ( 0.457 -0.000 -0.839) 0.955 33.383 ( 16.472 -0.000 -0.156) 16.473 33.681 ( -8.393 0.000 14.895) 17.097 36.528 ( -1.442 0.000 6.203) 6.368 36.720 ( 4.802 -0.000 -4.913) 6.869 39.488 ( 3.972 -0.000 6.686) 7.776 40.381 ( -1.158 0.000 8.067) 8.150 40.464 ( -2.098 0.000 -6.472) 6.804 42.017 ( 9.546 -0.000 -26.551) 28.216 ======================= Grid point 223 (116/165) ======================= q-point: (-0.50 -0.62 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 6.289 -3.497 -6.434) 9.653 2.768 ( 3.348 6.394 3.514) 8.028 2.998 ( -15.319 -1.185 11.197) 19.012 3.103 ( 7.301 -3.727 -4.138) 9.182 3.380 ( -9.632 2.900 -1.809) 10.221 3.689 ( -3.243 15.516 3.413) 16.215 3.786 ( -8.152 6.887 4.146) 11.448 3.836 ( 15.626 -2.295 -2.985) 16.074 4.100 ( 12.008 -2.571 3.039) 12.651 4.209 ( -6.346 -11.134 3.815) 13.371 4.379 ( 6.775 0.532 3.116) 7.476 4.578 ( -3.540 -4.382 -0.009) 5.633 4.623 ( -2.487 -6.102 14.157) 15.615 4.722 ( -3.738 -3.765 5.194) 7.425 5.002 ( -0.108 -3.964 2.545) 4.712 5.115 ( 2.032 -0.090 1.515) 2.536 5.305 ( 5.406 3.469 4.532) 7.862 5.372 ( 3.419 3.180 -3.041) 5.572 5.572 ( 4.866 4.152 -6.909) 9.415 5.784 ( -2.572 3.069 7.366) 8.385 5.928 ( -8.653 2.373 1.742) 9.140 5.949 ( 0.226 -1.929 -1.029) 2.198 6.024 ( -5.902 -4.572 2.668) 7.928 6.177 ( -4.322 -5.105 2.053) 6.997 6.338 ( -3.558 5.977 0.557) 6.978 6.533 ( 3.474 -0.231 1.887) 3.960 6.639 ( 2.001 -3.053 -4.468) 5.770 6.839 ( 14.948 -0.540 -4.491) 15.617 6.891 ( 3.261 -1.791 -10.156) 10.816 6.987 ( 0.301 6.199 -3.688) 7.219 7.226 ( -1.546 2.272 1.148) 2.979 7.347 ( -4.722 2.341 -0.694) 5.316 7.428 ( 0.972 0.348 1.889) 2.152 7.626 ( 4.300 -1.523 -4.387) 6.329 7.663 ( -0.224 -1.762 11.663) 11.798 7.859 ( -3.540 -4.864 -0.427) 6.031 7.996 ( -3.151 3.863 0.090) 4.986 8.137 ( 0.025 -0.458 1.164) 1.251 8.243 ( -0.524 5.363 1.013) 5.483 8.481 ( -12.689 6.494 -3.717) 14.731 8.770 ( -7.046 -0.829 -1.556) 7.263 8.868 ( 3.426 -12.487 -10.572) 16.716 13.291 ( 7.813 2.095 -0.609) 8.112 13.375 ( 0.703 1.362 0.674) 1.675 14.571 ( 2.896 -1.178 2.698) 4.130 14.861 ( -3.195 0.467 -1.642) 3.622 17.377 ( 0.153 1.050 -0.352) 1.118 17.394 ( 0.136 1.426 -0.342) 1.473 17.631 ( 5.872 -2.149 -0.701) 6.292 17.752 ( -8.143 -2.300 1.389) 8.575 21.239 ( -2.469 1.391 1.452) 3.184 21.330 ( 0.703 -1.971 -2.236) 3.063 21.775 ( -1.334 0.464 0.403) 1.469 21.833 ( -0.570 -0.280 -1.220) 1.375 24.107 ( -0.362 -0.249 -0.121) 0.455 24.143 ( 1.977 -0.131 -1.635) 2.569 28.225 ( -0.942 -0.619 1.117) 1.586 28.241 ( 0.773 -0.322 -0.478) 0.965 33.537 ( 8.977 5.136 4.102) 11.126 33.605 ( -4.452 1.963 7.965) 9.333 36.529 ( -2.951 -0.096 5.447) 6.196 36.765 ( 5.701 -0.132 -4.725) 7.406 39.609 ( 8.126 -1.792 8.389) 11.815 40.325 ( -0.988 4.587 -0.189) 4.696 40.488 ( -3.771 -4.993 3.375) 7.109 41.963 ( 5.568 3.058 -27.670) 28.390 ======================= Grid point 224 (117/165) ======================= q-point: (-0.38 -0.62 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.381 ( 7.549 -0.883 -0.313) 7.607 2.626 ( -5.591 8.077 -0.146) 9.825 2.891 ( -14.731 -3.927 7.961) 17.198 3.179 ( -20.530 -0.006 7.245) 21.771 3.200 ( 2.596 0.288 1.189) 2.870 3.440 ( -2.346 11.126 -0.087) 11.371 3.683 ( 7.959 7.361 1.381) 10.928 3.998 ( 16.943 3.059 -9.295) 19.565 4.228 ( -7.767 -2.916 6.126) 10.313 4.307 ( 7.655 -4.066 4.877) 9.946 4.477 ( 4.729 -1.333 0.206) 4.918 4.586 ( -2.064 -5.171 -2.423) 6.072 4.702 ( -11.028 -8.457 15.130) 20.543 4.824 ( 2.375 -2.647 3.488) 4.981 5.033 ( -1.287 1.826 0.248) 2.248 5.214 ( 6.861 2.800 4.169) 8.503 5.285 ( -4.742 -3.360 2.113) 6.184 5.358 ( 1.374 1.124 -1.824) 2.545 5.621 ( 11.692 -2.085 -1.454) 11.965 5.741 ( -0.300 5.174 5.001) 7.202 5.855 ( -4.045 1.620 7.869) 8.995 5.891 ( -3.132 -3.311 -5.074) 6.820 6.049 ( -1.225 -1.194 2.091) 2.701 6.213 ( -2.070 3.813 -1.836) 4.711 6.321 ( -0.969 -10.738 2.855) 11.153 6.560 ( 4.174 4.810 0.548) 6.392 6.588 ( -0.328 6.708 -7.864) 10.342 6.806 ( -1.280 4.159 -3.185) 5.393 6.947 ( -1.707 -1.190 -0.409) 2.121 7.027 ( 12.870 -1.412 -9.207) 15.887 7.173 ( -2.992 3.625 2.548) 5.347 7.268 ( -2.162 -3.007 -0.181) 3.708 7.463 ( -2.938 -3.477 0.255) 4.559 7.649 ( 3.171 0.202 -4.123) 5.205 7.723 ( -0.678 -0.280 5.792) 5.838 7.833 ( -3.451 4.276 -0.273) 5.501 7.950 ( 0.459 -1.843 0.241) 1.915 8.111 ( -2.315 2.570 -2.315) 4.162 8.194 ( -1.021 -0.064 2.754) 2.938 8.297 ( 1.500 7.661 1.825) 8.017 8.733 ( -4.262 -4.413 0.896) 6.200 9.046 ( -0.977 -13.443 -11.680) 17.835 13.303 ( 0.074 4.278 0.478) 4.305 13.357 ( 3.999 2.220 -1.460) 4.801 14.648 ( 3.745 -1.724 3.082) 5.148 14.801 ( -3.516 0.867 -1.714) 4.006 17.349 ( -1.049 1.595 -0.244) 1.924 17.370 ( -0.163 1.265 -0.658) 1.435 17.682 ( -5.117 -1.989 2.329) 5.964 17.779 ( 5.323 -4.254 -1.111) 6.904 21.205 ( -2.471 0.238 2.369) 3.431 21.361 ( 1.546 -1.650 -2.458) 3.340 21.755 ( -1.111 0.524 0.983) 1.573 21.828 ( -0.380 -0.579 -1.387) 1.550 24.108 ( -0.423 -0.468 -0.178) 0.655 24.156 ( 1.155 -0.004 -1.711) 2.064 28.233 ( -0.992 -1.229 0.926) 1.831 28.255 ( 0.894 -0.190 0.020) 0.914 33.398 ( -11.419 6.420 8.518) 15.626 33.658 ( 13.343 8.213 1.348) 15.726 36.512 ( -3.929 -0.340 4.090) 5.682 36.806 ( 5.400 0.730 -5.098) 7.462 39.777 ( 6.492 -1.451 9.779) 11.828 40.278 ( 4.125 -0.066 -5.975) 7.261 40.518 ( -5.781 -2.177 9.379) 11.231 41.816 ( 1.984 5.470 -28.092) 28.688 ======================= Grid point 225 (118/165) ======================= q-point: (-0.25 -0.62 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( -5.499 11.931 0.306) 13.140 2.510 ( 2.956 4.757 0.747) 5.650 2.766 ( -21.194 2.113 13.023) 24.965 3.111 ( 1.991 -5.777 2.634) 6.654 3.160 ( -5.655 2.408 0.172) 6.149 3.338 ( 1.088 1.290 -0.313) 1.716 3.703 ( 10.797 6.461 3.370) 13.026 4.072 ( 10.382 4.299 -8.855) 14.307 4.221 ( -6.188 -3.779 7.295) 10.286 4.416 ( -4.470 -3.122 3.634) 6.552 4.460 ( 3.690 4.316 -3.587) 6.716 4.603 ( -3.868 3.040 0.376) 4.934 4.791 ( -6.742 -7.590 15.650) 18.654 4.932 ( 4.036 -5.512 -0.152) 6.833 4.992 ( -2.200 -1.369 6.115) 6.641 5.189 ( 3.318 6.032 -4.154) 8.041 5.282 ( 0.985 2.221 6.707) 7.133 5.416 ( -6.319 -8.976 3.720) 11.590 5.676 ( 1.104 2.208 -5.016) 5.591 5.738 ( -0.250 4.544 0.364) 4.566 5.820 ( 6.103 -2.283 -0.367) 6.527 5.988 ( 0.008 -4.412 2.951) 5.308 6.072 ( 1.039 -2.437 -3.732) 4.577 6.206 ( 2.509 -3.489 3.871) 5.784 6.316 ( -0.044 10.041 -0.719) 10.067 6.486 ( 0.178 0.120 -5.459) 5.463 6.602 ( 3.767 0.687 0.286) 3.840 6.673 ( -2.352 3.773 -7.956) 9.114 6.892 ( -6.816 -2.095 0.288) 7.136 7.071 ( -4.489 3.634 4.211) 7.147 7.173 ( 5.694 -4.710 -5.064) 8.958 7.360 ( -0.828 -4.701 0.273) 4.781 7.452 ( -1.574 -1.369 0.573) 2.163 7.647 ( 1.603 0.928 -2.166) 2.850 7.686 ( -2.854 7.046 1.903) 7.837 7.791 ( 3.606 -1.907 1.515) 4.351 8.014 ( 3.595 -2.371 -0.366) 4.322 8.056 ( 1.479 0.919 -2.949) 3.425 8.178 ( -0.035 5.450 2.415) 5.961 8.280 ( 7.674 0.554 1.521) 7.843 8.812 ( -1.953 -7.440 4.285) 8.805 9.140 ( -7.008 -10.686 -11.804) 17.397 13.192 ( -5.055 4.909 -0.264) 7.051 13.369 ( 4.039 2.397 -1.003) 4.803 14.694 ( -1.132 1.484 1.848) 2.627 14.781 ( 2.197 -2.035 0.127) 2.998 17.304 ( -1.938 1.530 -0.363) 2.496 17.347 ( -0.522 0.739 -0.745) 1.172 17.660 ( -4.597 -1.609 2.213) 5.349 17.921 ( 7.350 -4.011 -1.051) 8.439 21.194 ( -2.657 -1.143 2.976) 4.150 21.397 ( 2.554 -1.257 -2.309) 3.665 21.744 ( -0.662 0.170 1.329) 1.494 21.830 ( 0.016 -0.655 -1.574) 1.705 24.105 ( -0.931 -0.165 -0.513) 1.076 24.157 ( 0.590 0.143 -1.341) 1.472 28.246 ( -0.923 -1.341 0.712) 1.776 28.265 ( 0.760 0.234 0.550) 0.967 33.199 ( -9.974 6.342 6.452) 13.466 33.637 ( 10.378 13.036 2.543) 16.856 36.489 ( -3.748 -0.694 3.103) 4.915 36.820 ( 4.173 1.774 -5.592) 7.199 39.821 ( -4.260 1.969 6.891) 8.337 40.426 ( 16.291 -5.886 -7.183) 18.752 40.503 ( -7.048 0.064 11.707) 13.665 41.614 ( 0.565 5.867 -26.577) 27.223 ======================= Grid point 226 (119/165) ======================= q-point: (-0.12 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.041 ( -2.686 11.482 1.591) 11.899 2.511 ( 2.588 2.557 2.627) 4.487 2.569 ( -5.319 6.097 16.786) 18.634 3.054 ( -7.189 0.038 -0.320) 7.196 3.211 ( 7.256 3.400 -4.784) 9.332 3.405 ( 0.451 -7.321 -0.532) 7.354 3.765 ( 11.568 4.111 4.768) 13.170 3.972 ( -2.108 7.979 -5.005) 9.652 4.224 ( -11.050 -0.470 0.856) 11.093 4.304 ( -7.442 1.388 5.644) 9.442 4.492 ( 7.657 2.439 -6.174) 10.134 4.584 ( 2.143 -0.265 7.835) 8.127 4.835 ( -9.934 0.500 17.783) 20.375 4.947 ( 1.326 1.183 4.749) 5.071 5.066 ( -1.567 0.864 -0.221) 1.804 5.149 ( 0.845 -4.481 -2.475) 5.189 5.320 ( 2.418 1.430 4.344) 5.173 5.472 ( -8.281 -6.933 4.035) 11.529 5.637 ( -2.336 -1.453 -4.115) 4.949 5.733 ( 9.518 1.729 -4.286) 10.580 5.927 ( 0.774 -8.585 -5.282) 10.110 5.997 ( 1.727 1.757 1.070) 2.686 6.094 ( 5.233 2.855 -8.827) 10.651 6.226 ( 1.333 1.306 -0.713) 1.997 6.263 ( -2.053 3.814 0.960) 4.437 6.383 ( -9.505 4.350 -4.503) 11.382 6.515 ( 0.453 -4.311 1.127) 4.479 6.799 ( 3.393 0.041 3.714) 5.030 6.869 ( -1.330 -7.338 -0.474) 7.473 6.981 ( -4.751 1.743 2.959) 5.862 7.237 ( -2.731 2.401 0.747) 3.713 7.331 ( -2.109 -3.297 -4.951) 6.311 7.503 ( 2.502 1.506 1.953) 3.513 7.582 ( -2.007 1.687 2.754) 3.803 7.691 ( 4.459 -2.432 0.301) 5.088 7.861 ( 6.021 0.824 -1.067) 6.170 8.003 ( -3.272 4.359 -0.335) 5.461 8.094 ( 4.146 -0.821 -0.188) 4.231 8.158 ( 3.459 -0.730 1.065) 3.692 8.439 ( 16.264 -2.127 -1.990) 16.523 8.920 ( -3.215 -7.114 4.643) 9.083 9.113 ( -12.970 -7.562 -10.114) 18.103 13.060 ( -5.130 3.153 -0.786) 6.072 13.363 ( 1.466 2.245 0.192) 2.688 14.642 ( -2.211 2.314 0.989) 3.350 14.860 ( 3.380 -1.864 1.638) 4.193 17.263 ( -1.153 0.848 -0.546) 1.532 17.332 ( -0.451 -0.023 -0.705) 0.837 17.642 ( -2.752 -0.277 1.784) 3.291 18.044 ( 5.211 -2.160 -1.262) 5.781 21.202 ( -2.736 -2.291 2.757) 4.509 21.437 ( 2.810 -0.703 -1.835) 3.429 21.747 ( -0.193 -0.431 1.207) 1.296 21.835 ( 0.518 -0.502 -1.648) 1.799 24.087 ( -1.067 0.396 -0.743) 1.359 24.154 ( 0.250 0.286 -0.852) 0.933 28.254 ( -0.634 -0.227 0.833) 1.071 28.270 ( 0.177 0.247 0.559) 0.636 33.042 ( -5.156 5.004 4.850) 8.669 33.545 ( 6.928 12.336 5.049) 15.022 36.476 ( -2.397 -0.613 3.082) 3.952 36.802 ( 2.720 2.364 -5.755) 6.790 39.727 ( -8.106 2.579 4.115) 9.449 40.451 ( -7.442 1.749 11.170) 13.535 40.677 ( 14.498 -3.720 -10.231) 18.130 41.476 ( 6.698 0.984 -21.714) 22.745 ======================= Grid point 231 (120/165) ======================= q-point: (-0.50 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( 10.689 -0.000 -0.495) 10.701 2.790 ( -8.948 0.000 -9.430) 12.999 2.792 ( -23.209 0.000 11.368) 25.844 3.060 ( -6.698 0.000 3.063) 7.365 3.332 ( -2.726 0.000 5.676) 6.297 3.735 ( -13.585 0.000 -8.827) 16.201 3.835 ( 2.829 -0.000 -1.027) 3.009 3.975 ( 9.801 -0.000 5.946) 11.464 4.145 ( 13.217 -0.000 14.052) 19.291 4.232 ( 6.822 -0.000 6.687) 9.553 4.425 ( 1.470 -0.000 3.151) 3.477 4.523 ( 0.663 -0.000 -3.085) 3.155 4.658 ( -3.860 0.000 4.653) 6.045 4.707 ( 7.185 -0.000 6.992) 10.026 5.000 ( 1.908 -0.000 1.500) 2.427 5.092 ( 2.394 -0.000 -3.221) 4.013 5.340 ( -4.996 0.000 1.901) 5.346 5.530 ( 12.698 -0.000 -2.173) 12.882 5.630 ( 1.416 -0.000 -2.740) 3.085 5.777 ( -9.367 0.000 0.903) 9.411 5.815 ( -7.111 0.000 -0.716) 7.147 5.876 ( -9.742 0.000 8.220) 12.746 5.967 ( 4.924 -0.000 -0.011) 4.924 6.156 ( 0.866 -0.000 7.207) 7.259 6.341 ( -6.998 0.000 3.632) 7.885 6.510 ( 2.692 -0.000 -3.496) 4.412 6.719 ( 6.413 -0.000 -2.874) 7.028 6.815 ( 4.554 -0.000 -5.649) 7.256 6.983 ( -4.806 0.000 -1.024) 4.914 7.041 ( 16.366 -0.000 -14.145) 21.632 7.242 ( -1.547 0.000 0.540) 1.638 7.304 ( -4.493 0.000 -0.160) 4.496 7.448 ( -2.718 0.000 -0.751) 2.820 7.650 ( 5.016 -0.000 -4.394) 6.668 7.680 ( -3.989 0.000 13.611) 14.183 7.784 ( -0.204 0.000 2.115) 2.125 8.031 ( 0.736 -0.000 0.808) 1.093 8.127 ( 0.615 -0.000 0.308) 0.688 8.232 ( -8.607 0.000 -1.038) 8.669 8.467 ( 1.056 -0.000 2.972) 3.154 8.636 ( -11.039 0.000 -0.472) 11.049 8.752 ( 4.011 -0.000 -13.906) 14.473 13.386 ( 5.757 -0.000 -0.706) 5.800 13.391 ( -0.430 0.000 -0.632) 0.764 14.614 ( 3.718 -0.000 3.326) 4.989 14.821 ( -2.753 0.000 -2.779) 3.911 17.386 ( -0.214 0.000 0.105) 0.238 17.396 ( -1.307 0.000 -0.070) 1.309 17.644 ( -7.310 0.000 1.084) 7.390 17.691 ( 7.229 -0.000 -0.654) 7.258 21.215 ( -3.746 0.000 1.249) 3.949 21.329 ( 2.654 -0.000 -1.955) 3.296 21.766 ( -1.242 0.000 0.817) 1.487 21.817 ( -0.817 0.000 -1.054) 1.333 24.100 ( -0.441 0.000 -0.047) 0.444 24.154 ( 1.166 -0.000 -1.740) 2.094 28.211 ( -1.216 0.000 0.871) 1.496 28.249 ( 1.315 -0.000 -0.494) 1.405 33.508 ( -13.894 0.000 8.990) 16.549 33.797 ( 18.674 -0.000 1.103) 18.706 36.508 ( -4.368 0.000 5.238) 6.821 36.820 ( 6.677 -0.000 -4.176) 7.876 39.752 ( 11.729 -0.000 8.905) 14.727 40.298 ( -5.007 0.000 -11.342) 12.399 40.460 ( -1.663 0.000 15.134) 15.225 41.903 ( 1.276 -0.000 -29.086) 29.114 ======================= Grid point 232 (121/165) ======================= q-point: (-0.38 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.464 ( 1.859 -5.746 5.378) 8.087 2.529 ( -22.017 -0.158 -6.095) 22.846 2.624 ( -12.835 -2.054 4.804) 13.858 2.991 ( -8.786 1.007 9.388) 12.897 3.318 ( 0.938 5.554 4.987) 7.523 3.496 ( -7.996 3.660 -6.872) 11.160 3.889 ( 6.979 1.357 -0.767) 7.151 4.113 ( 0.945 -4.110 9.963) 10.819 4.221 ( 7.980 7.566 5.672) 12.373 4.391 ( 2.937 4.377 4.586) 6.987 4.520 ( 4.327 -5.684 5.939) 9.290 4.546 ( 6.234 -0.374 -6.839) 9.262 4.631 ( 3.658 -1.274 1.971) 4.346 4.802 ( -0.986 -2.848 1.886) 3.555 5.015 ( 0.276 -2.417 -1.319) 2.767 5.199 ( -1.034 -1.557 3.836) 4.267 5.226 ( -1.965 0.953 -0.975) 2.392 5.523 ( 2.397 8.762 0.226) 9.087 5.597 ( -15.231 -3.789 9.156) 18.170 5.742 ( 3.180 0.888 -6.772) 7.534 5.763 ( -3.519 -5.102 -2.713) 6.766 5.860 ( 0.221 -3.024 4.868) 5.735 6.104 ( 4.476 -5.896 -0.317) 7.409 6.176 ( 3.449 3.161 9.609) 10.687 6.294 ( 0.158 1.223 1.455) 1.907 6.548 ( 0.878 -1.741 -3.471) 3.981 6.677 ( -0.156 3.981 -7.307) 8.323 6.866 ( -2.322 1.725 -3.165) 4.288 6.935 ( 3.877 0.794 -0.670) 4.014 7.081 ( 3.638 1.959 -12.621) 13.280 7.237 ( 1.652 -0.624 1.050) 2.054 7.251 ( 0.099 3.839 0.868) 3.937 7.377 ( -5.843 0.085 0.134) 5.845 7.660 ( 2.774 -0.050 -4.814) 5.556 7.716 ( -1.257 -1.847 9.434) 9.695 7.854 ( 2.119 -1.663 1.969) 3.337 7.982 ( 1.041 5.280 1.271) 5.530 8.113 ( -2.002 0.586 0.813) 2.239 8.183 ( -0.320 -0.222 1.018) 1.090 8.482 ( 7.321 6.776 3.282) 10.501 8.565 ( -9.022 -7.603 -0.717) 11.820 8.809 ( 0.961 -8.389 -10.537) 13.503 13.341 ( -2.918 3.373 -1.673) 4.764 13.425 ( 2.844 1.022 -0.636) 3.089 14.685 ( 3.927 -1.309 3.690) 5.545 14.772 ( -1.911 0.871 -3.233) 3.855 17.363 ( -1.418 1.688 0.141) 2.209 17.374 ( -1.342 0.760 -0.045) 1.543 17.594 ( -4.345 -1.990 0.611) 4.818 17.796 ( 6.835 -2.849 -0.146) 7.407 21.178 ( -3.424 -0.113 1.591) 3.777 21.361 ( 2.994 -0.775 -1.726) 3.542 21.755 ( -0.905 0.359 1.268) 1.599 21.808 ( -0.612 -0.556 -0.979) 1.281 24.096 ( -0.443 -0.233 -0.222) 0.548 24.155 ( 0.252 -0.121 -1.561) 1.586 28.207 ( -1.124 -0.810 0.740) 1.571 28.265 ( 1.338 -0.141 -0.270) 1.372 33.353 ( -13.705 2.792 6.589) 15.461 33.977 ( 18.758 6.750 1.273) 19.976 36.476 ( -4.655 -0.133 4.493) 6.471 36.871 ( 6.137 1.167 -4.362) 7.619 39.911 ( 7.835 3.117 7.269) 11.133 40.228 ( 1.274 -5.166 -11.326) 12.513 40.504 ( -3.881 -0.172 16.476) 16.928 41.743 ( -3.153 2.190 -29.759) 30.006 ======================= Grid point 233 (122/165) ======================= q-point: (-0.25 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( -21.584 -1.302 -6.524) 22.586 2.498 ( -20.035 -9.533 13.144) 25.788 2.681 ( 10.785 3.618 5.783) 12.761 2.967 ( -4.086 -5.646 5.498) 8.877 3.188 ( -3.836 6.174 -1.101) 7.352 3.432 ( 4.833 2.950 -1.876) 5.965 3.940 ( 7.271 3.172 -0.068) 7.933 4.143 ( -3.793 6.209 4.828) 8.732 4.202 ( -1.698 -1.473 -0.251) 2.262 4.308 ( -5.688 2.886 9.563) 11.495 4.534 ( -1.267 1.743 -1.565) 2.663 4.614 ( 4.400 2.323 -2.914) 5.766 4.791 ( 8.919 -1.204 4.903) 10.249 4.856 ( 1.018 -8.103 -3.255) 8.792 5.009 ( -6.871 5.738 8.561) 12.387 5.130 ( -4.425 -9.903 2.663) 11.169 5.304 ( -0.103 2.375 0.813) 2.512 5.454 ( 4.747 5.677 5.124) 9.000 5.588 ( -7.966 -7.973 4.823) 12.259 5.631 ( -10.520 -2.044 -5.432) 12.015 5.820 ( 3.074 -3.825 -5.708) 7.528 5.986 ( 5.894 -0.964 4.557) 7.513 6.146 ( 4.963 5.249 -1.580) 7.394 6.268 ( 6.986 0.765 3.245) 7.741 6.334 ( -2.465 -5.963 0.131) 6.454 6.487 ( -0.477 7.289 -3.325) 8.026 6.594 ( -2.892 -2.184 -2.102) 4.190 6.830 ( 8.014 6.208 -7.344) 12.518 6.869 ( -3.050 4.188 -3.038) 6.006 7.025 ( -1.672 1.933 -2.362) 3.480 7.205 ( 1.966 2.479 0.932) 3.298 7.316 ( 1.622 -3.195 1.710) 3.970 7.350 ( -3.805 -5.413 -2.843) 7.201 7.659 ( 1.680 1.605 -2.984) 3.781 7.773 ( -1.399 3.373 4.970) 6.168 7.847 ( 5.375 -0.229 1.604) 5.613 7.995 ( 0.926 -1.477 2.543) 3.083 8.125 ( 4.977 1.022 -0.722) 5.132 8.191 ( -0.005 -0.341 1.761) 1.794 8.457 ( 6.795 4.783 2.666) 8.727 8.638 ( -4.891 -9.269 -2.317) 10.734 8.893 ( -1.862 -6.668 -5.116) 8.608 13.209 ( -5.442 5.566 -2.057) 8.051 13.421 ( 0.103 1.362 -0.043) 1.366 14.714 ( -0.434 2.050 -1.845) 2.792 14.784 ( 3.306 -2.647 2.704) 5.024 17.313 ( -1.488 2.102 -0.271) 2.589 17.344 ( -1.295 0.780 -0.165) 1.520 17.599 ( -1.542 -2.227 0.502) 2.755 17.930 ( 5.785 -4.301 -0.151) 7.210 21.156 ( -2.901 -0.810 2.250) 3.760 21.406 ( 3.217 -1.082 -1.615) 3.759 21.746 ( -0.682 0.338 1.555) 1.731 21.812 ( 0.023 -0.896 -1.077) 1.401 24.091 ( -0.665 -0.052 -0.614) 0.906 24.152 ( -0.252 -0.297 -1.080) 1.148 28.216 ( -0.855 -1.396 0.725) 1.791 28.279 ( 0.881 0.024 0.095) 0.886 33.179 ( -11.060 3.339 4.883) 12.543 34.008 ( 13.830 14.991 1.418) 20.446 36.452 ( -3.221 -0.717 3.852) 5.072 36.883 ( 4.323 2.602 -5.135) 7.199 39.851 ( -3.877 5.597 0.192) 6.811 40.430 ( 10.736 -8.739 -3.078) 14.181 40.518 ( -2.348 -0.141 12.672) 12.888 41.526 ( -5.523 1.597 -27.904) 28.490 ======================= Grid point 234 (123/165) ======================= q-point: (-0.12 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.041 ( -12.645 -3.462 -1.446) 13.190 2.482 ( -7.357 -1.952 12.818) 14.908 2.761 ( 10.486 3.665 7.447) 13.373 2.963 ( -11.256 -1.142 3.825) 11.942 3.196 ( 3.051 -8.752 -7.480) 11.910 3.434 ( 7.814 6.408 -1.425) 10.205 3.936 ( -1.025 1.396 -2.220) 2.815 3.997 ( -0.849 6.165 -11.262) 12.867 4.127 ( -16.030 -1.410 12.526) 20.392 4.263 ( 2.722 7.274 7.760) 10.980 4.507 ( -3.922 -4.295 5.320) 7.882 4.638 ( 7.999 2.662 -0.582) 8.451 4.821 ( -7.978 -0.287 10.135) 12.901 4.967 ( -2.990 -2.760 -0.623) 4.117 5.024 ( 2.227 -4.732 4.264) 6.748 5.129 ( -3.565 1.596 -2.477) 4.625 5.239 ( -7.119 -4.413 4.184) 9.362 5.498 ( 5.116 4.371 8.674) 10.978 5.561 ( -13.104 -9.292 -2.098) 16.200 5.682 ( 7.325 -0.414 -1.802) 7.554 5.844 ( 5.537 2.148 -4.237) 7.295 6.087 ( 3.138 -0.270 1.949) 3.704 6.116 ( 1.951 -0.347 -5.927) 6.249 6.212 ( -7.490 1.591 -6.388) 9.972 6.353 ( 3.643 5.219 2.028) 6.680 6.406 ( 0.549 1.879 3.467) 3.981 6.606 ( 2.306 15.333 -7.813) 17.363 6.724 ( 4.472 -9.710 0.224) 10.693 6.922 ( 1.906 -4.652 -5.114) 7.171 6.957 ( 1.843 6.123 1.399) 6.546 7.211 ( -1.022 -1.251 1.045) 1.924 7.295 ( -0.401 2.854 0.034) 2.883 7.466 ( -0.948 -8.028 -0.604) 8.106 7.611 ( -1.437 2.869 0.510) 3.249 7.720 ( 0.950 2.394 2.358) 3.492 7.957 ( 7.150 -0.635 1.000) 7.247 8.012 ( -2.011 0.774 3.210) 3.867 8.160 ( 1.105 3.286 0.417) 3.492 8.178 ( 2.871 -0.067 -0.606) 2.935 8.597 ( 17.545 -2.087 -4.433) 18.217 8.675 ( -12.079 -11.015 -3.058) 16.630 8.927 ( -1.878 -2.016 1.236) 3.020 13.055 ( -4.618 4.244 -1.791) 6.523 13.390 ( -1.983 1.260 1.045) 2.571 14.669 ( 0.148 2.601 -1.272) 2.899 14.872 ( 2.148 -2.311 2.874) 4.268 17.272 ( -0.015 1.434 -0.823) 1.653 17.322 ( -0.684 0.231 -0.327) 0.792 17.619 ( -0.010 -1.068 0.469) 1.167 18.043 ( 2.742 -3.264 -0.496) 4.292 21.155 ( -2.169 -1.488 2.581) 3.685 21.451 ( 2.775 -0.829 -1.527) 3.274 21.743 ( -0.594 -0.117 1.474) 1.593 21.825 ( 0.740 -0.834 -1.281) 1.698 24.079 ( -0.414 0.160 -0.814) 0.927 24.150 ( -0.394 -0.290 -0.671) 0.830 28.233 ( -0.644 -1.334 0.724) 1.649 28.284 ( 0.237 0.426 0.515) 0.710 33.052 ( -6.073 1.812 3.759) 7.369 33.861 ( 4.673 17.298 2.878) 18.148 36.460 ( -0.562 -1.008 3.614) 3.794 36.851 ( 2.422 3.103 -5.771) 6.985 39.719 ( -4.540 4.390 0.441) 6.330 40.443 ( -8.258 2.681 12.363) 15.107 40.716 ( 10.900 -5.338 -9.048) 15.139 41.396 ( 1.230 -5.190 -21.924) 22.563 ======================= Grid point 240 (124/165) ======================= q-point: (-0.38 -0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( -30.610 0.000 -8.108) 31.666 2.190 ( -28.003 0.000 13.028) 30.885 2.746 ( 14.548 -0.000 6.771) 16.047 3.004 ( -1.152 0.000 5.972) 6.082 3.321 ( -13.408 0.000 -6.074) 14.719 3.428 ( 3.186 -0.000 6.323) 7.081 3.993 ( 9.839 -0.000 -2.527) 10.158 4.060 ( -11.376 0.000 16.987) 20.444 4.428 ( 3.761 -0.000 -1.665) 4.114 4.506 ( -3.852 0.000 -4.159) 5.668 4.523 ( 1.704 -0.000 7.357) 7.552 4.551 ( 1.329 -0.000 -3.459) 3.705 4.619 ( 8.708 -0.000 -6.321) 10.760 4.867 ( 10.889 -0.000 6.616) 12.741 5.009 ( -5.324 0.000 4.364) 6.884 5.154 ( 6.988 -0.000 -5.972) 9.193 5.297 ( 3.253 -0.000 -2.227) 3.943 5.372 ( -19.227 0.000 13.158) 23.299 5.610 ( -3.807 0.000 5.894) 7.017 5.628 ( -4.422 0.000 -2.079) 4.886 5.677 ( -5.741 0.000 -4.538) 7.318 5.971 ( 13.564 -0.000 3.768) 14.078 6.113 ( 6.622 -0.000 0.568) 6.647 6.316 ( 5.241 -0.000 4.257) 6.752 6.318 ( 4.109 -0.000 1.122) 4.260 6.545 ( 2.120 -0.000 -4.295) 4.790 6.571 ( -13.413 0.000 -4.644) 14.194 6.913 ( 2.250 -0.000 -9.062) 9.337 6.923 ( 1.735 -0.000 -6.216) 6.453 7.087 ( 2.110 -0.000 -3.299) 3.916 7.206 ( -4.462 0.000 -0.565) 4.497 7.305 ( 3.933 -0.000 -0.263) 3.941 7.330 ( -4.789 0.000 1.725) 5.090 7.672 ( 4.039 -0.000 -5.861) 7.118 7.758 ( 2.737 -0.000 12.202) 12.505 7.877 ( 0.240 -0.000 2.769) 2.779 8.065 ( -1.273 0.000 -1.675) 2.104 8.084 ( -1.481 0.000 2.631) 3.019 8.228 ( 7.054 -0.000 5.925) 9.212 8.345 ( -11.607 0.000 -2.284) 11.830 8.693 ( 11.629 -0.000 5.515) 12.870 8.704 ( 1.796 -0.000 -11.183) 11.326 13.318 ( -4.206 0.000 -3.230) 5.303 13.443 ( -0.830 0.000 -0.088) 0.835 14.731 ( 2.854 -0.000 4.032) 4.940 14.752 ( -0.055 0.000 -4.273) 4.273 17.348 ( -2.618 0.000 0.014) 2.618 17.377 ( -0.790 0.000 0.770) 1.103 17.545 ( -0.563 0.000 -0.848) 1.018 17.846 ( 5.406 -0.000 0.607) 5.440 21.144 ( -3.052 0.000 1.721) 3.504 21.385 ( 3.138 -0.000 -1.257) 3.381 21.757 ( -0.357 0.000 1.551) 1.591 21.791 ( -0.613 0.000 -0.644) 0.889 24.090 ( -0.250 0.000 -0.404) 0.475 24.146 ( -0.577 0.000 -1.226) 1.354 28.191 ( -0.889 0.000 0.675) 1.116 28.277 ( 1.138 -0.000 -0.409) 1.210 33.233 ( -13.849 0.000 4.723) 14.632 34.285 ( 22.244 -0.000 -0.412) 22.248 36.440 ( -4.402 0.000 4.417) 6.236 36.933 ( 5.393 -0.000 -4.525) 7.040 40.060 ( -4.769 0.000 -14.978) 15.719 40.139 ( 13.957 -0.000 7.250) 15.727 40.529 ( -5.445 0.000 18.453) 19.240 41.553 ( -9.200 0.000 -30.784) 32.129 ======================= Grid point 241 (125/165) ======================= q-point: (-0.25 -0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( -28.709 -5.882 -1.826) 29.362 2.065 ( -23.877 -16.667 15.190) 32.842 2.901 ( 7.773 3.703 7.466) 11.397 2.975 ( 0.461 3.998 1.653) 4.350 3.174 ( -4.602 0.401 -6.052) 7.613 3.498 ( 4.128 -0.191 5.065) 6.537 3.986 ( -18.533 -2.004 12.417) 22.398 4.043 ( 2.215 1.264 2.416) 3.513 4.295 ( -1.665 10.024 -12.755) 16.308 4.401 ( 1.721 2.526 -3.510) 4.654 4.578 ( -2.046 2.415 8.260) 8.846 4.620 ( -0.885 -3.546 -1.500) 3.950 4.695 ( 2.516 -5.327 -1.968) 6.211 4.866 ( -19.707 -7.246 8.873) 22.795 5.004 ( 14.895 8.076 -0.449) 16.950 5.156 ( -1.023 10.126 3.823) 10.872 5.319 ( 5.207 -4.050 -0.207) 6.600 5.360 ( -8.055 -2.744 5.955) 10.386 5.554 ( 0.283 -0.306 0.410) 0.585 5.627 ( 2.721 0.600 2.294) 3.609 5.724 ( 7.531 -8.749 -6.115) 13.063 6.102 ( 5.826 1.621 2.892) 6.703 6.226 ( 3.971 -3.029 -0.140) 4.996 6.260 ( -4.642 7.101 -1.672) 8.647 6.393 ( 6.853 2.685 1.761) 7.568 6.474 ( -3.542 -5.178 0.470) 6.291 6.563 ( 2.118 -1.454 -3.583) 4.409 6.754 ( -4.810 4.058 -10.461) 12.208 7.015 ( 0.674 -5.681 -4.834) 7.490 7.076 ( 7.042 7.951 -1.649) 10.748 7.177 ( -3.395 -4.050 -1.632) 5.531 7.275 ( -0.213 3.491 3.414) 4.888 7.345 ( 2.408 -0.063 0.535) 2.468 7.701 ( 3.532 1.160 -4.009) 5.467 7.809 ( -3.939 2.133 2.297) 5.034 7.881 ( 2.096 -2.214 5.272) 6.090 8.019 ( -0.437 1.042 2.206) 2.479 8.102 ( -0.235 -2.848 2.437) 3.756 8.272 ( -2.914 -1.855 -1.821) 3.905 8.365 ( 1.931 -3.295 8.084) 8.941 8.653 ( 4.769 2.826 -8.658) 10.281 8.869 ( 9.543 -1.194 2.670) 9.981 13.210 ( -5.517 4.090 -3.696) 7.799 13.414 ( -3.520 0.250 0.655) 3.589 14.732 ( 1.532 1.193 -4.302) 4.720 14.791 ( 1.455 -2.100 3.953) 4.707 17.313 ( -1.989 0.641 -0.340) 2.117 17.356 ( -0.440 1.637 0.634) 1.810 17.569 ( 2.355 -1.562 -1.198) 3.069 17.927 ( 3.486 -2.930 0.712) 4.609 21.126 ( -2.063 -0.418 2.548) 3.305 21.422 ( 2.932 -0.696 -1.115) 3.213 21.755 ( -0.324 0.713 1.593) 1.775 21.794 ( 0.111 -1.016 -0.483) 1.131 24.084 ( -0.185 0.153 -0.731) 0.769 24.135 ( -0.917 -0.430 -0.737) 1.252 28.193 ( -0.534 -0.862 0.742) 1.256 28.286 ( 0.480 -0.100 -0.338) 0.596 33.090 ( -11.768 0.596 3.409) 12.266 34.426 ( 18.071 13.701 -3.338) 22.922 36.422 ( -2.496 -1.094 4.102) 4.925 36.944 ( 3.005 2.188 -5.757) 6.853 39.885 ( -3.387 5.834 -9.584) 11.720 40.417 ( 13.124 -9.614 -0.297) 16.271 40.526 ( -7.621 0.831 17.766) 19.349 41.290 ( -13.310 -1.607 -28.201) 31.225 ======================= Grid point 242 (126/165) ======================= q-point: (-0.12 -0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( -18.556 -13.663 5.664) 23.730 2.264 ( -9.939 -23.523 14.915) 29.573 2.858 ( -7.772 6.236 0.923) 10.008 2.912 ( -0.859 0.855 6.359) 6.474 3.165 ( 7.823 1.066 -10.419) 13.072 3.575 ( 5.173 -0.419 2.524) 5.771 3.828 ( -13.690 0.774 5.957) 14.950 3.996 ( -7.008 5.748 -7.695) 11.889 4.114 ( -1.135 -0.117 -1.747) 2.087 4.308 ( -15.608 0.462 7.723) 17.421 4.521 ( 0.146 5.849 9.884) 11.486 4.663 ( -1.975 -6.936 -1.810) 7.435 4.792 ( -5.112 3.143 4.840) 7.710 4.838 ( 0.718 -6.163 3.904) 7.331 5.010 ( 4.724 1.429 -3.128) 5.843 5.148 ( 5.962 0.175 3.650) 6.992 5.213 ( -5.180 5.640 -1.920) 7.895 5.340 ( -4.335 0.565 4.408) 6.208 5.653 ( 7.491 -1.827 1.897) 7.940 5.737 ( 4.528 -4.168 0.502) 6.175 5.952 ( 12.075 -0.799 -4.388) 12.872 6.024 ( -10.420 3.551 -5.086) 12.127 6.122 ( 3.471 0.273 2.217) 4.127 6.259 ( 4.816 6.720 -1.558) 8.413 6.398 ( -2.296 -1.094 0.482) 2.588 6.522 ( 0.952 7.458 3.645) 8.355 6.607 ( 1.007 -5.550 0.871) 5.707 6.676 ( -0.074 -5.554 -12.557) 13.731 6.983 ( 4.828 9.837 -4.990) 12.040 7.050 ( 2.162 0.990 -0.060) 2.379 7.242 ( -2.128 -7.326 -5.433) 9.365 7.260 ( 3.575 2.750 5.211) 6.892 7.390 ( 3.707 -0.740 2.997) 4.824 7.633 ( -3.419 2.923 -0.219) 4.503 7.768 ( -0.589 1.303 0.092) 1.433 7.968 ( -0.223 -4.012 2.392) 4.676 8.007 ( -1.703 0.633 2.155) 2.818 8.145 ( -2.315 -0.100 0.579) 2.388 8.274 ( -2.213 -1.799 -1.129) 3.067 8.432 ( -1.630 -0.324 5.242) 5.499 8.687 ( 8.230 -2.902 -5.709) 10.428 8.996 ( 12.431 1.029 1.707) 12.590 13.064 ( -3.815 4.306 -2.737) 6.371 13.366 ( -4.721 0.076 1.533) 4.964 14.712 ( 2.281 2.263 -3.282) 4.593 14.855 ( -0.469 -2.901 3.450) 4.532 17.286 ( -0.106 0.619 -1.046) 1.220 17.332 ( 0.374 1.399 0.281) 1.475 17.619 ( 3.235 -0.923 -0.817) 3.462 18.006 ( 0.147 -3.392 0.232) 3.403 21.132 ( -0.756 -0.731 3.242) 3.409 21.461 ( 2.219 -0.843 -1.212) 2.665 21.745 ( -0.646 0.538 1.516) 1.733 21.816 ( 1.017 -1.087 -0.797) 1.689 24.076 ( 0.173 0.131 -0.856) 0.883 24.132 ( -0.714 -0.716 -0.436) 1.101 28.209 ( -0.351 -1.308 0.850) 1.599 28.289 ( -0.104 -0.059 -0.021) 0.122 32.990 ( -7.410 -1.055 2.733) 7.968 34.222 ( 1.533 23.673 -3.283) 23.949 36.458 ( 1.219 -2.021 3.263) 4.028 36.893 ( 0.584 2.892 -6.688) 7.310 39.752 ( -0.318 4.089 -3.779) 5.577 40.448 ( -10.167 4.199 13.639) 17.523 40.683 ( 6.766 -7.109 -8.215) 12.799 41.150 ( -4.603 -11.723 -19.318) 23.061 ======================= Grid point 249 (127/165) ======================= q-point: (-0.25 -0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( -22.494 0.000 9.550) 24.438 1.689 ( -23.965 0.000 19.075) 30.630 2.928 ( -11.552 0.000 5.932) 12.986 3.012 ( -2.693 0.000 -0.539) 2.747 3.188 ( 13.000 -0.000 -8.457) 15.509 3.582 ( 5.009 -0.000 4.410) 6.674 3.787 ( -18.117 0.000 10.823) 21.104 3.974 ( -22.929 0.000 12.722) 26.222 4.289 ( -7.293 0.000 -20.022) 21.309 4.401 ( 5.357 -0.000 -7.283) 9.041 4.519 ( -17.435 0.000 9.814) 20.007 4.560 ( -0.178 0.000 -2.002) 2.010 4.672 ( 4.156 -0.000 1.642) 4.469 4.771 ( 7.242 -0.000 1.923) 7.493 5.235 ( -4.002 0.000 -2.077) 4.509 5.288 ( 2.460 -0.000 9.098) 9.425 5.307 ( 2.920 -0.000 5.501) 6.228 5.351 ( 11.898 -0.000 -3.411) 12.377 5.539 ( -0.506 0.000 -1.998) 2.061 5.650 ( 1.429 -0.000 6.940) 7.085 5.752 ( 14.636 -0.000 -5.710) 15.711 6.108 ( -4.039 0.000 -4.621) 6.137 6.250 ( 2.748 -0.000 -1.026) 2.934 6.339 ( -0.177 0.000 6.687) 6.689 6.417 ( -0.863 0.000 -0.146) 0.876 6.491 ( 3.225 -0.000 -10.177) 10.675 6.517 ( 6.846 -0.000 4.836) 8.382 6.740 ( -5.437 0.000 -6.851) 8.747 6.915 ( 3.070 -0.000 -5.651) 6.431 7.138 ( -0.215 0.000 0.893) 0.919 7.206 ( 5.259 -0.000 -1.243) 5.404 7.345 ( 3.842 -0.000 5.435) 6.656 7.367 ( 2.095 -0.000 -0.027) 2.095 7.729 ( -10.641 0.000 -2.276) 10.882 7.746 ( 4.476 -0.000 -4.288) 6.199 7.897 ( -1.690 0.000 11.557) 11.680 7.983 ( -3.498 0.000 -0.434) 3.525 8.115 ( -7.681 0.000 0.887) 7.732 8.150 ( 4.580 -0.000 -0.399) 4.597 8.492 ( 4.260 -0.000 9.014) 9.970 8.686 ( 6.195 -0.000 -5.492) 8.279 9.019 ( 12.365 -0.000 1.430) 12.448 13.162 ( -5.265 0.000 -4.545) 6.955 13.362 ( -5.738 0.000 1.328) 5.890 14.750 ( 3.229 -0.000 -5.046) 5.991 14.792 ( -1.087 0.000 4.151) 4.291 17.296 ( -1.222 0.000 -0.410) 1.289 17.368 ( -0.527 0.000 0.874) 1.021 17.601 ( 6.061 -0.000 -2.450) 6.537 17.933 ( 0.916 -0.000 1.158) 1.476 21.121 ( -0.348 0.000 3.579) 3.595 21.443 ( 2.341 -0.000 -0.829) 2.484 21.774 ( 0.433 -0.000 1.705) 1.760 21.779 ( -0.050 0.000 -0.409) 0.412 24.083 ( 0.262 -0.000 -0.972) 1.006 24.115 ( -1.349 0.000 -0.301) 1.382 28.185 ( -0.187 0.000 0.781) 0.803 28.284 ( -0.232 0.000 -0.565) 0.611 32.971 ( -10.373 0.000 2.409) 10.649 34.740 ( 16.669 -0.000 -13.649) 21.544 36.399 ( -2.135 0.000 4.320) 4.819 36.950 ( -0.423 0.000 -8.037) 8.048 39.850 ( -1.291 0.000 -13.191) 13.254 40.438 ( 2.970 -0.000 0.250) 2.981 40.550 ( -2.727 0.000 20.640) 20.820 40.956 ( -18.767 0.000 -23.724) 30.250 ======================= Grid point 250 (128/165) ======================= q-point: (-0.12 -0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( -12.710 -6.338 18.862) 23.611 1.797 ( -10.386 -26.445 21.770) 35.793 2.827 ( -9.956 -2.364 3.215) 10.726 2.884 ( -10.038 5.762 0.344) 11.579 3.288 ( 13.294 3.040 -11.578) 17.889 3.556 ( -13.974 0.541 7.247) 15.750 3.722 ( -15.433 -7.837 9.909) 19.944 3.803 ( -12.124 -2.303 15.727) 19.991 3.990 ( -9.022 6.341 -18.380) 21.434 4.384 ( 3.794 7.270 -3.871) 9.068 4.503 ( -3.428 -5.515 -2.161) 6.844 4.539 ( -6.915 -1.813 -1.847) 7.384 4.732 ( 2.995 -2.987 -0.895) 4.323 4.880 ( 6.142 -0.160 3.556) 7.099 5.142 ( 2.081 5.913 1.275) 6.397 5.287 ( -3.546 3.177 15.484) 16.199 5.328 ( 1.089 1.541 -2.533) 3.158 5.364 ( 12.361 9.037 -3.641) 15.739 5.647 ( 1.027 -5.456 3.084) 6.350 5.719 ( 5.192 -2.147 -1.210) 5.747 5.994 ( 13.666 -8.658 -6.910) 17.592 6.016 ( -1.353 5.419 0.779) 5.639 6.236 ( -2.637 8.449 0.835) 8.890 6.268 ( -3.749 -3.286 -4.190) 6.512 6.427 ( 4.712 0.758 1.500) 5.002 6.535 ( 2.622 -1.217 -8.679) 9.148 6.610 ( 3.277 -1.633 1.043) 3.807 6.656 ( 0.960 2.660 2.199) 3.582 6.938 ( -3.991 -1.630 -1.044) 4.436 7.154 ( 2.430 -0.081 -0.720) 2.536 7.213 ( 5.539 4.652 -3.887) 8.212 7.387 ( 5.270 0.720 0.560) 5.348 7.436 ( 4.689 -0.075 5.290) 7.069 7.599 ( -6.567 0.274 -1.202) 6.681 7.738 ( -2.245 0.390 -2.205) 3.171 7.925 ( -4.933 0.067 3.202) 5.882 7.963 ( -5.424 -2.563 4.875) 7.730 8.083 ( -5.021 -5.153 0.517) 7.213 8.192 ( 3.470 1.931 -1.578) 4.274 8.516 ( -1.367 0.993 3.075) 3.509 8.761 ( 9.621 2.253 2.299) 10.145 9.168 ( 13.563 -1.018 -0.981) 13.637 13.068 ( -2.620 2.488 -3.258) 4.865 13.302 ( -6.182 -0.600 1.790) 6.464 14.761 ( 3.919 1.413 -4.573) 6.186 14.804 ( -3.295 -2.437 3.837) 5.614 17.286 ( 0.212 0.026 -0.825) 0.853 17.358 ( -0.073 0.905 0.382) 0.985 17.668 ( 6.959 0.351 -2.224) 7.315 17.950 ( -2.542 -2.139 0.858) 3.431 21.148 ( 1.803 0.067 4.281) 4.645 21.467 ( 1.441 -0.520 -0.856) 1.755 21.759 ( -0.258 1.281 0.989) 1.639 21.807 ( 0.967 -1.401 -0.182) 1.712 24.079 ( 0.390 0.252 -0.889) 1.003 24.108 ( -0.910 -0.978 -0.244) 1.358 28.194 ( -0.082 -0.757 0.866) 1.153 28.279 ( -0.601 -0.399 -0.486) 0.869 32.891 ( -6.497 -1.710 2.134) 7.049 34.546 ( -7.025 23.447 -18.428) 30.638 36.440 ( 0.869 -3.994 2.956) 5.044 36.877 ( -3.009 0.839 -8.574) 9.125 39.807 ( 5.957 1.730 -5.139) 8.055 40.421 ( -12.793 1.369 10.690) 16.727 40.604 ( -0.628 -2.542 -7.571) 8.011 40.810 ( -4.578 -13.892 -5.634) 15.674 ======================= Grid point 258 (129/165) ======================= q-point: (-0.12 -0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.466 ( -11.070 0.000 25.433) 27.738 1.493 ( 7.772 -0.000 33.610) 34.497 2.718 ( -6.661 0.000 4.278) 7.916 2.727 ( -25.521 0.000 5.970) 26.210 3.295 ( -30.469 0.000 14.716) 33.836 3.431 ( 11.828 -0.000 -7.476) 13.992 3.553 ( -4.012 0.000 1.184) 4.183 3.814 ( -2.797 0.000 -3.351) 4.365 3.914 ( 6.967 -0.000 -12.275) 14.114 4.381 ( -9.127 0.000 -4.853) 10.337 4.426 ( -5.718 0.000 -2.646) 6.301 4.427 ( -4.733 0.000 -1.442) 4.947 4.753 ( 6.477 -0.000 -8.173) 10.428 4.962 ( 7.878 -0.000 -2.484) 8.260 5.217 ( 2.249 -0.000 1.247) 2.572 5.278 ( -8.544 0.000 15.599) 17.786 5.410 ( 7.951 -0.000 2.581) 8.359 5.559 ( 3.668 -0.000 -3.862) 5.326 5.640 ( 2.104 -0.000 6.845) 7.161 5.769 ( 6.236 -0.000 -2.580) 6.748 6.004 ( 5.485 -0.000 -6.141) 8.234 6.094 ( 1.712 -0.000 5.399) 5.664 6.222 ( 8.096 -0.000 -4.740) 9.381 6.326 ( -2.598 0.000 -1.120) 2.829 6.366 ( 0.557 -0.000 -5.092) 5.122 6.555 ( -0.787 0.000 -9.129) 9.163 6.641 ( 5.880 -0.000 0.964) 5.958 6.699 ( 5.222 -0.000 6.773) 8.553 6.942 ( -2.049 0.000 4.225) 4.696 7.185 ( 3.604 -0.000 -0.634) 3.659 7.291 ( 3.629 -0.000 -2.662) 4.501 7.358 ( -4.316 0.000 -4.005) 5.887 7.538 ( 0.284 -0.000 -0.422) 0.509 7.548 ( 5.684 -0.000 3.119) 6.484 7.692 ( -9.841 0.000 2.622) 10.184 7.805 ( -11.352 0.000 -2.250) 11.573 7.968 ( 1.834 -0.000 5.920) 6.197 8.014 ( -0.465 0.000 1.023) 1.124 8.269 ( 4.448 -0.000 0.404) 4.467 8.480 ( -3.276 0.000 -3.223) 4.595 8.926 ( 8.181 -0.000 7.827) 11.323 9.273 ( 9.723 -0.000 -0.964) 9.771 13.057 ( 0.422 -0.000 -2.361) 2.398 13.230 ( -6.222 0.000 1.870) 6.497 14.750 ( -5.259 0.000 4.201) 6.731 14.803 ( 4.681 -0.000 -4.913) 6.786 17.289 ( 0.881 -0.000 -0.702) 1.126 17.359 ( -0.934 0.000 -0.047) 0.935 17.757 ( 8.584 -0.000 -3.064) 9.115 17.889 ( -5.934 0.000 1.565) 6.137 21.210 ( 4.936 -0.000 4.236) 6.505 21.472 ( 0.467 -0.000 -0.685) 0.829 21.783 ( 0.846 -0.000 -0.610) 1.043 21.793 ( -0.216 0.000 0.958) 0.982 24.081 ( -1.498 0.000 0.303) 1.528 24.087 ( 0.963 -0.000 -1.302) 1.619 28.192 ( 0.002 -0.000 0.832) 0.832 28.263 ( -0.855 0.000 -0.626) 1.060 32.827 ( -2.797 0.000 2.405) 3.689 34.421 ( -32.650 0.000 -31.313) 45.239 36.408 ( -0.689 0.000 4.502) 4.555 36.804 ( -2.497 0.000 -7.338) 7.751 39.944 ( 18.888 -0.000 -1.466) 18.945 40.313 ( -12.530 0.000 7.573) 14.641 40.480 ( -7.357 0.000 -4.852) 8.813 40.699 ( 1.648 -0.000 5.071) 5.332 ======================= Grid point 259 (130/165) ======================= q-point: ( 0.00 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( 5.195 -0.000 22.138) 22.739 2.362 ( -11.669 0.000 -3.234) 12.109 2.692 ( -6.284 0.000 29.647) 30.306 2.816 ( 5.161 -0.000 3.072) 6.006 2.865 ( -5.047 0.000 -1.029) 5.151 3.253 ( 14.597 -0.000 -28.480) 32.003 3.645 ( 7.796 -0.000 2.800) 8.283 3.739 ( 1.374 -0.000 2.371) 2.740 3.802 ( -14.114 0.000 -0.019) 14.114 3.920 ( -4.436 0.000 -3.584) 5.703 4.275 ( 0.437 -0.000 5.314) 5.332 4.384 ( -5.668 0.000 6.478) 8.608 4.646 ( 2.772 -0.000 -20.295) 20.483 4.652 ( 9.248 -0.000 -11.208) 14.531 5.448 ( -0.106 0.000 6.670) 6.670 5.470 ( -6.957 0.000 2.215) 7.301 5.507 ( 3.323 -0.000 10.698) 11.202 5.647 ( -7.632 0.000 -2.182) 7.938 5.834 ( -2.375 0.000 11.494) 11.737 5.974 ( 9.351 -0.000 3.618) 10.026 5.990 ( -3.297 0.000 0.610) 3.353 6.114 ( 1.631 -0.000 -11.513) 11.628 6.142 ( -0.345 0.000 -3.882) 3.897 6.194 ( 3.448 -0.000 -11.025) 11.552 6.263 ( -0.352 0.000 4.758) 4.771 6.358 ( 0.401 -0.000 -5.124) 5.139 6.938 ( 1.709 -0.000 2.135) 2.734 6.971 ( 3.500 -0.000 0.066) 3.501 7.127 ( 1.840 -0.000 9.121) 9.305 7.140 ( -14.047 0.000 0.282) 14.050 7.166 ( 7.860 -0.000 -1.082) 7.934 7.261 ( -2.295 0.000 -5.335) 5.808 7.450 ( -3.852 0.000 0.586) 3.897 7.471 ( 0.931 -0.000 -0.334) 0.989 7.704 ( 3.218 -0.000 1.811) 3.692 7.726 ( 3.101 -0.000 -0.756) 3.192 8.058 ( 0.225 -0.000 2.181) 2.193 8.067 ( -0.559 0.000 1.280) 1.397 8.239 ( -4.717 0.000 -0.968) 4.816 8.264 ( 0.282 -0.000 -3.819) 3.829 9.259 ( -1.475 0.000 7.566) 7.708 9.389 ( 4.678 -0.000 -5.916) 7.542 13.123 ( -6.229 0.000 0.752) 6.274 13.136 ( 6.682 -0.000 -0.622) 6.710 14.722 ( -6.247 0.000 4.147) 7.498 14.798 ( 5.337 -0.000 -3.885) 6.601 17.308 ( -2.200 0.000 -0.112) 2.203 17.309 ( 1.918 -0.000 -0.201) 1.929 17.795 ( -8.225 0.000 3.895) 9.101 17.865 ( 7.766 -0.000 -3.369) 8.466 21.397 ( 3.320 -0.000 1.432) 3.616 21.424 ( -2.279 0.000 -1.447) 2.699 21.783 ( -1.490 0.000 0.563) 1.593 21.795 ( 1.654 -0.000 -0.677) 1.787 24.062 ( -1.354 0.000 0.794) 1.569 24.081 ( 1.402 -0.000 -1.134) 1.804 28.215 ( 0.031 -0.000 0.912) 0.913 28.231 ( -0.157 0.000 -0.775) 0.791 33.035 ( 13.264 -0.000 6.292) 14.681 33.146 ( -22.698 0.000 -5.182) 23.282 36.528 ( -1.031 0.000 5.392) 5.490 36.635 ( 1.112 -0.000 -5.955) 6.058 40.132 ( -16.441 0.000 5.583) 17.363 40.230 ( 12.133 -0.000 -4.684) 13.006 40.683 ( -10.048 0.000 0.796) 10.080 40.723 ( 21.588 -0.000 -3.284) 21.836 ======================= Grid point 260 (131/165) ======================= q-point: ( 0.12 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.105 ( -1.961 9.087 14.341) 17.091 2.325 ( 7.723 1.103 -4.776) 9.148 2.624 ( -14.774 -3.497 23.479) 27.960 2.932 ( 0.750 -6.455 -0.046) 6.498 2.976 ( 4.142 -3.974 -0.531) 5.764 3.261 ( 1.676 -8.544 -25.572) 27.014 3.662 ( -3.401 0.003 -1.179) 3.599 3.828 ( 8.714 -0.644 2.886) 9.202 3.892 ( 8.907 -3.083 9.368) 13.289 4.011 ( 6.786 -12.407 5.878) 15.314 4.254 ( 1.345 3.209 -1.728) 3.885 4.391 ( -2.729 -4.059 7.391) 8.863 4.598 ( 6.849 -0.052 -11.110) 13.052 4.794 ( 8.627 -8.227 -14.667) 18.901 5.348 ( -9.303 4.227 2.564) 10.535 5.460 ( -6.984 0.265 10.702) 12.782 5.494 ( -8.960 4.340 -0.082) 9.956 5.564 ( -0.501 1.736 8.106) 8.305 5.750 ( -5.569 5.991 2.799) 8.646 5.938 ( -3.700 1.789 -2.617) 4.872 5.970 ( 2.430 5.431 -2.561) 6.478 6.101 ( -0.142 1.268 0.193) 1.290 6.159 ( 2.906 -0.432 -0.758) 3.034 6.194 ( 3.134 -0.299 -7.248) 7.902 6.285 ( -0.412 4.621 -3.101) 5.580 6.319 ( 2.573 -2.162 -2.531) 4.207 6.829 ( -11.535 2.912 1.330) 11.971 6.941 ( -2.628 2.051 -1.239) 3.556 7.002 ( -9.455 -1.967 2.632) 10.010 7.146 ( -8.251 2.632 1.768) 8.840 7.248 ( 5.043 -3.407 3.093) 6.827 7.314 ( 4.867 1.108 -4.191) 6.518 7.472 ( 6.072 -3.605 4.198) 8.215 7.502 ( 4.792 1.057 -0.067) 4.907 7.719 ( 3.813 1.911 -0.161) 4.268 7.822 ( 5.154 -0.449 -3.251) 6.110 7.992 ( 0.532 4.054 2.215) 4.650 8.050 ( 1.088 1.721 -0.960) 2.251 8.182 ( -7.314 0.481 -1.237) 7.433 8.307 ( 4.837 -3.288 2.478) 6.352 9.235 ( -4.402 1.863 5.914) 7.604 9.363 ( -1.044 3.094 -8.804) 9.390 13.059 ( -5.241 -0.251 0.246) 5.252 13.217 ( 6.055 -0.981 -0.591) 6.162 14.672 ( -5.852 -0.425 3.969) 7.084 14.843 ( 4.707 -0.076 -2.635) 5.395 17.281 ( -1.726 0.334 0.123) 1.763 17.329 ( 1.762 0.211 -0.064) 1.776 17.721 ( -7.816 -0.521 3.569) 8.608 17.940 ( 6.391 -0.823 -2.958) 7.090 21.374 ( -3.059 1.409 -1.590) 3.725 21.424 ( 1.577 0.582 0.767) 1.848 21.773 ( -0.402 -0.017 0.509) 0.649 21.811 ( 1.518 0.157 -0.925) 1.784 24.059 ( -1.065 -0.790 0.602) 1.457 24.098 ( 1.304 -0.704 -0.925) 1.747 28.227 ( 0.149 -0.836 1.112) 1.399 28.235 ( 0.016 -0.957 -0.872) 1.295 32.951 ( -10.795 -2.251 0.033) 11.028 33.265 ( 16.990 -0.664 10.456) 19.961 36.544 ( -1.335 -0.606 5.129) 5.334 36.628 ( 1.033 -0.818 -5.535) 5.690 39.946 ( -17.421 0.877 6.252) 18.529 40.355 ( 9.597 -2.511 -3.042) 10.376 40.577 ( -8.452 -0.843 -1.135) 8.569 40.979 ( 22.739 -1.316 -11.327) 25.438 ======================= Grid point 261 (132/165) ======================= q-point: ( 0.25 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( -0.937 2.638 7.113) 7.644 2.392 ( 10.483 -0.434 -2.577) 10.803 2.696 ( -1.785 -4.253 14.051) 14.788 2.980 ( -2.460 -4.522 -3.518) 6.235 3.099 ( 3.525 -4.054 5.601) 7.761 3.377 ( 3.846 -12.560 -17.251) 21.683 3.572 ( -6.367 2.269 -1.742) 6.981 3.925 ( 3.049 0.238 -1.303) 3.325 4.008 ( -0.837 4.149 8.023) 9.071 4.219 ( 7.266 -9.019 4.244) 12.335 4.450 ( 12.134 -10.577 -0.249) 16.099 4.533 ( 7.876 -4.404 1.583) 9.162 4.744 ( 4.852 -12.870 6.639) 15.273 4.973 ( 9.773 -6.539 -10.738) 15.925 5.168 ( -7.674 4.092 -3.176) 9.258 5.234 ( -12.171 7.382 -1.890) 14.359 5.385 ( -9.332 5.969 10.731) 15.423 5.526 ( -3.962 1.089 2.733) 4.935 5.627 ( -2.637 4.907 4.231) 6.995 5.851 ( 1.450 6.159 -4.811) 7.949 5.897 ( -2.838 0.665 -3.854) 4.832 6.044 ( -1.143 4.509 -1.925) 5.034 6.169 ( -2.019 3.187 -2.188) 4.361 6.176 ( 0.538 1.072 -1.066) 1.605 6.239 ( 2.731 -1.835 2.089) 3.898 6.364 ( 1.446 0.997 1.069) 2.056 6.689 ( -10.212 0.474 -0.041) 10.223 6.866 ( -0.674 4.043 0.606) 4.144 6.972 ( -6.262 3.900 3.242) 8.058 6.993 ( -5.356 -4.571 0.229) 7.044 7.237 ( 0.054 7.608 -5.735) 9.528 7.378 ( -0.667 -6.356 3.818) 7.444 7.499 ( 0.803 2.690 -0.143) 2.811 7.640 ( 4.099 -1.836 4.756) 6.541 7.721 ( 0.505 0.728 -2.604) 2.751 7.825 ( 8.441 3.139 3.196) 9.556 7.968 ( -0.532 3.329 -2.054) 3.948 8.092 ( -2.419 -0.715 -1.085) 2.746 8.117 ( 6.793 -2.781 -2.237) 7.673 8.447 ( 9.143 -1.955 1.269) 9.436 9.155 ( -6.755 2.857 3.584) 8.163 9.182 ( -8.189 7.294 -8.331) 13.772 13.009 ( -3.763 -0.042 -0.090) 3.764 13.298 ( 4.309 -1.628 -0.218) 4.612 14.634 ( -4.501 -0.633 3.113) 5.509 14.891 ( 3.942 -0.474 -0.947) 4.082 17.260 ( -0.991 0.487 0.295) 1.142 17.337 ( 0.832 0.801 -0.126) 1.162 17.664 ( -5.741 -0.953 2.303) 6.258 18.012 ( 4.567 -1.355 -2.309) 5.293 21.302 ( -3.095 2.002 -1.246) 3.891 21.433 ( 0.903 0.304 0.426) 1.043 21.775 ( 0.168 -0.007 0.370) 0.406 21.816 ( 1.126 0.496 -1.138) 1.676 24.062 ( -0.809 -0.697 0.221) 1.091 24.121 ( 0.753 -0.900 -0.609) 1.322 28.247 ( -0.091 -0.985 -0.567) 1.140 28.252 ( 0.164 -1.237 0.959) 1.574 32.945 ( -1.712 -4.656 1.435) 5.164 33.503 ( 14.078 0.699 11.297) 18.064 36.557 ( -1.179 -0.104 5.051) 5.187 36.640 ( 1.244 -1.795 -4.578) 5.073 39.774 ( -14.238 -0.195 5.099) 15.125 40.477 ( 3.354 -0.135 -8.758) 9.379 40.530 ( -2.630 -5.804 6.702) 9.248 41.168 ( 18.552 1.006 -15.371) 24.113 ======================= Grid point 262 (133/165) ======================= q-point: ( 0.38 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( 0.888 -1.466 4.882) 5.174 2.583 ( 8.537 -8.504 1.678) 12.166 2.782 ( 3.243 -0.708 1.336) 3.578 3.003 ( 2.350 2.580 3.800) 5.160 3.198 ( 2.370 -1.666 1.065) 3.086 3.463 ( -6.600 1.513 4.470) 8.113 3.554 ( 3.317 -10.914 -10.190) 15.295 3.815 ( -6.772 1.148 -9.573) 11.782 4.092 ( 9.197 -1.768 5.427) 10.824 4.384 ( -2.198 -0.614 5.260) 5.733 4.609 ( 2.391 2.735 -0.686) 3.697 4.725 ( 5.962 -6.284 9.687) 12.995 4.878 ( -10.104 -0.709 1.376) 10.222 5.033 ( -1.462 -1.301 -1.914) 2.737 5.065 ( -1.282 -2.630 -7.570) 8.116 5.194 ( 1.698 -6.007 10.374) 12.108 5.360 ( 13.529 -1.692 -11.181) 17.633 5.447 ( -6.841 2.177 4.556) 8.503 5.596 ( 1.015 -1.870 1.279) 2.483 5.702 ( -2.236 6.733 0.716) 7.131 5.872 ( -2.970 2.539 -6.081) 7.228 5.957 ( -1.066 0.174 0.020) 1.081 6.083 ( -6.795 3.167 -0.541) 7.516 6.160 ( 0.462 1.393 0.877) 1.709 6.291 ( -1.749 -1.068 7.408) 7.686 6.343 ( 1.207 2.750 2.252) 3.754 6.546 ( -3.951 2.769 -1.863) 5.172 6.830 ( 1.942 1.486 -4.127) 4.797 6.889 ( -0.328 1.368 -1.899) 2.363 7.030 ( -1.435 6.038 -0.371) 6.217 7.125 ( -2.000 -6.547 1.749) 7.065 7.372 ( -4.309 4.426 1.414) 6.337 7.518 ( 0.687 -3.359 1.114) 3.605 7.662 ( 0.512 1.612 3.928) 4.277 7.717 ( -0.597 -0.089 -2.693) 2.760 7.902 ( 0.087 -1.652 1.770) 2.423 7.959 ( 8.448 -1.375 1.019) 8.620 8.119 ( 2.301 -0.944 0.013) 2.488 8.208 ( 3.575 -1.031 -1.141) 3.892 8.549 ( 8.972 4.564 -6.203) 11.824 8.905 ( -9.392 6.293 -5.566) 12.601 9.050 ( -7.123 2.188 3.783) 8.357 12.974 ( -1.981 0.034 -0.319) 2.007 13.360 ( 1.856 -1.336 0.335) 2.312 14.616 ( -2.347 -0.901 1.679) 3.023 14.936 ( 2.451 -0.383 0.334) 2.504 17.247 ( -0.135 0.319 0.169) 0.385 17.325 ( -0.105 0.941 -0.301) 0.994 17.638 ( -2.594 -0.917 1.002) 2.928 18.062 ( 2.081 -0.886 -1.348) 2.632 21.238 ( -2.088 1.581 -0.287) 2.635 21.442 ( 0.727 -0.077 -0.127) 0.742 21.777 ( -0.146 0.192 0.681) 0.723 21.815 ( 0.921 0.487 -1.322) 1.683 24.063 ( -0.336 -0.294 -0.092) 0.456 24.136 ( 0.137 -0.540 -0.393) 0.682 28.255 ( -0.226 -0.450 -0.403) 0.645 28.276 ( 0.075 -0.964 0.937) 1.347 33.024 ( 1.269 -3.658 1.384) 4.111 33.660 ( 7.029 0.201 7.688) 10.419 36.564 ( -0.566 0.567 4.711) 4.778 36.668 ( 1.286 -2.108 -3.963) 4.669 39.674 ( -8.061 -1.471 3.306) 8.836 40.433 ( -4.590 -1.145 -2.201) 5.217 40.666 ( 3.104 -4.715 3.808) 6.809 41.246 ( 12.833 3.979 -15.544) 20.546 ======================= Grid point 263 (134/165) ======================= q-point: (-0.50 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 1.384 1.709 3.419) 4.065 2.770 ( -1.266 2.686 10.281) 10.701 2.778 ( -2.190 -3.132 -3.530) 5.203 2.985 ( 1.354 1.764 0.142) 2.228 3.233 ( 5.680 2.374 -4.527) 7.641 3.452 ( 2.815 -1.241 9.513) 9.998 3.645 ( -5.447 -5.003 -6.576) 9.897 3.700 ( -1.595 1.697 -10.918) 11.163 4.247 ( -5.452 2.185 3.793) 6.992 4.315 ( 6.299 -4.721 4.635) 9.135 4.570 ( -4.785 -1.550 -0.510) 5.055 4.753 ( -0.603 2.598 1.562) 3.091 4.878 ( 1.831 -2.637 3.369) 4.653 5.052 ( -4.530 3.421 2.529) 6.214 5.119 ( 1.357 -0.072 5.934) 6.087 5.220 ( 3.780 6.227 -1.463) 7.429 5.378 ( -1.236 -2.924 -1.685) 3.594 5.459 ( -6.773 1.671 4.249) 8.169 5.550 ( -3.698 2.363 -0.832) 4.467 5.669 ( -11.659 -1.920 6.877) 13.671 5.848 ( 16.416 -1.073 -7.598) 18.121 5.942 ( -2.891 -1.205 0.551) 3.180 6.015 ( 2.396 -4.404 -5.837) 7.695 6.156 ( 3.000 0.416 -0.784) 3.128 6.316 ( -0.116 -1.038 0.228) 1.069 6.402 ( 0.155 -5.613 6.705) 8.746 6.514 ( -0.355 -0.489 0.512) 0.792 6.713 ( 0.513 8.765 -12.468) 15.249 6.894 ( -3.012 0.527 2.796) 4.143 6.971 ( 4.890 -1.741 -1.877) 5.520 7.239 ( 0.031 -4.347 2.021) 4.794 7.288 ( 1.411 2.783 -0.567) 3.171 7.534 ( -1.566 0.549 0.980) 1.927 7.654 ( 0.221 2.006 3.402) 3.956 7.712 ( -0.014 -2.005 -1.804) 2.697 7.960 ( -0.802 -2.292 1.332) 2.770 8.103 ( 3.490 -1.887 2.308) 4.590 8.138 ( -1.653 -0.317 1.075) 1.997 8.226 ( 1.309 -0.068 2.584) 2.898 8.389 ( -5.674 5.638 -10.411) 13.129 8.821 ( 2.278 2.174 -0.675) 3.220 9.003 ( 2.372 -0.409 1.138) 2.663 12.962 ( 0.058 -0.219 -0.527) 0.574 13.381 ( -0.997 -0.287 0.794) 1.306 14.622 ( 0.113 -1.080 -0.109) 1.092 14.954 ( -0.100 0.377 0.914) 0.994 17.249 ( 0.742 -0.087 -0.462) 0.878 17.313 ( 0.107 0.191 -0.216) 0.308 17.636 ( 0.301 -0.192 0.137) 0.382 18.072 ( -0.809 0.218 -0.081) 0.842 21.205 ( -0.618 0.743 1.042) 1.421 21.449 ( 0.462 -0.228 -0.711) 0.878 21.772 ( -0.651 0.211 1.221) 1.399 21.813 ( 0.864 0.279 -1.332) 1.612 24.064 ( 0.339 0.004 -0.357) 0.492 24.138 ( -0.134 -0.012 -0.179) 0.223 28.253 ( -0.200 0.272 0.162) 0.374 28.289 ( -0.058 -0.348 0.398) 0.532 33.068 ( 0.042 0.378 1.311) 1.365 33.744 ( -0.686 -3.825 1.954) 4.350 36.568 ( 0.146 0.930 3.874) 3.987 36.695 ( 0.867 -1.908 -4.751) 5.193 39.657 ( -0.672 -1.604 1.205) 2.116 40.395 ( -5.754 -2.178 0.525) 6.175 40.755 ( 0.744 -1.230 3.663) 3.935 41.214 ( 6.451 6.655 -12.097) 15.240 ======================= Grid point 264 (135/165) ======================= q-point: (-0.38 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( -1.470 10.484 7.977) 13.255 2.645 ( -7.879 1.877 -3.973) 9.022 2.763 ( -2.312 3.101 1.938) 4.326 2.982 ( -1.491 0.648 6.356) 6.560 3.170 ( 3.000 10.747 2.450) 11.423 3.519 ( -11.331 0.040 -5.322) 12.518 3.640 ( 5.600 2.255 -11.274) 12.789 3.686 ( 8.371 -10.015 2.232) 13.243 4.130 ( -7.311 1.210 1.442) 7.550 4.476 ( 0.711 3.057 -2.455) 3.985 4.516 ( -12.395 -1.551 7.467) 14.553 4.768 ( -10.415 3.335 12.327) 16.479 4.878 ( 2.556 4.173 -3.035) 5.758 4.938 ( 2.040 -0.118 3.181) 3.780 5.036 ( 1.356 4.491 -2.008) 5.103 5.123 ( -2.233 5.651 5.583) 8.252 5.327 ( 5.255 2.307 -0.374) 5.751 5.461 ( -0.441 -6.230 6.169) 8.779 5.609 ( -3.190 -6.312 0.576) 7.096 5.716 ( 2.894 -5.403 -4.223) 7.443 5.874 ( 2.289 5.745 -0.585) 6.212 5.968 ( 0.012 -3.318 -1.444) 3.619 6.141 ( 7.461 -3.872 -6.303) 10.506 6.200 ( 1.267 0.017 -2.539) 2.838 6.342 ( -1.272 -1.633 0.922) 2.266 6.468 ( -2.143 3.196 -8.545) 9.372 6.527 ( 5.199 -6.648 -0.255) 8.443 6.659 ( 0.508 -5.264 5.969) 7.974 6.873 ( 0.498 -0.933 0.989) 1.448 7.078 ( 7.299 -1.684 -2.331) 7.845 7.186 ( -2.286 7.027 -4.923) 8.879 7.365 ( 5.036 -5.981 2.250) 8.136 7.515 ( 0.846 2.900 1.966) 3.605 7.654 ( 0.939 1.192 2.845) 3.225 7.731 ( -1.310 -1.168 -1.835) 2.540 7.948 ( -2.165 -0.513 -2.524) 3.365 7.978 ( -8.888 3.228 -0.899) 9.498 8.114 ( -3.149 0.675 0.502) 3.259 8.188 ( -7.564 1.785 0.172) 7.773 8.449 ( -0.487 -8.765 4.397) 9.818 8.826 ( 5.930 0.781 2.452) 6.465 9.116 ( 11.874 -1.705 -3.239) 12.425 12.977 ( 2.119 -0.389 -0.679) 2.259 13.352 ( -3.707 0.836 1.096) 3.955 14.650 ( 2.488 -1.086 -1.891) 3.308 14.927 ( -2.964 1.330 1.285) 3.494 17.259 ( 1.133 -0.187 -1.061) 1.564 17.323 ( 0.543 -0.853 -0.054) 1.013 17.654 ( 3.392 0.384 -0.671) 3.479 18.037 ( -3.595 1.218 1.240) 3.993 21.211 ( 1.089 -0.233 2.400) 2.646 21.453 ( 0.084 -0.302 -1.152) 1.194 21.768 ( -0.836 -0.012 1.490) 1.709 21.814 ( 0.653 0.110 -1.126) 1.306 24.067 ( 0.900 0.247 -0.571) 1.094 24.132 ( -0.283 0.545 0.024) 0.614 28.244 ( -0.111 0.872 0.702) 1.125 28.288 ( -0.187 0.400 -0.280) 0.523 33.025 ( -1.403 4.134 1.187) 4.524 33.779 ( -9.340 -8.292 -4.480) 13.269 36.571 ( 0.541 1.249 3.007) 3.301 36.700 ( -0.048 -0.986 -6.246) 6.323 39.718 ( 7.446 -1.059 -1.024) 7.591 40.366 ( -7.428 -2.862 3.214) 8.585 40.745 ( -0.248 4.084 0.488) 4.121 41.099 ( -0.607 7.231 -4.201) 8.384 ======================= Grid point 265 (136/165) ======================= q-point: (-0.25 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( -3.383 7.684 17.180) 19.122 2.516 ( -9.894 -2.954 -7.185) 12.579 2.685 ( 6.002 13.088 10.231) 17.663 2.969 ( -1.456 5.295 10.921) 12.224 3.069 ( 5.248 3.775 -8.399) 10.599 3.339 ( -15.691 -1.133 -6.484) 17.016 3.630 ( 5.900 2.415 -8.302) 10.468 3.866 ( -0.243 0.589 3.484) 3.542 4.102 ( -5.883 -0.553 7.532) 9.574 4.205 ( -9.933 6.112 1.632) 11.776 4.379 ( -12.621 0.180 1.830) 12.754 4.521 ( -9.719 9.001 -0.811) 13.271 4.798 ( -3.469 9.695 0.583) 10.313 4.988 ( -0.248 6.165 -7.022) 9.348 5.123 ( 11.215 -8.268 2.256) 14.114 5.215 ( 9.030 -4.651 -1.043) 10.211 5.436 ( 11.875 -4.350 1.188) 12.702 5.555 ( -2.986 -4.771 6.951) 8.944 5.685 ( -1.496 -5.075 1.268) 5.441 5.768 ( -2.703 1.150 2.979) 4.184 5.842 ( 3.568 -4.735 -3.436) 6.852 6.031 ( 0.347 -5.206 -0.051) 5.218 6.156 ( 0.883 2.058 -1.689) 2.805 6.225 ( 6.071 1.690 -6.501) 9.054 6.341 ( -2.037 1.171 -6.721) 7.120 6.416 ( 0.696 -2.178 -3.697) 4.346 6.663 ( 6.211 -1.716 2.178) 6.802 6.796 ( 1.380 -4.594 6.345) 7.954 6.950 ( 1.151 -2.325 4.406) 5.113 7.082 ( 4.722 -1.263 -6.134) 7.844 7.160 ( 3.208 -1.857 0.278) 3.717 7.433 ( -1.949 6.495 -1.708) 6.993 7.516 ( 2.709 -3.631 -1.361) 4.730 7.653 ( 0.331 1.527 4.423) 4.691 7.703 ( -1.299 1.189 -1.053) 2.051 7.839 ( -10.623 0.449 0.284) 10.637 7.969 ( -2.347 -4.380 -0.285) 4.977 8.068 ( -6.566 1.713 1.173) 6.886 8.098 ( 0.751 -2.791 -0.928) 3.036 8.474 ( -5.913 -0.183 -1.116) 6.020 8.992 ( 8.255 -5.056 9.342) 13.453 9.259 ( 11.132 -0.794 -5.498) 12.441 13.015 ( 4.032 -0.095 -0.689) 4.092 13.283 ( -5.620 1.299 1.259) 5.904 14.695 ( 4.400 -0.897 -3.298) 5.571 14.861 ( -5.046 1.704 2.143) 5.741 17.272 ( 1.379 -0.128 -0.953) 1.681 17.339 ( -0.571 -0.891 -0.249) 1.087 17.704 ( 6.797 0.172 -1.820) 7.038 17.966 ( -5.848 1.509 2.356) 6.483 21.258 ( 2.887 -1.124 3.120) 4.396 21.452 ( -0.385 -0.462 -1.294) 1.427 21.768 ( -0.516 -0.275 1.218) 1.351 21.813 ( 0.093 0.106 -0.829) 0.841 24.071 ( 1.146 0.484 -0.723) 1.439 24.114 ( -0.735 1.060 0.154) 1.299 28.230 ( -0.075 1.120 0.982) 1.492 28.271 ( -0.313 1.007 -0.791) 1.318 32.945 ( 0.316 4.919 1.275) 5.091 33.714 ( -19.901 -8.448 -10.572) 24.066 36.561 ( -0.212 2.170 2.976) 3.689 36.674 ( -0.111 0.109 -6.589) 6.591 39.861 ( 15.732 -1.121 -3.444) 16.144 40.331 ( -9.833 -2.775 6.098) 11.899 40.643 ( 2.138 8.311 -2.692) 8.994 40.955 ( -7.017 5.007 3.987) 9.497 ======================= Grid point 266 (137/165) ======================= q-point: (-0.12 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( -0.969 -3.605 22.270) 22.581 2.460 ( -7.355 -4.902 -4.542) 9.937 2.618 ( 7.233 12.325 21.748) 26.023 2.849 ( -2.153 9.481 7.886) 12.519 3.078 ( -12.304 0.232 -3.719) 12.856 3.164 ( 9.531 0.296 -19.835) 22.008 3.622 ( 1.476 1.973 -1.086) 2.692 3.742 ( -5.834 5.509 10.782) 13.440 3.982 ( -7.051 0.288 2.515) 7.492 4.140 ( -12.428 7.611 -8.878) 17.065 4.267 ( -8.426 -0.930 2.995) 8.991 4.372 ( 2.719 -3.941 -3.037) 5.670 4.630 ( 0.031 5.787 -3.645) 6.839 4.796 ( 1.323 8.233 -16.985) 18.921 5.367 ( 7.904 -4.389 6.666) 11.233 5.379 ( 6.069 -2.887 2.436) 7.149 5.523 ( -4.529 -1.384 2.895) 5.550 5.698 ( -1.119 -3.023 -3.968) 5.113 5.733 ( 3.184 -3.934 11.886) 12.919 5.804 ( 1.573 -5.567 6.570) 8.754 5.963 ( 5.844 -3.434 -4.425) 8.095 6.120 ( 0.774 -1.812 1.425) 2.432 6.144 ( -0.913 -2.773 -2.609) 3.916 6.226 ( 2.480 0.808 -4.721) 5.393 6.262 ( -0.524 2.551 -6.455) 6.961 6.388 ( -1.176 0.644 -6.898) 7.027 6.812 ( 11.949 -1.685 2.838) 12.397 6.875 ( 5.466 0.015 3.918) 6.725 7.026 ( 1.376 -3.596 4.745) 6.111 7.185 ( 3.726 -0.356 -2.404) 4.448 7.226 ( -1.914 -2.859 0.867) 3.548 7.307 ( -1.404 2.749 -1.659) 3.504 7.483 ( -5.781 1.038 -0.965) 5.952 7.579 ( -9.968 2.277 -4.969) 11.368 7.678 ( 1.379 0.727 4.054) 4.344 7.749 ( -3.961 2.146 3.941) 5.986 8.016 ( -2.814 -3.140 2.351) 4.827 8.030 ( 1.549 -2.873 -0.253) 3.273 8.199 ( 3.378 -4.982 -2.981) 6.717 8.366 ( -5.125 3.350 -3.590) 7.098 9.181 ( 3.250 -3.904 9.905) 11.131 9.344 ( 7.542 0.577 -5.262) 9.214 13.068 ( 5.763 0.302 -0.600) 5.802 13.200 ( -6.400 0.824 1.174) 6.559 14.749 ( 5.298 -0.486 -3.968) 6.637 14.785 ( -5.889 1.029 3.315) 6.836 17.288 ( 1.688 -0.085 -0.560) 1.780 17.331 ( -1.907 -0.328 -0.280) 1.955 17.784 ( 8.243 -0.010 -2.921) 8.745 17.880 ( -7.316 0.967 3.193) 8.041 21.333 ( 4.001 -1.192 2.552) 4.893 21.445 ( -1.191 -0.506 -1.213) 1.774 21.776 ( 0.278 -0.518 0.485) 0.762 21.803 ( -0.671 0.373 -0.412) 0.871 24.073 ( 1.025 0.448 -0.733) 1.337 24.085 ( -1.077 1.035 0.245) 1.514 28.218 ( -0.059 0.804 0.956) 1.251 28.246 ( -0.357 0.962 -0.881) 1.353 32.923 ( 6.004 2.802 2.686) 7.150 33.472 ( -27.203 -3.128 -11.337) 29.636 36.532 ( -1.022 1.943 4.464) 4.975 36.650 ( 1.026 0.159 -6.005) 6.094 40.070 ( 18.725 -0.900 -6.563) 19.862 40.265 ( -13.028 -2.064 6.004) 14.493 40.576 ( 9.299 5.868 0.692) 11.018 40.814 ( -9.824 2.752 4.635) 11.206 ======================= Grid point 268 (138/165) ======================= q-point: ( 0.12 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( 0.999 -0.000 -2.101) 2.326 2.455 ( 3.976 -0.000 10.439) 11.171 2.560 ( -5.120 0.000 15.111) 15.955 2.861 ( 1.710 -0.000 -24.015) 24.076 2.958 ( 6.320 -0.000 -6.000) 8.715 3.089 ( -0.033 0.000 10.999) 10.999 3.741 ( 8.939 -0.000 -7.428) 11.622 3.846 ( 2.753 -0.000 -5.402) 6.063 4.039 ( 10.359 -0.000 7.412) 12.738 4.147 ( 19.528 -0.000 14.655) 24.416 4.248 ( -11.636 0.000 12.188) 16.851 4.317 ( -1.227 0.000 3.430) 3.643 4.730 ( 2.228 -0.000 -2.535) 3.375 4.743 ( 23.409 -0.000 -22.812) 32.686 5.299 ( -7.200 0.000 1.722) 7.403 5.378 ( -11.757 0.000 1.086) 11.807 5.457 ( -7.598 0.000 12.297) 14.455 5.568 ( -6.480 0.000 7.184) 9.674 5.700 ( -12.653 0.000 -0.834) 12.680 5.842 ( -4.316 0.000 -1.571) 4.592 6.063 ( 2.717 -0.000 -9.628) 10.004 6.095 ( -1.426 0.000 -1.056) 1.775 6.172 ( 2.270 -0.000 2.158) 3.132 6.208 ( 1.999 -0.000 -5.949) 6.276 6.305 ( -1.995 0.000 -5.669) 6.009 6.309 ( 1.014 -0.000 3.414) 3.561 6.712 ( -14.418 0.000 2.200) 14.585 6.798 ( -4.800 0.000 -4.740) 6.746 7.008 ( -3.249 0.000 8.733) 9.318 7.124 ( -1.736 0.000 -4.001) 4.361 7.216 ( -1.830 0.000 6.080) 6.349 7.378 ( 0.051 -0.000 -3.717) 3.718 7.475 ( 2.636 -0.000 1.525) 3.045 7.638 ( 9.619 -0.000 5.802) 11.233 7.801 ( 3.833 -0.000 -11.212) 11.849 7.846 ( 5.038 -0.000 -0.813) 5.103 8.043 ( -1.339 0.000 -0.531) 1.441 8.044 ( 1.365 -0.000 0.508) 1.456 8.182 ( 0.024 -0.000 7.039) 7.039 8.289 ( 2.020 -0.000 0.455) 2.071 9.201 ( -6.454 0.000 2.980) 7.109 9.324 ( -4.350 0.000 -9.757) 10.683 13.016 ( -2.109 0.000 -0.037) 2.109 13.269 ( 4.322 -0.000 0.209) 4.328 14.622 ( -5.061 0.000 4.215) 6.586 14.878 ( 3.418 -0.000 -2.237) 4.085 17.274 ( -0.154 0.000 -0.187) 0.242 17.352 ( 1.644 -0.000 0.206) 1.657 17.644 ( -6.843 0.000 2.942) 7.448 17.978 ( 3.443 -0.000 -2.217) 4.095 21.341 ( -2.708 0.000 -2.878) 3.952 21.434 ( -1.051 0.000 1.239) 1.624 21.775 ( 0.670 -0.000 -0.214) 0.703 21.826 ( 1.212 -0.000 -0.750) 1.425 24.048 ( -0.262 0.000 0.621) 0.674 24.103 ( 1.061 -0.000 -0.847) 1.358 28.225 ( 0.103 -0.000 -0.874) 0.881 28.229 ( 0.335 -0.000 1.219) 1.265 32.867 ( -0.752 0.000 1.101) 1.333 33.540 ( 17.632 -0.000 17.488) 24.834 36.552 ( -0.665 0.000 5.826) 5.864 36.604 ( 0.723 -0.000 -5.708) 5.753 39.777 ( -16.021 0.000 5.413) 16.911 40.406 ( 5.308 -0.000 -0.480) 5.330 40.483 ( -4.906 0.000 -3.008) 5.755 41.186 ( 22.674 -0.000 -17.229) 28.477 ======================= Grid point 269 (139/165) ======================= q-point: ( 0.25 0.12 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.123 ( 2.396 7.298 -7.094) 10.456 2.509 ( -5.106 -2.731 2.506) 6.310 2.594 ( 7.664 -7.190 -3.933) 11.220 2.965 ( 13.423 -2.352 0.875) 13.656 3.110 ( 10.298 -6.285 -9.768) 15.523 3.189 ( 1.619 -2.892 17.389) 17.702 3.676 ( 3.457 9.070 -4.150) 10.557 3.908 ( -1.078 0.304 -3.622) 3.792 4.135 ( -3.759 1.270 4.899) 6.304 4.207 ( 10.417 -2.557 5.377) 11.999 4.379 ( 3.871 -10.994 3.321) 12.120 4.537 ( 8.131 -8.339 9.243) 14.869 4.725 ( 1.564 -1.269 8.047) 8.295 4.992 ( 16.118 -5.257 -13.603) 21.736 5.152 ( -11.012 7.540 0.341) 13.350 5.200 ( -7.861 5.734 1.472) 9.841 5.424 ( -4.349 3.911 -8.552) 10.361 5.447 ( -6.540 -0.926 14.856) 16.258 5.609 ( -7.844 -2.846 3.717) 9.135 5.820 ( -0.044 -1.937 -6.079) 6.380 5.969 ( -0.587 5.624 -5.020) 7.561 6.070 ( -10.202 1.896 -2.491) 10.671 6.085 ( -1.906 4.828 -0.567) 5.222 6.219 ( -0.959 1.068 -1.503) 2.079 6.257 ( 2.244 -0.690 0.830) 2.490 6.398 ( 4.005 -3.277 1.154) 5.302 6.583 ( -7.672 -0.280 3.301) 8.357 6.799 ( -1.971 -5.876 -3.415) 7.076 6.980 ( -2.676 3.425 6.292) 7.647 7.027 ( -1.765 7.285 0.960) 7.557 7.247 ( -4.822 -2.405 0.933) 5.469 7.330 ( 0.909 0.771 -4.084) 4.254 7.520 ( 0.916 -0.448 2.682) 2.869 7.684 ( -3.399 1.412 1.462) 3.960 7.738 ( 1.150 3.967 -5.764) 7.091 7.923 ( 4.092 -3.605 -0.679) 5.495 8.041 ( 0.915 5.559 1.112) 5.742 8.078 ( 3.109 -0.866 1.388) 3.513 8.147 ( 3.728 1.475 1.988) 4.475 8.447 ( 6.259 -9.136 -1.467) 11.171 9.117 ( -7.217 1.688 1.512) 7.565 9.153 ( -9.242 6.083 -10.136) 15.005 13.003 ( 1.008 1.080 0.134) 1.484 13.321 ( 2.841 -0.874 1.092) 3.167 14.591 ( -3.743 -0.496 3.776) 5.340 14.909 ( 2.089 -0.854 -1.405) 2.659 17.272 ( 1.211 0.864 -0.417) 1.545 17.363 ( 1.047 0.987 0.013) 1.439 17.593 ( -4.748 -1.249 1.805) 5.230 18.007 ( 0.584 -1.685 -1.435) 2.289 21.288 ( -2.081 1.267 -2.768) 3.687 21.425 ( -1.909 -0.696 1.117) 2.319 21.783 ( 0.843 0.134 -0.511) 0.995 21.830 ( 0.690 0.369 -1.022) 1.287 24.053 ( 0.395 -0.217 0.245) 0.513 24.114 ( 0.572 -0.550 -0.540) 0.960 28.228 ( 0.005 -0.782 -0.916) 1.205 28.244 ( 0.271 -0.713 1.365) 1.564 32.927 ( 6.417 -1.892 0.768) 6.734 33.768 ( 10.765 3.882 19.110) 22.275 36.573 ( -0.009 0.181 5.224) 5.227 36.605 ( 1.158 -1.631 -3.948) 4.426 39.639 ( -10.923 -0.475 4.809) 11.944 40.422 ( -3.845 0.546 1.093) 4.035 40.499 ( 4.223 -4.598 -1.290) 6.375 41.335 ( 18.484 1.516 -21.027) 28.037 ======================= Grid point 270 (140/165) ======================= q-point: ( 0.38 0.12 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( 4.279 -1.176 -7.069) 8.346 2.553 ( 1.427 -2.628 5.158) 5.963 2.824 ( 11.204 -8.317 -3.114) 14.296 3.112 ( 6.518 1.161 -1.134) 6.717 3.220 ( 8.589 0.724 -10.476) 13.566 3.350 ( 2.210 -3.613 12.974) 13.648 3.602 ( 4.989 5.908 4.043) 8.726 3.762 ( -4.982 3.881 -4.890) 7.987 4.203 ( 7.861 -2.430 1.159) 8.310 4.366 ( -0.410 -2.500 6.236) 6.731 4.559 ( -8.104 -4.165 5.692) 10.744 4.708 ( 5.843 -11.382 5.931) 14.102 4.809 ( -12.009 9.924 3.084) 15.881 4.917 ( -1.566 -4.906 -2.755) 5.841 5.061 ( 3.382 -7.989 -0.331) 8.682 5.152 ( 0.933 3.822 3.294) 5.131 5.402 ( -6.549 0.283 3.560) 7.460 5.473 ( 10.874 -4.278 -7.767) 14.031 5.583 ( -0.978 2.080 4.031) 4.640 5.723 ( -15.561 2.554 -6.758) 17.156 5.846 ( 0.577 7.480 0.155) 7.504 5.990 ( 3.102 -5.639 -2.726) 6.989 6.017 ( 1.566 5.566 0.739) 5.829 6.195 ( -0.050 0.362 1.149) 1.206 6.297 ( -1.704 -0.727 5.175) 5.496 6.437 ( 2.026 3.472 -0.087) 4.021 6.540 ( -2.959 0.407 1.412) 3.304 6.822 ( -6.312 2.457 0.472) 6.790 6.893 ( 1.955 0.262 -2.483) 3.171 7.018 ( 0.762 -5.211 2.865) 5.995 7.130 ( -2.454 6.684 -5.249) 8.846 7.351 ( -0.213 -1.112 0.830) 1.404 7.520 ( -1.180 2.602 -0.465) 2.894 7.642 ( -4.148 -4.045 4.528) 7.353 7.693 ( 0.371 0.170 -4.259) 4.279 7.927 ( -1.017 4.871 2.133) 5.414 8.035 ( 4.546 -1.386 1.408) 4.956 8.132 ( 1.599 -0.266 1.913) 2.508 8.212 ( 1.981 -2.285 0.933) 3.165 8.621 ( 4.862 -2.406 -8.005) 9.670 8.865 ( -9.596 6.634 -8.394) 14.372 9.012 ( -5.758 1.460 1.357) 6.093 13.003 ( 3.457 2.316 0.202) 4.166 13.365 ( 1.086 -0.661 1.677) 2.105 14.585 ( -1.794 -1.069 2.806) 3.498 14.936 ( 0.131 -1.232 -0.603) 1.378 17.272 ( 2.038 1.346 -0.504) 2.494 17.346 ( 0.277 1.720 -0.409) 1.789 17.592 ( -1.427 -2.313 0.694) 2.805 18.028 ( -2.255 -2.518 -0.533) 3.422 21.239 ( -0.981 1.302 -1.514) 2.224 21.422 ( -1.881 -1.337 0.331) 2.331 21.784 ( 0.240 0.381 -0.129) 0.468 21.825 ( 0.491 0.428 -1.405) 1.549 24.063 ( 0.906 -0.028 -0.263) 0.944 24.126 ( 0.139 -0.619 -0.182) 0.660 28.238 ( -0.100 -0.953 -0.678) 1.174 28.265 ( -0.040 -0.948 1.249) 1.568 33.049 ( 8.660 -1.117 0.144) 8.733 33.825 ( 1.594 6.778 14.151) 15.771 36.587 ( 0.396 0.247 2.109) 2.160 36.640 ( 1.159 -1.579 -0.353) 1.990 39.592 ( -3.892 -2.002 4.799) 6.495 40.373 ( -4.429 0.830 3.856) 5.931 40.627 ( 2.622 -5.935 1.039) 6.571 41.386 ( 13.390 3.896 -22.063) 26.100 ======================= Grid point 271 (141/165) ======================= q-point: ( 0.50 0.12 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( 6.673 -1.711 -3.465) 7.712 2.628 ( -1.904 -3.214 3.770) 5.307 3.010 ( 5.651 8.798 8.010) 13.172 3.018 ( -0.640 4.859 -4.430) 6.606 3.273 ( 9.534 -2.188 -12.369) 15.769 3.430 ( -3.758 -8.313 -2.714) 9.518 3.602 ( 4.832 4.999 7.467) 10.203 3.727 ( 2.533 3.535 0.924) 4.446 4.263 ( -9.423 2.851 8.326) 12.894 4.395 ( 12.719 -3.278 1.116) 13.182 4.505 ( -9.676 8.347 1.990) 12.932 4.612 ( -5.783 -7.018 0.069) 9.094 4.878 ( -0.169 -11.176 2.894) 11.546 5.051 ( 2.630 6.820 -1.848) 7.539 5.179 ( 5.112 -10.437 0.821) 11.651 5.268 ( 4.291 -5.801 -2.661) 7.690 5.299 ( -7.080 2.284 1.355) 7.561 5.428 ( -11.247 4.472 0.311) 12.107 5.545 ( -7.141 -1.025 12.012) 14.012 5.575 ( -1.118 4.923 4.389) 6.689 5.851 ( 1.593 -4.730 1.624) 5.248 5.963 ( 6.187 1.904 -8.987) 11.076 6.079 ( 5.482 4.435 0.826) 7.100 6.211 ( 1.679 3.952 -1.949) 4.715 6.321 ( 3.879 -5.433 0.452) 6.691 6.382 ( -1.367 3.172 3.480) 4.903 6.505 ( -0.908 1.244 1.234) 1.973 6.711 ( -5.448 1.014 -7.534) 9.353 6.928 ( -4.008 5.147 -1.495) 6.693 6.966 ( 6.860 -4.450 -3.299) 8.817 7.184 ( 1.259 -4.529 3.627) 5.937 7.369 ( 4.850 2.695 -2.414) 6.051 7.462 ( -4.719 -3.331 0.354) 5.787 7.649 ( -3.596 -1.370 -0.072) 3.849 7.724 ( 2.344 0.347 1.408) 2.756 7.897 ( -2.393 -1.185 3.151) 4.130 8.098 ( -2.496 -2.140 1.056) 3.454 8.138 ( 1.117 0.356 1.657) 2.030 8.239 ( -2.023 0.579 2.017) 2.915 8.393 ( -9.643 11.178 -7.442) 16.533 8.816 ( 0.398 -2.095 -5.113) 5.540 9.023 ( 5.396 -4.172 -2.319) 7.204 13.016 ( 5.459 2.704 -0.006) 6.091 13.373 ( -1.373 0.491 1.834) 2.343 14.607 ( 0.496 -1.500 1.474) 2.161 14.936 ( -2.587 -0.651 -0.142) 2.671 17.275 ( 2.430 1.256 -0.913) 2.884 17.326 ( 0.584 1.018 -0.473) 1.265 17.629 ( 1.559 -2.021 -0.017) 2.552 18.022 ( -4.989 -2.096 0.610) 5.445 21.217 ( 0.368 0.590 0.166) 0.715 21.423 ( -1.944 -1.546 -0.560) 2.546 21.776 ( -0.399 0.486 0.690) 0.933 21.819 ( 0.530 0.208 -1.722) 1.813 24.073 ( 1.383 0.137 -0.635) 1.528 24.135 ( -0.020 -0.332 0.064) 0.338 28.248 ( -0.062 -0.605 -0.134) 0.623 28.281 ( -0.321 -0.736 0.793) 1.129 33.138 ( 7.314 2.494 0.048) 7.727 33.746 ( -5.645 5.487 7.517) 10.885 36.596 ( 0.489 0.424 1.734) 1.851 36.666 ( 0.681 -0.901 -1.746) 2.079 39.649 ( 3.398 -2.985 4.210) 6.179 40.325 ( -5.847 0.365 5.717) 8.185 40.733 ( -0.161 -3.751 4.001) 5.486 41.337 ( 8.279 6.539 -21.039) 23.536 ======================= Grid point 272 (142/165) ======================= q-point: (-0.38 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 3.737 6.021 -0.955) 7.150 2.555 ( -12.028 4.548 0.201) 12.861 2.846 ( 4.610 6.629 0.586) 8.096 3.028 ( 2.659 1.263 2.320) 3.748 3.341 ( 4.305 3.066 -11.643) 12.787 3.456 ( -4.371 5.187 5.652) 8.829 3.606 ( -0.941 -2.814 1.908) 3.528 3.737 ( 5.636 -2.933 3.771) 7.388 4.126 ( -4.437 7.239 2.689) 8.906 4.366 ( -6.985 -0.493 1.117) 7.091 4.542 ( 2.673 -0.133 -1.254) 2.955 4.713 ( -0.025 -2.548 2.864) 3.833 4.944 ( -3.393 1.341 6.357) 7.329 5.016 ( 1.583 2.226 3.906) 4.766 5.162 ( -0.972 4.674 0.887) 4.855 5.190 ( -6.377 3.710 -2.603) 7.823 5.286 ( 8.069 -2.897 -2.901) 9.051 5.393 ( -3.498 -3.704 5.002) 7.140 5.545 ( -3.477 -0.465 8.054) 8.785 5.682 ( 5.368 -4.585 4.526) 8.385 5.900 ( 0.680 -1.252 -1.419) 2.011 5.976 ( -2.013 2.557 -0.267) 3.266 6.053 ( 2.518 -4.055 -6.589) 8.136 6.189 ( 0.416 -0.060 -3.780) 3.803 6.345 ( -0.180 -0.594 0.502) 0.799 6.409 ( -6.428 -0.513 -2.166) 6.803 6.571 ( 13.540 -2.528 -0.725) 13.793 6.611 ( -1.676 -1.039 -2.603) 3.266 6.871 ( -0.206 -0.684 -0.084) 0.719 7.133 ( 9.541 -2.945 -3.270) 10.507 7.232 ( -1.314 -0.344 1.067) 1.727 7.329 ( 0.001 0.441 -1.385) 1.453 7.531 ( -0.246 -3.739 1.053) 3.893 7.651 ( -1.611 -2.393 1.322) 3.173 7.713 ( 0.436 1.746 -2.060) 2.735 7.856 ( -7.048 1.082 0.060) 7.131 7.972 ( -7.384 5.519 -0.166) 9.220 8.102 ( -3.727 1.682 -1.052) 4.222 8.175 ( -2.688 4.711 2.253) 5.873 8.302 ( -4.126 -6.913 2.583) 8.455 8.873 ( 4.707 -3.607 1.572) 6.135 9.172 ( 8.832 -5.122 -7.474) 12.653 13.048 ( 6.944 2.394 -0.327) 7.352 13.331 ( -4.134 1.672 1.676) 4.764 14.654 ( 2.744 -1.622 0.060) 3.188 14.894 ( -4.995 0.234 0.270) 5.008 17.281 ( 2.306 0.866 -1.291) 2.781 17.323 ( 0.468 0.147 -0.297) 0.573 17.691 ( 4.742 -1.348 -0.644) 4.972 17.980 ( -7.118 -1.000 1.765) 7.402 21.232 ( 1.694 -0.414 1.821) 2.521 21.419 ( -2.083 -1.575 -1.354) 2.942 21.768 ( -0.627 0.319 1.401) 1.568 21.815 ( 0.473 0.039 -1.853) 1.912 24.086 ( 1.741 0.321 -0.761) 1.926 24.135 ( -0.292 0.192 0.116) 0.369 28.253 ( 0.038 0.074 0.503) 0.510 28.286 ( -0.384 -0.184 0.111) 0.440 33.139 ( 5.366 6.638 0.641) 8.560 33.603 ( -11.505 2.373 1.880) 11.897 36.599 ( -0.127 0.613 2.258) 2.343 36.670 ( 0.687 -0.341 -4.547) 4.612 39.795 ( 10.623 -3.245 2.101) 11.305 40.273 ( -7.991 -0.478 6.916) 10.579 40.768 ( -2.562 -0.061 6.015) 6.538 41.200 ( 3.818 8.696 -18.220) 20.547 ======================= Grid point 273 (143/165) ======================= q-point: (-0.25 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( -3.228 10.881 9.832) 15.016 2.360 ( -5.509 1.432 -9.527) 11.097 2.846 ( 1.988 3.350 5.542) 6.774 3.096 ( 4.194 -3.278 -5.347) 7.545 3.180 ( -7.238 7.405 4.958) 11.481 3.288 ( -0.055 12.944 5.670) 14.131 3.684 ( 4.356 -1.735 -4.646) 6.600 3.845 ( -4.306 -3.715 1.216) 5.816 4.064 ( 6.363 0.525 -0.216) 6.389 4.298 ( -2.582 1.777 -4.440) 5.435 4.340 ( -9.318 17.855 12.981) 23.961 4.574 ( -7.417 9.944 1.854) 12.543 4.920 ( -2.126 9.950 1.470) 10.280 5.061 ( 4.113 4.563 -5.329) 8.132 5.139 ( 7.999 -8.136 4.403) 12.230 5.232 ( 4.052 -6.310 -3.818) 8.415 5.427 ( -4.109 -3.256 5.264) 7.430 5.479 ( 5.725 -7.255 -0.073) 9.242 5.559 ( 0.218 -4.499 1.041) 4.623 5.714 ( -7.387 -1.522 1.940) 7.788 5.862 ( 0.326 2.067 3.727) 4.274 5.961 ( 0.715 -3.322 -1.113) 3.576 6.165 ( -0.366 -1.495 -1.792) 2.363 6.209 ( 5.039 -5.318 -10.872) 13.110 6.307 ( -3.260 1.411 -3.587) 5.048 6.360 ( -1.771 -1.945 -2.064) 3.343 6.681 ( -0.974 -6.807 6.082) 9.180 6.745 ( 5.473 -3.273 1.226) 6.493 6.967 ( 9.449 -5.678 -0.557) 11.037 7.166 ( 2.076 5.217 3.815) 6.789 7.197 ( 3.118 2.313 -4.448) 5.904 7.421 ( 0.230 -7.209 -0.182) 7.215 7.477 ( -5.929 4.386 -2.582) 7.815 7.621 ( -10.504 -1.374 -0.122) 10.594 7.733 ( 2.620 0.859 -1.081) 2.961 7.751 ( -1.569 0.334 -0.536) 1.691 7.905 ( 0.092 -0.035 2.304) 2.306 8.033 ( -5.490 2.557 1.168) 6.168 8.113 ( 3.573 0.125 2.005) 4.100 8.335 ( -7.645 -4.911 -1.020) 9.143 9.034 ( 5.444 -5.170 7.382) 10.529 9.297 ( 5.929 -4.043 -9.608) 11.993 13.099 ( 7.571 1.902 -0.542) 7.825 13.245 ( -6.160 2.046 1.239) 6.608 14.719 ( 4.274 -1.376 -0.975) 4.594 14.821 ( -5.957 0.844 0.981) 6.096 17.291 ( 2.002 0.424 -1.032) 2.292 17.320 ( -0.976 -0.144 -0.275) 1.025 17.776 ( 7.328 -0.780 -1.285) 7.481 17.906 ( -7.887 0.091 2.364) 8.234 21.284 ( 2.677 -1.491 2.887) 4.210 21.412 ( -2.114 -1.572 -1.931) 3.266 21.766 ( -0.438 -0.018 1.698) 1.754 21.811 ( 0.292 0.089 -1.895) 1.920 24.096 ( 1.784 0.683 -0.736) 2.047 24.120 ( -0.926 0.845 0.069) 1.255 28.250 ( 0.043 0.821 0.978) 1.278 28.278 ( -0.270 0.586 -0.570) 0.861 33.091 ( 6.165 7.582 1.924) 9.960 33.412 ( -16.403 1.293 -1.796) 16.551 36.588 ( -1.606 1.034 2.817) 3.403 36.659 ( 1.540 0.320 -5.705) 5.918 40.009 ( 15.532 -3.362 -0.963) 15.921 40.207 ( -10.157 -0.882 6.541) 12.113 40.738 ( -3.120 2.755 7.629) 8.691 41.015 ( 1.898 9.209 -14.584) 17.352 ======================= Grid point 274 (144/165) ======================= q-point: (-0.12 0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( -2.640 1.208 18.408) 18.635 2.295 ( 1.208 -2.090 -13.736) 13.947 2.771 ( -14.069 4.697 21.322) 25.974 2.992 ( -2.385 4.501 2.398) 5.630 3.112 ( -1.003 10.379 -0.884) 10.465 3.257 ( 16.951 0.187 -14.459) 22.281 3.705 ( 2.230 2.037 6.374) 7.053 3.837 ( 1.888 0.871 -4.322) 4.796 3.951 ( -10.894 13.785 14.437) 22.741 4.189 ( 7.874 1.211 -7.118) 10.683 4.255 ( -9.185 13.529 -0.356) 16.356 4.342 ( 7.060 -1.005 -3.204) 7.818 4.715 ( -4.209 10.744 2.487) 11.804 4.920 ( 5.461 9.968 -16.529) 20.059 5.342 ( -4.912 -7.930 6.350) 11.285 5.410 ( 6.516 -4.926 0.866) 8.214 5.462 ( 0.540 -2.714 6.451) 7.020 5.535 ( -10.347 -6.617 0.392) 12.288 5.683 ( -3.845 -5.954 4.261) 8.270 5.761 ( 7.043 -7.697 -1.566) 10.550 5.928 ( 1.341 -4.332 5.227) 6.920 6.043 ( 1.858 -5.448 -2.077) 6.119 6.171 ( 0.950 1.230 -0.185) 1.566 6.192 ( -4.266 -0.732 -3.685) 5.685 6.295 ( 2.009 1.323 -4.060) 4.719 6.325 ( -0.468 -0.689 -9.171) 9.208 6.817 ( -1.822 -7.863 5.142) 9.570 6.856 ( 1.697 -4.303 1.369) 4.824 7.152 ( -3.342 -0.683 -0.249) 3.420 7.159 ( 10.903 3.863 5.994) 13.028 7.189 ( -1.363 -4.111 -0.861) 4.416 7.302 ( -5.930 2.324 -4.929) 8.054 7.470 ( 2.546 3.525 1.024) 4.467 7.506 ( -4.622 0.723 -2.405) 5.260 7.701 ( -2.748 0.564 5.443) 6.123 7.786 ( 1.499 -0.904 -2.379) 2.953 7.935 ( 0.316 -1.353 2.375) 2.751 7.991 ( 2.605 -1.857 -2.853) 4.287 8.227 ( 7.108 -2.166 2.393) 7.806 8.279 ( -7.988 -1.274 -2.643) 8.510 9.181 ( 0.428 -4.013 8.578) 9.480 9.352 ( 1.547 -3.103 -9.442) 10.059 13.139 ( -4.789 1.174 1.328) 5.107 13.164 ( 5.385 1.685 -1.324) 5.795 14.737 ( -6.139 0.618 3.098) 6.904 14.791 ( 5.118 -0.457 -2.564) 5.743 17.301 ( -1.714 -0.169 0.087) 1.725 17.308 ( 1.376 -0.022 -0.647) 1.521 17.808 ( -7.840 0.470 3.882) 8.761 17.876 ( 7.820 0.278 -3.236) 8.468 21.356 ( 1.775 -2.144 2.732) 3.900 21.403 ( -1.314 -1.237 -2.254) 2.887 21.772 ( -0.351 -0.291 1.537) 1.603 21.804 ( 0.589 0.221 -1.789) 1.897 24.089 ( -1.245 1.277 0.291) 1.807 24.100 ( 1.382 0.911 -0.837) 1.855 28.238 ( 0.012 1.189 1.134) 1.643 28.258 ( -0.131 1.184 -0.912) 1.500 33.100 ( 8.523 4.198 5.083) 10.774 33.174 ( -14.693 2.837 -2.481) 15.169 36.559 ( -1.980 1.316 3.771) 4.458 36.647 ( 1.721 0.668 -5.366) 5.675 40.092 ( -15.682 -1.897 8.219) 17.807 40.242 ( 17.095 -0.277 -7.248) 18.570 40.686 ( -6.872 1.759 8.071) 10.745 40.879 ( 11.055 7.380 -12.318) 18.122 ======================= Grid point 277 (145/165) ======================= q-point: ( 0.25 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( -7.215 0.000 -21.183) 22.378 2.352 ( 13.756 -0.000 -6.164) 15.074 2.688 ( 6.077 -0.000 5.782) 8.388 3.125 ( 14.013 -0.000 -6.463) 15.431 3.203 ( 15.856 -0.000 -4.503) 16.483 3.341 ( 8.393 -0.000 26.317) 27.623 3.797 ( 1.717 -0.000 -6.798) 7.012 3.902 ( 4.746 -0.000 1.691) 5.038 4.089 ( -5.754 0.000 3.807) 6.899 4.219 ( -3.923 0.000 -0.476) 3.952 4.414 ( 12.587 -0.000 11.644) 17.146 4.546 ( -4.232 0.000 3.602) 5.558 4.778 ( 1.880 -0.000 14.155) 14.279 5.023 ( 1.712 -0.000 -3.424) 3.828 5.048 ( -17.011 0.000 0.828) 17.031 5.229 ( -2.732 0.000 2.280) 3.558 5.323 ( -6.291 0.000 -1.194) 6.403 5.472 ( -3.406 0.000 5.063) 6.102 5.574 ( 14.105 -0.000 -11.515) 18.209 5.784 ( 0.939 -0.000 -9.993) 10.037 5.868 ( -15.951 0.000 5.872) 16.998 6.020 ( -2.176 0.000 2.490) 3.306 6.131 ( 3.690 -0.000 -10.103) 10.756 6.222 ( -1.403 0.000 4.448) 4.664 6.302 ( 2.299 -0.000 1.266) 2.625 6.395 ( 4.128 -0.000 1.785) 4.498 6.528 ( -4.326 0.000 4.453) 6.208 6.693 ( -5.069 0.000 -1.301) 5.234 7.029 ( 0.118 -0.000 4.373) 4.375 7.029 ( -5.420 0.000 -7.355) 9.136 7.250 ( -3.563 0.000 -4.701) 5.898 7.270 ( 2.407 -0.000 7.485) 7.862 7.560 ( 1.723 -0.000 4.765) 5.067 7.609 ( -6.077 0.000 -5.248) 8.029 7.778 ( -5.131 0.000 -1.774) 5.429 7.878 ( 2.090 -0.000 1.559) 2.607 8.103 ( 2.207 -0.000 0.233) 2.219 8.116 ( 2.397 -0.000 -0.043) 2.398 8.287 ( 1.981 -0.000 7.562) 7.817 8.365 ( 7.770 -0.000 -9.740) 12.460 9.033 ( -12.023 0.000 -11.148) 16.396 9.050 ( -7.337 0.000 0.561) 7.359 13.052 ( 4.818 -0.000 0.832) 4.890 13.350 ( 2.080 -0.000 2.056) 2.925 14.567 ( -2.486 0.000 3.913) 4.636 14.909 ( 0.500 -0.000 -1.757) 1.827 17.302 ( 2.854 -0.000 -1.080) 3.051 17.387 ( 1.189 -0.000 -0.051) 1.190 17.538 ( -3.282 0.000 1.104) 3.462 17.974 ( -2.789 0.000 -0.608) 2.855 21.267 ( -0.807 0.000 -3.637) 3.725 21.392 ( -3.227 0.000 1.771) 3.681 21.790 ( 0.673 -0.000 -0.867) 1.097 21.833 ( 0.164 -0.000 -1.231) 1.242 24.063 ( 1.280 -0.000 -0.039) 1.281 24.113 ( 0.275 -0.000 -0.300) 0.407 28.218 ( 0.094 -0.000 -0.957) 0.962 28.247 ( 0.079 -0.000 1.423) 1.425 33.028 ( 12.070 -0.000 -0.178) 12.071 33.972 ( 1.439 -0.000 21.417) 21.465 36.586 ( 2.164 -0.000 -5.289) 5.714 36.612 ( 0.479 -0.000 7.691) 7.706 39.559 ( -5.345 0.000 5.334) 7.551 40.446 ( 1.452 -0.000 4.957) 5.165 40.458 ( -0.497 0.000 -1.685) 1.757 41.448 ( 15.400 -0.000 -24.944) 29.315 ======================= Grid point 278 (146/165) ======================= q-point: ( 0.38 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( 3.479 -1.907 -12.845) 13.444 2.579 ( 12.920 -5.452 -1.792) 14.137 2.808 ( 8.703 -4.399 -0.783) 9.783 3.188 ( 5.688 2.754 -6.776) 9.265 3.326 ( 7.962 1.063 -8.768) 11.891 3.511 ( 5.141 5.853 18.286) 19.876 3.756 ( 2.296 2.538 -5.328) 6.333 3.849 ( 5.444 10.698 9.092) 15.058 4.184 ( 6.195 -7.806 3.348) 10.512 4.299 ( -0.533 -9.403 2.079) 9.645 4.429 ( -16.429 1.477 9.082) 18.830 4.644 ( 6.640 -8.007 6.812) 12.434 4.741 ( -13.701 4.768 1.222) 14.558 4.950 ( 3.654 -6.507 0.111) 7.463 4.995 ( -2.886 4.019 4.632) 6.778 5.208 ( -0.015 -0.231 3.678) 3.685 5.298 ( -6.020 -3.147 0.755) 6.835 5.455 ( -1.292 2.091 1.173) 2.724 5.509 ( -14.489 1.149 -3.747) 15.009 5.740 ( 9.357 2.099 -7.196) 11.990 5.899 ( 2.377 1.184 -2.171) 3.431 6.018 ( 4.666 -0.324 3.380) 5.771 6.154 ( 7.560 1.088 -5.138) 9.205 6.203 ( -0.560 1.085 3.507) 3.713 6.281 ( -0.948 2.100 3.677) 4.339 6.473 ( 2.741 -1.236 -0.268) 3.019 6.506 ( -2.905 0.831 0.920) 3.159 6.706 ( -5.409 -7.525 2.792) 9.679 6.899 ( -7.011 -0.195 -7.666) 10.390 6.999 ( -0.114 4.888 0.726) 4.943 7.190 ( 2.588 2.779 -0.208) 3.803 7.355 ( 1.810 -1.202 0.218) 2.184 7.514 ( -4.286 1.875 -4.090) 6.214 7.568 ( -3.736 -0.440 3.742) 5.306 7.716 ( 2.695 1.760 2.223) 3.912 7.937 ( -2.584 -3.413 0.413) 4.300 8.068 ( -0.799 3.278 1.251) 3.599 8.152 ( 0.638 -1.007 1.390) 1.831 8.247 ( 2.277 4.191 3.095) 5.686 8.542 ( 4.897 -8.541 -9.957) 14.002 8.788 ( -12.660 4.364 -9.732) 16.554 8.958 ( -6.704 0.213 -0.421) 6.720 13.109 ( 6.829 2.270 1.015) 7.267 13.381 ( 0.948 0.005 2.299) 2.487 14.570 ( -0.589 -0.688 3.541) 3.655 14.905 ( -1.407 -0.896 -1.759) 2.424 17.324 ( 3.207 1.288 -1.048) 3.612 17.379 ( 0.525 1.995 -0.386) 2.099 17.544 ( 0.152 -2.707 0.273) 2.725 17.941 ( -5.483 -2.110 0.150) 5.877 21.242 ( 0.343 0.803 -2.670) 2.809 21.371 ( -3.326 -1.337 1.153) 3.766 21.790 ( 0.086 0.255 -0.528) 0.592 21.826 ( -0.040 0.172 -1.488) 1.498 24.078 ( 1.650 0.178 -0.528) 1.741 24.118 ( 0.014 -0.495 0.052) 0.498 28.222 ( 0.224 -0.678 -0.798) 1.071 28.256 ( -0.399 -0.576 1.281) 1.460 33.181 ( 14.086 0.556 -0.926) 14.127 33.972 ( -7.090 5.790 16.682) 19.028 36.598 ( 2.896 -0.131 -3.918) 4.874 36.650 ( -0.328 -0.234 6.687) 6.699 39.570 ( 0.947 -1.519 6.543) 6.784 40.384 ( -3.187 3.186 1.868) 4.878 40.569 ( 2.125 -5.550 6.081) 8.503 41.476 ( 11.432 2.253 -26.449) 28.902 ======================= Grid point 279 (147/165) ======================= q-point: ( 0.50 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.162 ( 9.028 -5.730 -4.418) 11.570 2.680 ( 2.176 5.286 3.673) 6.795 3.035 ( 8.068 -7.802 -3.693) 11.816 3.166 ( 5.603 1.889 -7.608) 9.636 3.300 ( -6.405 0.077 3.000) 7.074 3.399 ( 8.124 11.806 -8.683) 16.756 3.707 ( -0.625 4.029 4.432) 6.022 3.906 ( 3.849 7.158 8.376) 11.671 4.181 ( -10.936 0.172 11.332) 15.750 4.407 ( -1.541 -3.883 2.363) 4.800 4.445 ( 0.093 -5.899 -0.003) 5.900 4.627 ( 3.433 -0.969 -0.867) 3.671 4.774 ( 2.226 -1.443 -1.255) 2.935 4.993 ( -6.821 -6.726 9.406) 13.425 5.080 ( -1.067 -3.406 -4.774) 5.961 5.223 ( -6.719 -3.908 -1.192) 7.864 5.277 ( 8.202 -0.665 2.442) 8.584 5.375 ( -5.667 -3.064 3.050) 7.128 5.449 ( -2.753 1.315 8.723) 9.241 5.771 ( 7.881 6.443 -2.137) 10.401 5.862 ( 0.364 0.894 1.161) 1.510 6.011 ( -0.677 3.482 -0.712) 3.618 6.158 ( -3.227 1.725 3.667) 5.180 6.254 ( -1.068 -0.106 -0.563) 1.212 6.312 ( 5.397 -0.860 -2.253) 5.911 6.429 ( 1.508 1.996 -3.248) 4.100 6.544 ( 5.475 -1.562 -0.825) 5.753 6.661 ( -5.732 6.039 -0.330) 8.333 6.888 ( 2.370 -4.927 -6.133) 8.217 6.946 ( -3.356 -0.751 2.511) 4.258 7.196 ( 2.358 1.094 1.404) 2.954 7.361 ( -3.017 -1.514 -1.491) 3.690 7.449 ( 3.551 1.222 -3.581) 5.189 7.564 ( -3.624 -2.921 0.609) 4.694 7.761 ( 2.345 0.735 3.821) 4.543 7.906 ( -2.022 1.971 -0.462) 2.862 8.032 ( -4.373 -0.553 1.324) 4.602 8.161 ( -0.953 1.181 2.025) 2.530 8.232 ( -1.696 1.821 2.614) 3.609 8.412 ( -9.113 7.863 -5.480) 13.225 8.744 ( 1.556 -5.012 -7.506) 9.159 8.949 ( -0.484 -7.273 -3.665) 8.159 13.151 ( 7.832 3.591 0.495) 8.630 13.380 ( -1.340 1.261 1.925) 2.663 14.605 ( 1.621 -1.300 2.748) 3.445 14.881 ( -3.762 -0.797 -1.509) 4.131 17.329 ( 2.703 1.906 -0.969) 3.446 17.351 ( 0.501 1.669 -0.468) 1.805 17.615 ( 3.443 -3.258 -0.288) 4.749 17.908 ( -7.504 -3.019 0.969) 8.146 21.234 ( 1.241 0.477 -0.574) 1.448 21.361 ( -3.082 -1.902 -0.220) 3.628 21.782 ( -0.397 0.415 0.324) 0.660 21.817 ( 0.048 0.057 -1.720) 1.721 24.092 ( 1.694 0.184 -0.743) 1.859 24.127 ( -0.095 -0.552 0.116) 0.572 28.236 ( 0.404 -0.898 -0.357) 1.047 28.266 ( -0.777 -0.875 0.898) 1.475 33.308 ( 13.206 3.773 -1.120) 13.780 33.805 ( -11.264 8.198 10.290) 17.319 36.616 ( 1.901 0.506 -0.715) 2.093 36.664 ( -0.447 0.020 1.739) 1.795 39.683 ( 6.668 -3.236 6.984) 10.184 40.299 ( -5.935 1.810 1.762) 6.450 40.697 ( 0.340 -3.673 10.338) 10.976 41.416 ( 7.354 4.742 -26.254) 27.674 ======================= Grid point 280 (148/165) ======================= q-point: (-0.38 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 6.853 1.420 -1.067) 7.079 2.539 ( -6.965 7.720 -1.721) 10.539 3.049 ( 1.575 10.486 3.035) 11.030 3.089 ( -0.069 3.402 2.341) 4.130 3.369 ( 3.694 -3.366 -2.612) 5.639 3.464 ( 9.528 -6.547 -9.365) 14.878 3.624 ( 2.041 6.471 -2.241) 7.146 3.688 ( -19.282 5.032 13.798) 24.238 4.245 ( 6.407 2.655 6.859) 9.755 4.370 ( -0.347 2.602 0.697) 2.716 4.515 ( 1.924 -3.770 -3.704) 5.625 4.696 ( -4.858 -3.451 -2.948) 6.648 4.875 ( 1.117 -7.279 1.161) 7.455 4.967 ( -2.963 0.129 2.121) 3.646 5.101 ( 0.056 -3.707 6.755) 7.705 5.280 ( 1.706 2.750 -2.249) 3.941 5.344 ( 5.218 0.901 -4.285) 6.812 5.389 ( -9.108 -6.902 11.515) 16.223 5.511 ( 8.457 0.974 5.906) 10.361 5.724 ( -3.893 4.233 4.655) 7.399 5.916 ( 6.058 -5.961 0.342) 8.506 5.956 ( -0.303 1.914 -5.831) 6.145 6.056 ( -6.617 5.715 5.020) 10.082 6.204 ( 0.940 5.172 -4.729) 7.071 6.308 ( -1.490 -0.988 -1.223) 2.166 6.405 ( 0.414 4.855 0.237) 4.878 6.544 ( -1.734 -2.150 -3.466) 4.432 6.656 ( 5.641 -1.406 -5.821) 8.227 6.873 ( 3.955 0.141 0.141) 3.960 7.090 ( -1.463 -10.119 1.179) 10.292 7.201 ( 2.806 -0.067 -0.546) 2.860 7.336 ( -4.365 -1.363 1.154) 4.716 7.500 ( 5.624 0.154 -3.944) 6.871 7.580 ( -4.032 -3.006 1.084) 5.144 7.740 ( 0.406 2.920 -0.421) 2.978 7.835 ( -4.877 3.147 0.477) 5.824 7.976 ( -3.308 1.776 1.214) 3.947 8.064 ( -4.605 1.588 -3.247) 5.854 8.208 ( 1.192 0.339 0.805) 1.478 8.257 ( -3.944 5.408 3.514) 7.559 8.844 ( 3.142 -6.799 1.994) 7.751 9.080 ( 1.674 -9.719 -9.001) 13.352 13.188 ( 8.042 3.596 -0.173) 8.811 13.322 ( -4.252 2.687 1.206) 5.172 14.670 ( 3.609 -1.585 1.845) 4.352 14.829 ( -5.335 -0.254 -1.082) 5.450 17.322 ( 1.907 1.612 -1.078) 2.720 17.333 ( -0.157 1.018 -0.119) 1.037 17.719 ( 6.227 -2.884 -0.575) 6.886 17.865 ( -8.230 -2.620 1.529) 8.771 21.253 ( 1.526 -0.441 1.814) 2.411 21.355 ( -2.378 -1.946 -1.814) 3.569 21.773 ( -0.534 0.361 1.217) 1.377 21.811 ( 0.178 -0.082 -1.882) 1.892 24.107 ( 1.631 0.074 -0.583) 1.734 24.130 ( -0.471 -0.152 -0.141) 0.514 28.253 ( 0.530 -0.571 0.209) 0.806 28.272 ( -0.811 -0.812 0.365) 1.205 33.353 ( 10.649 8.097 -0.061) 13.378 33.570 ( -12.156 7.755 4.890) 15.226 36.611 ( -2.080 0.807 3.716) 4.335 36.666 ( 2.627 0.253 -4.742) 5.427 39.877 ( 10.309 -4.413 6.302) 12.863 40.207 ( -6.824 0.537 0.193) 6.848 40.769 ( -2.680 -0.405 13.591) 13.859 41.279 ( 4.297 6.799 -24.799) 26.070 ======================= Grid point 281 (149/165) ======================= q-point: (-0.25 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.218 ( -5.592 10.873 6.753) 13.968 2.363 ( 2.976 5.372 -7.426) 9.637 2.960 ( -4.486 7.973 6.352) 11.138 3.034 ( 1.198 0.819 -0.910) 1.713 3.338 ( -9.891 3.420 6.065) 12.096 3.389 ( 1.327 8.498 3.934) 9.458 3.661 ( -6.218 -8.027 -0.945) 10.198 3.726 ( 17.576 -3.716 -8.760) 19.987 4.217 ( 2.963 7.574 3.926) 9.031 4.335 ( 0.661 6.522 -7.146) 9.697 4.561 ( 5.449 4.779 5.620) 9.171 4.577 ( -11.436 0.280 3.050) 11.839 5.035 ( -0.301 -9.512 1.785) 9.682 5.072 ( -0.147 5.367 5.818) 7.916 5.081 ( 0.964 -8.311 -3.296) 8.993 5.196 ( 4.534 7.308 -1.483) 8.727 5.378 ( -10.492 -5.423 10.215) 15.615 5.474 ( 2.126 4.206 2.227) 5.212 5.550 ( 4.045 -1.752 0.189) 4.412 5.653 ( 3.251 2.474 -5.993) 7.253 5.889 ( -6.443 0.255 5.040) 8.184 5.948 ( 1.819 1.103 -2.326) 3.152 6.078 ( -3.919 -2.797 -1.498) 5.043 6.142 ( 5.842 -2.514 -7.795) 10.060 6.309 ( 1.171 -0.050 1.843) 2.184 6.347 ( 0.162 2.906 -2.968) 4.158 6.588 ( -1.664 -4.437 4.056) 6.237 6.699 ( 0.977 -6.847 -5.524) 8.851 7.027 ( 10.941 -2.823 2.399) 11.551 7.074 ( -12.023 -4.031 -1.386) 12.757 7.288 ( -3.641 -1.579 4.752) 6.191 7.365 ( 5.278 -2.698 -2.960) 6.625 7.490 ( -5.681 2.313 -0.085) 6.135 7.506 ( 2.769 3.422 -1.845) 4.773 7.726 ( -5.630 1.231 1.709) 6.011 7.763 ( 4.092 -0.525 -2.226) 4.688 7.977 ( 3.583 1.153 2.301) 4.411 8.020 ( -0.527 0.356 -2.119) 2.213 8.160 ( -2.125 1.787 4.026) 4.890 8.220 ( 1.554 -0.382 -2.331) 2.827 9.013 ( 1.728 -7.051 7.174) 10.207 9.179 ( -1.762 -8.018 -10.429) 13.272 13.204 ( -4.026 3.057 1.652) 5.318 13.237 ( 4.938 2.920 -1.811) 6.015 14.739 ( -0.448 -0.605 2.212) 2.336 14.773 ( -0.159 -0.600 -1.397) 1.528 17.308 ( -1.602 0.763 0.176) 1.783 17.318 ( 1.214 0.792 -0.827) 1.669 17.798 ( -6.482 -1.421 3.231) 7.380 17.853 ( 6.747 -2.046 -2.551) 7.497 21.292 ( -0.540 -1.694 3.647) 4.057 21.356 ( 0.389 -1.599 -3.169) 3.571 21.770 ( -0.398 0.121 1.747) 1.796 21.806 ( 0.330 -0.067 -2.012) 2.040 24.115 ( -1.024 0.221 0.077) 1.051 24.123 ( 1.272 0.488 -0.799) 1.580 28.265 ( 0.391 0.218 0.728) 0.855 28.274 ( -0.523 -0.331 -0.232) 0.661 33.293 ( -5.590 7.919 5.349) 11.071 33.363 ( 3.723 8.706 -1.800) 9.638 36.584 ( -3.255 0.409 3.774) 5.001 36.671 ( 3.230 0.862 -5.380) 6.334 40.026 ( -8.404 -2.289 9.642) 12.993 40.196 ( 12.864 -2.328 -8.079) 15.368 40.764 ( -6.286 2.532 15.139) 16.586 41.115 ( 5.300 6.949 -21.587) 23.289 ======================= Grid point 282 (150/165) ======================= q-point: (-0.12 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -5.147 5.494 10.956) 13.294 2.338 ( 10.245 4.486 -7.935) 13.714 2.775 ( -11.035 5.876 15.270) 19.735 3.054 ( 1.714 1.276 -1.046) 2.379 3.159 ( -5.699 4.574 0.565) 7.329 3.410 ( 8.495 2.985 -3.389) 9.621 3.697 ( -1.907 -2.925 -3.155) 4.706 3.865 ( 4.969 2.717 0.677) 5.703 4.084 ( -5.075 5.831 -6.213) 9.918 4.238 ( 4.765 5.020 1.455) 7.073 4.472 ( 2.009 5.893 2.120) 6.577 4.536 ( 8.589 11.085 5.557) 15.084 4.923 ( 0.882 14.567 4.567) 15.292 5.042 ( 1.189 5.072 -3.410) 6.226 5.196 ( 0.496 -2.575 -6.510) 7.018 5.240 ( -6.969 -10.023 -4.549) 13.028 5.366 ( -11.855 -5.822 11.144) 17.281 5.451 ( 0.700 -2.926 4.462) 5.381 5.574 ( 1.832 -2.623 -4.465) 5.493 5.743 ( 4.960 -3.624 -0.786) 6.194 5.899 ( -0.478 -2.366 4.772) 5.348 6.002 ( 2.661 -2.743 -3.528) 5.201 6.054 ( -4.441 -6.324 -0.253) 7.732 6.196 ( 1.192 -0.471 -1.495) 1.969 6.271 ( -1.086 2.594 -3.260) 4.306 6.341 ( 1.249 -0.223 -0.204) 1.285 6.698 ( -1.461 -7.029 4.437) 8.439 6.809 ( 2.586 -4.370 -3.620) 6.236 6.980 ( -12.672 -5.543 -1.961) 13.970 7.119 ( -3.960 -0.315 3.005) 4.981 7.247 ( -6.334 4.113 -3.286) 8.236 7.358 ( 5.853 -1.789 4.835) 7.799 7.451 ( 1.004 0.476 0.362) 1.168 7.608 ( 9.737 0.632 0.863) 9.796 7.676 ( -2.211 -1.953 3.003) 4.210 7.773 ( -0.037 2.466 -0.989) 2.657 7.943 ( 0.330 0.506 -2.033) 2.121 8.066 ( 7.530 0.932 -1.953) 7.835 8.147 ( -4.198 -0.595 -0.676) 4.294 8.308 ( 9.543 -2.904 1.067) 10.032 9.134 ( -3.114 -4.860 7.149) 9.188 9.200 ( -6.086 -6.633 -9.533) 13.112 13.089 ( -6.824 1.935 0.446) 7.107 13.269 ( 6.259 2.217 -1.182) 6.744 14.689 ( -5.212 0.490 2.054) 5.623 14.837 ( 5.295 -0.613 -0.589) 5.363 17.277 ( -2.230 0.264 0.425) 2.285 17.322 ( 0.872 -0.051 -0.419) 0.969 17.735 ( -7.007 -0.051 2.742) 7.524 17.957 ( 7.783 -0.433 -2.660) 8.237 21.308 ( -3.439 -2.313 0.954) 4.253 21.395 ( 3.022 -1.200 -0.769) 3.341 21.773 ( -0.314 -0.023 1.510) 1.542 21.805 ( 0.824 -0.159 -1.839) 2.021 24.089 ( -1.564 0.787 0.012) 1.751 24.127 ( 1.123 0.774 -0.594) 1.487 28.261 ( 0.002 0.858 0.850) 1.208 28.267 ( -0.077 0.618 -0.462) 0.775 33.090 ( -8.827 6.309 2.269) 11.085 33.355 ( 12.182 5.989 3.905) 14.125 36.561 ( -2.488 0.240 4.085) 4.789 36.665 ( 2.286 1.363 -4.783) 5.474 39.922 ( -14.886 -0.481 6.262) 16.156 40.388 ( 15.491 -1.631 -10.096) 18.562 40.667 ( -9.676 4.710 10.900) 15.317 41.054 ( 12.663 3.135 -14.686) 19.644 ======================= Grid point 286 (151/165) ======================= q-point: ( 0.38 0.38 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.050 ( 8.678 -0.000 -5.345) 10.192 2.711 ( 20.826 -0.000 -8.773) 22.598 2.849 ( 0.850 -0.000 0.009) 0.850 3.233 ( -1.492 0.000 -2.120) 2.592 3.345 ( 3.300 -0.000 -8.077) 8.725 3.690 ( 4.251 -0.000 9.561) 10.463 3.770 ( 0.516 -0.000 -8.612) 8.628 4.108 ( -0.746 0.000 8.411) 8.444 4.158 ( 8.280 -0.000 9.427) 12.547 4.246 ( -10.389 0.000 13.372) 16.934 4.308 ( 4.574 -0.000 2.259) 5.102 4.627 ( -2.359 0.000 2.027) 3.110 4.700 ( -5.116 0.000 7.223) 8.852 4.912 ( 2.314 -0.000 -6.664) 7.054 4.925 ( -9.003 0.000 8.278) 12.230 5.155 ( -10.054 0.000 -3.935) 10.797 5.285 ( 1.615 -0.000 -0.761) 1.785 5.412 ( -0.668 0.000 4.547) 4.596 5.511 ( 4.042 -0.000 0.952) 4.152 5.798 ( 5.943 -0.000 -2.352) 6.391 5.947 ( 0.673 -0.000 -7.506) 7.536 6.024 ( -4.683 0.000 7.445) 8.795 6.167 ( -6.513 0.000 6.567) 9.249 6.202 ( 4.796 -0.000 -4.124) 6.326 6.423 ( 9.815 -0.000 0.367) 9.822 6.502 ( 1.015 -0.000 -5.140) 5.239 6.514 ( 3.894 -0.000 -0.607) 3.941 6.575 ( -3.651 0.000 4.839) 6.062 6.758 ( -4.338 0.000 -6.239) 7.599 7.051 ( -1.398 0.000 0.387) 1.451 7.232 ( 2.033 -0.000 -1.450) 2.497 7.364 ( 0.143 -0.000 0.917) 0.928 7.494 ( 1.795 -0.000 -5.373) 5.665 7.525 ( -5.275 0.000 0.632) 5.313 7.812 ( 3.777 -0.000 8.794) 9.571 7.851 ( -3.788 0.000 1.192) 3.971 8.092 ( -2.738 0.000 2.825) 3.934 8.133 ( -0.481 0.000 -0.524) 0.711 8.365 ( -0.881 0.000 5.662) 5.730 8.450 ( 7.970 -0.000 -14.734) 16.751 8.616 ( -13.575 0.000 -8.720) 16.134 8.859 ( -8.784 0.000 -1.824) 8.972 13.219 ( 7.509 -0.000 1.214) 7.606 13.400 ( 0.345 -0.000 1.955) 1.985 14.584 ( 1.198 -0.000 3.830) 4.013 14.864 ( -2.607 0.000 -2.638) 3.709 17.363 ( 2.286 -0.000 -0.821) 2.429 17.404 ( 0.370 -0.000 -0.412) 0.553 17.537 ( 3.480 -0.000 -0.355) 3.498 17.848 ( -7.507 0.000 0.638) 7.534 21.248 ( 1.733 -0.000 -3.145) 3.591 21.323 ( -3.901 0.000 1.822) 4.305 21.789 ( -0.252 0.000 -0.313) 0.402 21.818 ( -0.326 0.000 -1.456) 1.492 24.098 ( 1.837 -0.000 -0.918) 2.053 24.113 ( -0.292 0.000 0.359) 0.463 28.218 ( 0.679 -0.000 -0.768) 1.025 28.249 ( -0.946 0.000 1.123) 1.469 33.368 ( 16.856 -0.000 -1.739) 16.945 33.960 ( -13.832 0.000 14.041) 19.710 36.627 ( 5.189 -0.000 -4.995) 7.202 36.664 ( -2.735 0.000 7.941) 8.399 39.628 ( 5.560 -0.000 8.099) 9.824 40.344 ( -6.186 0.000 -5.969) 8.596 40.614 ( 3.500 -0.000 16.806) 17.167 41.490 ( 8.285 -0.000 -28.359) 29.545 ======================= Grid point 287 (152/165) ======================= q-point: ( 0.50 0.38 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.211 ( 13.466 -3.590 2.548) 14.168 2.758 ( -8.335 3.782 -4.401) 10.156 2.967 ( 15.134 -7.702 -8.577) 19.024 3.162 ( -11.372 -1.289 3.538) 11.979 3.333 ( 6.003 4.998 -0.550) 7.831 3.605 ( -2.274 10.551 -7.954) 13.407 3.803 ( 9.473 1.275 0.749) 9.587 3.976 ( -16.243 5.906 9.775) 19.856 4.210 ( 6.848 0.330 8.337) 10.794 4.339 ( -2.214 -4.798 8.538) 10.041 4.406 ( 4.573 0.636 -0.109) 4.619 4.568 ( -8.167 -1.534 -1.409) 8.429 4.760 ( 6.350 -1.384 2.273) 6.885 4.917 ( -5.013 -6.324 9.262) 12.284 4.984 ( -1.983 -6.424 -1.231) 6.834 5.089 ( 1.735 -5.588 -4.605) 7.446 5.309 ( 5.320 0.837 -2.453) 5.917 5.395 ( -1.857 4.166 4.015) 6.076 5.539 ( 4.708 3.132 4.083) 6.974 5.839 ( -5.093 1.313 -4.365) 6.835 5.886 ( 4.733 0.243 -1.971) 5.133 5.994 ( -7.984 -1.368 2.627) 8.516 6.142 ( -4.917 -0.893 9.919) 11.107 6.235 ( 1.047 -1.550 0.710) 2.001 6.362 ( -2.020 6.198 2.107) 6.851 6.466 ( 4.828 4.026 -11.869) 13.431 6.614 ( -5.132 -5.103 5.348) 8.999 6.642 ( 12.944 -1.404 -6.229) 14.433 6.825 ( 6.386 -5.147 -1.436) 8.327 6.964 ( -3.970 5.601 -0.903) 6.925 7.238 ( 0.719 1.305 0.262) 1.512 7.324 ( -3.710 2.246 -1.674) 4.649 7.467 ( -0.710 -0.227 2.301) 2.418 7.522 ( 3.191 -0.424 -5.252) 6.160 7.817 ( 0.100 0.570 2.937) 2.993 7.874 ( -2.872 -0.592 1.490) 3.289 8.029 ( -2.371 4.112 3.821) 6.093 8.149 ( -2.306 -0.279 0.303) 2.342 8.306 ( -1.128 3.822 4.575) 6.067 8.378 ( -3.580 3.912 -6.524) 8.407 8.632 ( 3.753 -8.907 -8.025) 12.562 8.774 ( -8.064 -5.374 -2.883) 10.111 13.290 ( 6.994 2.181 0.531) 7.345 13.392 ( -1.600 1.357 1.012) 2.329 14.631 ( 3.043 -0.728 3.591) 4.763 14.817 ( -3.872 -0.302 -2.885) 4.838 17.371 ( 0.982 1.091 -0.247) 1.489 17.386 ( 0.267 1.876 -0.524) 1.966 17.618 ( 6.195 -2.708 -0.650) 6.792 17.775 ( -8.353 -2.237 0.999) 8.705 21.255 ( 1.490 0.525 -0.754) 1.750 21.298 ( -2.719 -1.460 0.026) 3.086 21.783 ( -0.460 0.196 0.394) 0.637 21.808 ( -0.295 -0.052 -1.385) 1.417 24.108 ( 0.575 0.116 -0.100) 0.595 24.119 ( 0.483 -0.436 -0.563) 0.860 28.230 ( 1.027 -0.565 -0.504) 1.275 28.245 ( -1.250 -0.642 0.813) 1.624 33.539 ( 17.189 3.233 -2.221) 17.630 33.793 ( -15.841 4.674 9.589) 19.098 36.643 ( -3.154 1.006 5.480) 6.403 36.674 ( 4.618 0.056 -3.987) 6.101 39.769 ( 9.230 -2.015 8.630) 12.796 40.225 ( -7.720 0.431 -6.860) 10.336 40.739 ( 1.122 -0.941 19.857) 19.911 41.423 ( 4.571 2.328 -28.535) 28.992 ======================= Grid point 288 (153/165) ======================= q-point: (-0.38 -0.62 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( 10.969 0.763 4.707) 11.960 2.540 ( -10.143 4.526 -6.701) 12.972 3.064 ( -12.820 -3.696 8.186) 15.653 3.170 ( 5.707 -3.188 -3.177) 7.268 3.305 ( -6.892 5.482 5.917) 10.610 3.417 ( -3.032 0.590 -4.353) 5.338 3.735 ( -2.574 11.395 4.916) 12.674 3.848 ( 15.703 8.690 -6.545) 19.104 4.357 ( -4.060 -2.763 5.657) 7.491 4.391 ( 10.556 -0.747 4.781) 11.612 4.436 ( -4.261 -2.312 -2.514) 5.461 4.520 ( -0.078 -5.232 -5.427) 7.538 4.850 ( 1.572 -3.110 4.338) 5.565 4.920 ( -6.043 0.032 -1.278) 6.177 5.102 ( -3.274 -8.297 9.844) 13.284 5.239 ( 1.072 -1.375 -2.445) 3.003 5.307 ( -0.929 0.317 1.365) 1.681 5.357 ( 4.603 -2.651 -1.356) 5.482 5.622 ( 7.890 -1.254 4.551) 9.195 5.757 ( -3.434 0.691 -6.681) 7.543 5.860 ( -5.816 0.787 5.024) 7.726 5.947 ( -0.008 0.799 -1.676) 1.857 6.124 ( -1.949 4.001 7.857) 9.030 6.275 ( 1.442 -0.130 4.283) 4.521 6.324 ( 2.597 0.958 -3.381) 4.369 6.412 ( 0.002 0.581 -5.846) 5.874 6.575 ( -2.909 3.290 1.445) 4.624 6.682 ( 3.348 8.341 -8.828) 12.598 6.921 ( 2.523 -3.548 -0.179) 4.357 6.941 ( 0.775 -4.748 -1.537) 5.051 7.224 ( -1.226 1.379 2.615) 3.201 7.262 ( -0.186 -1.469 -1.106) 1.848 7.485 ( -4.701 -2.757 2.362) 5.940 7.555 ( 4.825 -0.882 -4.845) 6.895 7.807 ( 0.575 2.347 2.620) 3.565 7.830 ( -2.441 2.711 -0.292) 3.660 7.977 ( 0.413 1.500 2.814) 3.215 8.047 ( -2.058 4.171 -4.056) 6.171 8.270 ( -2.342 1.615 4.388) 5.230 8.321 ( 3.586 5.295 -0.327) 6.403 8.757 ( -0.129 -8.157 2.455) 8.519 8.854 ( -2.068 -12.228 -7.976) 14.745 13.315 ( -1.527 3.478 0.761) 3.874 13.333 ( 3.078 2.778 -1.105) 4.291 14.706 ( 4.327 -1.228 3.014) 5.414 14.760 ( -4.201 -0.222 -2.571) 4.930 17.350 ( -0.764 1.767 0.278) 1.945 17.358 ( 0.273 1.637 -0.583) 1.759 17.723 ( -5.482 -2.945 1.902) 6.507 17.754 ( 5.562 -3.717 -1.468) 6.849 21.255 ( -2.464 -0.660 2.848) 3.823 21.310 ( 2.083 -1.253 -2.855) 3.750 21.777 ( -0.510 0.252 1.239) 1.363 21.802 ( -0.055 -0.181 -1.392) 1.405 24.111 ( -0.725 -0.298 0.479) 0.919 24.127 ( 1.010 -0.120 -1.217) 1.586 28.247 ( -1.069 -1.082 0.529) 1.610 28.253 ( 1.029 -0.709 -0.185) 1.264 33.546 ( -13.702 7.037 6.754) 16.820 33.642 ( 14.520 7.715 -3.065) 16.725 36.601 ( -4.897 0.766 5.251) 7.221 36.705 ( 5.491 1.219 -5.516) 7.878 39.952 ( 4.860 -2.205 8.931) 10.404 40.122 ( -1.337 -1.989 -9.031) 9.343 40.821 ( -2.667 1.075 21.196) 21.390 41.286 ( 1.710 3.761 -27.053) 27.367 ======================= Grid point 289 (154/165) ======================= q-point: (-0.25 -0.62 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.290 ( -10.202 6.431 0.059) 12.060 2.507 ( 8.486 5.631 0.632) 10.204 3.052 ( -8.206 4.355 11.572) 14.840 3.108 ( -3.581 4.454 1.168) 5.833 3.159 ( -7.707 -0.868 0.574) 7.776 3.406 ( -9.003 -6.641 5.249) 12.357 3.669 ( 12.275 6.376 -5.584) 14.917 3.907 ( 16.338 4.085 -8.981) 19.086 4.359 ( -1.073 1.591 -2.792) 3.388 4.392 ( -8.357 0.285 5.909) 10.239 4.407 ( 0.967 3.836 -2.774) 4.832 4.642 ( 4.208 -4.353 2.636) 6.603 4.909 ( -2.024 -7.353 -1.718) 7.817 4.960 ( 2.277 -5.580 2.549) 6.543 5.158 ( -8.937 -2.745 4.583) 10.412 5.182 ( -1.863 2.802 6.913) 7.688 5.307 ( 2.104 -1.774 -2.841) 3.955 5.507 ( 0.015 -3.137 -0.543) 3.183 5.641 ( 5.077 5.280 -3.116) 7.960 5.704 ( -3.964 0.210 6.231) 7.388 5.834 ( -3.132 -1.778 -0.462) 3.631 5.960 ( 3.801 0.099 -4.575) 5.949 6.072 ( -0.041 4.679 4.951) 6.812 6.226 ( 2.932 7.777 -7.321) 11.076 6.339 ( 2.633 -0.883 3.938) 4.819 6.382 ( -1.483 2.314 -2.390) 3.642 6.538 ( -1.135 -1.159 -3.674) 4.016 6.601 ( 2.460 -1.551 -0.718) 2.995 6.886 ( -6.327 -1.329 -0.671) 6.500 7.115 ( 2.353 -9.328 -1.543) 9.743 7.154 ( -3.727 2.817 4.010) 6.157 7.355 ( 1.481 -1.640 -0.639) 2.300 7.457 ( -2.898 -2.961 0.512) 4.175 7.606 ( 3.663 -0.828 -1.832) 4.179 7.721 ( -2.036 6.031 1.561) 6.554 7.823 ( 4.718 1.857 1.594) 5.315 8.007 ( 2.829 1.061 -2.146) 3.705 8.019 ( 3.679 -1.859 1.209) 4.296 8.211 ( -1.469 3.363 0.814) 3.760 8.298 ( 6.371 4.088 -0.350) 7.578 8.889 ( -6.343 -10.514 1.301) 12.348 8.975 ( -0.877 -8.091 -2.317) 8.462 13.188 ( -6.961 4.169 -0.119) 8.114 13.347 ( 4.995 2.550 -1.279) 5.753 14.699 ( -3.799 0.184 -1.032) 3.941 14.801 ( 5.215 -1.570 1.656) 5.692 17.306 ( -2.084 1.663 0.537) 2.720 17.336 ( -0.180 0.975 -0.394) 1.067 17.697 ( -5.888 -2.412 1.610) 6.563 17.896 ( 8.092 -3.296 -1.549) 8.874 21.247 ( -3.479 -1.476 2.266) 4.406 21.355 ( 3.745 -1.217 -1.782) 4.322 21.774 ( -0.504 0.133 1.761) 1.836 21.800 ( 0.312 -0.203 -1.492) 1.538 24.100 ( -1.521 0.038 0.040) 1.522 24.137 ( 0.900 -0.095 -0.763) 1.183 28.254 ( -0.779 -1.053 0.157) 1.319 28.273 ( 0.832 -0.303 0.231) 0.915 33.307 ( -11.582 6.785 4.450) 14.142 33.640 ( 12.594 11.112 -2.055) 16.921 36.562 ( -3.970 0.054 4.519) 6.016 36.714 ( 4.182 1.849 -5.391) 7.069 39.914 ( -10.965 -0.003 2.347) 11.213 40.276 ( 15.200 -4.957 -6.917) 17.420 40.814 ( -7.251 4.098 18.985) 20.732 41.147 ( 3.067 2.433 -20.978) 21.340 ======================= Grid point 290 (155/165) ======================= q-point: (-0.12 -0.62 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( -5.387 5.269 5.344) 9.238 2.545 ( 11.571 4.711 0.945) 12.529 2.861 ( -4.302 9.964 8.683) 13.899 3.002 ( -8.114 -0.935 -0.837) 8.210 3.174 ( 1.410 -0.871 1.860) 2.492 3.452 ( -2.725 -3.415 4.671) 6.396 3.680 ( 4.593 3.204 -8.364) 10.066 3.935 ( -0.339 0.968 -7.560) 7.629 4.142 ( -2.744 12.755 -2.285) 13.246 4.364 ( 5.854 1.263 0.887) 6.054 4.496 ( 1.816 -5.291 3.777) 6.750 4.700 ( -1.035 -0.680 3.586) 3.794 4.996 ( -5.990 -0.079 -0.631) 6.023 5.057 ( 3.631 -6.925 1.353) 7.935 5.109 ( -3.464 3.608 1.224) 5.149 5.148 ( -6.914 -4.075 10.745) 13.412 5.345 ( 7.444 4.476 -7.032) 11.176 5.471 ( 5.673 3.353 -6.120) 8.994 5.640 ( 2.697 5.673 1.845) 6.547 5.674 ( -6.630 -2.496 5.289) 8.841 5.844 ( -7.625 -7.663 -2.579) 11.113 5.951 ( 4.577 1.664 -3.160) 5.805 6.031 ( 4.615 1.588 0.665) 4.925 6.186 ( -1.701 -0.659 -3.178) 3.664 6.313 ( -0.808 2.729 3.247) 4.318 6.351 ( -0.450 3.111 1.896) 3.671 6.558 ( -6.681 -4.724 2.048) 8.435 6.719 ( 5.803 -9.924 -10.237) 15.393 6.860 ( 0.720 1.256 0.828) 1.667 7.055 ( -9.292 -0.911 4.420) 10.330 7.256 ( -3.948 5.359 -0.849) 6.710 7.292 ( 1.083 -6.472 1.759) 6.794 7.535 ( 2.119 -0.714 0.844) 2.390 7.629 ( -1.957 -0.550 2.391) 3.138 7.695 ( 4.516 -0.677 0.214) 4.571 7.854 ( 7.029 2.599 0.209) 7.497 7.980 ( 1.921 4.804 -1.302) 5.335 8.095 ( 2.974 -0.680 0.088) 3.052 8.187 ( 1.903 1.031 1.122) 2.438 8.376 ( 11.168 -2.876 -4.408) 12.346 8.929 ( -10.063 -8.481 -4.323) 13.852 9.053 ( -4.367 -4.434 4.684) 7.789 13.048 ( -6.260 2.751 -0.346) 6.846 13.356 ( 3.393 1.940 -0.883) 4.007 14.653 ( -2.921 0.465 0.266) 2.969 14.887 ( 4.563 -0.870 1.021) 4.756 17.263 ( -1.882 0.869 0.541) 2.142 17.322 ( -0.377 0.081 -0.250) 0.460 17.672 ( -4.033 -0.839 1.321) 4.326 18.014 ( 6.120 -1.589 -1.747) 6.559 21.241 ( -2.982 -1.674 0.976) 3.556 21.411 ( 3.075 -1.039 -0.629) 3.306 21.775 ( -0.514 -0.011 1.518) 1.603 21.804 ( 0.806 -0.292 -1.451) 1.685 24.079 ( -1.364 0.331 -0.080) 1.406 24.141 ( 0.394 0.214 -0.528) 0.692 28.260 ( -0.417 -0.417 -0.113) 0.600 28.281 ( 0.368 0.411 0.557) 0.784 33.118 ( -6.099 5.611 2.790) 8.745 33.608 ( 9.694 8.211 1.486) 12.791 36.550 ( -2.127 -0.500 4.536) 5.035 36.699 ( 2.455 2.057 -4.814) 5.783 39.789 ( -10.711 0.492 2.231) 10.952 40.453 ( 9.103 -1.961 -11.034) 14.438 40.712 ( -6.255 5.211 12.989) 15.330 41.132 ( 8.303 -1.240 -12.491) 15.050 ======================= Grid point 295 (156/165) ======================= q-point: (-0.50 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( 15.639 -0.000 7.922) 17.531 2.577 ( -16.269 0.000 -11.709) 20.044 2.976 ( -20.398 0.000 7.723) 21.811 3.072 ( 11.247 -0.000 -2.221) 11.464 3.451 ( 3.009 -0.000 6.382) 7.056 3.578 ( -10.253 0.000 -7.432) 12.664 3.868 ( -9.677 0.000 4.438) 10.646 3.971 ( 17.953 -0.000 -4.826) 18.590 4.347 ( 10.444 -0.000 6.884) 12.508 4.379 ( 2.738 -0.000 7.045) 7.558 4.455 ( -7.072 0.000 -3.402) 7.848 4.470 ( 3.771 -0.000 0.288) 3.782 4.791 ( -9.613 0.000 7.960) 12.481 4.842 ( -0.436 0.000 7.006) 7.019 4.940 ( 6.673 -0.000 -5.552) 8.681 4.998 ( 1.284 -0.000 -6.626) 6.749 5.367 ( -9.973 0.000 1.924) 10.157 5.443 ( 14.839 -0.000 -5.838) 15.946 5.650 ( 5.298 -0.000 5.012) 7.293 5.756 ( -7.286 0.000 -5.037) 8.858 5.866 ( -10.571 0.000 5.659) 11.990 5.945 ( 6.768 -0.000 -2.329) 7.158 6.092 ( -8.334 0.000 13.304) 15.699 6.254 ( 3.119 -0.000 -0.658) 3.188 6.397 ( -9.416 0.000 2.687) 9.792 6.475 ( 3.732 -0.000 -2.297) 4.382 6.634 ( 9.739 -0.000 -7.072) 12.035 6.657 ( 2.145 -0.000 -3.693) 4.271 6.899 ( 9.734 -0.000 -1.451) 9.841 6.931 ( -6.974 0.000 -3.652) 7.872 7.267 ( 1.661 -0.000 1.612) 2.315 7.294 ( -3.817 0.000 -1.025) 3.952 7.459 ( -2.852 0.000 2.575) 3.842 7.543 ( 3.215 -0.000 -5.740) 6.579 7.834 ( 3.296 -0.000 2.245) 3.988 7.843 ( -4.292 0.000 2.650) 5.044 8.093 ( -1.902 0.000 4.922) 5.276 8.134 ( 2.471 -0.000 -0.018) 2.471 8.260 ( -6.495 0.000 5.399) 8.446 8.462 ( 2.407 -0.000 -13.875) 14.082 8.539 ( 6.536 -0.000 4.394) 7.875 8.617 ( -7.998 0.000 -3.487) 8.725 13.378 ( 4.900 -0.000 -0.114) 4.901 13.381 ( -2.866 0.000 -0.376) 2.891 14.683 ( 3.914 -0.000 3.895) 5.522 14.757 ( -3.510 0.000 -3.785) 5.161 17.389 ( 0.431 -0.000 0.236) 0.491 17.394 ( -1.025 0.000 -0.196) 1.043 17.663 ( -7.970 0.000 0.907) 8.021 17.678 ( 7.917 -0.000 -0.727) 7.950 21.246 ( -3.853 0.000 2.025) 4.353 21.288 ( 3.414 -0.000 -2.270) 4.100 21.782 ( -0.383 0.000 0.829) 0.913 21.798 ( -0.401 0.000 -0.921) 1.004 24.105 ( -0.776 0.000 0.635) 1.003 24.124 ( 1.058 -0.000 -1.328) 1.698 28.226 ( -1.439 0.000 0.723) 1.610 28.239 ( 1.470 -0.000 -0.583) 1.581 33.666 ( -17.482 0.000 7.334) 18.958 33.773 ( 19.411 -0.000 -3.623) 19.746 36.618 ( -5.846 0.000 6.093) 8.444 36.729 ( 6.840 -0.000 -5.449) 8.745 39.912 ( 11.234 -0.000 8.520) 14.099 40.089 ( -8.629 0.000 -10.315) 13.448 40.836 ( -0.876 0.000 24.044) 24.060 41.345 ( 0.547 -0.000 -28.936) 28.942 ======================= Grid point 296 (157/165) ======================= q-point: (-0.38 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -18.997 -1.930 -9.297) 21.237 2.622 ( 14.135 -2.493 8.757) 16.813 2.793 ( -21.359 -4.454 9.540) 23.813 3.134 ( -4.154 0.586 5.237) 6.711 3.379 ( -8.896 3.665 -3.804) 10.346 3.450 ( 2.565 7.270 7.170) 10.528 3.848 ( 3.316 0.014 -3.040) 4.498 4.118 ( 12.752 5.150 -5.275) 14.729 4.360 ( 0.272 5.021 5.490) 7.444 4.377 ( 1.926 1.787 -8.011) 8.431 4.475 ( 0.794 -2.473 -3.351) 4.240 4.529 ( 10.131 -0.002 1.177) 10.199 4.753 ( -10.465 -6.322 5.123) 13.257 4.848 ( -2.892 -0.229 4.827) 5.631 4.993 ( 3.561 -4.967 1.091) 6.208 5.147 ( 2.211 -8.221 -6.919) 10.971 5.265 ( -2.053 -0.936 2.639) 3.473 5.490 ( 5.062 6.922 -5.674) 10.282 5.659 ( -4.769 -1.049 -6.747) 8.328 5.723 ( 3.879 1.124 5.537) 6.853 5.782 ( -11.698 -1.085 8.737) 14.641 5.997 ( 3.496 1.224 5.061) 6.272 6.130 ( -0.388 -4.545 5.977) 7.519 6.294 ( 3.039 -1.131 -0.932) 3.374 6.311 ( -2.372 0.763 1.492) 2.905 6.473 ( 2.490 5.552 -6.914) 9.210 6.560 ( -4.077 1.645 0.008) 4.396 6.806 ( 7.855 -3.490 -12.218) 14.938 6.817 ( -7.030 -1.633 -0.986) 7.284 6.953 ( 4.264 3.786 -0.323) 5.712 7.241 ( -2.056 0.995 -0.099) 2.286 7.287 ( 2.417 1.437 2.112) 3.516 7.416 ( -5.591 0.474 3.831) 6.795 7.556 ( 3.016 -1.060 -5.214) 6.116 7.825 ( 1.067 0.015 1.748) 2.047 7.876 ( 1.834 1.915 0.774) 2.763 8.054 ( 0.217 3.824 3.409) 5.128 8.134 ( 5.540 4.934 1.577) 7.584 8.243 ( -4.740 -1.159 5.177) 7.115 8.440 ( 4.354 0.278 -7.649) 8.806 8.554 ( -7.171 -6.063 0.848) 9.429 8.721 ( 6.653 -6.681 1.441) 9.538 13.310 ( -5.138 2.688 -1.462) 5.980 13.411 ( 2.933 1.206 -0.906) 3.298 14.703 ( -2.650 0.088 -3.849) 4.674 14.755 ( 4.198 -1.023 3.543) 5.587 17.367 ( -1.680 1.310 0.207) 2.140 17.377 ( -0.525 1.657 0.382) 1.779 17.606 ( -5.596 -2.605 0.662) 6.208 17.790 ( 7.785 -2.494 -0.547) 8.193 21.217 ( -3.391 -0.486 2.394) 4.179 21.325 ( 3.749 -0.563 -1.948) 4.262 21.781 ( -0.358 0.220 1.380) 1.443 21.793 ( -0.180 -0.224 -0.593) 0.659 24.098 ( -1.056 -0.084 0.419) 1.139 24.129 ( 0.552 -0.223 -1.133) 1.280 28.220 ( -1.167 -0.776 0.616) 1.531 28.258 ( 1.397 -0.433 -0.513) 1.550 33.467 ( -16.262 2.877 5.178) 17.307 33.938 ( 18.775 5.958 -5.232) 20.381 36.570 ( -5.599 0.321 5.281) 7.703 36.771 ( 5.940 1.331 -6.124) 8.634 39.931 ( -8.003 1.076 -6.998) 10.685 40.119 ( 11.996 -4.031 2.689) 12.938 40.905 ( -4.476 1.543 24.652) 25.103 41.196 ( -2.905 0.723 -26.888) 27.054 ======================= Grid point 297 (158/165) ======================= q-point: (-0.25 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 290 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( -16.318 -4.219 -2.138) 16.990 2.677 ( -4.185 1.642 4.518) 6.373 2.873 ( -1.987 -9.793 13.666) 16.930 3.036 ( -8.029 -0.693 2.068) 8.320 3.218 ( -11.283 4.835 5.068) 13.281 3.407 ( 10.182 8.402 -1.634) 13.302 3.850 ( 5.167 4.456 -8.787) 11.125 4.034 ( -4.293 5.747 -5.770) 9.206 4.356 ( 6.435 1.996 0.635) 6.768 4.372 ( 0.325 0.432 0.968) 1.109 4.479 ( -4.918 -3.364 -3.418) 6.869 4.600 ( 3.531 2.067 1.517) 4.364 4.781 ( -2.277 -5.797 -2.728) 6.799 4.921 ( 3.312 -4.687 8.872) 10.566 5.135 ( -2.943 -4.527 -0.411) 5.415 5.153 ( 7.718 -2.039 2.436) 8.346 5.299 ( -4.544 6.097 -0.856) 7.652 5.446 ( 0.651 -5.091 -4.496) 6.823 5.664 ( 1.702 -4.723 -7.007) 8.620 5.670 ( -10.969 -1.639 6.207) 12.710 5.739 ( -3.171 1.708 6.904) 7.787 6.039 ( 4.576 3.271 0.739) 5.673 6.169 ( 2.295 3.905 3.358) 5.639 6.289 ( -10.443 1.015 -1.803) 10.646 6.335 ( 3.934 0.732 -0.787) 4.078 6.391 ( 7.559 -0.879 -5.542) 9.414 6.538 ( 0.819 -0.898 -0.989) 1.567 6.728 ( 5.662 13.248 -5.672) 15.484 6.811 ( -7.730 -5.896 0.954) 9.768 6.987 ( 3.515 -0.825 -1.730) 4.004 7.223 ( 1.033 0.342 -0.819) 1.362 7.328 ( -1.260 -5.175 1.533) 5.543 7.367 ( -2.368 1.201 3.527) 4.414 7.602 ( 3.383 -1.319 -2.846) 4.613 7.803 ( -1.723 4.077 -0.648) 4.473 7.888 ( 4.022 -0.923 1.650) 4.445 8.044 ( 2.292 0.159 0.875) 2.459 8.154 ( 9.121 5.966 3.899) 11.575 8.219 ( -2.424 0.689 1.009) 2.715 8.434 ( 5.398 3.259 -5.258) 8.211 8.624 ( -7.126 -10.042 3.696) 12.856 8.886 ( 3.125 -5.326 2.712) 6.745 13.172 ( -6.797 4.468 -1.636) 8.297 13.410 ( 1.337 1.316 -1.139) 2.195 14.662 ( -1.316 0.171 -3.098) 3.371 14.841 ( 3.948 -1.796 2.727) 5.123 17.315 ( -2.294 2.151 0.455) 3.178 17.345 ( -0.852 1.327 0.204) 1.590 17.608 ( -2.689 -2.974 0.432) 4.032 17.923 ( 6.563 -3.576 -0.559) 7.495 21.202 ( -2.656 -0.807 2.404) 3.672 21.375 ( 3.732 -1.050 -1.415) 4.127 21.778 ( -0.575 0.222 1.561) 1.678 21.795 ( 0.328 -0.259 -0.416) 0.590 24.085 ( -1.254 0.115 0.002) 1.260 24.135 ( 0.166 -0.450 -0.685) 0.837 28.228 ( -0.688 -1.259 0.505) 1.520 28.277 ( 0.892 -0.491 -0.329) 1.071 33.262 ( -12.769 3.322 3.636) 13.686 33.963 ( 13.639 12.141 -5.868) 19.180 36.535 ( -3.698 -0.314 4.766) 6.041 36.771 ( 3.822 2.339 -6.379) 7.796 39.799 ( -7.594 0.287 -4.965) 9.078 40.341 ( 12.740 -4.720 -3.345) 13.992 40.860 ( -9.687 4.413 13.011) 16.811 41.084 ( -1.431 -2.062 -11.034) 11.316 ======================= Grid point 298 (159/165) ======================= q-point: (-0.12 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( -7.912 -4.257 4.200) 9.917 2.662 ( -0.321 -1.520 3.514) 3.842 2.938 ( -0.588 0.794 9.413) 9.464 2.999 ( -6.798 9.175 2.027) 11.598 3.121 ( -4.095 -11.215 0.631) 11.956 3.412 ( 8.103 3.845 -0.552) 8.986 3.757 ( 0.236 4.905 -9.968) 11.111 3.851 ( -9.925 2.015 -8.546) 13.251 4.320 ( -9.433 -0.014 4.859) 10.611 4.354 ( 2.496 7.942 3.415) 8.998 4.551 ( 11.908 -1.485 -0.983) 12.040 4.615 ( 2.560 -2.067 -1.603) 3.660 4.893 ( -2.837 -11.516 0.097) 11.861 5.026 ( 0.035 6.314 -0.509) 6.335 5.078 ( -5.832 -4.106 9.660) 12.008 5.185 ( -0.655 1.414 4.914) 5.155 5.350 ( 2.689 -5.435 2.601) 6.599 5.495 ( -9.985 -9.259 -4.211) 14.254 5.559 ( -3.314 1.689 -0.178) 3.724 5.710 ( 5.869 2.526 2.578) 6.890 5.770 ( 4.405 1.070 -3.109) 5.497 6.004 ( 0.970 3.319 -4.863) 5.967 6.117 ( -8.335 1.952 -3.240) 9.153 6.144 ( 1.814 3.417 3.680) 5.340 6.367 ( 5.300 4.383 -2.501) 7.318 6.459 ( 2.054 1.875 -0.127) 2.784 6.538 ( 0.031 7.939 1.234) 8.034 6.595 ( 3.067 -6.265 -6.152) 9.301 6.888 ( -1.164 -6.836 1.354) 7.066 6.965 ( 0.483 4.571 -0.645) 4.641 7.246 ( 1.321 -1.633 -1.455) 2.555 7.304 ( -2.923 2.748 3.117) 5.081 7.461 ( 1.456 -7.146 0.235) 7.297 7.626 ( 0.536 0.244 1.234) 1.367 7.748 ( 0.317 2.040 0.093) 2.066 7.943 ( 3.900 -0.216 -1.652) 4.241 8.093 ( -0.141 -1.936 2.667) 3.298 8.159 ( 3.761 4.696 -0.358) 6.027 8.200 ( 3.307 2.366 3.687) 5.489 8.420 ( 2.541 1.013 -9.023) 9.429 8.721 ( -1.728 -7.173 4.474) 8.628 8.975 ( -0.494 -2.597 2.871) 3.903 13.026 ( -5.127 3.379 -1.107) 6.240 13.396 ( -0.019 0.895 -0.472) 1.012 14.638 ( -0.258 0.464 -1.743) 1.822 14.918 ( 2.534 -1.532 1.794) 3.462 17.265 ( -1.237 1.412 0.085) 1.879 17.320 ( -0.580 0.696 0.087) 0.910 17.627 ( -0.898 -1.658 0.267) 1.905 18.033 ( 3.622 -2.639 -0.555) 4.516 21.199 ( -1.660 -0.858 1.876) 2.648 21.427 ( 2.741 -0.927 -0.912) 3.034 21.774 ( -0.755 0.086 1.519) 1.698 21.804 ( 0.757 -0.249 -0.743) 1.089 24.069 ( -0.785 0.148 -0.178) 0.819 24.139 ( -0.135 -0.313 -0.414) 0.536 28.243 ( -0.323 -1.074 0.376) 1.183 28.289 ( 0.304 -0.164 -0.030) 0.347 33.114 ( -7.126 1.877 2.466) 7.770 33.853 ( 5.662 12.127 -3.435) 13.817 36.538 ( -1.162 -1.005 4.440) 4.698 36.738 ( 1.794 2.404 -5.894) 6.614 39.706 ( -4.807 0.404 -1.793) 5.146 40.470 ( 4.110 0.211 -8.684) 9.610 40.748 ( -5.146 0.889 7.925) 9.491 41.109 ( 1.866 -4.212 -3.783) 5.961 ======================= Grid point 304 (160/165) ======================= q-point: (-0.38 -0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( -20.662 0.000 -3.506) 20.957 2.459 ( -24.842 0.000 14.799) 28.916 2.852 ( 11.755 -0.000 2.906) 12.109 3.130 ( -5.049 0.000 6.869) 8.525 3.258 ( -11.699 0.000 0.268) 11.702 3.574 ( 1.937 -0.000 8.995) 9.201 3.898 ( 9.932 -0.000 -7.937) 12.714 4.227 ( 1.209 -0.000 -1.332) 1.799 4.353 ( -10.652 0.000 -3.853) 11.327 4.371 ( -10.329 0.000 -12.257) 16.029 4.437 ( 4.891 -0.000 -6.766) 8.349 4.614 ( 5.016 -0.000 2.740) 5.716 4.637 ( 2.758 -0.000 10.334) 10.695 4.972 ( 6.478 -0.000 -11.541) 13.235 4.997 ( 12.627 -0.000 3.318) 13.055 5.068 ( 3.056 -0.000 3.108) 4.358 5.276 ( 1.939 -0.000 -0.153) 1.945 5.528 ( -4.531 0.000 -7.523) 8.782 5.569 ( -4.173 0.000 -3.818) 5.656 5.640 ( -15.142 0.000 12.793) 19.823 5.788 ( -1.217 0.000 10.051) 10.125 6.092 ( -0.024 0.000 6.065) 6.065 6.109 ( 7.545 -0.000 -1.571) 7.707 6.310 ( 3.679 -0.000 -5.879) 6.935 6.361 ( 7.375 -0.000 5.400) 9.141 6.501 ( -2.774 0.000 0.032) 2.775 6.505 ( -9.459 0.000 -3.382) 10.045 6.707 ( 2.145 -0.000 -9.751) 9.984 6.775 ( 0.218 -0.000 -7.057) 7.060 7.059 ( 5.398 -0.000 -0.589) 5.430 7.211 ( -3.649 0.000 0.845) 3.746 7.342 ( 2.041 -0.000 2.739) 3.416 7.390 ( -3.073 0.000 4.731) 5.642 7.570 ( 4.705 -0.000 -4.423) 6.458 7.872 ( 5.317 -0.000 0.139) 5.319 7.897 ( -3.135 0.000 -0.774) 3.230 8.106 ( -0.041 0.000 2.688) 2.689 8.190 ( -6.762 0.000 11.211) 13.093 8.206 ( -1.423 0.000 -7.634) 7.765 8.412 ( 7.530 -0.000 7.439) 10.585 8.524 ( 1.858 -0.000 -6.336) 6.603 8.794 ( 9.895 -0.000 4.757) 10.979 13.259 ( -6.011 0.000 -2.811) 6.636 13.431 ( 0.018 -0.000 -1.161) 1.162 14.665 ( -0.676 0.000 -4.627) 4.676 14.804 ( 2.936 -0.000 3.624) 4.664 17.351 ( -2.702 0.000 0.405) 2.732 17.392 ( -0.521 0.000 0.787) 0.944 17.535 ( -2.207 0.000 -0.189) 2.215 17.853 ( 6.448 -0.000 0.062) 6.448 21.190 ( -2.477 0.000 2.908) 3.820 21.357 ( 3.695 -0.000 -1.715) 4.074 21.785 ( -0.350 0.000 -0.031) 0.351 21.788 ( -0.000 0.000 1.660) 1.660 24.088 ( -0.982 0.000 0.223) 1.007 24.125 ( -0.041 0.000 -0.907) 0.908 28.204 ( -0.831 0.000 0.708) 1.091 28.267 ( 1.110 -0.000 -0.738) 1.333 33.315 ( -15.906 0.000 3.713) 16.333 34.188 ( 19.328 -0.000 -9.283) 21.441 36.531 ( -5.022 0.000 5.055) 7.126 36.816 ( 4.438 -0.000 -7.560) 8.767 39.808 ( -6.138 0.000 -11.305) 12.864 40.242 ( 10.551 -0.000 4.900) 11.634 40.967 ( -6.786 0.000 26.253) 27.116 41.015 ( -7.859 0.000 -25.252) 26.446 ======================= Grid point 305 (161/165) ======================= q-point: (-0.25 -0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.858 ( -16.010 -4.705 6.294) 17.835 2.366 ( -20.253 -14.570 15.671) 29.463 2.924 ( 2.877 2.127 -7.437) 8.253 3.046 ( -1.625 4.547 7.189) 8.660 3.165 ( -10.031 0.547 6.239) 11.826 3.601 ( 2.740 3.071 5.415) 6.802 3.909 ( 3.949 6.464 -14.568) 16.419 4.037 ( -9.389 9.170 -11.060) 17.163 4.182 ( -14.434 -6.034 3.800) 16.100 4.356 ( -0.398 -6.512 -2.187) 6.881 4.528 ( 6.684 -2.459 -4.029) 8.182 4.693 ( 0.644 -4.134 1.469) 4.434 4.726 ( 9.482 4.496 4.002) 11.231 4.944 ( 5.856 0.909 -2.369) 6.382 5.066 ( -14.108 -3.122 2.959) 14.749 5.181 ( 4.294 3.294 2.830) 6.107 5.311 ( -1.114 -2.105 -1.276) 2.702 5.425 ( 5.056 3.435 1.321) 6.253 5.551 ( -2.809 -0.827 2.242) 3.688 5.603 ( 3.032 -5.507 -2.832) 6.895 5.792 ( -1.046 1.481 9.127) 9.305 6.071 ( -4.113 0.448 -3.394) 5.351 6.203 ( 2.828 -1.398 -3.486) 4.702 6.278 ( -0.838 4.688 -1.992) 5.162 6.390 ( 1.348 1.676 -6.404) 6.756 6.432 ( 1.209 0.881 0.635) 1.625 6.520 ( 3.803 -2.150 -0.011) 4.368 6.676 ( -1.548 -0.720 3.815) 4.179 6.878 ( 6.545 -7.180 -6.632) 11.763 7.040 ( 2.600 6.811 -2.620) 7.746 7.176 ( -3.115 0.334 0.947) 3.273 7.334 ( 0.313 2.796 2.578) 3.816 7.410 ( 2.509 0.111 5.414) 5.968 7.627 ( 6.084 -0.879 -3.448) 7.049 7.780 ( -7.792 2.249 -3.225) 8.728 7.940 ( 4.367 0.010 0.484) 4.394 8.082 ( -0.397 2.204 1.353) 2.617 8.192 ( -2.076 -1.263 0.996) 2.626 8.208 ( -4.663 -5.734 2.525) 7.810 8.486 ( 2.957 -0.163 -2.893) 4.140 8.589 ( 8.574 1.791 9.279) 12.760 8.928 ( 8.386 -0.234 2.760) 8.832 13.146 ( -6.319 3.027 -2.853) 7.565 13.412 ( -1.896 0.131 -0.906) 2.106 14.647 ( 1.118 0.156 -4.466) 4.607 14.858 ( 1.558 -1.607 3.074) 3.802 17.311 ( -2.657 1.004 0.238) 2.850 17.369 ( -0.409 2.022 0.635) 2.159 17.552 ( 0.985 -2.385 -0.609) 2.651 17.938 ( 4.234 -2.394 0.428) 4.883 21.184 ( -1.229 -0.208 3.298) 3.526 21.397 ( 3.360 -0.670 -1.452) 3.721 21.780 ( -0.494 0.180 0.699) 0.875 21.798 ( 0.274 -0.116 1.168) 1.206 24.075 ( -0.834 0.208 -0.171) 0.876 24.123 ( -0.368 -0.482 -0.466) 0.765 28.207 ( -0.400 -0.839 0.761) 1.201 28.276 ( 0.466 -0.394 -0.780) 0.990 33.148 ( -13.224 0.465 2.546) 13.475 34.261 ( 12.848 9.826 -12.993) 20.747 36.508 ( -3.058 -0.727 4.791) 5.730 36.804 ( 1.686 1.379 -8.415) 8.693 39.708 ( -2.989 -0.044 -8.297) 8.819 40.397 ( 8.827 -3.386 -0.457) 9.465 40.790 ( -11.155 1.771 -11.997) 16.477 41.006 ( -7.319 -2.195 18.208) 19.746 ======================= Grid point 306 (162/165) ======================= q-point: (-0.12 -0.38 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -8.590 -9.844 11.888) 17.665 2.541 ( -5.408 -16.092 11.634) 20.580 2.825 ( -9.461 -0.645 -5.676) 11.052 3.035 ( -6.463 3.092 4.148) 8.278 3.051 ( 1.392 0.719 4.202) 4.484 3.606 ( 3.772 1.949 -1.804) 4.613 3.709 ( -7.394 4.460 -13.062) 15.658 3.796 ( -1.071 7.934 -8.140) 11.418 4.178 ( -7.273 -3.832 3.614) 8.980 4.429 ( -4.516 -5.704 1.492) 7.426 4.587 ( 1.786 0.412 0.138) 1.838 4.772 ( 0.605 0.251 9.137) 9.160 4.786 ( 2.623 -4.080 -1.349) 5.035 4.908 ( -0.660 2.610 -5.163) 5.822 5.045 ( -11.454 -9.003 7.386) 16.334 5.156 ( -9.406 5.329 1.769) 10.955 5.195 ( 6.135 0.175 3.876) 7.259 5.502 ( 4.152 3.558 7.353) 9.163 5.607 ( 7.142 -0.925 -4.051) 8.263 5.752 ( 5.622 -4.927 -4.149) 8.550 5.845 ( 4.714 1.954 -2.413) 5.644 5.962 ( -3.868 -0.615 -0.646) 3.970 6.111 ( 0.786 5.389 -4.568) 7.108 6.246 ( 1.460 2.636 -2.746) 4.077 6.401 ( -2.970 -0.656 0.481) 3.079 6.442 ( 2.710 -3.007 -8.761) 9.651 6.565 ( 2.632 1.389 -1.020) 3.146 6.695 ( 0.515 3.516 9.904) 10.523 6.913 ( 5.028 8.718 -2.862) 10.463 7.035 ( 3.542 -2.639 -0.883) 4.504 7.141 ( -3.082 -3.381 -4.370) 6.327 7.340 ( 3.678 0.520 2.457) 4.453 7.467 ( 3.537 0.830 4.479) 5.768 7.640 ( -2.236 1.044 1.283) 2.781 7.728 ( -0.044 -3.382 -3.948) 5.199 7.963 ( 1.443 1.100 -1.483) 2.344 8.048 ( -3.410 0.344 0.548) 3.471 8.159 ( -3.444 1.023 -0.267) 3.602 8.236 ( -5.357 -3.668 -1.533) 6.671 8.515 ( 3.196 3.206 3.123) 5.500 8.700 ( 7.653 -0.525 7.261) 10.562 9.021 ( 8.370 1.071 0.582) 8.458 13.021 ( -3.590 3.095 -1.689) 5.032 13.381 ( -2.995 -0.257 -0.015) 3.006 14.646 ( 2.209 0.444 -3.490) 4.154 14.910 ( -0.328 -2.188 2.176) 3.103 17.271 ( -0.933 1.030 -0.436) 1.457 17.339 ( 0.104 1.732 0.356) 1.772 17.605 ( 2.372 -1.824 -0.709) 3.076 18.015 ( 0.812 -2.842 0.667) 3.030 21.193 ( 0.075 -0.057 3.052) 3.054 21.438 ( 2.278 -0.749 -1.161) 2.664 21.774 ( -0.763 0.217 1.209) 1.446 21.807 ( 0.548 -0.106 0.117) 0.570 24.064 ( -0.202 0.087 -0.382) 0.441 24.126 ( -0.441 -0.670 -0.175) 0.821 28.225 ( -0.144 -1.221 0.768) 1.449 28.283 ( -0.035 -0.591 -0.615) 0.854 33.034 ( -8.123 -1.282 1.724) 8.402 34.073 ( -0.302 14.932 -11.335) 18.750 36.528 ( -0.337 -1.664 4.052) 4.393 36.752 ( -0.092 1.492 -7.701) 7.845 39.677 ( 2.054 -0.166 -4.128) 4.614 40.481 ( 0.399 1.902 -7.101) 7.362 40.666 ( -4.925 -5.590 -0.175) 7.453 41.037 ( -5.451 -3.682 10.615) 12.488 ======================= Grid point 313 (163/165) ======================= q-point: (-0.25 -0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( -5.164 0.000 19.367) 20.044 2.062 ( -19.284 0.000 19.441) 27.383 2.915 ( -1.384 0.000 -12.111) 12.190 3.036 ( -7.971 0.000 3.026) 8.526 3.101 ( -5.945 0.000 4.584) 7.507 3.659 ( 0.630 -0.000 2.670) 2.743 3.858 ( -9.827 0.000 -22.420) 24.479 3.915 ( -15.250 0.000 2.370) 15.433 4.112 ( 1.061 -0.000 1.657) 1.967 4.270 ( 5.031 -0.000 -5.977) 7.812 4.560 ( 1.698 -0.000 1.249) 2.108 4.591 ( -10.297 0.000 -5.489) 11.669 4.821 ( -18.832 0.000 14.937) 24.037 4.846 ( 3.326 -0.000 4.525) 5.616 5.151 ( 12.753 -0.000 -7.587) 14.840 5.278 ( 5.735 -0.000 -2.119) 6.114 5.288 ( 3.586 -0.000 -1.651) 3.948 5.479 ( -0.956 0.000 -0.995) 1.380 5.559 ( 1.476 -0.000 12.759) 12.844 5.621 ( 11.714 -0.000 -7.230) 13.766 5.837 ( -0.410 0.000 9.626) 9.635 6.047 ( 1.881 -0.000 -1.579) 2.456 6.156 ( -1.005 0.000 -9.401) 9.454 6.312 ( 1.412 -0.000 -5.904) 6.070 6.366 ( -2.691 0.000 -3.157) 4.148 6.425 ( -0.429 0.000 -0.796) 0.904 6.594 ( 5.368 -0.000 -0.836) 5.433 6.669 ( -0.952 0.000 -0.331) 1.008 6.880 ( 8.886 -0.000 5.476) 10.438 7.128 ( 3.919 -0.000 -5.496) 6.750 7.175 ( 0.184 -0.000 3.008) 3.013 7.369 ( -0.445 0.000 -2.112) 2.158 7.470 ( 4.516 -0.000 7.693) 8.920 7.643 ( -3.321 0.000 -4.385) 5.500 7.738 ( 0.375 -0.000 1.462) 1.509 7.940 ( -1.161 0.000 -3.570) 3.754 8.083 ( -4.634 0.000 5.393) 7.110 8.112 ( -3.899 0.000 -0.718) 3.965 8.190 ( 0.985 -0.000 6.545) 6.619 8.448 ( -0.273 0.000 -8.532) 8.536 8.804 ( 11.519 -0.000 12.451) 16.962 9.046 ( 9.102 -0.000 1.018) 9.159 13.089 ( -5.092 0.000 -2.992) 5.906 13.373 ( -3.936 0.000 -0.285) 3.947 14.652 ( 3.040 -0.000 -5.011) 5.861 14.862 ( -0.782 0.000 3.167) 3.262 17.292 ( -1.915 0.000 0.093) 1.917 17.381 ( -0.878 0.000 0.506) 1.013 17.563 ( 4.697 -0.000 -1.596) 4.961 17.956 ( 1.455 -0.000 1.177) 1.871 21.195 ( 0.530 -0.000 3.976) 4.011 21.422 ( 2.833 -0.000 -1.384) 3.153 21.778 ( -0.401 0.000 0.341) 0.526 21.806 ( 0.126 -0.000 1.609) 1.614 24.068 ( -0.403 0.000 -0.552) 0.683 24.111 ( -0.751 0.000 -0.054) 0.753 28.201 ( -0.130 0.000 0.874) 0.883 28.270 ( -0.183 0.000 -0.975) 0.992 33.011 ( -11.228 0.000 1.594) 11.341 34.387 ( 4.867 -0.000 -21.596) 22.138 36.488 ( -2.280 0.000 4.971) 5.469 36.776 ( -1.225 0.000 -9.424) 9.503 39.670 ( 2.916 -0.000 -6.784) 7.385 40.439 ( 3.339 -0.000 0.408) 3.364 40.613 ( -9.548 0.000 -13.088) 16.201 40.980 ( -10.632 0.000 24.049) 26.295 ======================= Grid point 314 (164/165) ======================= q-point: (-0.12 -0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 288 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.783 ( -3.793 1.011 22.863) 23.197 2.223 ( -3.171 -22.528 22.145) 31.749 2.768 ( -6.447 6.152 -9.481) 13.012 2.963 ( -10.339 -2.525 5.131) 11.815 3.056 ( 1.499 0.258 -8.386) 8.523 3.592 ( -9.656 2.742 -21.204) 23.460 3.624 ( -2.203 3.789 0.896) 4.474 3.845 ( -5.291 -3.268 4.190) 7.499 4.099 ( -7.092 -2.145 8.406) 11.205 4.294 ( -1.283 1.602 -4.026) 4.519 4.492 ( -10.750 -6.927 -2.920) 13.117 4.553 ( -8.952 0.128 3.519) 9.620 4.716 ( -9.333 -5.961 3.810) 11.711 4.918 ( -0.306 -5.882 -2.438) 6.374 5.146 ( 6.373 8.518 0.734) 10.663 5.236 ( 5.081 7.415 -3.457) 9.630 5.342 ( 12.980 4.034 0.434) 13.599 5.587 ( -1.069 -0.041 8.374) 8.442 5.645 ( 6.303 -3.894 1.696) 7.601 5.728 ( 7.828 0.003 -3.094) 8.418 5.881 ( 2.284 -1.924 0.127) 2.989 6.045 ( 5.960 5.958 1.462) 8.554 6.148 ( 0.222 -3.143 -6.880) 7.567 6.212 ( -2.447 5.600 -2.134) 6.473 6.359 ( -0.157 -3.028 -7.222) 7.833 6.436 ( 0.783 -0.356 -1.804) 1.998 6.616 ( 4.235 1.197 -0.097) 4.402 6.737 ( 1.170 -4.544 2.895) 5.513 6.974 ( 1.562 1.310 4.495) 4.935 7.112 ( 5.878 5.414 -6.087) 10.046 7.174 ( 1.893 3.671 3.801) 5.613 7.357 ( 0.704 -2.507 -3.240) 4.157 7.550 ( 1.178 1.543 2.066) 2.835 7.590 ( -1.640 -2.367 3.533) 4.557 7.720 ( 1.416 3.093 0.254) 3.411 7.926 ( -7.013 -2.766 -1.168) 7.629 8.041 ( -3.602 1.215 1.561) 4.110 8.090 ( -4.341 -3.410 0.258) 5.526 8.179 ( 0.323 5.261 -0.334) 5.282 8.467 ( -0.885 -5.831 -3.929) 7.087 8.931 ( 9.258 5.601 11.925) 16.103 9.151 ( 9.958 0.300 -1.144) 10.028 13.020 ( -1.499 1.532 -1.733) 2.757 13.326 ( -4.914 -0.670 0.570) 4.992 14.672 ( 4.129 0.336 -4.619) 6.205 14.868 ( -2.897 -1.688 2.821) 4.382 17.273 ( -0.282 0.444 -0.436) 0.683 17.362 ( -0.659 1.092 0.099) 1.280 17.629 ( 6.121 -0.680 -1.969) 6.465 17.976 ( -2.010 -1.770 1.706) 3.176 21.225 ( 2.115 0.438 3.783) 4.356 21.448 ( 1.708 -0.332 -1.181) 2.103 21.774 ( -0.425 0.207 0.519) 0.702 21.812 ( -0.011 -0.007 0.762) 0.762 24.063 ( 0.228 0.018 -0.733) 0.768 24.107 ( -0.859 -0.729 0.181) 1.141 28.211 ( -0.031 -0.812 0.912) 1.222 28.266 ( -0.494 -0.629 -0.927) 1.224 32.923 ( -6.334 -1.887 1.100) 6.700 34.154 ( -11.564 10.969 -21.326) 26.624 36.510 ( -0.571 -2.190 4.333) 4.889 36.716 ( -1.582 0.092 -8.051) 8.206 39.727 ( 10.439 -0.063 -4.150) 11.234 40.463 ( -6.296 2.302 -3.642) 7.629 40.508 ( -0.660 -7.192 -1.595) 7.397 40.962 ( -10.300 -1.920 17.176) 20.120 ======================= Grid point 322 (165/165) ======================= q-point: (-0.12 -0.12 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( -7.655 0.000 22.215) 23.497 2.131 ( 14.057 -0.000 32.390) 35.308 2.748 ( -15.998 0.000 -1.955) 16.117 2.772 ( -3.342 0.000 -0.399) 3.366 3.072 ( 11.679 -0.000 -19.664) 22.871 3.374 ( -18.581 0.000 -13.835) 23.166 3.639 ( -4.534 0.000 0.968) 4.636 3.718 ( -6.636 0.000 8.458) 10.751 4.022 ( -7.279 0.000 10.900) 13.107 4.261 ( -8.033 0.000 -5.349) 9.651 4.408 ( -11.245 0.000 3.019) 11.643 4.448 ( -6.123 0.000 -0.458) 6.140 4.540 ( 2.803 -0.000 -11.871) 12.198 4.811 ( -2.426 0.000 -11.386) 11.642 5.300 ( 5.460 -0.000 6.601) 8.566 5.330 ( 6.284 -0.000 -1.399) 6.438 5.525 ( 5.318 -0.000 -0.139) 5.320 5.662 ( 8.547 -0.000 4.799) 9.803 5.687 ( 2.735 -0.000 6.318) 6.885 5.847 ( -5.496 0.000 11.147) 12.429 5.870 ( 14.677 -0.000 -10.017) 17.770 6.100 ( 4.038 -0.000 -4.729) 6.218 6.199 ( 3.727 -0.000 5.391) 6.554 6.245 ( -3.413 0.000 -6.018) 6.918 6.263 ( -1.453 0.000 -5.648) 5.832 6.400 ( 0.592 -0.000 -6.407) 6.435 6.705 ( 4.266 -0.000 4.611) 6.282 6.744 ( 10.493 -0.000 -0.726) 10.518 7.044 ( 1.181 -0.000 4.757) 4.901 7.168 ( 3.058 -0.000 -7.955) 8.523 7.255 ( -0.088 0.000 7.688) 7.688 7.309 ( -0.634 0.000 -3.495) 3.552 7.510 ( -2.334 0.000 -1.980) 3.061 7.632 ( 1.589 -0.000 6.088) 6.292 7.738 ( -12.154 0.000 -4.494) 12.958 7.775 ( -5.374 0.000 5.251) 7.513 8.032 ( -0.095 0.000 0.748) 0.754 8.037 ( -0.684 0.000 1.648) 1.784 8.284 ( 1.917 -0.000 0.854) 2.099 8.347 ( -1.356 0.000 -9.081) 9.182 9.122 ( 5.969 -0.000 11.267) 12.750 9.248 ( 8.699 -0.000 -1.858) 8.896 13.025 ( 1.893 -0.000 -1.062) 2.171 13.260 ( -5.824 0.000 1.097) 5.927 14.709 ( 5.205 -0.000 -4.888) 7.140 14.823 ( -4.707 0.000 3.458) 5.841 17.277 ( 0.742 -0.000 -0.460) 0.873 17.356 ( -1.516 0.000 -0.198) 1.529 17.700 ( 8.066 -0.000 -2.973) 8.597 17.931 ( -4.899 0.000 2.595) 5.544 21.282 ( 3.762 -0.000 3.396) 5.068 21.456 ( 0.612 -0.000 -1.009) 1.181 21.775 ( 0.286 -0.000 -0.226) 0.365 21.811 ( -0.885 0.000 0.881) 1.249 24.064 ( 0.718 -0.000 -1.085) 1.301 24.089 ( -1.301 0.000 0.577) 1.424 28.208 ( -0.021 0.000 0.883) 0.883 28.249 ( -0.672 0.000 -0.910) 1.131 32.864 ( -1.057 0.000 1.263) 1.647 33.916 ( -25.634 0.000 -22.635) 34.197 36.501 ( -0.791 0.000 5.208) 5.268 36.671 ( -0.259 0.000 -6.710) 6.715 39.882 ( 18.154 -0.000 -4.984) 18.826 40.393 ( -7.658 0.000 1.539) 7.811 40.445 ( 1.192 -0.000 0.596) 1.333 40.885 ( -11.727 0.000 13.859) 18.155 =================== 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 3/38016 10.0 1103.204 1215.752 1341.020 0.000 -72.354 0.000 3/38016 20.0 180.360 175.624 136.920 0.000 -0.457 0.000 3/38016 30.0 60.495 50.837 40.757 0.000 -1.246 0.000 3/38016 40.0 29.296 22.943 19.457 0.000 -1.057 0.000 3/38016 50.0 17.649 13.323 11.826 0.000 -0.856 0.000 3/38016 60.0 12.210 9.025 8.278 0.000 -0.710 0.000 3/38016 70.0 9.247 6.744 6.330 0.000 -0.607 0.000 3/38016 80.0 7.440 5.376 5.130 0.000 -0.531 0.000 3/38016 90.0 6.242 4.478 4.325 0.000 -0.473 0.000 3/38016 100.0 5.393 3.847 3.749 0.000 -0.426 0.000 3/38016 110.0 4.760 3.380 3.316 0.000 -0.389 0.000 3/38016 120.0 4.270 3.020 2.978 0.000 -0.357 0.000 3/38016 130.0 3.879 2.733 2.707 0.000 -0.331 0.000 3/38016 140.0 3.558 2.499 2.483 0.000 -0.308 0.000 3/38016 150.0 3.290 2.304 2.295 0.000 -0.288 0.000 3/38016 160.0 3.062 2.139 2.135 0.000 -0.271 0.000 3/38016 170.0 2.866 1.997 1.998 0.000 -0.256 0.000 3/38016 180.0 2.695 1.874 1.877 0.000 -0.242 0.000 3/38016 190.0 2.545 1.766 1.771 0.000 -0.230 0.000 3/38016 200.0 2.412 1.670 1.677 0.000 -0.219 0.000 3/38016 210.0 2.293 1.585 1.593 0.000 -0.210 0.000 3/38016 220.0 2.186 1.509 1.517 0.000 -0.201 0.000 3/38016 230.0 2.089 1.439 1.449 0.000 -0.193 0.000 3/38016 240.0 2.001 1.377 1.387 0.000 -0.185 0.000 3/38016 250.0 1.921 1.320 1.331 0.000 -0.179 0.000 3/38016 260.0 1.847 1.267 1.279 0.000 -0.172 0.000 3/38016 270.0 1.780 1.219 1.231 0.000 -0.167 0.000 3/38016 280.0 1.717 1.175 1.188 0.000 -0.161 0.000 3/38016 290.0 1.660 1.134 1.147 0.000 -0.156 0.000 3/38016 300.0 1.606 1.096 1.110 0.000 -0.152 0.000 3/38016 310.0 1.556 1.061 1.075 0.000 -0.147 0.000 3/38016 320.0 1.509 1.028 1.042 0.000 -0.143 0.000 3/38016 330.0 1.466 0.997 1.012 0.000 -0.140 0.000 3/38016 340.0 1.425 0.968 0.984 0.000 -0.136 0.000 3/38016 350.0 1.386 0.941 0.957 0.000 -0.133 0.000 3/38016 360.0 1.350 0.916 0.932 0.000 -0.130 0.000 3/38016 370.0 1.316 0.891 0.909 0.000 -0.127 0.000 3/38016 380.0 1.284 0.869 0.887 0.000 -0.124 0.000 3/38016 390.0 1.253 0.847 0.866 0.000 -0.121 0.000 3/38016 400.0 1.224 0.827 0.846 0.000 -0.119 0.000 3/38016 410.0 1.197 0.807 0.827 0.000 -0.117 0.000 3/38016 420.0 1.170 0.789 0.809 0.000 -0.114 0.000 3/38016 430.0 1.145 0.771 0.792 0.000 -0.112 0.000 3/38016 440.0 1.122 0.755 0.776 0.000 -0.110 0.000 3/38016 450.0 1.099 0.739 0.761 0.000 -0.108 0.000 3/38016 460.0 1.077 0.723 0.746 0.000 -0.106 0.000 3/38016 470.0 1.056 0.709 0.732 0.000 -0.105 0.000 3/38016 480.0 1.036 0.695 0.719 0.000 -0.103 0.000 3/38016 490.0 1.017 0.681 0.706 0.000 -0.101 0.000 3/38016 500.0 0.999 0.669 0.693 0.000 -0.100 0.000 3/38016 510.0 0.981 0.656 0.682 0.000 -0.098 0.000 3/38016 520.0 0.964 0.644 0.670 0.000 -0.097 0.000 3/38016 530.0 0.948 0.633 0.659 0.000 -0.095 0.000 3/38016 540.0 0.932 0.622 0.649 0.000 -0.094 0.000 3/38016 550.0 0.917 0.611 0.639 0.000 -0.093 0.000 3/38016 560.0 0.902 0.601 0.629 0.000 -0.092 0.000 3/38016 570.0 0.888 0.591 0.619 0.000 -0.090 0.000 3/38016 580.0 0.874 0.581 0.610 0.000 -0.089 0.000 3/38016 590.0 0.861 0.572 0.601 0.000 -0.088 0.000 3/38016 600.0 0.848 0.563 0.593 0.000 -0.087 0.000 3/38016 610.0 0.836 0.555 0.584 0.000 -0.086 0.000 3/38016 620.0 0.824 0.546 0.576 0.000 -0.085 0.000 3/38016 630.0 0.812 0.538 0.569 0.000 -0.084 0.000 3/38016 640.0 0.801 0.530 0.561 0.000 -0.083 0.000 3/38016 650.0 0.790 0.523 0.554 0.000 -0.082 0.000 3/38016 660.0 0.779 0.515 0.547 0.000 -0.081 0.000 3/38016 670.0 0.769 0.508 0.540 0.000 -0.080 0.000 3/38016 680.0 0.759 0.501 0.533 0.000 -0.079 0.000 3/38016 690.0 0.749 0.494 0.526 0.000 -0.078 0.000 3/38016 700.0 0.739 0.488 0.520 0.000 -0.078 0.000 3/38016 710.0 0.730 0.481 0.514 0.000 -0.077 0.000 3/38016 720.0 0.721 0.475 0.508 0.000 -0.076 0.000 3/38016 730.0 0.712 0.469 0.502 0.000 -0.075 0.000 3/38016 740.0 0.704 0.463 0.496 0.000 -0.074 0.000 3/38016 750.0 0.695 0.457 0.490 0.000 -0.074 0.000 3/38016 760.0 0.687 0.451 0.485 0.000 -0.073 0.000 3/38016 770.0 0.679 0.446 0.480 0.000 -0.072 0.000 3/38016 780.0 0.671 0.441 0.474 0.000 -0.071 0.000 3/38016 790.0 0.664 0.435 0.469 0.000 -0.071 0.000 3/38016 800.0 0.656 0.430 0.464 0.000 -0.070 0.000 3/38016 810.0 0.649 0.425 0.459 0.000 -0.069 0.000 3/38016 820.0 0.642 0.420 0.455 0.000 -0.069 0.000 3/38016 830.0 0.635 0.416 0.450 0.000 -0.068 0.000 3/38016 840.0 0.628 0.411 0.445 0.000 -0.068 0.000 3/38016 850.0 0.622 0.406 0.441 0.000 -0.067 0.000 3/38016 860.0 0.615 0.402 0.437 0.000 -0.066 0.000 3/38016 870.0 0.609 0.398 0.432 0.000 -0.066 0.000 3/38016 880.0 0.602 0.393 0.428 0.000 -0.065 0.000 3/38016 890.0 0.596 0.389 0.424 0.000 -0.065 0.000 3/38016 900.0 0.590 0.385 0.420 0.000 -0.064 0.000 3/38016 910.0 0.585 0.381 0.416 0.000 -0.064 0.000 3/38016 920.0 0.579 0.377 0.412 0.000 -0.063 0.000 3/38016 930.0 0.573 0.373 0.408 0.000 -0.062 0.000 3/38016 940.0 0.568 0.370 0.405 0.000 -0.062 0.000 3/38016 950.0 0.562 0.366 0.401 0.000 -0.061 0.000 3/38016 960.0 0.557 0.362 0.397 0.000 -0.061 0.000 3/38016 970.0 0.552 0.359 0.394 0.000 -0.060 0.000 3/38016 980.0 0.547 0.355 0.390 0.000 -0.060 0.000 3/38016 990.0 0.542 0.352 0.387 0.000 -0.060 0.000 3/38016 1000.0 0.537 0.349 0.384 0.000 -0.059 0.000 3/38016 Thermal conductivity related properties were written into "kappa-m889.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 06:31:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|