----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 19:51:04]------------------------- 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: [2 1 3] 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: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.597053490112193 -5.635422180000000 0.000000000000000 b 3.597053490112193 5.635422180000000 0.000000000000000 c -3.369957281352032 0.000000000000000 3.904563336486158 Atomic positions (fractional): *1 O 0.63920133891048 0.05557022923091 0.84079775347356 15.999 2 O 0.94442977076909 0.36079866108952 0.65920224652644 15.999 3 O 0.36079866108952 0.94442977076909 0.15920224652644 15.999 4 O 0.05557022923091 0.63920133891048 0.34079775347356 15.999 *5 O 0.79000380460578 0.72760772908070 0.80031580037517 15.999 6 O 0.27239227091930 0.20999619539422 0.69968419962483 15.999 7 O 0.20999619539422 0.27239227091930 0.19968419962483 15.999 8 O 0.72760772908070 0.79000380460578 0.30031580037517 15.999 *9 Nb 0.89723488509000 0.10276511491000 0.75000000000000 92.906 10 Nb 0.10276511491000 0.89723488509000 0.25000000000000 92.906 *11 Nd 0.37029314066457 0.62970685933543 0.75000000000000 144.242 12 Nd 0.62970685933543 0.37029314066457 0.25000000000000 144.242 -------------------------------- unit cell --------------------------------- Lattice vectors: a 7.194106980224387 0.000000000000000 0.000000000000000 b 0.000000000000000 11.270844360000000 0.000000000000000 c -3.369957281352032 0.000000000000000 3.904563336486158 Atomic positions (fractional): *1 O 0.34738578407069 0.70818444516021 0.84079775347356 15.999 > 1 2 O 0.65261421592931 0.70818444516021 0.65920224652644 15.999 > 2 3 O 0.15261421592931 0.79181555483979 0.15920224652644 15.999 > 3 4 O 0.84738578407069 0.79181555483979 0.34079775347356 15.999 > 4 *5 O 0.75880576684324 0.96880196223746 0.80031580037517 15.999 > 5 6 O 0.24119423315676 0.96880196223746 0.69968419962483 15.999 > 6 7 O 0.74119423315676 0.53119803776254 0.19968419962483 15.999 > 7 8 O 0.25880576684324 0.53119803776254 0.30031580037517 15.999 > 8 9 O 0.84738578407069 0.20818444516022 0.84079775347356 15.999 > 1 10 O 0.15261421592931 0.20818444516022 0.65920224652644 15.999 > 2 11 O 0.65261421592931 0.29181555483978 0.15920224652644 15.999 > 3 12 O 0.34738578407069 0.29181555483978 0.34079775347356 15.999 > 4 13 O 0.25880576684324 0.46880196223746 0.80031580037517 15.999 > 5 14 O 0.74119423315676 0.46880196223746 0.69968419962483 15.999 > 6 15 O 0.24119423315676 0.03119803776254 0.19968419962483 15.999 > 7 16 O 0.75880576684324 0.03119803776254 0.30031580037517 15.999 > 8 *17 Nb 0.50000000000000 0.60276511491000 0.75000000000000 92.906 > 9 18 Nb 0.00000000000000 0.89723488509000 0.25000000000000 92.906 > 10 19 Nb 0.00000000000000 0.10276511491000 0.75000000000000 92.906 > 9 20 Nb 0.50000000000000 0.39723488509000 0.25000000000000 92.906 > 10 *21 Nd 0.00000000000000 0.62970685933543 0.75000000000000 144.242 > 11 22 Nd 0.50000000000000 0.87029314066457 0.25000000000000 144.242 > 12 23 Nd 0.50000000000000 0.12970685933543 0.75000000000000 144.242 > 11 24 Nd 0.00000000000000 0.37029314066457 0.25000000000000 144.242 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.388213960448773 0.000000000000000 0.000000000000000 b 0.000000000000000 11.270844360000000 0.000000000000000 c -10.109871844056096 0.000000000000000 11.713690009458475 Atomic positions (fractional): *1 O 0.17369289203535 0.70818444516021 0.28026591782452 15.999 > 1 2 O 0.67369289203535 0.70818444516021 0.28026591782452 15.999 > 1 3 O 0.17369289203535 0.70818444516021 0.61359925115785 15.999 > 1 4 O 0.67369289203535 0.70818444516021 0.61359925115785 15.999 > 1 5 O 0.17369289203535 0.70818444516021 0.94693258449119 15.999 > 1 6 O 0.67369289203535 0.70818444516021 0.94693258449119 15.999 > 1 7 O 0.32630710796465 0.70818444516021 0.21973408217548 15.999 > 2 8 O 0.82630710796465 0.70818444516021 0.21973408217548 15.999 > 2 9 O 0.32630710796465 0.70818444516021 0.55306741550881 15.999 > 2 10 O 0.82630710796465 0.70818444516021 0.55306741550881 15.999 > 2 11 O 0.32630710796465 0.70818444516021 0.88640074884215 15.999 > 2 12 O 0.82630710796465 0.70818444516021 0.88640074884215 15.999 > 2 13 O 0.07630710796465 0.79181555483979 0.05306741550881 15.999 > 3 14 O 0.57630710796465 0.79181555483979 0.05306741550881 15.999 > 3 15 O 0.07630710796465 0.79181555483979 0.38640074884215 15.999 > 3 16 O 0.57630710796465 0.79181555483979 0.38640074884215 15.999 > 3 17 O 0.07630710796465 0.79181555483979 0.71973408217548 15.999 > 3 18 O 0.57630710796465 0.79181555483979 0.71973408217548 15.999 > 3 19 O 0.42369289203535 0.79181555483979 0.11359925115785 15.999 > 4 20 O 0.92369289203535 0.79181555483979 0.11359925115785 15.999 > 4 21 O 0.42369289203535 0.79181555483979 0.44693258449119 15.999 > 4 22 O 0.92369289203535 0.79181555483979 0.44693258449119 15.999 > 4 23 O 0.42369289203535 0.79181555483979 0.78026591782452 15.999 > 4 24 O 0.92369289203535 0.79181555483979 0.78026591782452 15.999 > 4 *25 O 0.37940288342162 0.96880196223746 0.26677193345839 15.999 > 5 26 O 0.87940288342162 0.96880196223746 0.26677193345839 15.999 > 5 27 O 0.37940288342162 0.96880196223746 0.60010526679172 15.999 > 5 28 O 0.87940288342162 0.96880196223746 0.60010526679172 15.999 > 5 29 O 0.37940288342162 0.96880196223746 0.93343860012506 15.999 > 5 30 O 0.87940288342162 0.96880196223746 0.93343860012506 15.999 > 5 31 O 0.12059711657838 0.96880196223746 0.23322806654161 15.999 > 6 32 O 0.62059711657838 0.96880196223746 0.23322806654161 15.999 > 6 33 O 0.12059711657838 0.96880196223746 0.56656139987494 15.999 > 6 34 O 0.62059711657838 0.96880196223746 0.56656139987494 15.999 > 6 35 O 0.12059711657838 0.96880196223746 0.89989473320828 15.999 > 6 36 O 0.62059711657838 0.96880196223746 0.89989473320828 15.999 > 6 37 O 0.37059711657838 0.53119803776254 0.06656139987494 15.999 > 7 38 O 0.87059711657838 0.53119803776254 0.06656139987494 15.999 > 7 39 O 0.37059711657838 0.53119803776254 0.39989473320828 15.999 > 7 40 O 0.87059711657838 0.53119803776254 0.39989473320828 15.999 > 7 41 O 0.37059711657838 0.53119803776254 0.73322806654161 15.999 > 7 42 O 0.87059711657838 0.53119803776254 0.73322806654161 15.999 > 7 43 O 0.12940288342162 0.53119803776254 0.10010526679172 15.999 > 8 44 O 0.62940288342162 0.53119803776254 0.10010526679172 15.999 > 8 45 O 0.12940288342162 0.53119803776254 0.43343860012506 15.999 > 8 46 O 0.62940288342162 0.53119803776254 0.43343860012506 15.999 > 8 47 O 0.12940288342162 0.53119803776254 0.76677193345839 15.999 > 8 48 O 0.62940288342162 0.53119803776254 0.76677193345839 15.999 > 8 49 O 0.42369289203535 0.20818444516022 0.28026591782452 15.999 > 1 50 O 0.92369289203535 0.20818444516022 0.28026591782452 15.999 > 1 51 O 0.42369289203535 0.20818444516022 0.61359925115785 15.999 > 1 52 O 0.92369289203535 0.20818444516022 0.61359925115785 15.999 > 1 53 O 0.42369289203535 0.20818444516022 0.94693258449119 15.999 > 1 54 O 0.92369289203535 0.20818444516022 0.94693258449119 15.999 > 1 55 O 0.07630710796465 0.20818444516022 0.21973408217548 15.999 > 2 56 O 0.57630710796465 0.20818444516022 0.21973408217548 15.999 > 2 57 O 0.07630710796465 0.20818444516022 0.55306741550881 15.999 > 2 58 O 0.57630710796465 0.20818444516022 0.55306741550881 15.999 > 2 59 O 0.07630710796465 0.20818444516022 0.88640074884215 15.999 > 2 60 O 0.57630710796465 0.20818444516022 0.88640074884215 15.999 > 2 61 O 0.32630710796465 0.29181555483978 0.05306741550881 15.999 > 3 62 O 0.82630710796465 0.29181555483978 0.05306741550881 15.999 > 3 63 O 0.32630710796465 0.29181555483978 0.38640074884215 15.999 > 3 64 O 0.82630710796465 0.29181555483978 0.38640074884215 15.999 > 3 65 O 0.32630710796465 0.29181555483978 0.71973408217548 15.999 > 3 66 O 0.82630710796465 0.29181555483978 0.71973408217548 15.999 > 3 67 O 0.17369289203535 0.29181555483978 0.11359925115785 15.999 > 4 68 O 0.67369289203535 0.29181555483978 0.11359925115785 15.999 > 4 69 O 0.17369289203535 0.29181555483978 0.44693258449119 15.999 > 4 70 O 0.67369289203535 0.29181555483978 0.44693258449119 15.999 > 4 71 O 0.17369289203535 0.29181555483978 0.78026591782452 15.999 > 4 72 O 0.67369289203535 0.29181555483978 0.78026591782452 15.999 > 4 73 O 0.12940288342162 0.46880196223746 0.26677193345839 15.999 > 5 74 O 0.62940288342162 0.46880196223746 0.26677193345839 15.999 > 5 75 O 0.12940288342162 0.46880196223746 0.60010526679172 15.999 > 5 76 O 0.62940288342162 0.46880196223746 0.60010526679172 15.999 > 5 77 O 0.12940288342162 0.46880196223746 0.93343860012506 15.999 > 5 78 O 0.62940288342162 0.46880196223746 0.93343860012506 15.999 > 5 79 O 0.37059711657838 0.46880196223746 0.23322806654161 15.999 > 6 80 O 0.87059711657838 0.46880196223746 0.23322806654161 15.999 > 6 81 O 0.37059711657838 0.46880196223746 0.56656139987494 15.999 > 6 82 O 0.87059711657838 0.46880196223746 0.56656139987494 15.999 > 6 83 O 0.37059711657838 0.46880196223746 0.89989473320828 15.999 > 6 84 O 0.87059711657838 0.46880196223746 0.89989473320828 15.999 > 6 85 O 0.12059711657838 0.03119803776254 0.06656139987494 15.999 > 7 86 O 0.62059711657838 0.03119803776254 0.06656139987494 15.999 > 7 87 O 0.12059711657838 0.03119803776254 0.39989473320828 15.999 > 7 88 O 0.62059711657838 0.03119803776254 0.39989473320828 15.999 > 7 89 O 0.12059711657838 0.03119803776254 0.73322806654161 15.999 > 7 90 O 0.62059711657838 0.03119803776254 0.73322806654161 15.999 > 7 91 O 0.37940288342162 0.03119803776254 0.10010526679172 15.999 > 8 92 O 0.87940288342162 0.03119803776254 0.10010526679172 15.999 > 8 93 O 0.37940288342162 0.03119803776254 0.43343860012506 15.999 > 8 94 O 0.87940288342162 0.03119803776254 0.43343860012506 15.999 > 8 95 O 0.37940288342162 0.03119803776254 0.76677193345839 15.999 > 8 96 O 0.87940288342162 0.03119803776254 0.76677193345839 15.999 > 8 *97 Nb 0.25000000000000 0.60276511491000 0.25000000000000 92.906 > 9 98 Nb 0.75000000000000 0.60276511491000 0.25000000000000 92.906 > 9 99 Nb 0.25000000000000 0.60276511491000 0.58333333333333 92.906 > 9 100 Nb 0.75000000000000 0.60276511491000 0.58333333333333 92.906 > 9 101 Nb 0.25000000000000 0.60276511491000 0.91666666666667 92.906 > 9 102 Nb 0.75000000000000 0.60276511491000 0.91666666666667 92.906 > 9 103 Nb 0.00000000000000 0.89723488509000 0.08333333333333 92.906 > 10 104 Nb 0.50000000000000 0.89723488509000 0.08333333333333 92.906 > 10 105 Nb 0.00000000000000 0.89723488509000 0.41666666666667 92.906 > 10 106 Nb 0.50000000000000 0.89723488509000 0.41666666666667 92.906 > 10 107 Nb 0.00000000000000 0.89723488509000 0.75000000000000 92.906 > 10 108 Nb 0.50000000000000 0.89723488509000 0.75000000000000 92.906 > 10 109 Nb 0.00000000000000 0.10276511491000 0.25000000000000 92.906 > 9 110 Nb 0.50000000000000 0.10276511491000 0.25000000000000 92.906 > 9 111 Nb 0.00000000000000 0.10276511491000 0.58333333333333 92.906 > 9 112 Nb 0.50000000000000 0.10276511491000 0.58333333333333 92.906 > 9 113 Nb 0.00000000000000 0.10276511491000 0.91666666666667 92.906 > 9 114 Nb 0.50000000000000 0.10276511491000 0.91666666666667 92.906 > 9 115 Nb 0.25000000000000 0.39723488509000 0.08333333333333 92.906 > 10 116 Nb 0.75000000000000 0.39723488509000 0.08333333333333 92.906 > 10 117 Nb 0.25000000000000 0.39723488509000 0.41666666666667 92.906 > 10 118 Nb 0.75000000000000 0.39723488509000 0.41666666666667 92.906 > 10 119 Nb 0.25000000000000 0.39723488509000 0.75000000000000 92.906 > 10 120 Nb 0.75000000000000 0.39723488509000 0.75000000000000 92.906 > 10 *121 Nd 0.00000000000000 0.62970685933543 0.25000000000000 144.242 > 11 122 Nd 0.50000000000000 0.62970685933543 0.25000000000000 144.242 > 11 123 Nd 0.00000000000000 0.62970685933543 0.58333333333333 144.242 > 11 124 Nd 0.50000000000000 0.62970685933543 0.58333333333333 144.242 > 11 125 Nd 0.00000000000000 0.62970685933543 0.91666666666667 144.242 > 11 126 Nd 0.50000000000000 0.62970685933543 0.91666666666667 144.242 > 11 127 Nd 0.25000000000000 0.87029314066457 0.08333333333333 144.242 > 12 128 Nd 0.75000000000000 0.87029314066457 0.08333333333333 144.242 > 12 129 Nd 0.25000000000000 0.87029314066457 0.41666666666667 144.242 > 12 130 Nd 0.75000000000000 0.87029314066457 0.41666666666667 144.242 > 12 131 Nd 0.25000000000000 0.87029314066457 0.75000000000000 144.242 > 12 132 Nd 0.75000000000000 0.87029314066457 0.75000000000000 144.242 > 12 133 Nd 0.25000000000000 0.12970685933543 0.25000000000000 144.242 > 11 134 Nd 0.75000000000000 0.12970685933543 0.25000000000000 144.242 > 11 135 Nd 0.25000000000000 0.12970685933543 0.58333333333333 144.242 > 11 136 Nd 0.75000000000000 0.12970685933543 0.58333333333333 144.242 > 11 137 Nd 0.25000000000000 0.12970685933543 0.91666666666667 144.242 > 11 138 Nd 0.75000000000000 0.12970685933543 0.91666666666667 144.242 > 11 139 Nd 0.00000000000000 0.37029314066457 0.08333333333333 144.242 > 12 140 Nd 0.50000000000000 0.37029314066457 0.08333333333333 144.242 > 12 141 Nd 0.00000000000000 0.37029314066457 0.41666666666667 144.242 > 12 142 Nd 0.50000000000000 0.37029314066457 0.41666666666667 144.242 > 12 143 Nd 0.00000000000000 0.37029314066457 0.75000000000000 144.242 > 12 144 Nd 0.50000000000000 0.37029314066457 0.75000000000000 144.242 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.1538060 0.0000000 -0.2844252 0.0000000 4.7820614 0.0000000 -0.2844259 0.0000000 5.0518392 -------------------------- Born effective charges -------------------------- 1 O -3.3607507 1.0692273 0.4135158 1.0088489 -2.5736029 -0.6436819 0.4564826 -0.5743769 -1.4754497 2 O -3.3607507 -1.0692273 0.4135158 -1.0088489 -2.5736029 0.6436819 0.4564826 0.5743769 -1.4754497 3 O -3.3607507 1.0692273 0.4135158 1.0088489 -2.5736029 -0.6436819 0.4564826 -0.5743769 -1.4754497 4 O -3.3607507 -1.0692273 0.4135158 -1.0088489 -2.5736029 0.6436819 0.4564826 0.5743769 -1.4754497 5 O -1.8219115 -0.0931771 -0.0092441 -0.0041055 -2.0943017 0.6373984 -0.0437156 0.6824043 -3.5511907 6 O -1.8219115 0.0931771 -0.0092441 0.0041055 -2.0943017 -0.6373984 -0.0437156 -0.6824043 -3.5511907 7 O -1.8219115 -0.0931771 -0.0092441 -0.0041055 -2.0943017 0.6373984 -0.0437156 0.6824043 -3.5511907 8 O -1.8219115 0.0931771 -0.0092441 0.0041055 -2.0943017 -0.6373984 -0.0437156 -0.6824043 -3.5511907 9 Nb 5.6418146 0.0000000 -0.7596148 0.0000000 5.2383780 0.0000000 -1.3206461 0.0000000 5.4934765 10 Nb 5.6418146 0.0000000 -0.7596148 0.0000000 5.2383780 0.0000000 -1.3206461 0.0000000 5.4934765 11 Nd 4.7235098 0.0000000 -0.0489284 0.0000000 4.0974313 0.0000000 0.4951121 0.0000000 4.5598043 12 Nd 4.7235098 0.0000000 -0.0489284 0.0000000 4.0974313 0.0000000 0.4951121 0.0000000 4.5598043 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 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: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 400 - Time: 0.981 Solver_block: 200 / 400 - Time: 0.921 Solver_block: 300 / 400 - Time: 0.877 Solver_block: 400 / 400 - Time: 0.901 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.094 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 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: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 19:51:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:51:41]------------------------- 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): [2 1 3] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.597053490112193 -5.635422180000000 0.000000000000000 b 3.597053490112193 5.635422180000000 0.000000000000000 c -3.369957281352032 0.000000000000000 3.904563336486158 Atomic positions (fractional): 1 O 0.63920133891048 0.05557022923091 0.84079775347356 15.999 2 O 0.94442977076909 0.36079866108952 0.65920224652644 15.999 3 O 0.36079866108952 0.94442977076909 0.15920224652644 15.999 4 O 0.05557022923091 0.63920133891048 0.34079775347356 15.999 5 O 0.79000380460578 0.72760772908070 0.80031580037517 15.999 6 O 0.27239227091930 0.20999619539422 0.69968419962483 15.999 7 O 0.20999619539422 0.27239227091930 0.19968419962483 15.999 8 O 0.72760772908070 0.79000380460578 0.30031580037517 15.999 9 Nb 0.89723488509000 0.10276511491000 0.75000000000000 92.906 10 Nb 0.10276511491000 0.89723488509000 0.25000000000000 92.906 11 Nd 0.37029314066457 0.62970685933543 0.75000000000000 144.242 12 Nd 0.62970685933543 0.37029314066457 0.25000000000000 144.242 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.388213960448773 0.000000000000000 0.000000000000000 b 0.000000000000000 11.270844360000000 0.000000000000000 c -10.109871844056096 0.000000000000000 11.713690009458475 Atomic positions (fractional): 1 O 0.17369289203535 0.70818444516021 0.28026591782452 15.999 > 1 2 O 0.67369289203535 0.70818444516021 0.28026591782452 15.999 > 1 3 O 0.17369289203535 0.70818444516021 0.61359925115785 15.999 > 1 4 O 0.67369289203535 0.70818444516021 0.61359925115785 15.999 > 1 5 O 0.17369289203535 0.70818444516021 0.94693258449119 15.999 > 1 6 O 0.67369289203535 0.70818444516021 0.94693258449119 15.999 > 1 7 O 0.32630710796465 0.70818444516021 0.21973408217548 15.999 > 7 8 O 0.82630710796465 0.70818444516021 0.21973408217548 15.999 > 7 9 O 0.32630710796465 0.70818444516021 0.55306741550881 15.999 > 7 10 O 0.82630710796465 0.70818444516021 0.55306741550881 15.999 > 7 11 O 0.32630710796465 0.70818444516021 0.88640074884215 15.999 > 7 12 O 0.82630710796465 0.70818444516021 0.88640074884215 15.999 > 7 13 O 0.07630710796465 0.79181555483979 0.05306741550881 15.999 > 13 14 O 0.57630710796465 0.79181555483979 0.05306741550881 15.999 > 13 15 O 0.07630710796465 0.79181555483979 0.38640074884215 15.999 > 13 16 O 0.57630710796465 0.79181555483979 0.38640074884215 15.999 > 13 17 O 0.07630710796465 0.79181555483979 0.71973408217548 15.999 > 13 18 O 0.57630710796465 0.79181555483979 0.71973408217548 15.999 > 13 19 O 0.42369289203535 0.79181555483979 0.11359925115785 15.999 > 19 20 O 0.92369289203535 0.79181555483979 0.11359925115785 15.999 > 19 21 O 0.42369289203535 0.79181555483979 0.44693258449119 15.999 > 19 22 O 0.92369289203535 0.79181555483979 0.44693258449119 15.999 > 19 23 O 0.42369289203535 0.79181555483979 0.78026591782452 15.999 > 19 24 O 0.92369289203535 0.79181555483979 0.78026591782452 15.999 > 19 25 O 0.37940288342162 0.96880196223746 0.26677193345839 15.999 > 25 26 O 0.87940288342162 0.96880196223746 0.26677193345839 15.999 > 25 27 O 0.37940288342162 0.96880196223746 0.60010526679172 15.999 > 25 28 O 0.87940288342162 0.96880196223746 0.60010526679172 15.999 > 25 29 O 0.37940288342162 0.96880196223746 0.93343860012506 15.999 > 25 30 O 0.87940288342162 0.96880196223746 0.93343860012506 15.999 > 25 31 O 0.12059711657838 0.96880196223746 0.23322806654161 15.999 > 31 32 O 0.62059711657838 0.96880196223746 0.23322806654161 15.999 > 31 33 O 0.12059711657838 0.96880196223746 0.56656139987494 15.999 > 31 34 O 0.62059711657838 0.96880196223746 0.56656139987494 15.999 > 31 35 O 0.12059711657838 0.96880196223746 0.89989473320828 15.999 > 31 36 O 0.62059711657838 0.96880196223746 0.89989473320828 15.999 > 31 37 O 0.37059711657838 0.53119803776254 0.06656139987494 15.999 > 37 38 O 0.87059711657838 0.53119803776254 0.06656139987494 15.999 > 37 39 O 0.37059711657838 0.53119803776254 0.39989473320828 15.999 > 37 40 O 0.87059711657838 0.53119803776254 0.39989473320828 15.999 > 37 41 O 0.37059711657838 0.53119803776254 0.73322806654161 15.999 > 37 42 O 0.87059711657838 0.53119803776254 0.73322806654161 15.999 > 37 43 O 0.12940288342162 0.53119803776254 0.10010526679172 15.999 > 43 44 O 0.62940288342162 0.53119803776254 0.10010526679172 15.999 > 43 45 O 0.12940288342162 0.53119803776254 0.43343860012506 15.999 > 43 46 O 0.62940288342162 0.53119803776254 0.43343860012506 15.999 > 43 47 O 0.12940288342162 0.53119803776254 0.76677193345839 15.999 > 43 48 O 0.62940288342162 0.53119803776254 0.76677193345839 15.999 > 43 49 O 0.42369289203535 0.20818444516022 0.28026591782452 15.999 > 1 50 O 0.92369289203535 0.20818444516022 0.28026591782452 15.999 > 1 51 O 0.42369289203535 0.20818444516022 0.61359925115785 15.999 > 1 52 O 0.92369289203535 0.20818444516022 0.61359925115785 15.999 > 1 53 O 0.42369289203535 0.20818444516022 0.94693258449119 15.999 > 1 54 O 0.92369289203535 0.20818444516022 0.94693258449119 15.999 > 1 55 O 0.07630710796465 0.20818444516022 0.21973408217548 15.999 > 7 56 O 0.57630710796465 0.20818444516022 0.21973408217548 15.999 > 7 57 O 0.07630710796465 0.20818444516022 0.55306741550881 15.999 > 7 58 O 0.57630710796465 0.20818444516022 0.55306741550881 15.999 > 7 59 O 0.07630710796465 0.20818444516022 0.88640074884215 15.999 > 7 60 O 0.57630710796465 0.20818444516022 0.88640074884215 15.999 > 7 61 O 0.32630710796465 0.29181555483978 0.05306741550881 15.999 > 13 62 O 0.82630710796465 0.29181555483978 0.05306741550881 15.999 > 13 63 O 0.32630710796465 0.29181555483978 0.38640074884215 15.999 > 13 64 O 0.82630710796465 0.29181555483978 0.38640074884215 15.999 > 13 65 O 0.32630710796465 0.29181555483978 0.71973408217548 15.999 > 13 66 O 0.82630710796465 0.29181555483978 0.71973408217548 15.999 > 13 67 O 0.17369289203535 0.29181555483978 0.11359925115785 15.999 > 19 68 O 0.67369289203535 0.29181555483978 0.11359925115785 15.999 > 19 69 O 0.17369289203535 0.29181555483978 0.44693258449119 15.999 > 19 70 O 0.67369289203535 0.29181555483978 0.44693258449119 15.999 > 19 71 O 0.17369289203535 0.29181555483978 0.78026591782452 15.999 > 19 72 O 0.67369289203535 0.29181555483978 0.78026591782452 15.999 > 19 73 O 0.12940288342162 0.46880196223746 0.26677193345839 15.999 > 25 74 O 0.62940288342162 0.46880196223746 0.26677193345839 15.999 > 25 75 O 0.12940288342162 0.46880196223746 0.60010526679172 15.999 > 25 76 O 0.62940288342162 0.46880196223746 0.60010526679172 15.999 > 25 77 O 0.12940288342162 0.46880196223746 0.93343860012506 15.999 > 25 78 O 0.62940288342162 0.46880196223746 0.93343860012506 15.999 > 25 79 O 0.37059711657838 0.46880196223746 0.23322806654161 15.999 > 31 80 O 0.87059711657838 0.46880196223746 0.23322806654161 15.999 > 31 81 O 0.37059711657838 0.46880196223746 0.56656139987494 15.999 > 31 82 O 0.87059711657838 0.46880196223746 0.56656139987494 15.999 > 31 83 O 0.37059711657838 0.46880196223746 0.89989473320828 15.999 > 31 84 O 0.87059711657838 0.46880196223746 0.89989473320828 15.999 > 31 85 O 0.12059711657838 0.03119803776254 0.06656139987494 15.999 > 37 86 O 0.62059711657838 0.03119803776254 0.06656139987494 15.999 > 37 87 O 0.12059711657838 0.03119803776254 0.39989473320828 15.999 > 37 88 O 0.62059711657838 0.03119803776254 0.39989473320828 15.999 > 37 89 O 0.12059711657838 0.03119803776254 0.73322806654161 15.999 > 37 90 O 0.62059711657838 0.03119803776254 0.73322806654161 15.999 > 37 91 O 0.37940288342162 0.03119803776254 0.10010526679172 15.999 > 43 92 O 0.87940288342162 0.03119803776254 0.10010526679172 15.999 > 43 93 O 0.37940288342162 0.03119803776254 0.43343860012506 15.999 > 43 94 O 0.87940288342162 0.03119803776254 0.43343860012506 15.999 > 43 95 O 0.37940288342162 0.03119803776254 0.76677193345839 15.999 > 43 96 O 0.87940288342162 0.03119803776254 0.76677193345839 15.999 > 43 97 Nb 0.25000000000000 0.60276511491000 0.25000000000000 92.906 > 97 98 Nb 0.75000000000000 0.60276511491000 0.25000000000000 92.906 > 97 99 Nb 0.25000000000000 0.60276511491000 0.58333333333333 92.906 > 97 100 Nb 0.75000000000000 0.60276511491000 0.58333333333333 92.906 > 97 101 Nb 0.25000000000000 0.60276511491000 0.91666666666667 92.906 > 97 102 Nb 0.75000000000000 0.60276511491000 0.91666666666667 92.906 > 97 103 Nb 0.00000000000000 0.89723488509000 0.08333333333333 92.906 > 103 104 Nb 0.50000000000000 0.89723488509000 0.08333333333333 92.906 > 103 105 Nb 0.00000000000000 0.89723488509000 0.41666666666667 92.906 > 103 106 Nb 0.50000000000000 0.89723488509000 0.41666666666667 92.906 > 103 107 Nb 0.00000000000000 0.89723488509000 0.75000000000000 92.906 > 103 108 Nb 0.50000000000000 0.89723488509000 0.75000000000000 92.906 > 103 109 Nb 0.00000000000000 0.10276511491000 0.25000000000000 92.906 > 97 110 Nb 0.50000000000000 0.10276511491000 0.25000000000000 92.906 > 97 111 Nb 0.00000000000000 0.10276511491000 0.58333333333333 92.906 > 97 112 Nb 0.50000000000000 0.10276511491000 0.58333333333333 92.906 > 97 113 Nb 0.00000000000000 0.10276511491000 0.91666666666667 92.906 > 97 114 Nb 0.50000000000000 0.10276511491000 0.91666666666667 92.906 > 97 115 Nb 0.25000000000000 0.39723488509000 0.08333333333333 92.906 > 103 116 Nb 0.75000000000000 0.39723488509000 0.08333333333333 92.906 > 103 117 Nb 0.25000000000000 0.39723488509000 0.41666666666667 92.906 > 103 118 Nb 0.75000000000000 0.39723488509000 0.41666666666667 92.906 > 103 119 Nb 0.25000000000000 0.39723488509000 0.75000000000000 92.906 > 103 120 Nb 0.75000000000000 0.39723488509000 0.75000000000000 92.906 > 103 121 Nd 0.00000000000000 0.62970685933543 0.25000000000000 144.242 > 121 122 Nd 0.50000000000000 0.62970685933543 0.25000000000000 144.242 > 121 123 Nd 0.00000000000000 0.62970685933543 0.58333333333333 144.242 > 121 124 Nd 0.50000000000000 0.62970685933543 0.58333333333333 144.242 > 121 125 Nd 0.00000000000000 0.62970685933543 0.91666666666667 144.242 > 121 126 Nd 0.50000000000000 0.62970685933543 0.91666666666667 144.242 > 121 127 Nd 0.25000000000000 0.87029314066457 0.08333333333333 144.242 > 127 128 Nd 0.75000000000000 0.87029314066457 0.08333333333333 144.242 > 127 129 Nd 0.25000000000000 0.87029314066457 0.41666666666667 144.242 > 127 130 Nd 0.75000000000000 0.87029314066457 0.41666666666667 144.242 > 127 131 Nd 0.25000000000000 0.87029314066457 0.75000000000000 144.242 > 127 132 Nd 0.75000000000000 0.87029314066457 0.75000000000000 144.242 > 127 133 Nd 0.25000000000000 0.12970685933543 0.25000000000000 144.242 > 121 134 Nd 0.75000000000000 0.12970685933543 0.25000000000000 144.242 > 121 135 Nd 0.25000000000000 0.12970685933543 0.58333333333333 144.242 > 121 136 Nd 0.75000000000000 0.12970685933543 0.58333333333333 144.242 > 121 137 Nd 0.25000000000000 0.12970685933543 0.91666666666667 144.242 > 121 138 Nd 0.75000000000000 0.12970685933543 0.91666666666667 144.242 > 121 139 Nd 0.00000000000000 0.37029314066457 0.08333333333333 144.242 > 127 140 Nd 0.50000000000000 0.37029314066457 0.08333333333333 144.242 > 127 141 Nd 0.00000000000000 0.37029314066457 0.41666666666667 144.242 > 127 142 Nd 0.50000000000000 0.37029314066457 0.41666666666667 144.242 > 127 143 Nd 0.00000000000000 0.37029314066457 0.75000000000000 144.242 > 127 144 Nd 0.50000000000000 0.37029314066457 0.75000000000000 144.242 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.1538060 0.0000000 -0.2844252 0.0000000 4.7820614 0.0000000 -0.2844259 0.0000000 5.0518392 -------------------------- Born effective charges -------------------------- 1 O -3.3607507 1.0692273 0.4135158 1.0088489 -2.5736029 -0.6436819 0.4564826 -0.5743769 -1.4754497 2 O -3.3607507 -1.0692273 0.4135158 -1.0088489 -2.5736029 0.6436819 0.4564826 0.5743769 -1.4754497 3 O -3.3607507 1.0692273 0.4135158 1.0088489 -2.5736029 -0.6436819 0.4564826 -0.5743769 -1.4754497 4 O -3.3607507 -1.0692273 0.4135158 -1.0088489 -2.5736029 0.6436819 0.4564826 0.5743769 -1.4754497 5 O -1.8219115 -0.0931771 -0.0092441 -0.0041055 -2.0943017 0.6373984 -0.0437156 0.6824043 -3.5511907 6 O -1.8219115 0.0931771 -0.0092441 0.0041055 -2.0943017 -0.6373984 -0.0437156 -0.6824043 -3.5511907 7 O -1.8219115 -0.0931771 -0.0092441 -0.0041055 -2.0943017 0.6373984 -0.0437156 0.6824043 -3.5511907 8 O -1.8219115 0.0931771 -0.0092441 0.0041055 -2.0943017 -0.6373984 -0.0437156 -0.6824043 -3.5511907 9 Nb 5.6418146 0.0000000 -0.7596148 0.0000000 5.2383780 0.0000000 -1.3206461 0.0000000 5.4934765 10 Nb 5.6418146 0.0000000 -0.7596148 0.0000000 5.2383780 0.0000000 -1.3206461 0.0000000 5.4934765 11 Nd 4.7235098 0.0000000 -0.0489284 0.0000000 4.0974313 0.0000000 0.4951121 0.0000000 4.5598043 12 Nd 4.7235098 0.0000000 -0.0489284 0.0000000 4.0974313 0.0000000 0.4951121 0.0000000 4.5598043 ---------------------------------------------------------------------------- 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Computing fc3[ 97, 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Computing fc3[ 121, 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (xyx) -0.00000000 (xyx) -0.00000000 (xxy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zx) 0.00000000 (zx) 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 2026-01-07 19:52:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:52:06]------------------------- 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): [2 1 3] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.597053490112193 -5.635422180000000 0.000000000000000 b 3.597053490112193 5.635422180000000 0.000000000000000 c -3.369957281352032 0.000000000000000 3.904563336486158 Atomic positions (fractional): 1 O 0.63920133891048 0.05557022923091 0.84079775347356 15.999 2 O 0.94442977076909 0.36079866108952 0.65920224652644 15.999 3 O 0.36079866108952 0.94442977076909 0.15920224652644 15.999 4 O 0.05557022923091 0.63920133891048 0.34079775347356 15.999 5 O 0.79000380460578 0.72760772908070 0.80031580037517 15.999 6 O 0.27239227091930 0.20999619539422 0.69968419962483 15.999 7 O 0.20999619539422 0.27239227091930 0.19968419962483 15.999 8 O 0.72760772908070 0.79000380460578 0.30031580037517 15.999 9 Nb 0.89723488509000 0.10276511491000 0.75000000000000 92.906 10 Nb 0.10276511491000 0.89723488509000 0.25000000000000 92.906 11 Nd 0.37029314066457 0.62970685933543 0.75000000000000 144.242 12 Nd 0.62970685933543 0.37029314066457 0.25000000000000 144.242 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.388213960448773 0.000000000000000 0.000000000000000 b 0.000000000000000 11.270844360000000 0.000000000000000 c -10.109871844056096 0.000000000000000 11.713690009458475 Atomic positions (fractional): 1 O 0.17369289203535 0.70818444516021 0.28026591782452 15.999 > 1 2 O 0.67369289203535 0.70818444516021 0.28026591782452 15.999 > 1 3 O 0.17369289203535 0.70818444516021 0.61359925115785 15.999 > 1 4 O 0.67369289203535 0.70818444516021 0.61359925115785 15.999 > 1 5 O 0.17369289203535 0.70818444516021 0.94693258449119 15.999 > 1 6 O 0.67369289203535 0.70818444516021 0.94693258449119 15.999 > 1 7 O 0.32630710796465 0.70818444516021 0.21973408217548 15.999 > 7 8 O 0.82630710796465 0.70818444516021 0.21973408217548 15.999 > 7 9 O 0.32630710796465 0.70818444516021 0.55306741550881 15.999 > 7 10 O 0.82630710796465 0.70818444516021 0.55306741550881 15.999 > 7 11 O 0.32630710796465 0.70818444516021 0.88640074884215 15.999 > 7 12 O 0.82630710796465 0.70818444516021 0.88640074884215 15.999 > 7 13 O 0.07630710796465 0.79181555483979 0.05306741550881 15.999 > 13 14 O 0.57630710796465 0.79181555483979 0.05306741550881 15.999 > 13 15 O 0.07630710796465 0.79181555483979 0.38640074884215 15.999 > 13 16 O 0.57630710796465 0.79181555483979 0.38640074884215 15.999 > 13 17 O 0.07630710796465 0.79181555483979 0.71973408217548 15.999 > 13 18 O 0.57630710796465 0.79181555483979 0.71973408217548 15.999 > 13 19 O 0.42369289203535 0.79181555483979 0.11359925115785 15.999 > 19 20 O 0.92369289203535 0.79181555483979 0.11359925115785 15.999 > 19 21 O 0.42369289203535 0.79181555483979 0.44693258449119 15.999 > 19 22 O 0.92369289203535 0.79181555483979 0.44693258449119 15.999 > 19 23 O 0.42369289203535 0.79181555483979 0.78026591782452 15.999 > 19 24 O 0.92369289203535 0.79181555483979 0.78026591782452 15.999 > 19 25 O 0.37940288342162 0.96880196223746 0.26677193345839 15.999 > 25 26 O 0.87940288342162 0.96880196223746 0.26677193345839 15.999 > 25 27 O 0.37940288342162 0.96880196223746 0.60010526679172 15.999 > 25 28 O 0.87940288342162 0.96880196223746 0.60010526679172 15.999 > 25 29 O 0.37940288342162 0.96880196223746 0.93343860012506 15.999 > 25 30 O 0.87940288342162 0.96880196223746 0.93343860012506 15.999 > 25 31 O 0.12059711657838 0.96880196223746 0.23322806654161 15.999 > 31 32 O 0.62059711657838 0.96880196223746 0.23322806654161 15.999 > 31 33 O 0.12059711657838 0.96880196223746 0.56656139987494 15.999 > 31 34 O 0.62059711657838 0.96880196223746 0.56656139987494 15.999 > 31 35 O 0.12059711657838 0.96880196223746 0.89989473320828 15.999 > 31 36 O 0.62059711657838 0.96880196223746 0.89989473320828 15.999 > 31 37 O 0.37059711657838 0.53119803776254 0.06656139987494 15.999 > 37 38 O 0.87059711657838 0.53119803776254 0.06656139987494 15.999 > 37 39 O 0.37059711657838 0.53119803776254 0.39989473320828 15.999 > 37 40 O 0.87059711657838 0.53119803776254 0.39989473320828 15.999 > 37 41 O 0.37059711657838 0.53119803776254 0.73322806654161 15.999 > 37 42 O 0.87059711657838 0.53119803776254 0.73322806654161 15.999 > 37 43 O 0.12940288342162 0.53119803776254 0.10010526679172 15.999 > 43 44 O 0.62940288342162 0.53119803776254 0.10010526679172 15.999 > 43 45 O 0.12940288342162 0.53119803776254 0.43343860012506 15.999 > 43 46 O 0.62940288342162 0.53119803776254 0.43343860012506 15.999 > 43 47 O 0.12940288342162 0.53119803776254 0.76677193345839 15.999 > 43 48 O 0.62940288342162 0.53119803776254 0.76677193345839 15.999 > 43 49 O 0.42369289203535 0.20818444516022 0.28026591782452 15.999 > 1 50 O 0.92369289203535 0.20818444516022 0.28026591782452 15.999 > 1 51 O 0.42369289203535 0.20818444516022 0.61359925115785 15.999 > 1 52 O 0.92369289203535 0.20818444516022 0.61359925115785 15.999 > 1 53 O 0.42369289203535 0.20818444516022 0.94693258449119 15.999 > 1 54 O 0.92369289203535 0.20818444516022 0.94693258449119 15.999 > 1 55 O 0.07630710796465 0.20818444516022 0.21973408217548 15.999 > 7 56 O 0.57630710796465 0.20818444516022 0.21973408217548 15.999 > 7 57 O 0.07630710796465 0.20818444516022 0.55306741550881 15.999 > 7 58 O 0.57630710796465 0.20818444516022 0.55306741550881 15.999 > 7 59 O 0.07630710796465 0.20818444516022 0.88640074884215 15.999 > 7 60 O 0.57630710796465 0.20818444516022 0.88640074884215 15.999 > 7 61 O 0.32630710796465 0.29181555483978 0.05306741550881 15.999 > 13 62 O 0.82630710796465 0.29181555483978 0.05306741550881 15.999 > 13 63 O 0.32630710796465 0.29181555483978 0.38640074884215 15.999 > 13 64 O 0.82630710796465 0.29181555483978 0.38640074884215 15.999 > 13 65 O 0.32630710796465 0.29181555483978 0.71973408217548 15.999 > 13 66 O 0.82630710796465 0.29181555483978 0.71973408217548 15.999 > 13 67 O 0.17369289203535 0.29181555483978 0.11359925115785 15.999 > 19 68 O 0.67369289203535 0.29181555483978 0.11359925115785 15.999 > 19 69 O 0.17369289203535 0.29181555483978 0.44693258449119 15.999 > 19 70 O 0.67369289203535 0.29181555483978 0.44693258449119 15.999 > 19 71 O 0.17369289203535 0.29181555483978 0.78026591782452 15.999 > 19 72 O 0.67369289203535 0.29181555483978 0.78026591782452 15.999 > 19 73 O 0.12940288342162 0.46880196223746 0.26677193345839 15.999 > 25 74 O 0.62940288342162 0.46880196223746 0.26677193345839 15.999 > 25 75 O 0.12940288342162 0.46880196223746 0.60010526679172 15.999 > 25 76 O 0.62940288342162 0.46880196223746 0.60010526679172 15.999 > 25 77 O 0.12940288342162 0.46880196223746 0.93343860012506 15.999 > 25 78 O 0.62940288342162 0.46880196223746 0.93343860012506 15.999 > 25 79 O 0.37059711657838 0.46880196223746 0.23322806654161 15.999 > 31 80 O 0.87059711657838 0.46880196223746 0.23322806654161 15.999 > 31 81 O 0.37059711657838 0.46880196223746 0.56656139987494 15.999 > 31 82 O 0.87059711657838 0.46880196223746 0.56656139987494 15.999 > 31 83 O 0.37059711657838 0.46880196223746 0.89989473320828 15.999 > 31 84 O 0.87059711657838 0.46880196223746 0.89989473320828 15.999 > 31 85 O 0.12059711657838 0.03119803776254 0.06656139987494 15.999 > 37 86 O 0.62059711657838 0.03119803776254 0.06656139987494 15.999 > 37 87 O 0.12059711657838 0.03119803776254 0.39989473320828 15.999 > 37 88 O 0.62059711657838 0.03119803776254 0.39989473320828 15.999 > 37 89 O 0.12059711657838 0.03119803776254 0.73322806654161 15.999 > 37 90 O 0.62059711657838 0.03119803776254 0.73322806654161 15.999 > 37 91 O 0.37940288342162 0.03119803776254 0.10010526679172 15.999 > 43 92 O 0.87940288342162 0.03119803776254 0.10010526679172 15.999 > 43 93 O 0.37940288342162 0.03119803776254 0.43343860012506 15.999 > 43 94 O 0.87940288342162 0.03119803776254 0.43343860012506 15.999 > 43 95 O 0.37940288342162 0.03119803776254 0.76677193345839 15.999 > 43 96 O 0.87940288342162 0.03119803776254 0.76677193345839 15.999 > 43 97 Nb 0.25000000000000 0.60276511491000 0.25000000000000 92.906 > 97 98 Nb 0.75000000000000 0.60276511491000 0.25000000000000 92.906 > 97 99 Nb 0.25000000000000 0.60276511491000 0.58333333333333 92.906 > 97 100 Nb 0.75000000000000 0.60276511491000 0.58333333333333 92.906 > 97 101 Nb 0.25000000000000 0.60276511491000 0.91666666666667 92.906 > 97 102 Nb 0.75000000000000 0.60276511491000 0.91666666666667 92.906 > 97 103 Nb 0.00000000000000 0.89723488509000 0.08333333333333 92.906 > 103 104 Nb 0.50000000000000 0.89723488509000 0.08333333333333 92.906 > 103 105 Nb 0.00000000000000 0.89723488509000 0.41666666666667 92.906 > 103 106 Nb 0.50000000000000 0.89723488509000 0.41666666666667 92.906 > 103 107 Nb 0.00000000000000 0.89723488509000 0.75000000000000 92.906 > 103 108 Nb 0.50000000000000 0.89723488509000 0.75000000000000 92.906 > 103 109 Nb 0.00000000000000 0.10276511491000 0.25000000000000 92.906 > 97 110 Nb 0.50000000000000 0.10276511491000 0.25000000000000 92.906 > 97 111 Nb 0.00000000000000 0.10276511491000 0.58333333333333 92.906 > 97 112 Nb 0.50000000000000 0.10276511491000 0.58333333333333 92.906 > 97 113 Nb 0.00000000000000 0.10276511491000 0.91666666666667 92.906 > 97 114 Nb 0.50000000000000 0.10276511491000 0.91666666666667 92.906 > 97 115 Nb 0.25000000000000 0.39723488509000 0.08333333333333 92.906 > 103 116 Nb 0.75000000000000 0.39723488509000 0.08333333333333 92.906 > 103 117 Nb 0.25000000000000 0.39723488509000 0.41666666666667 92.906 > 103 118 Nb 0.75000000000000 0.39723488509000 0.41666666666667 92.906 > 103 119 Nb 0.25000000000000 0.39723488509000 0.75000000000000 92.906 > 103 120 Nb 0.75000000000000 0.39723488509000 0.75000000000000 92.906 > 103 121 Nd 0.00000000000000 0.62970685933543 0.25000000000000 144.242 > 121 122 Nd 0.50000000000000 0.62970685933543 0.25000000000000 144.242 > 121 123 Nd 0.00000000000000 0.62970685933543 0.58333333333333 144.242 > 121 124 Nd 0.50000000000000 0.62970685933543 0.58333333333333 144.242 > 121 125 Nd 0.00000000000000 0.62970685933543 0.91666666666667 144.242 > 121 126 Nd 0.50000000000000 0.62970685933543 0.91666666666667 144.242 > 121 127 Nd 0.25000000000000 0.87029314066457 0.08333333333333 144.242 > 127 128 Nd 0.75000000000000 0.87029314066457 0.08333333333333 144.242 > 127 129 Nd 0.25000000000000 0.87029314066457 0.41666666666667 144.242 > 127 130 Nd 0.75000000000000 0.87029314066457 0.41666666666667 144.242 > 127 131 Nd 0.25000000000000 0.87029314066457 0.75000000000000 144.242 > 127 132 Nd 0.75000000000000 0.87029314066457 0.75000000000000 144.242 > 127 133 Nd 0.25000000000000 0.12970685933543 0.25000000000000 144.242 > 121 134 Nd 0.75000000000000 0.12970685933543 0.25000000000000 144.242 > 121 135 Nd 0.25000000000000 0.12970685933543 0.58333333333333 144.242 > 121 136 Nd 0.75000000000000 0.12970685933543 0.58333333333333 144.242 > 121 137 Nd 0.25000000000000 0.12970685933543 0.91666666666667 144.242 > 121 138 Nd 0.75000000000000 0.12970685933543 0.91666666666667 144.242 > 121 139 Nd 0.00000000000000 0.37029314066457 0.08333333333333 144.242 > 127 140 Nd 0.50000000000000 0.37029314066457 0.08333333333333 144.242 > 127 141 Nd 0.00000000000000 0.37029314066457 0.41666666666667 144.242 > 127 142 Nd 0.50000000000000 0.37029314066457 0.41666666666667 144.242 > 127 143 Nd 0.00000000000000 0.37029314066457 0.75000000000000 144.242 > 127 144 Nd 0.50000000000000 0.37029314066457 0.75000000000000 144.242 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.1538060 0.0000000 -0.2844252 0.0000000 4.7820614 0.0000000 -0.2844259 0.0000000 5.0518392 -------------------------- Born effective charges -------------------------- 1 O -3.3607507 1.0692273 0.4135158 1.0088489 -2.5736029 -0.6436819 0.4564826 -0.5743769 -1.4754497 2 O -3.3607507 -1.0692273 0.4135158 -1.0088489 -2.5736029 0.6436819 0.4564826 0.5743769 -1.4754497 3 O -3.3607507 1.0692273 0.4135158 1.0088489 -2.5736029 -0.6436819 0.4564826 -0.5743769 -1.4754497 4 O -3.3607507 -1.0692273 0.4135158 -1.0088489 -2.5736029 0.6436819 0.4564826 0.5743769 -1.4754497 5 O -1.8219115 -0.0931771 -0.0092441 -0.0041055 -2.0943017 0.6373984 -0.0437156 0.6824043 -3.5511907 6 O -1.8219115 0.0931771 -0.0092441 0.0041055 -2.0943017 -0.6373984 -0.0437156 -0.6824043 -3.5511907 7 O -1.8219115 -0.0931771 -0.0092441 -0.0041055 -2.0943017 0.6373984 -0.0437156 0.6824043 -3.5511907 8 O -1.8219115 0.0931771 -0.0092441 0.0041055 -2.0943017 -0.6373984 -0.0437156 -0.6824043 -3.5511907 9 Nb 5.6418146 0.0000000 -0.7596148 0.0000000 5.2383780 0.0000000 -1.3206461 0.0000000 5.4934765 10 Nb 5.6418146 0.0000000 -0.7596148 0.0000000 5.2383780 0.0000000 -1.3206461 0.0000000 5.4934765 11 Nd 4.7235098 0.0000000 -0.0489284 0.0000000 4.0974313 0.0000000 0.4951121 0.0000000 4.5598043 12 Nd 4.7235098 0.0000000 -0.0489284 0.0000000 4.0974313 0.0000000 0.4951121 0.0000000 4.5598043 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xyx) -0.00000000 (xyx) -0.00000000 (xxy) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- 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 ... [ 10 10 13 ] 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: 0.77, Number of G-points: 299, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/361) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 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 3.522 ( 0.000 0.000 0.000) 0.000 3.600 ( 0.000 0.000 0.000) 0.000 3.911 ( 0.000 0.000 0.000) 0.000 3.929 ( 0.000 0.000 0.000) 0.000 4.892 ( 0.000 0.000 0.000) 0.000 5.061 ( 0.000 0.000 0.000) 0.000 5.518 ( 0.000 0.000 0.000) 0.000 5.521 ( 0.000 0.000 0.000) 0.000 5.550 ( 0.000 0.000 0.000) 0.000 6.218 ( 0.000 0.000 0.000) 0.000 6.298 ( 0.000 0.000 0.000) 0.000 6.800 ( 0.000 0.000 0.000) 0.000 7.232 ( 0.000 0.000 0.000) 0.000 7.822 ( 0.000 0.000 0.000) 0.000 8.862 ( 0.000 0.000 0.000) 0.000 9.603 ( 0.000 0.000 0.000) 0.000 9.644 ( 0.000 0.000 0.000) 0.000 9.871 ( 0.000 0.000 0.000) 0.000 10.469 ( 0.000 0.000 0.000) 0.000 10.934 ( 0.000 0.000 0.000) 0.000 11.859 ( 0.000 0.000 0.000) 0.000 12.307 ( 0.000 0.000 0.000) 0.000 12.567 ( 0.000 0.000 0.000) 0.000 13.074 ( 0.000 0.000 0.000) 0.000 15.217 ( 0.000 0.000 0.000) 0.000 17.072 ( 0.000 0.000 0.000) 0.000 18.616 ( 0.000 0.000 0.000) 0.000 18.937 ( 0.000 0.000 0.000) 0.000 19.516 ( 0.000 0.000 0.000) 0.000 19.516 ( 0.000 0.000 0.000) 0.000 20.384 ( 0.000 0.000 0.000) 0.000 22.965 ( 0.000 0.000 0.000) 0.000 23.677 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/361) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.534 ( 10.553 -14.249 21.529) 27.891 0.678 ( 10.628 -26.487 24.033) 37.311 1.266 ( 47.026 -14.559 38.208) 62.316 3.513 ( -0.409 1.831 -5.092) 5.427 3.564 ( 6.602 0.616 -3.545) 7.519 3.882 ( -3.123 3.073 2.467) 5.028 4.056 ( 13.096 1.659 -1.840) 13.328 4.894 ( 0.825 0.481 -2.202) 2.400 5.432 ( -3.721 6.181 -0.927) 7.273 5.448 ( 3.052 8.227 -5.657) 10.440 5.521 ( 8.045 2.158 -10.330) 13.269 5.668 ( 2.748 2.807 6.497) 7.592 6.204 ( -1.306 6.399 -6.527) 9.234 6.545 ( 8.932 26.649 1.553) 28.149 7.000 ( 15.811 5.282 4.348) 17.227 7.604 ( -6.402 -21.504 -13.096) 25.979 7.864 ( -11.825 -33.635 -15.190) 38.754 8.887 ( 1.396 5.903 5.902) 8.463 9.582 ( 0.394 1.840 -2.896) 3.454 9.614 ( -4.185 -5.933 -3.539) 8.077 10.391 ( 5.282 14.560 -4.478) 16.123 10.868 ( 47.142 10.484 -33.104) 58.550 11.042 ( -16.159 11.867 35.376) 40.662 11.865 ( 1.125 -0.242 -0.271) 1.182 12.318 ( 2.100 -5.225 -4.215) 7.034 12.874 ( -10.460 -40.513 -17.055) 45.184 13.046 ( -3.138 -0.813 -1.734) 3.676 15.125 ( -6.753 0.254 -9.213) 11.425 18.002 ( -35.278 42.792 77.271) 95.113 18.878 ( -34.252 -28.848 14.148) 46.963 18.892 ( -7.679 -2.863 -1.163) 8.278 19.513 ( -3.580 -3.533 0.026) 5.030 20.433 ( 4.710 0.525 3.882) 6.126 22.402 ( 53.490 56.335 -17.759) 79.689 23.520 ( -0.922 -47.235 -37.028) 60.025 23.698 ( 1.819 -0.184 0.584) 1.919 ======================= Grid point 2 (3/361) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.056 ( 8.484 -14.665 21.616) 27.464 1.339 ( 11.898 -23.414 23.133) 34.999 2.454 ( 43.056 -12.476 33.969) 56.244 3.464 ( 1.744 1.123 -2.063) 2.925 3.590 ( 7.243 6.266 -5.921) 11.260 3.879 ( -0.288 2.154 6.827) 7.165 4.172 ( 4.523 3.367 4.678) 7.327 4.831 ( 0.298 4.272 -6.780) 8.019 5.294 ( 1.368 10.353 -9.895) 14.386 5.349 ( -1.091 3.878 -1.242) 4.216 5.472 ( 1.760 0.559 -5.964) 6.243 5.766 ( -1.615 -1.185 8.663) 8.892 6.088 ( 2.631 1.862 -4.723) 5.718 6.475 ( 3.026 11.403 0.025) 11.798 7.119 ( 5.884 5.627 -3.893) 9.025 7.515 ( -1.476 -2.950 -9.934) 10.467 7.877 ( -9.992 -29.607 -2.821) 31.375 8.910 ( 0.619 10.421 6.849) 12.486 9.498 ( -4.939 0.814 -3.218) 5.951 9.594 ( 1.646 -4.994 -3.879) 6.534 10.299 ( 2.458 7.000 -3.291) 8.116 11.042 ( 22.513 0.715 -12.447) 25.735 11.143 ( -9.803 1.243 20.857) 23.080 11.898 ( 3.089 -0.806 0.347) 3.212 12.362 ( 4.156 -11.176 -7.833) 14.267 12.892 ( -2.974 -6.277 0.426) 6.959 12.961 ( -6.790 -2.423 -2.200) 7.538 14.841 ( -10.625 3.582 -14.105) 18.019 18.071 ( -13.763 17.507 34.789) 41.306 18.749 ( -5.947 3.935 -3.857) 8.107 18.836 ( -15.002 -14.140 3.861) 20.974 19.449 ( -6.703 -2.031 -3.562) 7.858 20.608 ( 8.231 -2.002 8.519) 12.014 22.434 ( 28.141 25.278 -11.578) 39.560 23.480 ( -2.678 -22.575 -16.623) 28.163 23.732 ( 0.816 1.189 2.489) 2.876 ======================= Grid point 3 (4/361) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 5.713 -13.784 19.389) 24.465 1.980 ( 13.645 -19.350 22.373) 32.576 3.413 ( 4.778 0.552 17.170) 17.831 3.473 ( 30.618 -2.526 3.633) 30.936 3.528 ( 2.516 7.311 -3.545) 8.505 3.965 ( 3.601 3.798 3.499) 6.296 4.285 ( 4.550 -0.178 8.557) 9.693 4.698 ( 3.520 3.325 -9.643) 10.790 5.065 ( -3.329 8.437 -10.884) 14.168 5.293 ( -2.704 4.632 1.015) 5.459 5.435 ( -1.323 -1.681 -0.852) 2.302 5.842 ( -0.953 -1.181 5.963) 6.153 6.153 ( 4.994 -4.993 2.208) 7.399 6.408 ( 2.365 9.430 -3.080) 10.199 6.988 ( -3.056 7.328 -8.928) 11.948 7.409 ( 1.330 -0.126 -8.646) 8.749 8.000 ( -8.631 -25.495 1.343) 26.950 8.879 ( -0.071 12.711 4.801) 13.587 9.374 ( -5.375 0.464 -3.782) 6.589 9.663 ( 6.753 -0.381 1.212) 6.872 10.268 ( 0.373 -5.324 -3.175) 6.210 11.074 ( -2.614 10.705 3.097) 11.446 11.315 ( 8.398 -8.941 2.764) 12.574 11.969 ( 4.211 -1.184 0.994) 4.486 12.432 ( 2.947 -14.130 -8.556) 16.780 12.784 ( -6.746 4.440 -4.552) 9.271 13.001 ( 0.122 -0.763 11.785) 11.810 14.456 ( -12.139 4.277 -16.705) 21.088 18.111 ( -7.277 7.827 13.564) 17.269 18.622 ( -4.292 4.775 3.506) 7.315 18.809 ( -5.961 -6.480 0.646) 8.828 19.287 ( -7.746 -0.148 -7.333) 10.667 20.861 ( 7.522 -3.404 9.372) 12.491 22.450 ( 17.368 13.688 -9.784) 24.181 23.457 ( -1.660 -13.477 -8.708) 16.131 23.754 ( -0.641 1.836 3.103) 3.662 ======================= Grid point 4 (5/361) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.897 ( 3.002 -9.431 12.646) 16.058 2.586 ( 13.955 -14.513 20.479) 28.719 3.324 ( -4.726 4.060 -2.519) 6.720 3.448 ( 0.274 5.936 -2.974) 6.645 3.834 ( -0.850 10.943 -8.065) 13.621 4.098 ( 21.110 -0.362 5.220) 21.748 4.505 ( 3.021 -5.967 10.906) 12.794 4.744 ( 10.394 2.093 -3.655) 11.215 4.834 ( -4.350 0.247 -5.754) 7.217 5.230 ( -2.855 5.911 5.778) 8.745 5.454 ( -1.933 -5.218 3.163) 6.400 5.910 ( 0.993 -0.386 4.169) 4.303 6.262 ( -2.583 4.902 -10.933) 12.257 6.306 ( 3.534 -2.388 5.183) 6.712 6.766 ( -3.705 6.088 -7.044) 10.020 7.364 ( 2.698 0.103 -3.723) 4.599 8.085 ( -7.239 -16.527 -0.183) 18.044 8.818 ( 0.396 9.999 2.428) 10.297 9.266 ( -3.359 0.483 -2.668) 4.317 9.779 ( 6.512 3.792 3.155) 8.169 10.353 ( 2.333 -16.312 -1.044) 16.511 10.896 ( -8.072 14.486 -0.161) 16.584 11.550 ( 9.792 -7.515 1.511) 12.435 12.042 ( 2.972 -0.769 0.766) 3.164 12.448 ( -5.350 -6.721 -3.913) 9.440 12.607 ( -2.101 3.020 -5.042) 6.242 13.216 ( 5.634 -0.738 15.052) 16.089 14.053 ( -11.036 3.764 -16.321) 20.059 18.062 ( -3.634 3.206 1.140) 4.979 18.642 ( -3.971 0.937 12.016) 12.690 18.795 ( 1.787 1.459 -2.269) 3.236 19.092 ( -6.578 -1.548 -8.228) 10.647 21.063 ( 3.909 -2.119 5.808) 7.315 22.445 ( 8.695 6.305 -6.111) 12.357 23.463 ( -0.147 -7.148 -3.759) 8.077 23.757 ( -1.152 1.620 2.137) 2.919 ======================= Grid point 5 (6/361) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 326 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 0.000 -0.000 0.000) 0.000 3.005 ( 0.000 0.000 -0.000) 0.000 3.174 ( 0.000 -0.000 0.000) 0.000 3.397 ( 0.000 -0.000 0.000) 0.000 3.654 ( 0.000 -0.000 0.000) 0.000 4.314 ( 0.000 -0.000 0.000) 0.000 4.577 ( 0.000 -0.000 0.000) 0.000 4.780 ( 0.000 0.000 -0.000) 0.000 4.784 ( -0.000 -0.000 0.000) 0.000 5.255 ( 0.000 -0.000 0.000) 0.000 5.526 ( 0.000 -0.000 0.000) 0.000 5.989 ( 0.000 -0.000 0.000) 0.000 6.051 ( 0.000 -0.000 0.000) 0.000 6.387 ( 0.000 -0.000 0.000) 0.000 6.662 ( 0.000 -0.000 0.000) 0.000 7.367 ( 0.000 -0.000 0.000) 0.000 8.102 ( 0.000 -0.000 0.000) 0.000 8.789 ( 0.000 -0.000 0.000) 0.000 9.223 ( 0.000 -0.000 0.000) 0.000 9.827 ( 0.000 0.000 0.000) 0.000 10.533 ( 0.000 -0.000 0.000) 0.000 10.678 ( 0.000 -0.000 0.000) 0.000 11.684 ( 0.000 -0.000 0.000) 0.000 12.072 ( 0.000 -0.000 0.000) 0.000 12.372 ( 0.000 -0.000 0.000) 0.000 12.569 ( 0.000 -0.000 0.000) 0.000 13.423 ( 0.000 -0.000 0.000) 0.000 13.790 ( 0.000 -0.000 0.000) 0.000 18.024 ( 0.000 -0.000 0.000) 0.000 18.717 ( -0.000 -0.000 0.000) 0.000 18.772 ( 0.000 0.000 -0.000) 0.000 18.988 ( 0.000 0.000 0.000) 0.000 21.135 ( 0.000 -0.000 0.000) 0.000 22.440 ( 0.000 -0.000 0.000) 0.000 23.475 ( 0.000 -0.000 0.000) 0.000 23.752 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 12 (7/361) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.981 ( -1.284 0.000 39.522) 39.543 1.030 ( 21.813 -0.000 19.728) 29.411 2.348 ( 47.709 -0.000 35.842) 59.672 3.474 ( 4.072 -0.000 -2.785) 4.933 3.648 ( 8.407 -0.000 -5.666) 10.138 3.897 ( -2.339 0.000 6.211) 6.637 4.201 ( 2.809 -0.000 5.056) 5.784 4.869 ( -1.338 0.000 -3.992) 4.210 5.384 ( -2.504 0.000 -0.940) 2.675 5.419 ( -2.613 0.000 -3.761) 4.580 5.449 ( 7.166 -0.000 -19.856) 21.109 5.762 ( -1.016 0.000 9.527) 9.582 6.070 ( -6.865 0.000 -4.828) 8.393 6.752 ( 10.003 -0.000 -10.310) 14.365 7.178 ( 6.387 -0.000 -6.153) 8.869 7.332 ( -1.175 0.000 3.741) 3.922 7.603 ( -8.755 0.000 -1.906) 8.960 9.008 ( 1.374 -0.000 5.563) 5.730 9.470 ( -7.235 0.000 -2.378) 7.616 9.570 ( 4.983 -0.000 -5.134) 7.155 10.378 ( -4.007 0.000 -3.167) 5.107 11.002 ( 22.088 -0.000 -14.743) 26.557 11.287 ( -5.624 0.000 15.064) 16.080 11.890 ( 2.820 -0.000 0.482) 2.861 12.178 ( 3.814 -0.000 -11.445) 12.064 12.793 ( 2.168 -0.000 11.831) 12.028 12.968 ( -4.815 0.000 -3.000) 5.673 14.870 ( -11.284 0.000 -13.529) 17.617 18.313 ( -38.931 0.000 45.315) 59.741 18.608 ( -2.539 0.000 -3.324) 4.183 18.815 ( 1.668 -0.000 -5.038) 5.307 19.429 ( -6.044 0.000 -1.190) 6.160 20.594 ( 6.033 -0.000 10.101) 11.766 22.894 ( 24.266 -0.000 -37.072) 44.308 23.045 ( 3.291 -0.000 1.692) 3.700 23.744 ( 1.464 -0.000 2.577) 2.964 ======================= Grid point 13 (8/361) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( 2.045 0.103 32.782) 32.846 1.652 ( 17.310 -14.601 23.434) 32.588 3.364 ( 38.470 -1.837 28.279) 47.780 3.538 ( 8.011 4.129 -1.462) 9.131 3.624 ( 0.534 2.554 -4.590) 5.280 3.981 ( 4.364 -0.491 3.035) 5.338 4.275 ( -0.132 -0.684 6.594) 6.631 4.740 ( -4.508 1.288 -8.275) 9.511 5.211 ( 0.844 7.321 -18.917) 20.302 5.350 ( -2.408 1.409 0.698) 2.876 5.374 ( -1.303 -4.555 -4.913) 6.825 5.864 ( -0.978 3.717 9.377) 10.134 6.000 ( -2.983 -8.517 2.115) 9.269 6.695 ( 7.541 16.194 -5.052) 18.564 7.108 ( -0.767 6.333 -7.962) 10.203 7.365 ( 2.511 -6.873 -9.469) 11.967 7.560 ( -12.922 -17.580 8.708) 23.492 9.049 ( 0.008 5.556 3.887) 6.781 9.349 ( -7.624 -2.083 -2.323) 8.237 9.642 ( 11.093 -0.699 -0.893) 11.150 10.256 ( -4.571 0.942 -5.166) 6.962 11.179 ( 19.908 -3.221 -7.499) 21.516 11.323 ( -8.947 11.629 16.742) 22.261 11.951 ( 3.247 -0.767 1.633) 3.714 12.162 ( 5.121 -12.866 -11.964) 18.300 12.837 ( -6.823 1.517 -4.106) 8.106 12.984 ( 2.715 -0.687 13.253) 13.545 14.503 ( -13.622 1.207 -16.721) 21.601 18.267 ( -14.881 9.011 16.937) 24.280 18.514 ( -15.736 -10.318 3.743) 19.186 18.842 ( 13.275 3.862 -6.736) 15.379 19.295 ( -8.249 0.536 -4.518) 9.420 20.830 ( 5.936 -0.526 13.831) 15.061 22.700 ( 14.361 12.773 -21.515) 28.849 23.189 ( 2.588 -13.814 -3.240) 14.423 23.787 ( -0.027 1.219 3.583) 3.784 ======================= Grid point 14 (9/361) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( 2.855 -0.727 25.738) 25.906 2.299 ( 15.469 -16.001 22.730) 31.812 3.430 ( -7.185 6.771 -3.362) 10.429 3.569 ( -1.158 6.791 -1.343) 7.019 3.991 ( 9.001 5.756 -5.736) 12.126 4.078 ( 18.380 -1.952 3.341) 18.783 4.415 ( 1.137 -2.558 10.609) 10.973 4.663 ( 7.769 -7.890 -4.852) 12.089 4.918 ( -3.972 6.259 -13.940) 15.789 5.295 ( -2.738 -0.325 -2.480) 3.709 5.371 ( -4.675 -2.152 7.610) 9.187 5.912 ( 0.075 0.426 4.729) 4.749 6.125 ( -0.513 -6.762 5.247) 8.574 6.541 ( -1.036 13.825 -5.551) 14.933 6.914 ( -1.105 11.430 -6.143) 13.023 7.344 ( 0.884 -2.153 -3.064) 3.848 7.691 ( -7.515 -24.964 3.499) 26.305 9.006 ( -1.435 9.367 1.795) 9.645 9.250 ( -5.165 -2.233 -1.898) 5.939 9.838 ( 12.327 2.328 2.510) 12.794 10.155 ( -1.315 -6.383 -4.497) 7.918 11.209 ( -3.895 19.531 4.542) 20.427 11.433 ( 12.630 -5.065 3.100) 13.957 12.022 ( 1.572 -1.904 2.170) 3.287 12.238 ( 3.457 -14.693 -7.149) 16.702 12.663 ( -6.974 2.624 -4.741) 8.832 13.206 ( 4.974 -0.436 14.142) 14.998 14.098 ( -13.227 1.392 -16.577) 21.253 18.146 ( -6.465 6.248 1.053) 9.052 18.494 ( -13.644 -11.370 9.764) 20.267 18.925 ( 16.281 7.326 -6.508) 19.003 19.098 ( -7.921 1.232 -6.453) 10.290 21.061 ( 2.991 1.245 13.197) 13.589 22.549 ( 7.934 5.220 -16.717) 19.226 23.296 ( 2.563 -9.623 -1.448) 10.063 23.805 ( -1.226 2.694 3.834) 4.843 ======================= Grid point 15 (10/361) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( 2.865 4.149 14.493) 15.345 2.876 ( 10.840 -12.535 17.693) 24.242 3.190 ( -11.082 2.694 -6.128) 12.947 3.445 ( -4.329 5.116 -1.366) 6.840 3.768 ( -6.202 9.563 -9.064) 14.563 4.271 ( 3.734 -4.278 -7.325) 9.268 4.553 ( 5.021 -3.648 -3.465) 7.108 4.741 ( -3.524 -2.470 8.036) 9.115 4.791 ( 7.039 0.475 -11.773) 13.725 5.216 ( -3.584 -3.875 -7.538) 9.203 5.516 ( -2.618 -0.704 19.028) 19.220 5.965 ( -0.675 -1.636 2.292) 2.896 6.073 ( -4.401 1.457 -9.636) 10.693 6.445 ( 0.564 5.031 7.882) 9.368 6.753 ( 0.593 10.582 -3.706) 11.228 7.344 ( -3.607 -2.310 2.110) 4.775 7.886 ( 2.015 -20.424 2.141) 20.635 8.899 ( -2.785 9.284 -0.153) 9.694 9.208 ( -1.728 -1.762 0.011) 2.468 9.855 ( -1.061 2.913 -5.182) 6.038 10.343 ( 13.201 -10.549 4.321) 17.442 10.991 ( -4.662 23.617 2.401) 24.192 11.664 ( 8.965 -1.859 1.834) 9.338 12.067 ( -0.756 -0.975 1.620) 2.036 12.311 ( -0.830 -8.010 -0.239) 8.056 12.540 ( -0.532 -1.608 -3.612) 3.990 13.421 ( 2.993 -0.254 3.008) 4.251 13.781 ( -6.528 -0.915 -4.040) 7.731 18.046 ( -2.416 2.476 -0.044) 3.460 18.525 ( -10.228 -11.970 3.531) 16.136 18.883 ( 2.074 4.229 -9.280) 10.407 19.057 ( 11.250 6.276 -0.240) 12.884 21.182 ( -1.188 4.776 8.715) 10.008 22.425 ( 0.640 -1.603 -11.213) 11.345 23.400 ( 2.986 -6.434 0.284) 7.099 23.802 ( -1.028 3.961 3.293) 5.252 ======================= Grid point 16 (11/361) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( 0.337 13.898 -0.620) 13.916 2.773 ( -15.623 6.480 -13.876) 21.877 3.286 ( 2.368 -2.231 6.678) 7.429 3.377 ( -2.956 -1.675 1.968) 3.926 3.651 ( 0.873 -7.695 3.697) 8.581 4.087 ( -18.254 -2.043 -6.154) 19.371 4.592 ( -2.258 2.565 -8.523) 9.182 4.656 ( 4.234 -3.923 -12.938) 14.167 4.844 ( -6.349 -1.056 8.609) 10.749 5.116 ( 0.338 -6.219 -6.026) 8.666 5.539 ( -3.978 4.307 -2.508) 6.377 5.924 ( 0.023 0.894 -1.430) 1.686 6.077 ( -4.814 -8.581 6.087) 11.570 6.508 ( 2.597 11.794 5.799) 13.397 6.699 ( 2.919 -0.499 2.354) 3.782 7.340 ( -5.242 -2.310 5.137) 7.695 8.139 ( 8.689 -11.371 2.289) 14.493 8.773 ( -3.521 6.243 -1.562) 7.336 9.234 ( 0.596 -3.033 2.080) 3.726 9.730 ( -4.040 -1.227 -7.018) 8.190 10.667 ( 12.446 0.664 3.448) 12.932 10.761 ( -0.800 16.588 2.858) 16.851 11.679 ( -4.463 6.468 -0.680) 7.888 12.052 ( -3.396 0.283 0.535) 3.450 12.442 ( 7.863 -6.033 4.921) 11.065 12.573 ( 1.948 -2.156 1.871) 3.457 13.233 ( -6.953 1.154 -16.197) 17.664 13.967 ( 8.077 -5.620 15.861) 18.665 18.032 ( 1.543 -0.224 -1.087) 1.901 18.472 ( -9.440 -12.029 -5.094) 16.117 18.859 ( 9.646 3.349 -3.248) 10.715 19.170 ( 11.187 6.526 2.460) 13.183 21.148 ( -5.097 7.439 2.010) 9.239 22.323 ( -7.900 -7.514 -4.349) 11.738 23.496 ( 2.849 -2.729 2.152) 4.494 23.791 ( 0.449 4.819 2.233) 5.330 ======================= Grid point 17 (12/361) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( -3.658 21.085 -10.710) 23.931 2.276 ( -16.092 13.174 -15.853) 26.150 3.348 ( -0.582 -4.838 3.133) 5.793 3.405 ( -1.803 -4.733 1.268) 5.221 3.633 ( -27.678 11.389 -12.378) 32.388 3.828 ( -0.183 -10.961 -0.749) 10.988 4.277 ( -9.288 -0.611 -14.906) 17.573 4.622 ( -6.077 -5.217 3.844) 8.884 4.925 ( -0.001 -7.174 7.361) 10.279 5.193 ( 3.293 -6.352 -0.317) 7.162 5.444 ( 0.177 -0.264 -4.692) 4.703 5.884 ( 1.283 2.852 -4.202) 5.238 6.074 ( -12.794 -7.662 1.445) 14.982 6.483 ( 3.294 11.110 3.466) 12.096 6.862 ( 3.805 -6.256 7.086) 10.189 7.388 ( -2.734 -2.155 9.317) 9.946 8.331 ( 10.001 5.483 1.346) 11.484 8.673 ( -3.555 -4.422 -4.225) 7.074 9.323 ( 1.549 -5.166 3.629) 6.501 9.624 ( -3.022 -3.414 -4.735) 6.573 10.526 ( -1.273 22.998 2.501) 23.168 10.944 ( 9.836 -4.476 -0.258) 10.810 11.490 ( -8.043 10.023 -1.448) 12.933 11.989 ( -4.812 1.006 -0.016) 4.916 12.619 ( -2.966 5.335 5.590) 8.277 12.684 ( 8.113 -5.390 4.670) 10.802 12.996 ( 1.715 -1.565 -11.169) 11.407 14.350 ( 9.857 -7.498 15.977) 20.215 17.994 ( 1.081 -5.319 -15.101) 16.047 18.465 ( -2.445 -9.450 4.792) 10.874 18.958 ( 16.901 6.961 -5.009) 18.952 19.318 ( 9.511 3.596 5.795) 11.704 20.963 ( -9.072 8.191 -4.225) 12.932 22.222 ( -17.114 -12.292 1.086) 21.099 23.588 ( 3.087 0.305 4.946) 5.838 23.782 ( 2.024 6.107 1.575) 6.624 ======================= Grid point 18 (13/361) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( -6.389 24.487 -13.957) 28.900 1.729 ( -16.054 19.102 -14.344) 28.782 2.799 ( -31.322 25.553 -25.759) 47.933 3.419 ( -4.742 -7.132 -0.182) 8.567 3.457 ( 0.530 -5.237 6.281) 8.195 3.816 ( -1.584 -4.829 -7.357) 8.942 4.084 ( -7.348 -6.269 -4.910) 10.835 4.721 ( -3.624 -7.900 10.501) 13.632 5.079 ( -3.112 -12.928 5.373) 14.342 5.266 ( -0.082 -5.362 0.616) 5.398 5.427 ( -0.422 -4.177 -1.727) 4.540 5.802 ( -0.913 2.089 -7.685) 8.016 5.981 ( -7.466 -5.741 1.688) 9.568 6.489 ( 3.903 7.485 2.102) 8.699 7.003 ( -3.312 -6.631 3.850) 8.353 7.518 ( 0.938 -1.543 10.930) 11.078 8.351 ( 7.557 21.533 5.992) 23.594 8.668 ( -0.342 -15.595 -8.545) 17.786 9.435 ( 1.204 -5.759 2.864) 6.543 9.615 ( -0.092 -5.195 0.728) 5.247 10.341 ( -3.928 16.224 1.124) 16.730 11.015 ( 1.658 1.016 -4.598) 4.993 11.278 ( -5.143 10.393 -2.628) 11.890 11.915 ( -3.944 1.035 -0.038) 4.077 12.491 ( -7.271 4.766 -2.577) 9.068 12.850 ( 3.264 -6.104 3.407) 7.715 13.103 ( 13.363 6.263 8.648) 17.105 14.734 ( 8.824 -8.457 13.833) 18.459 17.803 ( -0.377 -12.012 -29.246) 31.619 18.656 ( 4.958 -4.923 10.433) 12.556 19.078 ( 23.110 11.599 -6.936) 26.772 19.495 ( 8.724 3.069 6.211) 11.141 20.679 ( -11.678 6.186 -6.565) 14.756 22.069 ( -27.616 -16.666 2.885) 32.384 23.685 ( 1.087 -1.342 3.142) 3.586 23.798 ( 5.866 11.413 8.016) 15.130 ======================= Grid point 19 (14/361) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.944 ( -6.278 27.156 -11.589) 30.186 1.127 ( -20.903 22.059 -13.925) 33.428 1.795 ( -22.880 41.408 -24.074) 53.082 3.421 ( -3.985 -8.458 -0.154) 9.351 3.568 ( 0.366 0.698 6.861) 6.906 3.784 ( 0.961 -7.308 -4.344) 8.555 3.999 ( -8.829 -4.726 -0.816) 10.048 4.848 ( -2.242 -5.201 7.277) 9.221 5.157 ( -10.218 -16.155 -0.532) 19.122 5.342 ( 1.971 -7.151 1.615) 7.592 5.450 ( -2.465 -6.258 0.868) 6.781 5.649 ( -6.561 0.450 -5.260) 8.421 6.029 ( 2.050 -6.437 0.884) 6.813 6.493 ( 3.531 6.861 0.030) 7.716 6.946 ( -11.078 -2.498 -2.596) 11.649 7.676 ( 3.303 -0.359 7.488) 8.192 8.433 ( 11.933 20.671 20.746) 31.624 8.700 ( 1.997 -13.975 -9.725) 17.143 9.522 ( 1.417 -4.864 1.004) 5.165 9.693 ( -1.430 -6.532 2.426) 7.113 10.132 ( -11.854 5.791 -3.391) 13.622 10.865 ( -7.293 8.318 -5.538) 12.371 11.110 ( -0.365 9.139 -4.419) 10.158 11.870 ( -1.741 0.369 0.220) 1.793 12.351 ( -3.865 0.761 -2.877) 4.879 12.978 ( 2.133 -4.639 2.958) 5.900 13.406 ( 16.659 13.064 23.279) 31.466 15.062 ( 6.249 -7.760 11.088) 14.907 17.490 ( -0.523 -15.872 -44.169) 46.937 18.869 ( 5.463 -1.193 5.812) 8.065 19.263 ( 33.203 13.732 -6.521) 36.518 19.614 ( 5.965 7.167 2.495) 9.652 20.432 ( -8.875 0.851 -2.792) 9.343 21.789 ( -41.373 -19.424 1.901) 45.745 23.694 ( -0.588 -0.245 -1.020) 1.203 23.974 ( 9.455 11.348 18.681) 23.815 ======================= Grid point 20 (15/361) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.513 ( 0.000 28.712 0.000) 28.712 0.555 ( 0.000 31.013 0.000) 31.013 1.015 ( 0.000 56.267 0.000) 56.267 3.459 ( -0.000 -6.849 -0.000) 6.849 3.616 ( 0.000 1.701 0.000) 1.701 3.837 ( -0.000 -6.959 -0.000) 6.959 3.927 ( -0.000 -1.364 -0.000) 1.364 4.985 ( -0.000 -5.603 -0.000) 5.603 5.022 ( -0.000 -4.536 -0.000) 4.536 5.471 ( -0.000 -7.459 -0.000) 7.459 5.474 ( -0.000 -5.284 -0.000) 5.284 5.541 ( 0.000 1.453 0.000) 1.453 6.108 ( -0.000 -6.179 -0.000) 6.179 6.442 ( 0.000 9.797 0.000) 9.797 6.807 ( 0.000 0.782 0.000) 0.782 7.755 ( -0.000 -0.018 -0.000) 0.018 8.753 ( -0.000 -11.488 -0.000) 11.488 8.786 ( 0.000 0.678 0.000) 0.678 9.588 ( -0.000 -1.847 -0.000) 1.847 9.704 ( -0.000 -14.757 -0.000) 14.757 9.807 ( 0.000 17.917 0.000) 17.917 10.634 ( 0.000 14.465 0.000) 14.465 11.005 ( 0.000 7.438 0.000) 7.438 11.860 ( 0.000 0.029 0.000) 0.029 12.305 ( -0.000 -0.204 -0.000) 0.204 13.046 ( -0.000 -3.166 -0.000) 3.166 13.813 ( -0.000 -3.221 -0.000) 3.221 15.300 ( -0.000 -8.896 -0.000) 8.896 17.082 ( 0.000 1.081 0.000) 1.081 18.941 ( 0.000 0.497 0.000) 0.497 19.537 ( 0.000 2.230 0.000) 2.230 19.587 ( 0.000 7.766 0.000) 7.766 20.372 ( -0.000 -1.354 -0.000) 1.354 21.408 ( -0.000 -2.759 -0.000) 2.759 23.680 ( 0.000 0.282 0.000) 0.282 24.212 ( -0.000 -0.407 -0.000) 0.407 ======================= Grid point 23 (16/361) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -2.601 0.000 35.679) 35.774 2.119 ( 21.531 -0.000 19.075) 28.765 3.506 ( -9.220 0.000 -5.068) 10.521 3.640 ( -0.215 0.000 1.834) 1.846 4.026 ( 1.491 -0.000 -3.709) 3.998 4.058 ( 31.706 -0.000 -2.136) 31.778 4.421 ( 3.510 -0.000 19.250) 19.567 4.559 ( -4.616 0.000 -8.463) 9.640 4.990 ( 0.959 -0.000 -22.397) 22.417 5.257 ( -3.333 0.000 -4.361) 5.489 5.373 ( -4.974 0.000 10.093) 11.252 5.918 ( -1.996 0.000 3.012) 3.613 6.062 ( 2.523 -0.000 9.865) 10.183 6.677 ( -5.944 0.000 -9.913) 11.559 7.184 ( 8.686 -0.000 0.397) 8.695 7.228 ( 2.286 -0.000 -8.541) 8.842 7.380 ( -16.115 0.000 8.632) 18.281 9.108 ( -0.860 0.000 2.584) 2.723 9.211 ( -6.741 0.000 -2.023) 7.038 9.858 ( 17.446 -0.000 3.554) 17.804 10.103 ( -5.833 0.000 -7.636) 9.609 11.380 ( 19.562 -0.000 -3.057) 19.799 11.460 ( -10.401 0.000 17.997) 20.786 11.955 ( -0.025 0.000 -3.669) 3.669 12.086 ( 9.127 -0.000 -6.921) 11.455 12.688 ( -7.943 0.000 -4.478) 9.118 13.202 ( 4.859 -0.000 13.866) 14.693 14.109 ( -13.997 0.000 -16.656) 21.756 18.256 ( -10.721 0.000 -2.528) 11.015 18.336 ( -8.897 0.000 11.192) 14.298 18.994 ( 17.174 -0.000 -7.036) 18.560 19.111 ( -9.096 0.000 -5.978) 10.885 21.078 ( 2.666 -0.000 16.538) 16.752 22.604 ( 6.694 -0.000 -23.391) 24.330 23.195 ( 4.416 -0.000 2.060) 4.873 23.831 ( -1.185 0.000 4.138) 4.304 ======================= Grid point 24 (17/361) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( 0.529 4.539 26.416) 26.809 2.662 ( 16.901 -8.747 17.969) 26.174 3.244 ( -14.954 2.232 -7.307) 16.793 3.550 ( -7.187 5.027 -2.293) 9.066 3.888 ( -10.408 2.372 -7.370) 12.972 4.207 ( 8.568 -1.586 -17.033) 19.132 4.480 ( 5.776 -2.642 -5.952) 8.705 4.675 ( -1.513 -3.686 9.931) 10.701 4.830 ( 7.477 2.452 -11.156) 13.653 5.147 ( -5.131 -2.801 -6.616) 8.829 5.508 ( -3.146 -0.189 21.226) 21.459 5.945 ( -0.116 -0.621 2.172) 2.262 6.090 ( -4.571 0.446 -7.974) 9.202 6.517 ( -2.876 2.328 4.211) 5.605 7.021 ( -2.752 17.469 -1.333) 17.734 7.305 ( -4.926 -1.461 3.310) 6.112 7.490 ( 6.167 -21.345 3.663) 22.518 9.052 ( -3.894 7.338 0.187) 8.310 9.155 ( -3.242 -4.305 0.264) 5.396 9.911 ( -3.718 2.522 -8.909) 9.977 10.206 ( 18.831 -4.500 5.757) 20.199 11.411 ( -4.218 20.271 8.076) 22.224 11.636 ( 12.929 -0.834 4.023) 13.566 11.979 ( -2.047 -11.036 1.294) 11.299 12.152 ( 6.601 -4.607 -4.935) 9.442 12.533 ( -5.261 0.244 -3.695) 6.434 13.416 ( 4.459 -0.175 4.943) 6.660 13.766 ( -10.082 -0.532 -6.657) 12.093 18.103 ( -5.725 3.115 0.612) 6.546 18.349 ( -5.578 -6.652 -0.003) 8.681 18.931 ( -5.358 1.391 -3.766) 6.695 19.144 ( 17.477 2.656 -6.552) 18.852 21.268 ( -1.850 3.475 15.409) 15.904 22.393 ( 0.831 -1.379 -20.343) 20.407 23.304 ( 4.732 -3.254 2.422) 6.233 23.856 ( -1.203 1.702 4.160) 4.653 ======================= Grid point 25 (18/361) ======================= q-point: (-0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.352 ( 2.198 11.832 10.104) 15.713 2.842 ( -16.214 1.983 -8.698) 18.506 3.187 ( 7.736 -7.612 13.980) 17.698 3.378 ( -7.247 1.430 -0.426) 7.398 3.607 ( -10.816 1.080 -6.844) 12.845 4.021 ( -10.981 -4.496 -10.811) 16.052 4.526 ( 5.467 -5.087 -7.370) 10.492 4.712 ( 0.490 5.504 -15.260) 16.230 4.800 ( -3.737 -2.644 8.276) 9.457 5.022 ( -3.009 -4.578 -6.010) 8.132 5.602 ( -9.284 2.615 1.820) 9.816 5.929 ( -1.123 -0.840 1.691) 2.197 5.971 ( -2.561 -2.908 0.434) 3.899 6.614 ( 3.395 1.287 9.197) 9.887 6.824 ( -4.275 12.050 -0.373) 12.792 7.306 ( -3.213 -0.373 5.041) 5.990 7.830 ( 9.031 -19.560 3.624) 21.847 8.926 ( -4.278 8.610 0.543) 9.629 9.165 ( -2.168 -4.634 1.051) 5.223 9.734 ( -2.626 1.106 -10.068) 10.464 10.581 ( 18.223 -3.945 5.833) 19.536 11.228 ( -1.960 27.759 5.687) 28.403 11.768 ( 1.193 3.446 0.354) 3.664 12.039 ( -4.520 -3.049 3.145) 6.295 12.270 ( 5.338 -12.081 0.802) 13.232 12.522 ( 6.291 -2.572 0.733) 6.836 13.254 ( -7.808 0.971 -16.837) 18.585 13.874 ( 5.611 -4.269 15.365) 16.905 18.053 ( -0.334 2.585 -0.169) 2.612 18.279 ( -6.966 -9.313 -6.138) 13.150 18.899 ( 3.958 1.454 2.429) 4.865 19.274 ( 16.103 4.255 -5.435) 17.520 21.308 ( -6.293 9.453 9.600) 14.870 22.182 ( -6.242 -7.781 -14.828) 17.870 23.431 ( 4.442 -3.380 2.767) 6.230 23.873 ( 0.279 3.569 3.882) 5.281 ======================= Grid point 26 (19/361) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.234 ( -0.598 20.469 -6.716) 21.551 2.449 ( -17.474 6.958 -8.870) 20.795 3.243 ( -9.050 -5.576 1.755) 10.774 3.380 ( -4.278 0.167 0.771) 4.350 3.599 ( 2.489 -12.873 0.712) 13.131 3.784 ( -15.808 2.412 0.837) 16.013 4.328 ( -9.677 8.174 -21.990) 25.378 4.525 ( -0.884 -4.789 -5.220) 7.139 4.810 ( -8.690 -5.670 8.002) 13.103 5.069 ( 3.184 -7.836 -1.063) 8.525 5.435 ( -4.433 -0.668 -6.743) 8.097 5.925 ( 1.620 1.372 -5.375) 5.779 5.974 ( -9.727 -3.478 6.727) 12.327 6.679 ( -2.407 9.855 3.849) 10.850 6.784 ( 4.564 -2.188 5.135) 7.210 7.353 ( -1.764 -0.890 8.285) 8.517 8.141 ( 8.461 -17.909 -0.924) 19.828 8.797 ( -3.991 10.636 1.876) 11.514 9.208 ( -1.901 -7.021 2.349) 7.644 9.591 ( -0.347 -0.204 -8.885) 8.894 10.890 ( 14.298 -1.778 2.522) 14.628 11.017 ( -0.461 30.122 4.917) 30.525 11.650 ( -6.808 7.618 -1.739) 10.364 12.001 ( -5.392 0.140 1.044) 5.494 12.486 ( 3.051 -13.236 4.248) 14.232 12.721 ( 8.722 2.147 5.430) 10.496 12.956 ( -2.098 -2.122 -13.952) 14.267 14.209 ( 7.798 -7.646 14.582) 18.219 17.921 ( -3.975 -2.945 -17.073) 17.776 18.326 ( 1.472 -5.856 9.883) 11.581 19.040 ( 13.028 2.836 2.797) 13.623 19.394 ( 13.880 3.994 -2.550) 14.666 21.150 ( -10.110 12.627 -0.049) 16.176 22.002 ( -14.716 -12.668 -6.729) 20.550 23.550 ( 3.689 -2.810 3.025) 5.537 23.898 ( 2.617 5.532 3.938) 7.277 ======================= Grid point 27 (20/361) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( -4.357 23.810 -13.496) 27.713 2.024 ( -16.875 15.184 -7.088) 23.781 3.212 ( -11.190 -4.279 -1.079) 12.028 3.254 ( -19.995 5.530 -2.157) 20.858 3.441 ( 3.446 8.632 -7.158) 11.731 3.722 ( 0.842 -5.032 -3.941) 6.447 3.975 ( -8.229 -4.369 -8.681) 12.734 4.569 ( -4.235 -8.475 8.986) 13.058 4.862 ( -7.426 -11.115 5.307) 14.383 5.153 ( 0.477 -7.984 -1.537) 8.144 5.334 ( -2.905 -5.765 -6.834) 9.401 5.823 ( -6.337 0.610 -4.536) 7.817 5.940 ( -0.630 0.184 0.047) 0.658 6.633 ( 1.297 7.661 2.539) 8.174 6.909 ( -0.346 -3.416 4.493) 5.655 7.475 ( 0.275 -2.913 10.502) 10.902 8.342 ( 5.617 -17.026 -7.956) 19.614 8.686 ( -1.739 13.430 5.705) 14.695 9.287 ( -2.472 -9.870 2.896) 10.579 9.528 ( 1.780 -2.832 -5.562) 6.491 10.790 ( -0.490 30.964 3.488) 31.164 11.051 ( 7.827 2.250 -1.684) 8.316 11.456 ( -6.107 9.074 -2.155) 11.148 11.931 ( -4.824 0.612 0.295) 4.871 12.559 ( -8.067 2.903 -7.149) 11.164 12.700 ( 2.770 -10.853 2.055) 11.388 13.143 ( 15.523 -0.912 9.546) 18.246 14.555 ( 6.909 -10.892 11.843) 17.511 17.647 ( -5.634 -5.941 -23.072) 24.482 18.587 ( 7.233 -2.879 14.275) 16.260 19.241 ( 20.671 7.091 -1.805) 21.927 19.548 ( 11.929 2.390 3.468) 12.651 20.831 ( -13.548 10.924 -6.632) 18.624 21.808 ( -23.118 -13.557 -2.272) 26.897 23.647 ( 2.009 -2.272 2.076) 3.676 23.956 ( 5.543 6.450 6.054) 10.439 ======================= Grid point 28 (21/361) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( -6.290 25.260 -10.489) 28.065 1.518 ( -16.331 23.304 -9.020) 29.852 2.571 ( -13.289 43.151 -10.088) 46.264 3.226 ( -5.760 -13.102 -1.253) 14.367 3.527 ( 3.755 -7.778 3.400) 9.282 3.687 ( -0.257 -0.910 -4.381) 4.482 3.894 ( -5.646 -6.799 -1.447) 8.956 4.720 ( -4.293 -8.542 11.403) 14.880 4.902 ( -6.569 -12.661 -0.579) 14.275 5.201 ( -0.605 -8.467 -0.706) 8.518 5.297 ( -2.472 -10.716 -4.999) 12.081 5.670 ( -5.671 1.708 -3.574) 6.917 5.970 ( 3.922 -1.378 -0.553) 4.193 6.624 ( 3.188 6.982 1.154) 7.762 6.914 ( -6.279 -0.746 0.834) 6.378 7.640 ( 1.768 -3.706 8.119) 9.098 8.418 ( 0.307 -15.674 -8.278) 17.728 8.699 ( 5.685 10.510 10.297) 15.774 9.368 ( -3.252 -12.105 0.392) 12.540 9.536 ( 0.410 -5.215 -3.015) 6.038 10.530 ( -1.465 31.048 1.090) 31.102 11.026 ( 0.774 8.580 -3.521) 9.307 11.284 ( -2.629 9.648 -2.101) 10.218 11.876 ( -2.549 0.242 0.154) 2.566 12.366 ( -4.465 0.974 -5.210) 6.930 12.859 ( 1.736 -8.961 2.730) 9.527 13.489 ( 12.490 -0.753 13.227) 18.208 14.865 ( 4.417 -13.384 8.152) 16.282 17.331 ( -5.058 -4.257 -23.695) 24.600 18.854 ( 6.095 -0.455 9.591) 11.373 19.448 ( 24.062 8.205 -3.917) 25.723 19.742 ( 10.653 6.367 6.334) 13.933 20.477 ( -13.346 4.636 -6.152) 15.409 21.537 ( -27.161 -11.226 -1.864) 29.449 23.686 ( 0.205 -0.575 0.155) 0.630 24.089 ( 6.576 3.481 8.221) 11.088 ======================= Grid point 29 (22/361) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.015 ( 0.000 27.681 0.000) 27.681 1.096 ( 0.000 29.937 0.000) 29.937 1.980 ( 0.000 52.017 0.000) 52.017 3.289 ( -0.000 -11.984 -0.000) 11.984 3.657 ( 0.000 2.862 0.000) 2.862 3.674 ( -0.000 -11.276 -0.000) 11.276 3.875 ( -0.000 -4.478 -0.000) 4.478 4.860 ( -0.000 -7.868 -0.000) 7.868 4.900 ( -0.000 -8.950 -0.000) 8.950 5.296 ( -0.000 -11.189 -0.000) 11.189 5.335 ( -0.000 -10.314 -0.000) 10.314 5.582 ( 0.000 2.783 0.000) 2.783 6.025 ( -0.000 -3.372 -0.000) 3.372 6.601 ( 0.000 7.753 0.000) 7.753 6.832 ( 0.000 2.204 0.000) 2.204 7.738 ( -0.000 -2.386 -0.000) 2.386 8.500 ( -0.000 -15.653 -0.000) 15.653 8.813 ( 0.000 2.434 0.000) 2.434 9.438 ( -0.000 -14.127 -0.000) 14.127 9.544 ( -0.000 -2.870 -0.000) 2.870 10.242 ( 0.000 30.010 0.000) 30.010 10.892 ( 0.000 13.546 0.000) 13.546 11.166 ( 0.000 9.858 0.000) 9.858 11.860 ( -0.000 -0.039 -0.000) 0.039 12.301 ( -0.000 -0.083 -0.000) 0.083 12.959 ( -0.000 -6.815 -0.000) 6.815 13.734 ( -0.000 -5.515 -0.000) 5.515 15.085 ( -0.000 -14.599 -0.000) 14.599 17.108 ( 0.000 1.767 0.000) 1.767 18.953 ( 0.000 0.800 0.000) 0.800 19.593 ( 0.000 3.956 0.000) 3.956 19.775 ( 0.000 12.853 0.000) 12.853 20.337 ( -0.000 -2.542 -0.000) 2.542 21.337 ( -0.000 -5.129 -0.000) 5.129 23.685 ( 0.000 0.290 0.000) 0.290 24.203 ( -0.000 -0.621 -0.000) 0.621 ======================= Grid point 34 (23/361) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( 0.793 -0.000 16.542) 16.560 2.854 ( -13.429 0.000 -6.503) 14.921 3.105 ( 9.955 -0.000 12.194) 15.742 3.402 ( -11.155 0.000 -3.562) 11.710 3.619 ( -16.106 0.000 -6.468) 17.356 3.974 ( -6.732 0.000 -15.338) 16.750 4.476 ( 5.907 -0.000 -6.653) 8.896 4.746 ( -4.579 0.000 1.070) 4.702 4.806 ( 5.810 -0.000 -4.877) 7.586 4.967 ( -6.380 0.000 -7.617) 9.936 5.626 ( -10.843 0.000 4.573) 11.768 5.910 ( -5.086 0.000 1.367) 5.267 5.957 ( 1.662 -0.000 -1.750) 2.414 6.624 ( 3.433 -0.000 7.918) 8.631 6.958 ( -14.191 0.000 2.504) 14.411 7.339 ( 4.680 -0.000 0.009) 4.680 7.589 ( 9.500 -0.000 7.921) 12.369 9.038 ( -4.525 0.000 0.775) 4.591 9.088 ( -3.282 0.000 0.896) 3.402 9.747 ( -2.381 0.000 -10.974) 11.229 10.545 ( 19.790 -0.000 6.251) 20.754 11.583 ( -3.510 0.000 9.983) 10.582 11.813 ( 1.936 -0.000 4.378) 4.787 11.900 ( -0.010 0.000 1.056) 1.056 12.155 ( 4.723 -0.000 -5.136) 6.978 12.499 ( 5.743 -0.000 1.092) 5.846 13.263 ( -8.004 0.000 -17.025) 18.813 13.833 ( 4.699 -0.000 15.151) 15.863 18.105 ( -1.286 0.000 6.634) 6.758 18.167 ( -5.428 0.000 -13.053) 14.137 18.912 ( 1.663 -0.000 4.595) 4.887 19.312 ( 17.544 -0.000 -8.101) 19.324 21.412 ( -7.168 0.000 15.094) 16.710 22.097 ( -5.019 0.000 -21.729) 22.301 23.398 ( 5.036 -0.000 3.433) 6.095 23.906 ( 0.229 -0.000 4.167) 4.173 ======================= Grid point 35 (24/361) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.515 ( -8.539 6.807 -6.864) 12.898 2.547 ( -6.531 6.218 -1.305) 9.112 3.185 ( -12.144 -0.291 -2.708) 12.445 3.315 ( -12.066 -7.942 -6.773) 15.954 3.464 ( 7.581 -0.966 9.900) 12.507 3.758 ( -12.728 -2.463 1.961) 13.112 4.431 ( -2.527 -0.584 -8.564) 8.948 4.562 ( -0.950 8.533 -16.042) 18.195 4.752 ( -11.291 1.500 4.953) 12.421 4.902 ( -0.843 -10.957 -3.331) 11.483 5.424 ( -8.477 -0.404 -7.139) 11.089 5.923 ( -7.650 -0.693 6.332) 9.955 5.952 ( 2.432 0.032 -2.891) 3.778 6.769 ( 4.205 0.573 6.781) 7.999 6.807 ( -8.974 3.194 3.863) 10.279 7.380 ( 2.802 3.262 1.667) 4.612 7.852 ( 7.954 -11.613 3.860) 14.595 8.956 ( -4.034 7.105 2.488) 8.541 9.090 ( -3.411 -6.027 1.606) 7.109 9.599 ( 0.403 0.522 -10.693) 10.714 10.867 ( 16.336 -0.654 3.890) 16.806 11.531 ( -0.663 24.223 7.603) 25.397 11.752 ( -6.892 4.322 -0.917) 8.187 11.971 ( -5.862 -5.530 4.406) 9.185 12.218 ( 5.169 -13.340 -2.322) 14.494 12.730 ( 16.132 -0.323 7.422) 17.761 12.936 ( -8.181 -0.294 -16.487) 18.408 14.107 ( 6.640 -3.206 13.476) 15.361 17.888 ( -6.799 -0.907 -18.089) 19.346 18.258 ( 4.561 -1.882 12.800) 13.719 19.072 ( 9.651 0.921 8.591) 12.953 19.441 ( 16.212 1.270 -8.020) 18.132 21.381 ( -11.741 11.276 7.096) 17.758 21.782 ( -11.515 -10.675 -16.672) 22.902 23.512 ( 4.280 -1.200 3.426) 5.612 23.964 ( 2.478 1.892 3.960) 5.040 ======================= Grid point 36 (25/361) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.195 ( -10.154 12.383 -8.045) 17.921 2.321 ( -4.882 17.734 -7.110) 19.720 3.018 ( -11.105 -9.809 -3.960) 15.337 3.175 ( -8.716 -10.517 -2.750) 13.933 3.657 ( 3.378 -0.397 6.116) 6.998 3.673 ( -11.600 2.242 5.866) 13.190 4.066 ( -5.002 16.825 -20.146) 26.720 4.448 ( -1.655 -4.161 2.067) 4.932 4.699 ( -11.565 -6.587 7.725) 15.389 4.955 ( -1.665 -14.346 -4.174) 15.034 5.254 ( -5.430 -2.803 -8.602) 10.551 5.837 ( -8.724 1.005 -0.038) 8.782 5.948 ( 2.648 0.255 -3.128) 4.106 6.735 ( -4.049 3.471 4.639) 7.068 6.893 ( 3.699 1.389 4.291) 5.833 7.431 ( 0.841 -1.661 4.767) 5.118 8.063 ( 5.274 -12.965 -2.931) 14.300 8.879 ( -2.873 8.473 4.737) 10.124 9.129 ( -3.272 -7.527 2.244) 8.509 9.503 ( 2.613 -0.472 -8.360) 8.772 11.082 ( 10.596 1.181 0.560) 10.676 11.361 ( 0.399 31.452 5.797) 31.984 11.586 ( -6.744 5.395 -2.267) 8.928 11.935 ( -5.463 -0.263 0.842) 5.533 12.432 ( 2.611 -17.653 3.106) 18.114 12.614 ( -7.673 1.618 -13.141) 15.303 13.106 ( 16.628 -2.329 9.529) 19.306 14.382 ( 5.691 -7.609 9.846) 13.683 17.578 ( -7.186 -2.171 -18.933) 20.367 18.551 ( 8.631 -1.229 16.533) 18.691 19.340 ( 16.700 4.105 7.254) 18.664 19.570 ( 14.599 0.143 -3.417) 14.994 21.056 ( -14.290 13.948 -8.672) 21.771 21.570 ( -18.989 -13.597 -4.476) 23.780 23.613 ( 2.888 -1.447 2.752) 4.243 24.037 ( 4.362 2.901 3.962) 6.568 ======================= Grid point 37 (26/361) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( -8.360 20.493 -6.976) 23.206 1.954 ( -6.591 24.350 -7.615) 26.351 2.970 ( -6.468 -15.257 -2.570) 16.770 3.168 ( -7.190 7.553 7.633) 12.922 3.410 ( -3.954 9.889 -9.682) 14.393 3.736 ( 3.364 5.042 0.371) 6.072 3.782 ( -2.872 -3.274 -5.464) 6.987 4.565 ( -3.256 -8.327 11.110) 14.260 4.710 ( -6.967 -8.832 3.393) 11.749 5.010 ( -1.973 -14.706 -3.387) 15.219 5.120 ( -3.763 -6.959 -8.695) 11.756 5.702 ( -5.718 1.625 -2.168) 6.327 5.958 ( 3.112 -0.279 -1.930) 3.673 6.722 ( 0.406 3.671 1.908) 4.157 6.934 ( -0.980 3.271 2.537) 4.254 7.547 ( 0.635 -6.567 5.592) 8.649 8.165 ( 2.250 -11.945 -6.089) 13.595 8.856 ( 0.219 7.397 6.602) 9.918 9.175 ( -3.344 -8.795 0.562) 9.426 9.477 ( 2.527 -2.332 -4.592) 5.737 11.123 ( -0.214 32.894 3.547) 33.085 11.151 ( 4.342 6.736 -1.833) 8.221 11.434 ( -3.281 6.901 -1.954) 7.887 11.877 ( -3.195 -0.107 0.085) 3.198 12.385 ( -4.830 1.093 -7.080) 8.640 12.647 ( 1.486 -15.354 2.416) 15.614 13.442 ( 10.955 -3.470 8.671) 14.395 14.628 ( 3.340 -12.114 5.721) 13.807 17.293 ( -5.414 -0.770 -14.871) 15.845 18.851 ( 6.498 0.008 11.945) 13.598 19.576 ( 18.762 6.451 -1.957) 19.937 19.813 ( 14.649 1.279 10.110) 17.845 20.601 ( -16.183 8.976 -12.552) 22.361 21.353 ( -20.206 -9.863 -2.351) 22.607 23.675 ( 1.080 -0.665 1.190) 1.739 24.129 ( 4.344 1.400 3.856) 5.975 ======================= Grid point 38 (27/361) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( 0.000 25.604 0.000) 25.604 1.612 ( 0.000 27.936 0.000) 27.936 2.839 ( 0.000 43.867 0.000) 43.867 3.045 ( -0.000 -15.231 -0.000) 15.231 3.439 ( -0.000 -15.247 -0.000) 15.247 3.717 ( 0.000 4.163 0.000) 4.163 3.779 ( -0.000 -5.737 -0.000) 5.737 4.723 ( -0.000 -10.312 -0.000) 10.312 4.726 ( -0.000 -6.913 -0.000) 6.913 5.104 ( -0.000 -9.736 -0.000) 9.736 5.111 ( -0.000 -14.930 -0.000) 14.930 5.628 ( 0.000 2.199 0.000) 2.199 5.982 ( -0.000 -1.627 -0.000) 1.627 6.709 ( 0.000 4.270 0.000) 4.270 6.891 ( 0.000 4.640 0.000) 4.640 7.657 ( -0.000 -6.901 -0.000) 6.901 8.240 ( -0.000 -12.753 -0.000) 12.753 8.873 ( 0.000 4.218 0.000) 4.218 9.222 ( -0.000 -9.929 -0.000) 9.929 9.492 ( -0.000 -2.932 -0.000) 2.932 10.831 ( 0.000 35.173 0.000) 35.173 11.095 ( 0.000 9.152 0.000) 9.152 11.332 ( 0.000 8.329 0.000) 8.329 11.857 ( -0.000 -0.252 -0.000) 0.252 12.303 ( 0.000 0.285 0.000) 0.285 12.795 ( -0.000 -12.066 -0.000) 12.066 13.629 ( -0.000 -5.858 -0.000) 5.858 14.813 ( -0.000 -15.104 -0.000) 15.104 17.140 ( 0.000 1.788 0.000) 1.788 18.968 ( 0.000 0.795 0.000) 0.795 19.671 ( 0.000 4.641 0.000) 4.641 20.020 ( 0.000 14.059 0.000) 14.059 20.284 ( -0.000 -3.230 -0.000) 3.230 21.231 ( -0.000 -6.668 -0.000) 6.668 23.689 ( 0.000 0.069 0.000) 0.069 24.192 ( -0.000 -0.563 -0.000) 0.563 ======================= Grid point 45 (28/361) ======================= q-point: ( 0.40 -0.60 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.316 ( -10.221 0.000 -0.974) 10.267 2.513 ( 0.818 -0.000 -11.219) 11.249 2.932 ( -12.984 0.000 -8.002) 15.252 3.030 ( -10.341 0.000 -4.258) 11.183 3.648 ( 4.192 -0.000 4.654) 6.264 3.672 ( -11.663 0.000 11.965) 16.709 4.276 ( -5.856 0.000 -5.965) 8.359 4.451 ( 0.248 -0.000 -9.252) 9.255 4.666 ( -1.685 0.000 -8.404) 8.571 4.727 ( -14.271 0.000 8.917) 16.827 5.230 ( -5.949 0.000 -8.772) 10.599 5.849 ( -10.103 0.000 2.089) 10.317 5.949 ( 4.358 -0.000 -4.875) 6.539 6.763 ( -7.087 0.000 6.236) 9.440 6.916 ( 5.527 -0.000 5.058) 7.492 7.419 ( 1.716 -0.000 -2.075) 2.693 7.936 ( 5.226 -0.000 2.124) 5.641 8.985 ( -3.101 0.000 3.185) 4.445 9.031 ( -3.178 0.000 3.077) 4.423 9.500 ( 2.401 -0.000 -9.252) 9.558 11.092 ( 11.479 -0.000 1.292) 11.552 11.630 ( -4.921 0.000 -3.474) 6.024 11.781 ( -3.870 0.000 10.906) 11.572 11.904 ( -5.537 0.000 3.649) 6.631 12.170 ( 5.291 -0.000 -3.860) 6.550 12.630 ( -7.929 0.000 -13.877) 15.982 13.083 ( 16.997 -0.000 9.741) 19.590 14.311 ( 5.284 -0.000 9.066) 10.493 17.560 ( -7.491 0.000 -17.580) 19.110 18.541 ( 9.078 -0.000 17.276) 19.516 19.379 ( 14.569 -0.000 13.263) 19.702 19.567 ( 15.992 -0.000 -8.516) 18.118 21.282 ( -14.569 0.000 -22.554) 26.850 21.350 ( -17.281 0.000 7.702) 18.920 23.600 ( 3.198 -0.000 3.043) 4.414 24.063 ( 3.882 -0.000 3.302) 5.096 ======================= Grid point 47 (29/361) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( -5.862 13.356 -2.099) 14.736 2.321 ( -1.758 13.950 -8.445) 16.402 2.724 ( -8.139 -9.845 -4.989) 13.713 2.986 ( -2.353 -12.323 1.686) 12.658 3.631 ( -6.004 5.055 1.524) 7.995 3.690 ( -3.773 -3.210 2.329) 5.474 4.059 ( 0.380 21.928 -5.856) 22.699 4.443 ( 0.159 -5.482 4.831) 7.309 4.586 ( -4.488 -6.003 -0.238) 7.499 4.727 ( -7.151 -13.008 2.657) 15.080 5.046 ( -4.591 -1.959 -9.911) 11.097 5.723 ( -6.346 0.658 -1.703) 6.603 5.955 ( 2.912 -0.100 -2.771) 4.021 6.757 ( -2.820 0.645 4.081) 5.002 7.013 ( 3.172 4.114 2.694) 5.852 7.431 ( 0.406 -5.045 -0.375) 5.075 8.017 ( 2.357 -4.295 -1.002) 5.001 8.962 ( -1.413 4.325 3.640) 5.827 9.059 ( -2.219 -4.341 2.080) 5.301 9.447 ( 2.349 -0.943 -5.709) 6.245 11.209 ( 5.320 1.656 -0.090) 5.573 11.520 ( -3.638 2.531 -1.953) 4.844 11.698 ( -0.147 27.486 5.061) 27.948 11.874 ( -3.466 -0.255 0.245) 3.484 12.317 ( 2.231 -19.992 0.367) 20.119 12.400 ( -5.138 0.448 -7.851) 9.393 13.393 ( 10.574 -1.583 7.187) 12.883 14.471 ( 2.899 -4.828 4.553) 7.242 17.288 ( -5.306 -0.018 -11.682) 12.831 18.852 ( 6.662 0.055 13.048) 14.651 19.675 ( 15.307 4.116 -3.259) 16.182 19.799 ( 16.789 -1.907 14.462) 22.241 20.758 ( -17.048 6.722 -19.745) 26.939 21.198 ( -16.710 -6.314 1.076) 17.896 23.665 ( 1.618 -0.300 1.778) 2.423 24.144 ( 3.182 0.413 2.151) 3.863 ======================= Grid point 48 (30/361) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.912 ( 0.000 21.418 0.000) 21.418 2.073 ( 0.000 23.030 0.000) 23.030 2.763 ( -0.000 -15.794 -0.000) 15.794 3.141 ( -0.000 -17.403 -0.000) 17.403 3.460 ( 0.000 21.619 0.000) 21.619 3.693 ( -0.000 -3.576 -0.000) 3.576 3.860 ( 0.000 15.851 0.000) 15.851 4.560 ( -0.000 -7.227 -0.000) 7.227 4.613 ( -0.000 -6.876 -0.000) 6.876 4.818 ( -0.000 -16.583 -0.000) 16.583 4.968 ( -0.000 -5.334 -0.000) 5.334 5.656 ( 0.000 1.018 0.000) 1.018 5.963 ( -0.000 -0.613 -0.000) 0.613 6.756 ( 0.000 1.286 0.000) 1.286 6.996 ( 0.000 6.748 0.000) 6.748 7.506 ( -0.000 -9.274 -0.000) 9.274 8.068 ( -0.000 -6.418 -0.000) 6.418 8.950 ( 0.000 3.861 0.000) 3.861 9.089 ( -0.000 -5.000 -0.000) 5.000 9.444 ( -0.000 -2.221 -0.000) 2.221 11.215 ( 0.000 4.389 0.000) 4.389 11.450 ( 0.000 4.731 0.000) 4.731 11.451 ( 0.000 33.561 0.000) 33.561 11.851 ( -0.000 -0.365 -0.000) 0.365 12.310 ( 0.000 0.389 0.000) 0.389 12.518 ( -0.000 -19.243 -0.000) 19.243 13.541 ( -0.000 -3.696 -0.000) 3.696 14.585 ( -0.000 -9.651 -0.000) 9.651 17.167 ( 0.000 1.115 0.000) 1.115 18.979 ( 0.000 0.488 0.000) 0.488 19.747 ( 0.000 3.524 0.000) 3.524 20.229 ( -0.000 -2.654 -0.000) 2.654 20.246 ( 0.000 10.436 0.000) 10.436 21.113 ( -0.000 -5.985 -0.000) 5.985 23.688 ( -0.000 -0.076 -0.000) 0.076 24.184 ( -0.000 -0.314 -0.000) 0.314 ======================= Grid point 58 (31/361) ======================= q-point: (-0.50 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( -0.000 -0.000 -0.000) 0.000 2.319 ( 0.000 0.000 0.000) 0.000 2.575 ( -0.000 -0.000 -0.000) 0.000 2.930 ( -0.000 -0.000 -0.000) 0.000 3.607 ( -0.000 -0.000 -0.000) 0.000 3.661 ( -0.000 -0.000 -0.000) 0.000 4.176 ( 0.000 0.000 0.000) 0.000 4.427 ( -0.000 -0.000 -0.000) 0.000 4.492 ( -0.000 -0.000 -0.000) 0.000 4.668 ( -0.000 -0.000 -0.000) 0.000 4.920 ( -0.000 -0.000 -0.000) 0.000 5.665 ( -0.000 -0.000 -0.000) 0.000 5.958 ( -0.000 -0.000 -0.000) 0.000 6.765 ( -0.000 -0.000 -0.000) 0.000 7.080 ( -0.000 -0.000 -0.000) 0.000 7.396 ( -0.000 -0.000 -0.000) 0.000 8.012 ( -0.000 -0.000 -0.000) 0.000 8.988 ( -0.000 -0.000 -0.000) 0.000 9.045 ( -0.000 -0.000 -0.000) 0.000 9.422 ( -0.000 -0.000 -0.000) 0.000 11.254 ( -0.000 -0.000 -0.000) 0.000 11.493 ( -0.000 -0.000 -0.000) 0.000 11.847 ( -0.000 -0.000 -0.000) 0.000 11.891 ( -0.000 -0.000 -0.000) 0.000 12.210 ( -0.000 -0.000 -0.000) 0.000 12.314 ( -0.000 -0.000 -0.000) 0.000 13.507 ( -0.000 -0.000 -0.000) 0.000 14.496 ( -0.000 -0.000 -0.000) 0.000 17.177 ( -0.000 -0.000 -0.000) 0.000 18.984 ( -0.000 -0.000 -0.000) 0.000 19.781 ( -0.000 -0.000 -0.000) 0.000 20.203 ( -0.000 -0.000 -0.000) 0.000 20.348 ( -0.000 -0.000 -0.000) 0.000 21.051 ( -0.000 -0.000 -0.000) 0.000 23.687 ( -0.000 -0.000 -0.000) 0.000 24.181 ( -0.000 -0.000 -0.000) 0.000 ======================= Grid point 105 (32/361) ======================= q-point: ( 0.00 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.602 ( -3.797 0.000 30.770) 31.003 0.644 ( 24.982 -0.000 31.677) 40.343 1.253 ( -6.945 0.000 61.391) 61.783 3.499 ( 0.162 -0.000 -2.307) 2.312 3.671 ( -1.757 0.000 6.940) 7.159 3.976 ( -3.353 0.000 6.028) 6.898 4.798 ( -57.420 0.000 3.473) 57.525 4.842 ( 3.313 -0.000 -4.880) 5.898 5.328 ( 4.695 -0.000 -0.653) 4.740 5.472 ( 0.526 -0.000 -4.963) 4.990 5.567 ( -4.303 0.000 5.758) 7.188 6.060 ( -50.996 0.000 7.007) 51.475 6.258 ( -3.679 0.000 -2.333) 4.356 6.576 ( 5.669 -0.000 -7.727) 9.583 6.900 ( 3.243 -0.000 4.912) 5.886 7.300 ( 1.795 -0.000 3.996) 4.380 7.736 ( 1.052 -0.000 -5.700) 5.796 8.955 ( -0.240 0.000 7.897) 7.901 9.533 ( -1.689 0.000 -6.861) 7.066 9.620 ( -2.069 0.000 -1.679) 2.665 10.032 ( 28.434 -0.000 2.398) 28.535 10.471 ( -2.034 0.000 -0.006) 2.034 11.672 ( -23.231 0.000 8.955) 24.898 11.837 ( 1.293 -0.000 -2.376) 2.705 12.170 ( 0.274 -0.000 -10.369) 10.372 12.680 ( 2.421 -0.000 7.984) 8.343 13.059 ( -0.822 0.000 -1.483) 1.696 15.098 ( -0.420 0.000 -11.746) 11.754 18.548 ( 2.239 -0.000 -6.162) 6.556 18.970 ( -5.026 0.000 2.545) 5.634 19.341 ( 32.277 -0.000 -4.383) 32.573 19.525 ( 22.236 -0.000 0.571) 22.243 20.376 ( 7.060 -0.000 -0.360) 7.069 22.987 (-102.600 0.000 -4.274) 102.689 23.003 ( -1.574 0.000 3.583) 3.914 23.674 ( 2.803 -0.000 -0.413) 2.833 ======================= Grid point 106 (33/361) ======================= q-point: ( 0.10 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.022 ( 7.631 -3.543 27.764) 29.010 1.310 ( 12.753 -9.346 29.944) 33.862 2.136 ( 23.787 -10.532 47.395) 54.065 3.491 ( 5.615 2.711 -4.519) 7.700 3.647 ( -14.220 1.277 11.580) 18.383 3.984 ( -3.857 2.212 6.080) 7.532 4.431 ( -23.747 4.100 26.444) 35.777 4.804 ( 2.361 3.977 -6.607) 8.065 5.289 ( -1.513 1.328 -6.774) 7.067 5.374 ( -2.099 4.301 -7.017) 8.494 5.415 ( -3.853 0.732 -6.020) 7.185 5.906 ( -5.050 3.035 17.783) 18.734 6.149 ( -6.409 3.316 1.502) 7.371 6.541 ( 2.909 10.554 0.861) 10.981 7.030 ( 8.022 1.997 -0.912) 8.317 7.386 ( -0.785 -10.935 -11.339) 15.772 7.771 ( -3.190 -14.924 4.462) 15.900 9.029 ( -0.471 4.268 6.896) 8.124 9.457 ( 2.988 -1.690 -7.683) 8.415 9.550 ( -5.268 -3.400 -2.904) 6.910 10.272 ( 14.040 16.438 -4.613) 22.104 10.593 ( 12.714 -18.163 -3.789) 22.492 11.557 ( -11.590 12.162 19.189) 25.504 11.836 ( 3.547 -0.372 -2.933) 4.617 12.132 ( 1.006 -13.995 -10.436) 17.487 12.857 ( 3.135 -5.452 6.404) 8.976 13.004 ( -3.551 -0.094 -2.437) 4.308 14.863 ( -5.850 2.859 -17.085) 18.284 18.470 ( 4.516 14.007 -0.077) 14.717 18.823 ( -10.350 6.461 -4.788) 13.107 19.164 ( -24.858 -12.310 0.886) 27.753 19.611 ( -14.895 0.795 6.728) 16.364 20.520 ( 12.312 3.641 5.778) 14.079 22.275 ( 6.459 26.784 0.172) 27.552 23.206 ( -5.198 -29.029 -4.436) 29.823 23.720 ( 3.380 0.120 0.660) 3.446 ======================= Grid point 107 (34/361) ======================= q-point: ( 0.20 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 10.601 -3.215 23.345) 25.840 1.914 ( 9.493 -13.720 28.060) 32.645 3.059 ( 27.026 -8.984 27.368) 39.498 3.474 ( 5.786 5.894 -5.987) 10.201 3.630 ( -7.510 3.666 15.158) 17.309 3.980 ( -0.521 2.226 1.251) 2.606 4.430 ( -11.313 3.497 18.196) 21.710 4.667 ( -1.392 6.391 -8.724) 10.904 5.138 ( -7.475 1.805 -3.680) 8.525 5.299 ( 5.090 2.866 -3.329) 6.724 5.364 ( 3.079 -3.501 -4.919) 6.778 5.985 ( -8.267 2.333 11.114) 14.047 6.151 ( -1.687 -3.265 10.637) 11.254 6.494 ( 0.501 13.403 4.078) 14.019 7.003 ( -0.217 5.243 -7.563) 9.205 7.295 ( 1.734 -2.727 -10.566) 11.049 7.945 ( -7.303 -20.336 7.709) 22.941 9.020 ( -1.127 9.101 3.515) 9.821 9.402 ( -1.870 0.956 -5.689) 6.064 9.548 ( 3.808 -6.789 -0.275) 7.789 10.218 ( 2.554 5.106 -4.207) 7.092 10.881 ( 14.703 -10.517 -4.014) 18.518 11.509 ( -9.494 10.442 12.578) 18.905 11.880 ( 6.671 -0.541 -2.415) 7.115 12.195 ( 1.583 -17.181 -5.191) 18.018 12.876 ( -5.435 3.130 -3.122) 7.006 13.038 ( 3.315 -2.542 8.020) 9.043 14.502 ( -9.066 4.363 -19.154) 21.636 18.395 ( -7.445 12.749 4.985) 15.583 18.582 ( 5.227 6.630 -10.551) 13.513 19.013 ( -22.045 -17.624 4.198) 28.535 19.425 ( -16.209 4.045 2.761) 16.933 20.773 ( 13.845 2.605 8.701) 16.558 22.236 ( 15.925 12.071 -8.629) 21.766 23.294 ( -2.509 -16.756 -4.460) 17.520 23.770 ( 2.838 1.261 0.969) 3.253 ======================= Grid point 108 (35/361) ======================= q-point: ( 0.30 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( 7.283 -1.227 17.544) 19.035 2.487 ( 10.394 -13.154 24.051) 29.317 3.376 ( 0.874 7.735 -5.036) 9.271 3.486 ( 3.352 5.497 1.058) 6.525 3.795 ( 5.826 1.180 6.682) 8.943 3.966 ( 5.209 2.835 4.311) 7.332 4.507 ( 5.819 -0.215 -10.586) 12.082 4.543 ( -2.763 -3.568 10.812) 11.716 5.000 ( -11.199 -0.328 4.192) 11.962 5.287 ( 0.203 0.213 -3.548) 3.560 5.481 ( 3.917 -1.749 12.543) 13.256 5.993 ( -4.374 1.250 8.969) 10.057 6.278 ( -7.184 -8.015 2.583) 11.068 6.401 ( 0.550 18.033 7.500) 19.538 6.806 ( -2.953 6.494 -9.130) 11.587 7.264 ( 5.292 0.256 -4.751) 7.117 8.082 ( -11.215 -19.692 6.709) 23.634 8.937 ( -0.666 11.849 1.184) 11.927 9.293 ( -3.307 0.718 -3.919) 5.178 9.712 ( 8.401 -2.042 3.444) 9.307 10.198 ( 0.804 -8.392 -3.352) 9.072 11.016 ( 5.098 5.782 -4.794) 9.078 11.474 ( -1.471 -0.448 7.322) 7.482 11.960 ( 7.539 -0.178 -1.980) 7.797 12.333 ( 0.563 -15.970 -0.380) 15.984 12.699 ( -7.975 5.056 -3.785) 10.174 13.225 ( 6.119 -1.062 9.203) 11.103 14.105 ( -9.705 4.666 -17.256) 20.340 18.186 ( -7.914 7.178 -1.751) 10.827 18.591 ( 12.840 7.531 -4.653) 15.596 18.939 ( -17.433 -17.977 2.355) 25.152 19.182 ( -14.389 5.387 1.032) 15.399 21.014 ( 10.781 4.554 6.391) 13.334 22.269 ( 12.579 1.976 -8.310) 15.205 23.350 ( 0.173 -10.434 -3.079) 10.880 23.793 ( 1.486 2.871 0.737) 3.316 ======================= Grid point 109 (36/361) ======================= q-point: ( 0.40 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( 0.620 5.225 7.277) 8.980 2.982 ( 9.455 -7.515 16.708) 20.616 3.200 ( -5.789 7.016 -8.222) 12.261 3.447 ( 0.026 4.409 1.955) 4.823 3.655 ( -0.840 7.449 -8.781) 11.546 4.260 ( 5.692 -6.657 13.334) 15.954 4.515 ( 10.865 -5.536 -13.775) 18.397 4.614 ( -1.503 -1.835 -1.102) 2.615 4.940 ( -11.602 -3.648 9.440) 15.396 5.228 ( -2.079 -1.761 -4.892) 5.600 5.754 ( -5.038 4.130 26.042) 26.844 6.034 ( -5.910 4.794 -10.128) 12.668 6.066 ( -3.868 -2.276 8.440) 9.559 6.452 ( -0.363 6.745 8.285) 10.690 6.658 ( 0.085 2.348 -3.382) 4.118 7.308 ( 7.128 2.024 -1.774) 7.620 8.151 ( -10.704 -12.727 6.876) 17.995 8.839 ( -0.603 9.373 0.049) 9.393 9.223 ( -0.712 0.449 -1.636) 1.840 9.820 ( 1.461 -0.152 0.547) 1.567 10.350 ( 6.454 -16.098 1.203) 17.385 10.831 ( -2.948 17.941 -5.610) 19.027 11.643 ( 4.842 -5.928 6.798) 10.237 12.028 ( 5.489 0.452 -2.175) 5.921 12.428 ( -6.050 -4.620 1.128) 7.696 12.537 ( -0.647 -0.270 -1.596) 1.743 13.388 ( 2.831 -1.366 -2.435) 3.976 13.814 ( -2.828 2.869 -2.906) 4.967 18.049 ( -2.423 3.114 -1.327) 4.163 18.595 ( 7.391 6.484 -10.849) 14.641 18.897 ( -10.918 -14.568 0.045) 18.205 19.027 ( -7.887 2.355 7.423) 11.084 21.120 ( 6.588 7.705 -0.080) 10.138 22.355 ( 6.514 -6.006 -2.692) 9.261 23.413 ( 2.477 -5.961 -1.610) 6.653 23.779 ( 0.564 4.379 0.173) 4.419 ======================= Grid point 110 (37/361) ======================= q-point: (-0.50 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( -4.899 14.240 -3.900) 15.556 2.820 ( -17.216 12.949 -9.805) 23.669 3.248 ( 5.635 -0.148 3.194) 6.479 3.453 ( -0.878 -1.070 3.241) 3.524 3.705 ( 8.796 -9.819 2.445) 13.408 4.299 ( -8.967 2.138 -11.545) 14.774 4.482 ( -1.132 -2.264 -7.598) 8.008 4.725 ( 0.101 -11.582 13.907) 18.099 4.960 ( -4.908 -4.071 4.264) 7.671 5.151 ( -4.140 -3.867 -3.121) 6.468 5.567 ( -12.658 12.526 -1.510) 17.871 5.953 ( -4.434 0.877 1.806) 4.868 6.295 ( -1.198 -8.608 16.186) 18.372 6.417 ( -1.737 12.487 5.593) 13.792 6.710 ( 3.467 -4.986 4.927) 7.821 7.365 ( 5.655 2.146 -0.213) 6.053 8.180 ( -4.152 2.544 6.963) 8.497 8.766 ( -1.885 0.001 -1.743) 2.568 9.233 ( 2.981 -0.046 0.708) 3.064 9.795 ( -5.690 -5.737 -2.977) 8.612 10.535 ( -1.178 14.892 -0.435) 14.945 10.649 ( 9.699 -6.843 -1.734) 11.996 11.749 ( -7.023 1.710 6.605) 9.792 12.045 ( 2.044 1.152 -2.619) 3.516 12.403 ( 4.496 0.678 3.089) 5.497 12.611 ( 1.558 -4.227 3.441) 5.668 13.190 ( -7.001 1.764 -16.285) 17.814 13.980 ( 10.765 -3.084 12.018) 16.427 18.006 ( -0.214 -0.456 -3.583) 3.618 18.463 ( 5.464 3.670 -13.246) 14.791 18.889 ( -10.154 -10.248 3.621) 14.874 19.085 ( 2.931 0.335 7.736) 8.279 21.067 ( 3.020 9.019 -6.985) 11.801 22.478 ( -1.692 -11.387 3.872) 12.146 23.483 ( 3.603 -1.490 0.834) 3.988 23.743 ( 0.981 5.082 -0.721) 5.226 ======================= Grid point 111 (38/361) ======================= q-point: (-0.40 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( -8.429 19.594 -8.124) 22.824 2.294 ( -21.052 18.876 -8.368) 29.488 3.329 ( 1.391 -2.742 -2.282) 3.829 3.508 ( -1.342 -5.322 1.417) 5.669 3.850 ( -20.630 5.700 -13.257) 25.176 3.902 ( 1.001 -9.098 -4.545) 10.219 4.355 ( -9.650 -1.439 -1.205) 9.831 4.858 ( -11.847 -2.569 6.871) 13.934 5.045 ( 3.559 -9.564 9.590) 14.004 5.188 ( 3.287 -4.942 1.137) 6.043 5.419 ( -2.230 0.006 3.074) 3.798 5.856 ( -4.094 2.305 -4.196) 6.299 6.351 ( -6.891 10.913 10.465) 16.616 6.432 ( -7.810 -8.388 5.961) 12.919 6.937 ( 4.675 -7.988 10.580) 14.058 7.443 ( 4.938 1.209 4.039) 6.493 8.138 ( 2.040 19.094 4.390) 19.698 8.751 ( -2.596 -10.297 -3.401) 11.151 9.310 ( 5.986 -0.010 1.068) 6.081 9.717 ( -7.254 -6.228 -2.712) 9.938 10.364 ( 1.222 15.074 -0.886) 15.149 10.841 ( 9.058 -6.225 -3.933) 11.673 11.622 ( -16.135 5.616 8.765) 19.202 12.003 ( -0.798 1.980 -3.088) 3.754 12.580 ( 8.038 4.501 8.908) 12.814 12.718 ( 1.753 -2.743 5.892) 6.731 12.896 ( -2.807 -0.183 -16.389) 16.628 14.339 ( 14.179 -5.170 11.216) 18.803 17.887 ( -0.427 -2.715 -18.843) 19.043 18.459 ( 10.039 1.863 -0.999) 10.259 18.881 ( -8.319 -6.173 4.493) 11.291 19.245 ( 6.598 -0.326 6.763) 9.454 20.888 ( -0.407 8.894 -11.916) 14.875 22.584 ( -10.672 -15.551 7.635) 20.347 23.572 ( 3.997 2.630 6.762) 8.284 23.705 ( 2.285 4.726 -2.015) 5.623 ======================= Grid point 112 (39/361) ======================= q-point: (-0.30 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( -12.609 21.093 -4.909) 25.060 1.720 ( -22.396 24.105 -4.621) 33.227 2.858 ( -31.939 13.488 -27.856) 44.475 3.587 ( -6.800 -4.824 6.686) 10.687 3.620 ( -2.116 -8.435 5.651) 10.371 3.864 ( -6.908 -4.218 -4.021) 9.038 4.259 ( -8.414 -3.099 4.275) 9.933 4.872 ( -1.786 -0.247 7.274) 7.494 5.253 ( 4.413 -8.617 1.609) 9.814 5.284 ( 3.137 -4.089 0.203) 5.157 5.527 ( -5.722 -11.389 12.933) 18.158 5.737 ( -1.695 2.301 -4.213) 5.091 6.287 ( -13.211 2.883 13.685) 19.239 6.440 ( -4.838 -7.700 -0.343) 9.100 7.152 ( -2.040 -8.356 7.431) 11.367 7.560 ( 3.535 0.983 5.363) 6.498 8.037 ( 8.340 28.131 4.834) 29.737 8.782 ( -3.169 -13.582 -3.009) 14.268 9.408 ( 7.753 -0.120 -1.383) 7.876 9.667 ( -2.469 -0.035 1.416) 2.846 10.283 ( 0.873 2.006 -2.807) 3.559 10.886 ( 5.265 1.360 -8.896) 10.427 11.478 ( -20.018 0.273 15.026) 25.031 11.930 ( -1.437 1.926 -2.856) 3.732 12.543 ( -8.541 4.249 -2.361) 9.827 12.866 ( 4.575 -2.522 4.044) 6.606 12.884 ( 14.461 7.968 3.973) 16.983 14.709 ( 14.822 -5.656 7.774) 17.667 17.611 ( 0.561 -3.605 -31.271) 31.483 18.627 ( 11.052 2.297 5.017) 12.353 18.875 ( -4.380 -1.230 3.709) 5.870 19.413 ( 6.710 1.038 5.272) 8.597 20.638 ( -2.495 6.832 -13.174) 15.048 22.634 ( -18.795 -20.739 8.326) 29.201 23.674 ( 3.155 2.548 -3.817) 5.569 23.728 ( 3.592 6.659 17.781) 19.324 ======================= Grid point 113 (40/361) ======================= q-point: (-0.20 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -18.627 18.960 4.765) 27.003 1.152 ( -23.990 26.964 2.596) 36.185 1.850 ( -44.991 19.761 -21.224) 53.527 3.589 ( -7.656 -6.767 3.234) 10.718 3.724 ( -9.840 -1.265 4.740) 10.995 3.802 ( 2.846 -4.729 1.921) 5.844 4.343 ( -5.841 -7.870 21.609) 23.727 4.916 ( -0.070 1.850 2.445) 3.067 5.356 ( 2.479 -4.568 0.171) 5.200 5.385 ( 3.224 -6.429 0.516) 7.211 5.662 ( -3.719 -1.021 -1.729) 4.226 5.715 ( -8.143 -14.228 13.795) 21.426 6.296 ( -10.881 -4.760 14.866) 19.027 6.436 ( -6.262 -15.160 -3.888) 16.857 7.150 ( -13.536 -4.706 0.366) 14.335 7.642 ( 5.178 2.155 1.997) 5.954 8.047 ( 18.039 30.221 8.311) 36.163 8.831 ( -4.053 -10.167 2.297) 11.183 9.481 ( 7.610 -1.831 -6.114) 9.932 9.665 ( 2.842 8.020 2.402) 8.841 10.272 ( -2.362 -13.974 -7.655) 16.108 10.764 ( -0.220 7.763 -10.083) 12.727 11.448 ( -25.412 -15.750 23.083) 37.771 11.876 ( -0.489 0.899 -1.638) 1.932 12.381 ( -5.086 0.193 -4.180) 6.586 12.992 ( 3.566 -2.357 2.669) 5.039 13.073 ( 20.984 26.342 10.816) 35.372 15.012 ( 13.226 -4.154 1.779) 13.977 17.233 ( -1.869 -1.048 -30.601) 30.676 18.791 ( 8.448 7.449 3.396) 11.764 18.871 ( 2.056 3.293 1.603) 4.200 19.519 ( 3.925 3.833 3.233) 6.368 20.425 ( -1.087 2.172 -10.033) 10.322 22.652 ( -25.499 -30.686 9.503) 41.014 23.656 ( 3.097 1.724 -3.301) 4.843 24.001 ( 3.260 4.955 29.724) 30.310 ======================= Grid point 114 (41/361) ======================= q-point: (-0.10 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.545 ( -21.225 12.893 17.539) 30.403 0.588 ( -36.555 13.627 -5.687) 39.424 1.020 ( -33.780 28.265 36.167) 56.991 3.547 ( -6.050 -3.919 -1.163) 7.302 3.647 ( -4.429 1.296 2.193) 5.109 3.917 ( -0.306 -3.548 5.566) 6.608 4.764 ( 3.746 -16.166 14.250) 21.873 4.966 ( 7.892 5.011 15.456) 18.063 5.406 ( -4.101 -6.707 -4.778) 9.200 5.487 ( 3.512 -2.096 2.225) 4.656 5.534 ( -5.501 0.295 -7.325) 9.165 5.981 ( -2.351 -25.913 20.208) 32.945 6.344 ( 1.857 8.984 1.661) 9.323 6.507 ( -32.217 -62.307 5.121) 70.330 6.957 ( -19.116 -6.069 2.426) 20.202 7.697 ( 4.599 2.734 -4.934) 7.278 8.044 ( 23.072 44.866 -21.180) 54.716 8.902 ( -1.181 0.589 6.312) 6.449 9.510 ( 7.498 -0.916 -5.335) 9.248 9.642 ( 3.066 7.209 -1.606) 7.997 10.124 ( -26.007 -18.323 -20.170) 37.669 10.543 ( -2.782 12.281 -0.804) 12.618 11.651 ( -26.490 -48.836 19.075) 58.741 11.854 ( -0.609 -0.704 -1.212) 1.528 12.306 ( -0.878 0.141 -1.911) 2.108 13.038 ( 13.301 34.908 -20.026) 42.386 13.068 ( 9.445 20.124 -7.248) 23.382 15.155 ( 7.507 -1.113 -7.082) 10.380 17.366 ( 29.025 -15.522 67.097) 74.735 18.766 ( 15.454 27.204 -3.280) 31.459 18.944 ( 1.600 0.096 4.315) 4.603 19.535 ( 0.242 3.881 0.722) 3.955 20.339 ( 2.553 -0.967 -5.568) 6.202 22.745 ( -28.202 -48.696 11.659) 57.468 23.653 ( 2.682 0.565 -2.075) 3.438 24.376 ( -5.193 -12.030 2.795) 13.398 ======================= Grid point 116 (42/361) ======================= q-point: ( 0.10 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( 13.566 -0.000 27.482) 30.648 1.743 ( 3.455 -0.000 32.379) 32.563 2.977 ( 31.787 -0.000 28.425) 42.643 3.530 ( 7.129 -0.000 -6.395) 9.577 3.666 ( -6.841 0.000 17.228) 18.537 3.995 ( -3.032 0.000 1.847) 3.550 4.464 ( -15.329 0.000 18.057) 23.686 4.742 ( -2.051 0.000 -8.459) 8.704 5.134 ( -4.967 0.000 -10.977) 12.048 5.307 ( 0.311 -0.000 -5.204) 5.213 5.353 ( 5.176 -0.000 -2.499) 5.748 6.035 ( -5.528 0.000 15.892) 16.826 6.077 ( -9.242 0.000 4.925) 10.472 6.689 ( 3.411 -0.000 4.300) 5.489 7.082 ( 2.323 -0.000 -2.680) 3.547 7.205 ( 1.529 -0.000 -12.851) 12.941 7.732 ( -9.225 0.000 11.250) 14.549 9.107 ( -0.537 0.000 3.819) 3.857 9.406 ( -3.752 0.000 -5.815) 6.920 9.474 ( 7.321 -0.000 -1.405) 7.455 10.305 ( -6.274 0.000 -4.385) 7.655 10.755 ( 26.160 -0.000 -6.232) 26.892 11.706 ( -11.263 0.000 20.291) 23.207 11.860 ( 7.802 -0.000 -6.334) 10.050 11.955 ( 1.306 -0.000 -8.020) 8.126 12.905 ( -5.772 0.000 -3.286) 6.642 13.012 ( 5.385 -0.000 9.768) 11.154 14.541 ( -10.299 0.000 -18.773) 21.412 18.576 ( 1.165 -0.000 -0.469) 1.256 18.662 ( -3.528 0.000 -9.245) 9.896 18.767 ( -23.140 0.000 4.439) 23.562 19.462 ( -16.403 0.000 3.783) 16.834 20.806 ( 11.711 -0.000 11.464) 16.388 22.390 ( 11.688 -0.000 -17.488) 21.035 23.091 ( 1.940 -0.000 2.632) 3.270 23.783 ( 3.641 -0.000 0.966) 3.767 ======================= Grid point 117 (43/361) ======================= q-point: ( 0.20 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( 10.402 8.644 25.117) 28.527 2.226 ( 5.023 -14.489 28.121) 32.031 3.495 ( 3.324 4.855 -3.802) 7.005 3.539 ( 12.961 0.322 2.337) 13.174 3.843 ( 3.360 4.264 13.008) 14.095 3.966 ( 1.665 -3.083 -2.637) 4.385 4.501 ( -0.134 -1.191 8.732) 8.814 4.553 ( -4.589 4.193 -9.550) 11.394 4.940 ( -8.915 -4.577 -6.470) 11.928 5.271 ( -1.468 -0.796 -1.916) 2.541 5.478 ( 3.983 0.476 12.795) 13.409 6.019 ( -6.843 1.501 7.444) 10.222 6.160 ( -4.205 -4.325 9.261) 11.052 6.669 ( -3.878 8.418 -0.454) 9.279 6.981 ( 1.493 13.948 -4.807) 14.829 7.212 ( 4.305 -7.315 -0.770) 8.522 7.750 ( -14.632 -13.555 9.462) 22.076 9.105 ( -0.590 6.131 1.624) 6.370 9.284 ( -4.964 -1.320 -3.840) 6.413 9.659 ( 14.472 -2.504 3.187) 15.029 10.139 ( -6.227 -0.272 -6.580) 9.063 11.045 ( 21.191 -0.952 -3.181) 21.450 11.637 ( -5.963 17.130 6.715) 19.341 11.950 ( 8.040 -3.560 -2.553) 9.156 12.008 ( -1.437 -17.094 1.342) 17.206 12.761 ( -7.834 1.802 -3.377) 8.719 13.210 ( 6.589 -0.504 8.426) 10.708 14.159 ( -11.879 1.470 -16.681) 20.531 18.344 ( -11.558 9.968 -1.708) 15.358 18.623 ( -12.009 -11.652 -1.474) 16.798 18.707 ( 11.980 0.445 -4.895) 12.949 19.249 ( -15.871 1.951 0.577) 16.001 21.098 ( 9.536 3.355 13.302) 16.707 22.305 ( 10.085 1.586 -18.196) 20.864 23.185 ( 2.775 -6.116 1.277) 6.837 23.833 ( 2.563 1.314 0.931) 3.027 ======================= Grid point 118 (44/361) ======================= q-point: ( 0.30 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 3.430 10.953 17.405) 20.849 2.769 ( 9.263 -15.023 21.507) 27.821 3.320 ( -8.458 6.004 -6.970) 12.497 3.560 ( -2.112 7.320 -0.408) 7.629 3.800 ( 0.025 6.572 -11.974) 13.659 4.135 ( 3.750 -7.283 7.735) 11.267 4.420 ( 3.723 -2.791 -7.705) 9.001 4.605 ( 7.196 -0.101 -6.059) 9.408 4.844 ( -9.125 -6.526 3.171) 11.658 5.203 ( -5.661 -0.850 -2.531) 6.259 5.763 ( -0.156 -1.183 27.957) 27.983 6.020 ( -4.938 -2.157 4.208) 6.837 6.112 ( -10.357 2.807 -5.065) 11.866 6.559 ( -2.047 3.831 4.877) 6.531 6.832 ( 2.006 15.939 -2.074) 16.198 7.327 ( 4.300 0.610 2.772) 5.152 7.822 ( -12.360 -21.320 9.252) 26.323 9.024 ( -2.258 9.671 0.552) 9.946 9.216 ( -2.138 -1.461 -1.407) 2.947 9.849 ( 2.339 3.439 -2.671) 4.943 10.109 ( 8.304 -11.284 1.432) 14.083 11.174 ( 8.815 17.771 -3.381) 20.123 11.585 ( 4.428 1.919 6.685) 8.245 12.034 ( 5.756 0.183 -1.727) 6.012 12.192 ( -0.927 -18.744 3.457) 19.083 12.587 ( -7.706 3.030 -2.761) 8.728 13.367 ( 4.776 -0.857 -1.490) 5.076 13.848 ( -7.618 1.048 -5.008) 9.177 18.133 ( -5.355 6.321 -1.545) 8.427 18.537 ( -8.910 -12.440 -7.818) 17.183 18.805 ( 10.385 4.132 -3.452) 11.698 19.058 ( -9.300 0.546 2.456) 9.634 21.287 ( 5.195 9.756 9.288) 14.437 22.240 ( 5.989 -6.406 -13.896) 16.432 23.299 ( 3.939 -5.715 1.114) 7.030 23.851 ( 1.375 3.153 0.899) 3.555 ======================= Grid point 119 (45/361) ======================= q-point: (-0.60 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( -1.432 16.185 4.126) 16.763 2.984 ( -16.184 5.364 -5.900) 18.041 3.229 ( 8.157 -4.876 9.957) 13.764 3.467 ( -5.034 2.144 0.921) 5.548 3.598 ( 0.283 0.316 -7.174) 7.186 4.256 ( -10.765 -7.706 4.750) 14.066 4.436 ( 6.726 -3.301 -12.650) 14.702 4.585 ( -0.571 -2.279 -1.571) 2.827 4.865 ( -0.062 -5.555 2.022) 5.911 5.091 ( -6.671 -2.944 -2.398) 7.676 5.759 ( -16.905 8.606 -4.270) 19.445 5.967 ( -4.522 0.394 3.043) 5.465 6.144 ( -3.426 -7.249 19.184) 20.792 6.636 ( 1.876 1.871 9.401) 9.767 6.706 ( 0.872 13.400 0.264) 13.431 7.383 ( 1.487 0.088 1.629) 2.208 8.000 ( -3.705 -18.000 8.301) 20.165 8.900 ( -3.391 10.812 0.855) 11.364 9.214 ( 0.504 -1.957 0.501) 2.082 9.724 ( -5.530 -2.018 -7.621) 9.630 10.443 ( 14.979 -8.128 5.873) 18.026 10.990 ( 2.177 26.981 -1.621) 27.117 11.761 ( 2.323 -0.171 7.486) 7.840 12.062 ( 2.148 0.759 -2.105) 3.102 12.363 ( 0.297 -9.016 4.831) 10.233 12.502 ( 1.231 -4.143 -0.313) 4.333 13.217 ( -6.586 1.190 -15.729) 17.094 13.918 ( 7.095 -3.528 9.998) 12.757 18.023 ( -1.799 2.447 -4.796) 5.676 18.412 ( -4.887 -8.854 -9.554) 13.912 18.827 ( 1.790 3.373 1.497) 4.101 19.083 ( 5.387 -1.113 2.707) 6.131 21.277 ( 1.238 14.207 -0.261) 14.263 22.256 ( -1.230 -13.595 -4.661) 14.424 23.420 ( 4.735 -4.250 1.553) 6.549 23.843 ( 1.195 5.093 1.104) 5.346 ======================= Grid point 120 (46/361) ======================= q-point: (-0.50 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( -5.444 21.338 -4.993) 22.580 2.575 ( -19.966 11.875 -5.576) 23.890 3.323 ( 1.956 1.533 0.335) 2.507 3.433 ( -4.050 -2.355 1.413) 4.893 3.689 ( 2.689 -13.765 -2.053) 14.175 4.009 ( -19.242 10.189 -9.354) 23.697 4.301 ( -8.339 -3.685 -6.666) 11.294 4.673 ( -7.121 -13.814 8.628) 17.775 4.942 ( 2.181 -4.358 1.599) 5.129 5.091 ( 1.404 -6.025 1.596) 6.389 5.473 ( -8.874 4.929 -1.529) 10.266 5.884 ( -3.413 0.645 -4.860) 5.974 6.277 ( -15.151 -5.074 13.575) 20.966 6.610 ( -0.979 13.407 5.092) 14.375 6.816 ( 4.103 -4.900 9.232) 11.228 7.441 ( 1.665 -1.361 4.396) 4.894 8.195 ( 2.290 -11.834 2.457) 12.302 8.764 ( -3.736 11.224 1.305) 11.901 9.274 ( 2.354 -3.805 1.522) 4.726 9.595 ( -5.176 -5.905 -6.199) 10.005 10.739 ( 8.787 7.605 4.240) 12.370 10.771 ( 5.700 16.220 -1.556) 17.263 11.737 ( -11.713 6.492 6.524) 14.896 12.033 ( -0.994 1.322 -2.299) 2.832 12.561 ( 7.568 -6.582 6.543) 11.975 12.654 ( 7.883 -4.664 5.799) 10.840 12.904 ( -7.521 1.179 -15.812) 17.549 14.225 ( 12.109 -7.252 8.847) 16.658 17.849 ( -3.144 -1.553 -18.270) 18.603 18.422 ( 2.745 -5.235 3.735) 6.992 18.862 ( 4.420 3.580 1.980) 6.023 19.233 ( 8.766 -1.260 3.428) 9.497 21.088 ( -2.245 13.498 -8.555) 16.138 22.302 ( -10.600 -16.391 2.487) 19.678 23.543 ( 4.751 -3.149 2.500) 6.224 23.831 ( 2.346 6.946 2.304) 7.685 ======================= Grid point 121 (47/361) ======================= q-point: (-0.40 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( -8.902 23.924 -5.630) 26.140 2.102 ( -20.948 17.812 -3.903) 27.773 3.187 ( -15.431 21.583 -18.208) 32.179 3.439 ( -1.126 -10.678 4.882) 11.795 3.528 ( -14.973 -2.244 0.444) 15.147 3.761 ( -3.245 -6.269 -2.400) 7.455 4.173 ( -11.320 -6.235 2.085) 13.091 4.806 ( -5.644 -8.420 11.627) 15.426 5.064 ( -0.542 -10.346 3.861) 11.056 5.192 ( 2.502 -6.086 -0.205) 6.583 5.387 ( -4.393 -4.933 1.542) 6.783 5.776 ( -0.585 2.003 -5.518) 5.899 6.182 ( -20.424 -5.108 7.352) 22.300 6.559 ( 0.127 10.149 4.769) 11.214 7.010 ( -0.424 -6.851 7.794) 10.386 7.552 ( 2.600 -1.956 5.470) 6.365 8.318 ( 6.014 -3.965 -3.224) 7.892 8.652 ( -3.518 7.419 4.190) 9.218 9.364 ( 3.293 -4.469 -0.249) 5.557 9.562 ( -2.414 -9.479 -1.305) 9.868 10.540 ( 1.295 25.164 -1.770) 25.260 10.915 ( 7.502 1.718 -0.636) 7.722 11.561 ( -15.799 7.176 8.166) 19.178 11.965 ( -2.404 1.763 -2.301) 3.766 12.589 ( -8.739 1.694 -9.823) 13.257 12.768 ( 3.355 -7.648 4.321) 9.403 12.980 ( 17.991 1.348 9.375) 20.332 14.568 ( 13.526 -9.901 4.977) 17.486 17.555 ( -3.550 -2.563 -25.039) 25.419 18.619 ( 6.894 -2.463 9.707) 12.158 18.928 ( 8.932 6.293 0.778) 10.954 19.421 ( 9.845 -0.299 4.591) 10.867 20.793 ( -5.287 10.544 -12.764) 17.380 22.287 ( -20.702 -18.334 5.140) 28.127 23.650 ( 3.058 -2.243 0.540) 3.830 23.873 ( 5.068 7.000 8.574) 12.174 ======================= Grid point 122 (48/361) ======================= q-point: (-0.30 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( -11.355 25.265 -0.170) 27.700 1.569 ( -24.385 20.071 -5.425) 32.045 2.384 ( -26.330 37.590 -10.603) 47.103 3.443 ( -9.663 -9.969 1.277) 13.942 3.635 ( 0.401 -8.959 7.739) 11.846 3.726 ( -4.372 -2.783 0.015) 5.182 4.186 ( -9.011 -9.328 14.046) 19.118 4.912 ( -3.790 -2.950 7.680) 9.058 5.163 ( -7.174 -15.399 1.645) 17.067 5.265 ( 1.434 -6.734 -0.349) 6.893 5.434 ( -6.926 -13.221 3.836) 15.410 5.703 ( -1.812 2.587 -2.236) 3.869 6.053 ( -14.176 -8.453 4.419) 17.086 6.536 ( 1.171 8.588 3.291) 9.272 7.062 ( -9.268 -4.426 2.424) 10.553 7.653 ( 4.316 -1.064 0.815) 4.519 8.374 ( 10.653 2.127 -6.812) 12.823 8.683 ( -1.672 0.244 13.272) 13.379 9.426 ( 3.839 -4.026 -3.606) 6.630 9.644 ( -2.100 -12.622 1.695) 12.907 10.293 ( -1.445 20.671 -5.910) 21.547 10.914 ( 1.323 8.429 -1.604) 8.681 11.391 ( -17.243 4.591 11.180) 21.057 11.896 ( -1.719 1.186 -1.766) 2.735 12.382 ( -5.086 0.102 -6.256) 8.063 12.914 ( 2.831 -6.230 2.169) 7.178 13.339 ( 19.745 5.637 10.566) 23.093 14.874 ( 12.989 -11.091 -1.121) 17.117 17.225 ( -3.675 0.175 -20.305) 20.635 18.836 ( 6.586 0.458 7.349) 9.879 19.024 ( 15.452 10.247 -0.100) 18.541 19.597 ( 8.873 4.358 4.517) 10.869 20.487 ( -5.210 4.962 -12.464) 14.392 22.174 ( -31.918 -22.354 7.140) 39.617 23.674 ( 1.776 0.540 -1.993) 2.724 24.059 ( 5.634 1.965 14.633) 15.803 ======================= Grid point 123 (49/361) ======================= q-point: (-0.20 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.914 ( -14.398 24.283 6.031) 28.868 0.948 ( -19.439 25.349 -1.472) 31.979 1.723 ( -18.380 45.094 19.103) 52.309 3.429 ( -5.684 -9.151 -0.027) 10.772 3.675 ( -4.105 1.623 2.219) 4.941 3.798 ( -0.720 -9.422 5.566) 10.967 4.425 ( -13.400 -18.648 26.914) 35.379 4.980 ( 0.017 -3.040 8.114) 8.665 5.127 ( -25.630 -20.816 -0.216) 33.019 5.363 ( 2.365 -8.631 1.024) 9.007 5.480 ( -7.722 -12.390 -0.282) 14.602 5.597 ( -7.347 1.666 1.926) 7.776 6.076 ( -2.171 -8.030 3.918) 9.195 6.512 ( 1.756 8.744 2.008) 9.141 6.927 ( -12.970 -0.361 1.866) 13.109 7.701 ( 4.155 -1.123 -5.246) 6.786 8.407 ( 13.718 4.066 -14.668) 20.490 8.870 ( 0.262 -3.919 10.132) 10.867 9.481 ( 6.233 -2.555 -0.647) 6.767 9.701 ( -9.841 -14.535 -1.043) 17.584 9.988 ( -3.640 20.127 -6.895) 21.585 10.792 ( -2.441 14.347 1.416) 14.622 11.298 ( -16.535 -1.201 16.782) 23.590 11.856 ( -0.334 0.254 -1.640) 1.693 12.301 ( -0.560 -0.387 -1.413) 1.568 13.000 ( 1.133 -4.798 -0.739) 4.985 13.562 ( 16.248 9.620 -15.529) 24.447 15.061 ( 9.573 -9.701 -11.253) 17.675 17.178 ( 5.167 -5.049 24.065) 25.126 18.945 ( 1.543 0.239 1.982) 2.523 19.188 ( 29.026 16.869 -2.801) 33.688 19.662 ( 2.755 9.904 2.804) 10.655 20.312 ( 0.466 -1.849 -8.309) 8.525 21.986 ( -45.717 -29.228 15.093) 56.322 23.667 ( 1.727 0.996 -1.526) 2.511 24.251 ( -2.566 -3.601 4.304) 6.171 ======================= Grid point 124 (50/361) ======================= q-point: (-0.10 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.788 ( -2.103 19.722 20.354) 28.420 0.817 ( 19.550 17.332 24.286) 35.671 1.597 ( -5.242 33.039 46.996) 57.686 3.447 ( 0.229 -5.806 -1.713) 6.058 3.664 ( -3.825 -0.501 5.913) 7.060 3.920 ( -2.749 -6.078 6.494) 9.309 4.548 ( -43.189 -19.184 22.285) 52.249 4.840 ( -8.946 -5.105 -7.128) 12.526 5.255 ( 0.001 -11.478 11.034) 15.922 5.435 ( -2.920 -5.741 -4.860) 8.069 5.487 ( -10.211 -17.837 1.600) 20.615 5.627 ( 6.046 -2.599 12.051) 13.731 6.149 ( -4.619 -5.999 3.731) 8.441 6.483 ( 0.176 4.823 2.070) 5.251 6.883 ( 1.905 -0.907 5.468) 5.861 7.634 ( -0.984 1.311 -11.174) 11.293 8.118 ( -0.256 29.007 -24.100) 37.713 8.919 ( -4.266 -5.408 6.120) 9.214 9.548 ( -2.992 0.084 -4.035) 5.024 9.695 ( -4.487 1.741 -2.798) 5.567 9.884 ( 20.888 -2.091 3.637) 21.305 10.673 ( 1.864 16.380 2.083) 16.617 11.376 ( -14.201 -10.950 21.756) 28.194 11.838 ( 1.289 0.057 -2.340) 2.672 12.298 ( 1.909 2.999 -3.054) 4.687 12.988 ( -0.863 2.687 -9.080) 9.508 13.156 ( -1.707 23.032 -18.837) 29.803 15.045 ( 1.040 -6.139 -14.137) 15.448 18.022 ( 10.524 -37.711 30.215) 49.455 18.931 ( -5.185 -3.266 -1.784) 6.382 19.443 ( 14.489 8.617 -5.379) 17.695 19.628 ( 8.536 7.607 1.216) 11.498 20.307 ( 4.321 -4.734 -1.539) 6.591 21.916 ( -34.244 -35.252 28.339) 56.731 23.674 ( 2.056 0.648 -0.834) 2.311 23.880 ( -23.482 23.474 -19.520) 38.516 ======================= Grid point 127 (51/361) ======================= q-point: ( 0.20 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( -2.207 0.000 22.194) 22.304 2.533 ( 15.124 -0.000 22.092) 26.773 3.381 ( -9.866 0.000 -7.406) 12.337 3.645 ( -1.768 0.000 -1.524) 2.334 3.856 ( 2.822 -0.000 -12.913) 13.217 4.047 ( 1.733 -0.000 6.746) 6.965 4.418 ( -2.531 0.000 -6.168) 6.667 4.600 ( 11.604 -0.000 -10.378) 15.568 4.768 ( -6.430 0.000 4.031) 7.589 5.196 ( -7.561 0.000 -0.596) 7.585 5.749 ( 0.106 -0.000 26.360) 26.360 5.999 ( -5.161 0.000 3.105) 6.023 6.135 ( -9.176 0.000 -0.911) 9.221 6.593 ( -3.409 0.000 0.319) 3.424 7.041 ( 6.776 -0.000 -8.649) 10.988 7.357 ( 2.994 -0.000 16.892) 17.155 7.542 ( -17.808 0.000 6.697) 19.025 9.146 ( -0.924 0.000 1.192) 1.508 9.171 ( -4.793 0.000 -1.505) 5.024 9.934 ( -7.422 0.000 -9.463) 12.027 9.955 ( 19.422 -0.000 6.709) 20.548 11.324 ( 19.639 -0.000 0.385) 19.643 11.785 ( 8.191 -0.000 -10.618) 13.410 11.849 ( -10.383 0.000 17.661) 20.487 12.036 ( 5.258 -0.000 -1.029) 5.358 12.616 ( -8.706 0.000 -2.618) 9.091 13.359 ( 5.389 -0.000 -1.321) 5.548 13.856 ( -9.335 0.000 -5.571) 10.871 18.238 ( -9.024 0.000 0.529) 9.040 18.367 ( -7.145 0.000 -7.967) 10.701 18.858 ( 16.266 -0.000 -6.181) 17.401 19.056 ( -12.727 0.000 1.016) 12.768 21.392 ( 4.413 -0.000 15.593) 16.206 22.170 ( 5.554 -0.000 -21.242) 21.956 23.243 ( 4.759 -0.000 2.733) 5.488 23.880 ( 1.702 -0.000 0.931) 1.940 ======================= Grid point 128 (52/361) ======================= q-point: ( 0.30 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( -1.745 12.187 9.539) 15.574 2.968 ( -0.969 -7.254 6.460) 9.762 3.144 ( -3.840 -0.858 3.014) 4.956 3.514 ( -8.140 2.181 -3.302) 9.051 3.666 ( -4.246 3.940 -13.089) 14.314 4.099 ( -9.893 -6.881 7.664) 14.281 4.384 ( 4.374 -1.482 -4.000) 6.110 4.592 ( 6.892 0.633 -13.602) 15.262 4.794 ( 1.735 -1.886 2.846) 3.830 5.049 ( -10.373 -1.479 -2.756) 10.834 5.869 ( -15.777 3.705 -6.208) 17.354 5.956 ( -4.114 -1.450 -1.571) 4.636 6.059 ( -5.671 -2.127 26.820) 27.496 6.638 ( 2.305 0.168 5.773) 6.219 6.975 ( 1.163 11.882 -2.622) 12.224 7.390 ( -5.946 1.533 4.906) 7.860 7.673 ( -0.876 -15.389 13.076) 20.213 9.064 ( -3.908 7.040 1.511) 8.193 9.164 ( -2.051 -3.682 0.606) 4.258 9.715 ( -5.505 0.343 -10.597) 11.946 10.337 ( 19.029 -3.356 7.824) 20.847 11.458 ( 7.608 21.793 0.659) 23.092 11.769 ( 7.033 3.032 4.763) 9.019 12.063 ( -2.698 -12.095 6.385) 13.941 12.078 ( 4.677 -7.819 -1.290) 9.202 12.490 ( -3.722 0.420 -0.615) 3.796 13.231 ( -5.742 0.392 -15.618) 16.645 13.870 ( 4.348 -1.577 8.841) 9.977 18.094 ( -4.054 5.402 -8.432) 10.803 18.240 ( -5.205 -8.808 -2.368) 10.501 18.926 ( 2.062 6.056 0.606) 6.426 19.037 ( 9.615 -4.002 -2.618) 10.739 21.535 ( -1.133 12.479 9.980) 16.019 22.014 ( 0.040 -11.726 -16.393) 20.155 23.361 ( 5.364 -1.899 3.185) 6.521 23.906 ( 1.535 1.858 1.206) 2.695 ======================= Grid point 129 (53/361) ======================= q-point: (-0.60 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( -4.434 18.196 -2.573) 18.905 2.715 ( -18.146 4.183 -3.758) 18.997 3.323 ( -7.424 -1.729 -2.943) 8.171 3.435 ( -1.246 -12.330 -7.156) 14.311 3.461 ( 1.455 3.330 7.151) 8.022 4.087 ( -17.717 -3.578 12.393) 21.916 4.333 ( -0.346 8.625 -18.587) 20.493 4.475 ( -3.548 -7.088 0.756) 7.962 4.865 ( 0.173 -3.766 -1.503) 4.058 4.973 ( -0.205 -7.145 0.562) 7.170 5.555 ( -15.070 3.589 -2.786) 15.740 5.884 ( -1.249 -0.292 -5.431) 5.581 6.216 ( -15.282 -2.276 18.834) 24.361 6.751 ( 3.453 0.347 4.315) 5.538 6.850 ( -2.840 9.919 3.930) 11.041 7.405 ( -0.725 -2.201 4.115) 4.723 7.932 ( 1.735 -14.193 6.125) 15.555 8.966 ( -4.047 9.386 3.424) 10.780 9.190 ( -1.372 -5.142 1.417) 5.508 9.534 ( -2.905 -1.200 -9.859) 10.348 10.694 ( 15.562 -2.308 6.144) 16.889 11.293 ( 3.497 30.503 1.522) 30.740 11.833 ( -7.081 4.172 5.900) 10.117 12.049 ( -1.218 0.516 -1.948) 2.354 12.329 ( 2.542 -18.795 4.119) 19.409 12.591 ( 13.175 -2.250 6.167) 14.720 12.927 ( -8.894 1.035 -15.205) 17.646 14.106 ( 9.944 -5.344 6.964) 13.264 17.831 ( -5.278 -0.510 -19.133) 19.854 18.329 ( 2.185 -4.235 9.657) 10.769 18.960 ( 8.145 6.320 1.866) 10.477 19.193 ( 11.806 -3.350 -1.789) 12.402 21.360 ( -4.437 16.935 -7.284) 18.962 22.000 ( -9.247 -17.589 -0.684) 19.883 23.493 ( 4.914 -2.209 3.495) 6.422 23.926 ( 2.564 3.675 1.863) 4.853 ======================= Grid point 130 (54/361) ======================= q-point: (-0.50 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( -7.536 21.811 -5.475) 23.717 2.359 ( -18.331 11.750 -2.762) 21.948 3.234 ( -8.662 -10.706 -1.757) 13.882 3.341 ( -4.080 -8.437 -3.697) 10.075 3.617 ( 2.617 4.325 1.084) 5.170 3.788 ( -17.339 18.812 -7.140) 26.561 4.058 ( -12.827 -6.042 0.502) 14.188 4.605 ( -2.884 -11.894 10.250) 15.964 4.903 ( -2.545 -9.314 0.956) 9.703 5.072 ( 1.471 -7.043 1.105) 7.279 5.330 ( -11.494 -1.793 -3.006) 12.015 5.811 ( 1.614 2.095 -5.088) 5.734 6.136 ( -20.420 -1.143 8.885) 22.299 6.718 ( -1.576 7.478 1.359) 7.762 6.930 ( 0.870 -2.065 8.554) 8.843 7.493 ( 1.519 -4.411 3.924) 6.096 8.109 ( 1.831 -12.858 -0.516) 12.998 8.872 ( -2.782 11.694 4.981) 13.012 9.249 ( -1.215 -7.819 1.375) 8.032 9.437 ( 0.190 -3.724 -6.300) 7.321 10.938 ( 10.471 1.341 2.678) 10.891 11.074 ( 2.823 32.216 1.398) 32.370 11.691 ( -13.599 6.830 5.571) 16.205 11.987 ( -3.110 0.762 -2.066) 3.811 12.553 ( 2.578 -12.860 -2.300) 13.316 12.634 ( -8.334 -0.934 -6.329) 10.506 12.959 ( 18.729 -2.590 10.378) 21.568 14.384 ( 11.703 -9.748 2.449) 15.427 17.522 ( -5.188 -1.145 -20.755) 21.424 18.575 ( 7.140 -2.076 14.079) 15.922 19.059 ( 14.413 7.959 -1.515) 16.534 19.395 ( 12.599 -2.839 3.017) 13.262 21.005 ( -7.771 12.872 -14.320) 20.764 21.981 ( -19.133 -16.179 4.004) 25.374 23.612 ( 3.308 -1.886 3.166) 4.952 23.970 ( 4.577 4.106 3.840) 7.249 ======================= Grid point 131 (55/361) ======================= q-point: (-0.40 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( -8.952 24.107 -1.686) 25.770 1.909 ( -19.871 18.923 -5.270) 27.941 3.044 ( -12.071 27.262 -8.799) 31.086 3.259 ( -14.343 -3.358 1.502) 14.808 3.434 ( 0.394 -13.064 3.507) 13.532 3.698 ( -1.110 -0.352 2.465) 2.726 4.021 ( -10.815 -8.784 10.050) 17.179 4.781 ( -4.026 -11.270 7.570) 14.161 4.942 ( -9.799 -9.024 4.058) 13.926 5.143 ( 0.236 -6.658 -2.041) 6.968 5.211 ( -8.385 -11.916 -1.120) 14.613 5.759 ( -2.428 3.505 -1.221) 4.435 5.971 ( -10.662 -2.316 2.596) 11.215 6.663 ( 0.044 5.736 0.988) 5.820 7.011 ( -4.736 -1.125 5.330) 7.218 7.596 ( 3.563 -5.358 -0.825) 6.487 8.222 ( 1.097 -11.695 -0.855) 11.777 8.824 ( 0.545 9.854 6.389) 11.757 9.312 ( -2.598 -9.765 0.040) 10.104 9.447 ( 1.732 -6.037 -2.431) 6.734 10.803 ( 2.367 32.824 -2.536) 33.007 11.047 ( 3.972 6.542 2.786) 8.144 11.509 ( -13.358 7.412 6.954) 16.785 11.913 ( -2.928 0.611 -1.870) 3.528 12.387 ( -4.789 0.342 -7.893) 9.239 12.761 ( 1.964 -11.426 2.210) 11.802 13.353 ( 16.121 -2.329 9.473) 18.843 14.648 ( 11.364 -13.360 -3.157) 17.821 17.235 ( -3.731 0.795 -14.992) 15.470 18.843 ( 6.722 0.390 10.182) 12.207 19.191 ( 19.568 8.378 -2.547) 21.438 19.655 ( 14.391 1.868 7.051) 16.133 20.602 ( -9.686 7.809 -15.785) 20.099 21.843 ( -28.341 -15.574 4.948) 32.715 23.678 ( 1.194 -0.082 1.025) 1.576 24.084 ( 5.357 1.004 6.580) 8.544 ======================= Grid point 132 (56/361) ======================= q-point: (-0.30 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.350 ( -11.957 24.649 1.186) 27.422 1.431 ( -8.547 27.782 2.472) 29.172 2.518 ( -10.290 42.670 7.100) 44.463 3.232 ( -6.798 -12.597 1.349) 14.378 3.588 ( -1.588 -12.990 3.211) 13.475 3.715 ( -1.342 1.873 4.047) 4.657 4.144 ( -15.734 -13.474 21.982) 30.204 4.827 ( -11.926 -13.363 -5.396) 18.706 4.883 ( -7.387 -7.198 3.842) 11.006 5.203 ( -0.363 -9.707 0.693) 9.738 5.269 ( -3.173 -11.790 3.491) 12.699 5.650 ( -5.695 3.017 1.754) 6.679 5.986 ( 1.899 -3.081 2.229) 4.251 6.635 ( 1.735 4.888 -0.304) 5.195 6.944 ( -8.961 2.511 2.443) 9.622 7.649 ( 3.954 -4.868 -7.246) 9.583 8.346 ( 2.970 -8.592 1.638) 9.237 8.839 ( -0.021 1.565 0.355) 1.605 9.359 ( -4.090 -11.856 1.185) 12.597 9.508 ( 1.350 -4.220 0.555) 4.465 10.494 ( 1.719 33.031 -4.013) 33.318 11.024 ( -0.568 11.317 3.671) 11.911 11.375 ( -10.558 7.132 10.003) 16.198 11.859 ( -1.044 0.074 -1.766) 2.053 12.296 ( -0.088 -0.093 -1.541) 1.547 12.880 ( 0.806 -9.005 -0.812) 9.077 13.604 ( 8.401 -2.051 -3.841) 9.463 14.837 ( 8.905 -14.469 -10.499) 19.972 17.139 ( 2.114 -0.307 7.117) 7.430 18.951 ( 1.290 0.411 -0.635) 1.496 19.404 ( 23.694 8.747 -1.069) 25.280 19.864 ( 8.151 11.996 6.291) 15.809 20.281 ( -3.750 -1.279 -12.242) 12.867 21.622 ( -32.300 -14.625 9.189) 36.628 23.686 ( 0.521 1.028 -0.169) 1.165 24.204 ( 0.293 -2.019 2.560) 3.273 ======================= Grid point 133 (57/361) ======================= q-point: (-0.20 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.185 ( 11.134 22.750 15.374) 29.629 1.225 ( 1.406 27.620 9.906) 29.376 2.259 ( -2.947 38.763 28.286) 48.076 3.299 ( -0.042 -10.622 -0.058) 10.622 3.647 ( -5.446 -2.972 3.050) 6.913 3.789 ( -1.128 -6.495 7.697) 10.134 4.253 ( -29.206 -13.519 26.997) 42.008 4.692 ( -3.644 -10.213 -9.808) 14.621 4.987 ( 0.179 -14.284 4.903) 15.103 5.276 ( -1.176 -7.760 -1.975) 8.093 5.370 ( 1.437 -6.042 1.434) 6.374 5.655 ( 1.225 2.063 8.525) 8.856 6.056 ( -2.699 -4.134 3.090) 5.824 6.590 ( -0.946 5.839 -1.625) 6.134 6.874 ( -0.704 0.447 3.334) 3.437 7.607 ( 0.239 -3.388 -11.022) 11.534 8.418 ( 4.872 7.123 -8.318) 11.986 8.775 ( -7.796 -8.101 1.384) 11.327 9.448 ( -1.904 -13.137 -1.916) 13.411 9.585 ( 2.718 -2.559 3.993) 5.466 10.207 ( 4.118 28.259 -2.737) 28.688 10.952 ( 0.195 14.091 4.514) 14.797 11.342 ( -8.627 4.075 14.894) 17.688 11.838 ( 1.380 -0.018 -2.251) 2.641 12.327 ( 3.600 1.171 1.730) 4.162 12.922 ( -0.735 -6.646 -3.862) 7.722 13.452 ( -3.707 8.244 -19.842) 21.804 14.881 ( 3.245 -11.857 -15.716) 19.953 17.541 ( 8.889 -16.967 28.995) 34.750 18.878 ( -5.149 -2.470 -7.395) 9.343 19.587 ( 9.507 6.623 -1.801) 11.726 19.765 ( -7.273 7.732 -1.609) 10.736 20.271 ( 9.457 1.310 -1.658) 9.690 21.547 ( -12.645 -12.511 16.186) 24.050 23.684 ( 0.863 0.499 -0.264) 1.031 24.094 ( -10.257 5.175 -9.287) 14.773 ======================= Grid point 134 (58/361) ======================= q-point: (-0.10 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.221 ( 7.073 18.758 16.477) 25.950 1.527 ( 19.107 13.276 22.877) 32.629 2.470 ( 14.291 24.987 40.157) 49.408 3.397 ( 4.972 -7.652 -3.629) 9.820 3.611 ( -12.342 -2.387 9.068) 15.500 3.913 ( -1.281 -5.438 5.937) 8.152 4.311 ( -18.860 -8.586 24.791) 32.311 4.682 ( 2.976 -9.047 -8.510) 12.772 5.172 ( -2.239 -13.625 1.404) 13.879 5.265 ( 1.016 -3.926 -5.913) 7.170 5.417 ( 2.230 -0.031 -3.478) 4.132 5.848 ( 3.729 -2.502 15.588) 16.222 6.056 ( -6.754 -5.029 3.918) 9.287 6.487 ( -4.043 3.508 -0.671) 5.394 6.969 ( 5.563 -4.282 -0.655) 7.051 7.459 ( -2.246 -0.719 -13.068) 13.279 8.170 ( -1.989 22.730 -4.022) 23.168 8.883 ( -2.183 -11.884 7.121) 14.025 9.454 ( -0.482 -3.275 -4.650) 5.708 9.628 ( -1.622 0.998 -3.241) 3.759 10.128 ( 10.600 5.841 -1.626) 12.212 10.891 ( 5.167 14.763 0.626) 15.654 11.406 ( -9.474 -2.802 16.655) 19.365 11.842 ( 3.974 0.359 -2.853) 4.905 12.347 ( 4.138 8.532 -4.057) 10.314 12.900 ( -0.927 -3.214 -2.855) 4.398 13.097 ( -5.497 9.998 -6.341) 13.053 14.764 ( -3.594 -8.145 -18.129) 20.197 18.124 ( 4.594 -20.718 16.905) 27.132 18.706 ( -8.204 -6.154 -10.420) 14.621 19.412 ( -18.570 13.484 2.602) 23.097 19.583 ( -15.886 -2.187 2.323) 16.203 20.468 ( 17.527 0.176 3.119) 17.803 21.877 ( 14.947 -15.993 7.411) 23.111 23.639 ( -7.608 12.583 -9.657) 17.592 23.737 ( -1.265 5.828 -1.674) 6.194 ======================= Grid point 138 (59/361) ======================= q-point: ( 0.30 -0.70 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( -4.902 0.000 0.451) 4.922 2.731 ( -16.447 0.000 -4.781) 17.128 3.281 ( 1.794 -0.000 -2.627) 3.181 3.316 ( -11.277 0.000 -6.779) 13.158 3.510 ( -2.238 0.000 3.680) 4.308 4.029 ( -15.543 0.000 15.522) 21.966 4.402 ( 1.423 -0.000 -1.051) 1.769 4.460 ( 2.432 -0.000 -17.552) 17.720 4.833 ( -10.396 0.000 -5.952) 11.980 4.883 ( 4.788 -0.000 2.788) 5.540 5.587 ( -17.549 0.000 -3.347) 17.865 5.882 ( 0.472 -0.000 -5.201) 5.223 6.194 ( -15.665 0.000 20.759) 26.006 6.756 ( 3.993 -0.000 6.159) 7.340 6.958 ( -5.107 0.000 -2.327) 5.612 7.382 ( -1.633 0.000 3.637) 3.987 7.786 ( 2.505 -0.000 10.704) 10.993 9.078 ( -4.153 0.000 3.108) 5.187 9.112 ( -2.949 0.000 1.610) 3.360 9.528 ( -2.207 0.000 -10.999) 11.218 10.672 ( 16.842 -0.000 7.153) 18.298 11.691 ( 0.949 -0.000 4.213) 4.318 11.906 ( 9.141 -0.000 -1.206) 9.220 11.996 ( -10.562 0.000 10.630) 14.985 12.060 ( 0.700 -0.000 -3.959) 4.021 12.571 ( 12.428 -0.000 6.231) 13.903 12.936 ( -8.892 0.000 -15.231) 17.637 14.056 ( 9.039 -0.000 6.279) 11.006 17.827 ( -6.180 0.000 -19.796) 20.738 18.289 ( 3.161 -0.000 11.902) 12.314 19.040 ( 4.861 -0.000 7.638) 9.054 19.140 ( 16.519 -0.000 -9.205) 18.910 21.650 ( -4.517 0.000 -23.565) 23.994 21.706 ( -9.401 0.000 14.737) 17.480 23.472 ( 5.038 -0.000 4.064) 6.473 23.959 ( 2.582 -0.000 1.601) 3.038 ======================= Grid point 140 (60/361) ======================= q-point: (-0.60 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.399 ( -9.103 14.124 -3.189) 17.103 2.506 ( -11.984 3.094 -0.624) 12.392 3.077 ( -12.684 -5.252 -6.835) 15.336 3.153 ( -6.979 -9.037 -7.125) 13.459 3.642 ( 3.018 0.712 6.975) 7.633 3.970 ( -14.957 -2.477 6.565) 16.521 4.200 ( -6.321 20.737 -8.957) 23.457 4.434 ( -1.097 -7.574 5.345) 9.335 4.705 ( -3.811 -11.396 -5.861) 13.370 4.974 ( -0.565 -3.092 5.039) 5.939 5.313 ( -16.187 -0.356 -3.725) 16.614 5.845 ( 3.471 1.342 -4.491) 5.833 6.120 ( -21.686 -0.680 10.694) 24.189 6.832 ( -1.463 5.496 -0.479) 5.708 6.908 ( 1.104 -1.842 6.220) 6.580 7.418 ( 0.008 -2.987 1.930) 3.556 7.942 ( 1.749 -5.098 5.453) 7.667 9.026 ( -3.925 5.866 4.115) 8.170 9.128 ( -2.862 -5.225 1.747) 6.208 9.405 ( 1.467 -0.581 -8.401) 8.548 10.950 ( 12.120 0.279 5.064) 13.139 11.609 ( 0.689 22.038 1.890) 22.129 11.814 ( -10.383 10.965 5.371) 16.028 11.993 ( -3.389 0.001 -2.159) 4.018 12.214 ( 3.835 -23.409 1.376) 23.761 12.642 ( -8.809 0.421 -11.972) 14.870 12.919 ( 18.646 -1.317 10.750) 21.563 14.256 ( 10.498 -4.002 1.120) 11.291 17.510 ( -5.594 -0.286 -18.799) 19.616 18.550 ( 8.229 -0.694 16.067) 18.066 19.198 ( 15.726 7.314 -3.154) 17.629 19.320 ( 14.124 -5.484 2.873) 15.421 21.220 ( -9.236 9.420 -20.787) 24.620 21.731 ( -17.455 -10.222 8.825) 22.069 23.588 ( 3.464 -0.735 4.388) 5.638 24.019 ( 4.071 1.378 1.929) 4.711 ======================= Grid point 141 (61/361) ======================= q-point: (-0.50 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( -9.340 19.281 -1.455) 21.473 2.238 ( -11.804 17.057 -1.739) 20.816 2.937 ( -10.758 -13.915 -2.888) 17.824 3.167 ( -2.829 -15.111 2.338) 15.550 3.646 ( -9.123 8.922 -4.836) 13.646 3.766 ( 0.239 13.664 -6.035) 14.940 3.926 ( -10.663 4.794 12.832) 17.359 4.594 ( -2.226 -8.658 7.506) 11.673 4.737 ( -4.657 -15.808 0.909) 16.505 5.045 ( -1.050 -4.071 -1.581) 4.492 5.052 ( -17.674 -4.989 1.199) 18.403 5.823 ( -3.334 3.652 -0.402) 4.962 5.936 ( -10.426 -2.175 1.451) 10.749 6.751 ( -0.290 4.263 -2.423) 4.912 7.009 ( -0.733 0.304 6.300) 6.350 7.481 ( 1.335 -6.603 -0.594) 6.763 8.056 ( 0.101 -6.387 3.828) 7.447 8.972 ( -2.458 6.449 3.272) 7.638 9.149 ( -2.964 -7.033 -0.672) 7.662 9.388 ( 3.343 -1.964 -2.208) 4.462 11.116 ( 6.819 3.327 3.145) 8.213 11.403 ( 1.653 29.715 -0.282) 29.762 11.637 ( -11.878 8.231 6.286) 15.759 11.916 ( -3.476 -0.106 -2.202) 4.116 12.379 ( -2.089 -3.566 -8.590) 9.532 12.504 ( -0.867 -15.527 1.965) 15.675 13.301 ( 14.651 -2.692 9.202) 17.509 14.441 ( 10.220 -8.904 -4.118) 14.166 17.249 ( -3.403 0.607 -12.799) 13.258 18.849 ( 7.124 0.290 11.767) 13.758 19.317 ( 20.390 5.588 -6.551) 22.134 19.663 ( 17.885 -0.668 10.861) 20.935 20.746 ( -12.258 7.541 -20.068) 24.695 21.613 ( -24.787 -10.075 6.129) 27.450 23.674 ( 1.044 -0.276 3.409) 3.576 24.098 ( 4.700 0.572 2.342) 5.283 ======================= Grid point 142 (62/361) ======================= q-point: (-0.40 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.776 ( -8.092 22.850 1.545) 24.290 1.911 ( -5.497 25.861 3.347) 26.649 2.938 ( -5.037 -11.880 0.868) 12.933 3.224 ( -9.221 21.120 -4.275) 23.438 3.340 ( -0.794 -9.283 6.813) 11.542 3.753 ( 0.379 1.581 3.516) 3.873 3.959 ( -11.393 -4.962 16.323) 20.515 4.632 ( -5.731 -8.798 -4.442) 11.401 4.754 ( -10.309 -6.765 -2.316) 12.546 4.979 ( -0.610 -15.624 2.685) 15.865 5.106 ( -6.289 -6.056 8.662) 12.299 5.692 ( -6.682 1.654 1.412) 7.027 5.951 ( 2.851 -1.104 1.294) 3.320 6.694 ( 1.954 2.189 -4.286) 5.195 7.007 ( -5.408 4.076 3.987) 7.858 7.539 ( 2.964 -6.900 -5.643) 9.393 8.178 ( -1.023 -8.914 7.193) 11.500 8.907 ( -1.073 5.061 -2.922) 5.942 9.164 ( -3.124 -8.945 -0.764) 9.506 9.461 ( 2.674 -2.067 3.460) 4.837 11.088 ( 3.409 29.094 -4.325) 29.610 11.198 ( -0.689 11.373 4.706) 12.327 11.506 ( -9.089 7.365 8.096) 14.227 11.857 ( -1.492 -0.346 -1.991) 2.512 12.298 ( 0.412 0.199 -1.520) 1.588 12.668 ( 0.371 -15.239 -0.531) 15.253 13.544 ( 5.577 -3.784 0.867) 6.795 14.587 ( 8.356 -12.592 -9.556) 17.880 17.146 ( 1.798 0.701 1.017) 2.182 18.958 ( 1.286 0.352 -2.672) 2.986 19.524 ( 20.610 5.047 -1.393) 21.265 20.047 ( 18.185 7.185 12.952) 23.454 20.286 ( -12.507 2.588 -18.255) 22.279 21.414 ( -24.908 -9.427 7.152) 27.576 23.701 ( -0.693 0.669 1.462) 1.750 24.175 ( 1.838 -1.285 0.689) 2.346 ======================= Grid point 143 (63/361) ======================= q-point: (-0.30 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( 5.213 22.810 9.700) 25.329 1.726 ( 2.439 28.069 7.586) 29.178 2.890 ( -0.803 28.524 11.362) 30.714 3.084 ( -1.099 -12.387 1.627) 12.541 3.502 ( -1.466 -10.645 5.730) 12.178 3.766 ( -2.211 2.098 4.117) 5.122 4.054 ( -18.674 -8.502 22.723) 30.616 4.517 ( -1.884 -8.716 -11.660) 14.679 4.755 ( -0.523 -11.911 -0.169) 11.924 5.135 ( -0.212 -8.540 3.352) 9.177 5.229 ( 0.095 -9.361 7.177) 11.796 5.682 ( 0.097 1.063 5.926) 6.022 6.008 ( -0.502 -1.372 2.511) 2.905 6.655 ( 2.233 1.217 -5.485) 6.046 6.921 ( -4.504 4.909 2.615) 7.157 7.530 ( 1.060 -4.751 -9.694) 10.848 8.363 ( 0.236 -10.880 9.288) 14.307 8.759 ( -3.385 5.509 -8.277) 10.504 9.221 ( 0.407 -11.062 -1.411) 11.159 9.557 ( -0.221 -1.420 6.058) 6.226 10.769 ( 2.133 33.526 -5.226) 33.997 11.157 ( -2.364 8.942 5.232) 10.626 11.449 ( -6.238 6.908 10.329) 13.904 11.836 ( 1.551 -0.308 -2.215) 2.721 12.350 ( 4.812 1.445 4.200) 6.548 12.761 ( -0.718 -11.668 -3.171) 12.113 13.507 ( -5.175 -0.471 -10.506) 11.721 14.650 ( 4.557 -13.303 -14.805) 20.419 17.353 ( 7.953 -5.906 17.880) 20.441 18.845 ( -4.776 -1.390 -11.624) 12.644 19.678 ( 5.350 3.986 0.297) 6.679 19.868 ( -11.910 3.107 -13.227) 18.068 20.368 ( 14.991 9.432 8.414) 19.608 21.368 ( -5.861 -8.900 11.251) 15.496 23.691 ( -1.077 0.287 0.142) 1.123 24.141 ( -4.502 1.085 -4.867) 6.718 ======================= Grid point 144 (64/361) ======================= q-point: (-0.20 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( 7.131 26.318 7.869) 28.379 1.767 ( 17.036 13.808 16.588) 27.496 2.928 ( 8.530 23.511 25.595) 35.785 3.228 ( 4.606 -10.996 -1.473) 12.013 3.567 ( -8.497 -2.510 6.807) 11.173 3.812 ( -0.249 -5.111 4.504) 6.817 4.158 ( -13.624 -7.537 22.604) 27.448 4.512 ( 5.264 -9.319 -8.011) 13.369 4.909 ( 1.442 -14.650 2.784) 14.981 5.202 ( 0.762 -3.746 -1.428) 4.081 5.382 ( 2.796 -4.351 2.751) 5.858 5.807 ( 3.106 -2.403 10.275) 11.000 6.007 ( -5.626 -0.494 3.355) 6.569 6.576 ( -1.670 4.587 -4.019) 6.324 6.905 ( 1.005 -1.957 -0.077) 2.201 7.421 ( -1.599 -2.590 -12.167) 12.541 8.499 ( 2.474 13.570 -2.761) 14.067 8.630 ( -5.577 -14.871 5.594) 16.838 9.315 ( 2.289 -10.804 -3.784) 11.674 9.610 ( -1.974 -0.547 3.961) 4.459 10.468 ( 3.324 27.722 -4.403) 28.266 11.099 ( -2.374 8.435 3.430) 9.410 11.442 ( -5.920 5.632 11.139) 13.814 11.848 ( 4.500 0.171 -2.969) 5.394 12.461 ( 6.677 4.949 2.729) 8.747 12.796 ( -1.199 -8.032 -2.223) 8.420 13.232 ( -9.482 4.232 -10.036) 14.441 14.586 ( -0.887 -11.382 -18.461) 21.706 17.815 ( 7.963 -13.482 20.881) 26.099 18.613 ( -8.008 -4.285 -14.017) 16.702 19.531 ( -19.550 -2.130 -0.043) 19.666 19.619 ( -8.183 8.019 -2.501) 11.727 20.558 ( 16.155 9.763 3.937) 19.282 21.663 ( 15.144 -9.699 8.665) 19.963 23.674 ( -1.402 -1.002 -1.359) 2.195 23.921 ( -7.267 8.574 -8.057) 13.829 ======================= Grid point 145 (65/361) ======================= q-point: (-0.10 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 8.980 16.261 12.483) 22.381 2.135 ( 15.298 10.307 21.703) 28.483 3.247 ( 14.509 7.781 15.890) 22.881 3.349 ( 6.121 -6.376 -2.669) 9.233 3.576 ( -6.205 -0.030 15.312) 16.521 3.897 ( 0.745 -7.287 -1.256) 7.432 4.356 ( -2.505 -4.231 18.096) 18.752 4.570 ( 1.413 -4.082 -3.081) 5.306 5.035 ( -5.763 -9.411 2.964) 11.426 5.237 ( 3.738 -3.530 -1.066) 5.251 5.432 ( 3.072 2.762 -1.670) 4.456 5.968 ( -7.151 0.247 7.135) 10.105 6.067 ( 5.774 -10.109 12.113) 16.801 6.446 ( -5.044 5.941 -1.651) 7.966 6.907 ( -2.242 -5.242 -6.299) 8.496 7.292 ( 1.843 -1.936 -10.551) 10.885 8.309 ( -4.947 18.281 1.958) 19.040 8.804 ( -1.332 -14.643 4.093) 15.262 9.352 ( -0.715 -5.259 -4.337) 6.854 9.629 ( 1.632 1.683 2.043) 3.110 10.288 ( 4.593 15.034 -3.356) 16.074 11.028 ( -0.540 4.687 -1.217) 4.872 11.444 ( -5.423 3.385 9.323) 11.304 11.889 ( 6.969 0.408 -2.931) 7.571 12.455 ( 3.833 11.356 -3.407) 12.461 12.800 ( -5.504 -5.026 -2.623) 7.902 13.080 ( -0.545 1.487 5.185) 5.422 14.389 ( -6.247 -8.146 -19.822) 22.322 18.189 ( -1.791 -10.275 10.135) 14.543 18.443 ( 2.288 -8.162 -10.327) 13.360 19.300 ( -26.944 7.212 13.380) 30.936 19.347 ( -8.578 2.425 -8.745) 12.487 20.765 ( 15.446 2.728 3.213) 16.011 22.051 ( 18.164 -8.572 0.231) 20.086 23.545 ( -4.786 9.240 -7.274) 12.696 23.759 ( 0.372 1.443 -0.250) 1.511 ======================= Grid point 150 (66/361) ======================= q-point: ( 0.40 -0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( -9.843 0.000 -0.300) 9.848 2.409 ( -6.288 0.000 1.537) 6.473 2.786 ( -12.481 0.000 -5.222) 13.530 2.983 ( -4.486 0.000 1.056) 4.609 3.679 ( -2.753 0.000 -0.516) 2.801 3.807 ( -7.774 0.000 -3.148) 8.387 4.260 ( -7.523 0.000 1.239) 7.625 4.400 ( -0.590 0.000 9.341) 9.360 4.545 ( -2.522 0.000 -1.306) 2.840 5.005 ( -6.546 0.000 10.505) 12.378 5.016 ( -15.933 0.000 -7.942) 17.803 5.879 ( 5.005 -0.000 -1.652) 5.271 5.894 ( -19.339 0.000 2.584) 19.511 6.796 ( -1.788 0.000 -3.527) 3.954 7.011 ( 3.461 -0.000 4.465) 5.649 7.411 ( -1.216 0.000 1.668) 2.064 8.000 ( 0.132 -0.000 4.952) 4.954 9.037 ( -3.576 0.000 1.679) 3.951 9.082 ( -2.335 0.000 0.389) 2.368 9.369 ( 3.434 -0.000 -2.589) 4.300 11.144 ( 7.318 -0.000 4.280) 8.477 11.623 ( -8.740 0.000 2.383) 9.059 11.913 ( -3.163 0.000 -3.254) 4.538 11.935 ( -4.541 0.000 4.811) 6.615 12.122 ( 6.248 -0.000 -0.880) 6.309 12.421 ( -6.116 0.000 -6.797) 9.144 13.276 ( 14.280 -0.000 9.159) 16.965 14.358 ( 9.812 -0.000 -4.379) 10.745 17.254 ( -3.242 0.000 -12.217) 12.639 18.852 ( 7.282 -0.000 12.260) 14.259 19.371 ( 20.401 -0.000 -9.808) 22.636 19.652 ( 19.015 -0.000 13.998) 23.612 20.824 ( -12.915 0.000 -23.336) 26.672 21.514 ( -23.512 0.000 8.426) 24.976 23.671 ( 1.034 -0.000 4.267) 4.390 24.103 ( 4.396 -0.000 1.007) 4.510 ======================= Grid point 152 (67/361) ======================= q-point: (-0.50 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( -5.841 15.148 1.279) 16.286 2.308 ( -3.727 16.064 5.478) 17.376 2.688 ( -6.565 -11.987 2.516) 13.897 3.028 ( -3.616 -13.422 1.681) 14.002 3.586 ( -3.059 8.521 -1.996) 9.271 3.711 ( -3.602 -4.437 0.256) 5.721 4.099 ( -3.785 16.216 6.474) 17.866 4.521 ( -4.076 -3.188 0.889) 5.251 4.620 ( -5.576 -11.750 7.887) 15.210 4.725 ( -6.495 -7.193 -8.312) 12.768 5.038 ( -9.299 -1.848 12.019) 15.308 5.710 ( -7.481 0.463 0.655) 7.524 5.940 ( 3.346 -0.273 1.329) 3.610 6.721 ( 1.232 0.879 -7.146) 7.304 7.069 ( -0.445 2.249 2.261) 3.220 7.435 ( -0.345 -3.727 0.934) 3.858 8.062 ( -2.006 -3.540 5.655) 6.966 8.986 ( -2.206 3.045 -1.718) 4.134 9.054 ( -1.220 -3.412 -2.542) 4.427 9.430 ( 2.229 -1.127 4.412) 5.070 11.249 ( 1.954 2.307 4.041) 5.047 11.526 ( -4.779 6.211 1.793) 8.039 11.751 ( -2.835 22.913 0.256) 23.089 11.853 ( -1.834 0.861 -1.454) 2.494 12.277 ( 2.902 -7.871 -1.811) 8.583 12.363 ( -1.750 -12.467 1.299) 12.656 13.493 ( 4.699 -1.637 2.494) 5.566 14.425 ( 8.085 -4.957 -9.043) 13.104 17.157 ( 1.858 0.363 -1.044) 2.162 18.962 ( 1.349 0.130 -3.836) 4.068 19.585 ( 19.770 1.786 -2.587) 20.019 20.107 ( 19.345 0.799 13.156) 23.409 20.359 ( -12.593 3.527 -17.750) 22.047 21.291 ( -22.578 -3.921 7.201) 24.021 23.709 ( -1.462 0.212 2.608) 2.997 24.159 ( 2.594 -0.448 -0.575) 2.694 ======================= Grid point 153 (68/361) ======================= q-point: (-0.40 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.974 ( 1.242 19.129 5.577) 19.964 2.200 ( 1.953 24.668 8.852) 26.280 2.817 ( -0.129 -14.189 5.245) 15.128 3.091 ( -3.391 -10.752 -0.915) 11.311 3.481 ( 1.611 9.832 3.975) 10.727 3.758 ( -3.591 -4.782 3.974) 7.181 4.047 ( -7.107 9.259 16.093) 19.881 4.402 ( -1.945 -3.997 -12.778) 13.529 4.586 ( -2.101 -5.716 1.550) 6.284 4.925 ( -0.804 -15.346 9.902) 18.281 5.101 ( -1.324 -4.154 8.111) 9.208 5.695 ( 0.504 0.496 4.030) 4.092 5.997 ( 0.355 -0.155 3.127) 3.151 6.655 ( 3.634 -0.575 -9.121) 9.835 7.017 ( -4.454 4.704 0.971) 6.550 7.460 ( 0.450 -2.620 -3.197) 4.158 8.160 ( -3.461 -9.920 7.541) 12.933 8.875 ( -1.056 6.339 -5.472) 8.440 9.066 ( 0.841 -6.518 -2.189) 6.927 9.531 ( -0.523 -1.334 7.663) 7.796 11.257 ( -2.064 6.204 3.443) 7.390 11.351 ( 0.743 24.944 -5.505) 25.555 11.575 ( -6.044 8.742 7.839) 13.206 11.828 ( 1.702 -0.479 -2.390) 2.973 12.371 ( 5.565 0.155 5.091) 7.544 12.504 ( -0.876 -16.636 -0.519) 16.667 13.478 ( -6.054 -1.890 -5.729) 8.546 14.445 ( 5.143 -8.754 -13.551) 16.933 17.292 ( 7.624 -1.657 11.576) 13.960 18.827 ( -4.239 -0.657 -14.423) 15.047 19.736 ( 4.960 2.538 -0.759) 5.623 19.886 ( -13.206 -0.309 -18.020) 22.343 20.562 ( 18.045 10.701 15.655) 26.177 21.218 ( -5.877 -7.725 9.056) 13.275 23.694 ( -2.772 0.065 0.486) 2.815 24.150 ( -1.438 0.129 -3.470) 3.758 ======================= Grid point 154 (69/361) ======================= q-point: (-0.30 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.008 ( 10.965 13.092 10.550) 20.073 2.114 ( 5.436 26.504 5.465) 27.602 3.016 ( 5.290 -11.674 0.750) 12.839 3.168 ( 2.652 -0.456 8.617) 9.028 3.549 ( 1.413 1.259 8.727) 8.930 3.746 ( -5.492 -3.127 1.111) 6.417 4.116 ( -6.289 5.205 21.679) 23.165 4.370 ( 8.373 -6.214 -7.555) 12.876 4.680 ( -0.229 -10.089 4.848) 11.196 5.110 ( -0.440 -7.912 3.972) 8.864 5.273 ( 4.665 -6.417 6.897) 10.513 5.776 ( 2.392 -0.798 5.286) 5.857 6.017 ( -3.063 0.978 3.752) 4.941 6.611 ( 4.074 -0.328 -8.231) 9.190 6.919 ( -4.599 2.666 -0.188) 5.319 7.397 ( -1.249 0.648 -7.605) 7.734 8.316 ( -4.581 -16.776 6.818) 18.679 8.734 ( 0.602 10.389 -4.135) 11.198 9.136 ( 3.057 -8.640 -2.422) 9.479 9.609 ( -2.787 0.055 7.992) 8.465 11.008 ( 2.018 31.324 -7.867) 32.360 11.202 ( -7.752 3.650 3.229) 9.157 11.559 ( -2.987 6.499 9.082) 11.560 11.846 ( 4.960 -0.470 -3.296) 5.974 12.507 ( 4.406 -2.866 0.331) 5.266 12.638 ( 2.246 -6.805 6.234) 9.498 13.257 ( -12.408 -0.649 -8.734) 15.187 14.386 ( 0.973 -10.189 -17.705) 20.451 17.642 ( 9.620 -6.370 18.335) 21.663 18.554 ( -7.881 -2.439 -16.849) 18.760 19.493 ( -15.908 -1.700 -9.861) 18.793 19.720 ( -5.768 3.548 0.127) 6.773 20.786 ( 12.448 14.881 7.328) 20.738 21.495 ( 14.033 -9.800 10.269) 19.960 23.653 ( -3.137 -1.187 -1.164) 3.551 24.027 ( -4.515 3.872 -6.357) 8.705 ======================= Grid point 155 (70/361) ======================= q-point: (-0.20 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.026 ( 6.319 22.117 3.572) 23.278 2.280 ( 15.857 6.358 15.781) 23.258 3.169 ( 6.697 -8.366 -3.945) 11.419 3.324 ( 3.657 -2.437 3.145) 5.404 3.682 ( 1.879 7.425 18.551) 20.070 3.736 ( -3.574 -9.535 -1.269) 10.261 4.317 ( 5.814 1.062 15.489) 16.578 4.512 ( 6.583 -2.499 4.649) 8.438 4.841 ( -2.794 -11.250 7.375) 13.739 5.169 ( -0.811 -4.390 0.391) 4.482 5.445 ( 4.183 -1.188 4.530) 6.279 5.905 ( 3.389 -6.239 3.541) 7.934 5.998 ( -4.548 1.707 5.977) 7.702 6.558 ( 1.116 4.777 -4.106) 6.397 6.836 ( -4.572 -2.337 -4.230) 6.653 7.269 ( 0.289 0.633 -8.855) 8.883 8.430 ( -9.290 -13.923 1.038) 16.770 8.653 ( 4.005 7.658 2.175) 8.912 9.225 ( 2.298 -8.035 -2.586) 8.748 9.655 ( -1.329 1.885 7.070) 7.437 10.688 ( 2.961 27.304 -6.649) 28.257 11.065 ( -11.167 0.787 -0.478) 11.205 11.570 ( -0.739 8.659 7.969) 11.791 11.892 ( 7.346 -0.182 -3.760) 8.255 12.547 ( 1.847 -3.492 -3.973) 5.603 12.751 ( -3.647 2.202 1.537) 4.528 13.075 ( -3.604 -2.175 4.444) 6.121 14.228 ( -3.504 -9.473 -20.036) 22.437 18.032 ( 4.724 -7.309 14.645) 17.036 18.317 ( -2.360 -5.699 -12.224) 13.692 19.227 ( -14.620 -4.834 -3.894) 15.883 19.547 ( -14.143 9.453 3.449) 17.358 20.882 ( 12.592 10.126 -0.150) 16.159 21.915 ( 17.601 -7.311 7.265) 20.396 23.595 ( -3.543 -1.281 -3.226) 4.960 23.846 ( -2.758 6.288 -5.332) 8.694 ======================= Grid point 156 (71/361) ======================= q-point: (-0.10 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( 3.733 10.232 5.640) 12.265 2.656 ( 14.219 5.517 18.578) 24.037 3.247 ( 3.123 -6.450 -6.299) 9.541 3.384 ( 0.735 -4.432 -0.041) 4.492 3.705 ( -2.276 -9.559 -8.019) 12.683 3.981 ( 8.144 5.137 21.892) 23.916 4.521 ( 14.012 0.477 -8.068) 16.176 4.633 ( -1.822 5.835 10.131) 11.833 4.951 ( -9.166 -5.220 12.046) 16.011 5.233 ( -0.257 -5.469 3.784) 6.656 5.536 ( 2.361 3.278 8.295) 9.227 5.973 ( -2.191 -1.472 5.883) 6.448 6.105 ( -0.523 -12.389 2.230) 12.599 6.444 ( -4.370 8.940 0.495) 9.964 6.723 ( -3.405 -2.807 -7.025) 8.295 7.233 ( 5.914 -2.371 -5.701) 8.550 8.330 ( -11.477 3.529 2.305) 12.227 8.741 ( 2.359 -6.086 2.224) 6.896 9.254 ( -0.932 -3.666 -2.932) 4.786 9.732 ( 3.325 1.234 5.732) 6.740 10.464 ( 4.076 20.748 -3.337) 21.407 10.893 ( -10.391 -6.235 -5.185) 13.181 11.583 ( 2.201 9.153 6.484) 11.431 11.961 ( 7.655 -0.204 -2.815) 8.159 12.541 ( 1.856 4.818 -1.414) 5.354 12.594 ( -10.930 -4.315 -3.800) 12.350 13.244 ( 6.311 0.985 11.478) 13.136 13.995 ( -6.625 -7.434 -18.145) 20.698 18.091 ( -5.028 -3.662 -2.066) 6.555 18.438 ( 10.883 -9.040 0.021) 14.148 19.073 ( -11.855 -6.216 0.477) 13.395 19.248 ( -17.745 15.890 3.490) 24.074 20.979 ( 10.796 1.235 -1.791) 11.013 22.237 ( 13.520 -1.866 2.069) 13.804 23.493 ( -1.514 4.187 -4.409) 6.266 23.759 ( -0.016 0.152 -1.451) 1.459 ======================= Grid point 162 (72/361) ======================= q-point: (-0.50 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( -0.744 -0.000 2.342) 2.457 2.496 ( 0.816 0.000 13.224) 13.250 2.648 ( 0.919 0.000 7.317) 7.375 2.896 ( -2.215 -0.000 -2.444) 3.298 3.602 ( -4.195 0.000 -0.500) 4.225 3.677 ( 1.297 -0.000 4.258) 4.451 4.181 ( -1.065 -0.000 4.820) 4.936 4.370 ( -1.889 -0.000 -15.022) 15.141 4.617 ( -1.332 0.000 9.651) 9.743 4.673 ( -4.911 -0.000 13.741) 14.593 5.067 ( -1.442 -0.000 8.349) 8.472 5.700 ( 0.868 -0.000 3.536) 3.641 5.997 ( 0.505 -0.000 3.477) 3.513 6.648 ( 3.809 -0.000 -10.490) 11.160 7.061 ( -2.850 -0.000 -1.969) 3.464 7.439 ( -0.955 -0.000 3.308) 3.443 8.063 ( -4.371 -0.000 4.709) 6.425 8.959 ( -0.814 -0.000 -2.208) 2.353 8.985 ( 0.954 0.000 -4.541) 4.640 9.517 ( -0.437 -0.000 8.288) 8.300 11.297 ( -3.769 -0.000 4.230) 5.666 11.542 ( -1.056 -0.000 3.445) 3.604 11.796 ( 2.623 -0.000 -4.968) 5.618 11.829 ( -3.659 -0.000 -5.064) 6.248 12.233 ( 0.127 -0.000 2.079) 2.083 12.397 ( 4.726 -0.000 7.982) 9.276 13.459 ( -6.328 -0.000 -4.435) 7.727 14.364 ( 5.298 -0.000 -13.027) 14.063 17.279 ( 7.543 -0.000 9.705) 12.291 18.821 ( -3.981 -0.000 -15.442) 15.947 19.761 ( 6.642 -0.000 -1.539) 6.818 19.879 ( -15.119 -0.000 -18.499) 23.891 20.676 ( 21.783 -0.000 18.744) 28.737 21.133 ( -9.056 -0.000 7.228) 11.586 23.694 ( -3.445 -0.000 0.622) 3.500 24.150 ( -0.408 -0.000 -3.174) 3.200 ======================= Grid point 164 (73/361) ======================= q-point: (-0.40 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 4.805 7.139 4.218) 9.583 2.540 ( 0.843 19.204 7.526) 20.643 2.843 ( 8.721 -5.504 5.680) 11.773 3.002 ( 4.965 -13.941 3.417) 15.188 3.573 ( -2.079 0.743 6.995) 7.335 3.688 ( -4.775 -2.404 -1.828) 5.650 4.249 ( 6.658 3.675 -1.711) 7.795 4.308 ( 6.679 -0.766 4.285) 7.973 4.635 ( -3.389 7.844 11.221) 14.104 4.893 ( -2.996 -15.348 12.152) 19.804 5.203 ( 6.622 -1.603 6.085) 9.135 5.772 ( 2.511 0.058 3.177) 4.050 6.031 ( -2.221 0.417 4.243) 4.807 6.596 ( 6.863 -0.678 -10.467) 12.534 6.956 ( -5.738 0.993 -3.794) 6.950 7.446 ( -1.347 3.405 0.918) 3.775 8.068 ( -6.955 -9.110 3.213) 11.904 8.887 ( 1.257 7.011 -2.777) 7.645 9.008 ( 2.543 -6.111 -2.203) 6.976 9.608 ( -2.319 -0.053 9.822) 10.092 11.241 ( -9.780 1.019 2.416) 10.126 11.499 ( 4.332 19.196 -9.547) 21.872 11.661 ( -3.452 6.325 6.420) 9.651 11.821 ( 4.925 -3.219 -5.011) 7.729 12.310 ( -1.694 -12.440 0.253) 12.557 12.623 ( 8.169 0.926 13.645) 15.931 13.237 ( -14.066 -0.891 -7.874) 16.144 14.254 ( 1.817 -4.073 -16.861) 17.441 17.573 ( 10.151 -1.759 16.045) 19.068 18.525 ( -7.617 -0.807 -18.502) 20.025 19.473 ( -14.321 -0.563 -14.414) 20.327 19.757 ( -4.724 0.892 1.094) 4.930 21.055 ( 10.395 14.723 8.861) 20.084 21.301 ( 13.575 -12.195 12.057) 21.872 23.637 ( -4.270 -0.503 -1.259) 4.480 24.070 ( -2.805 1.122 -5.492) 6.268 ======================= Grid point 165 (74/361) ======================= q-point: (-0.30 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.351 ( 11.573 5.651 7.429) 14.868 2.421 ( 2.760 16.647 0.139) 16.874 3.050 ( 9.966 -3.790 -0.569) 10.678 3.244 ( 8.225 -7.074 2.888) 11.226 3.569 ( -7.852 -6.849 -6.473) 12.267 3.749 ( 0.327 -0.370 22.270) 22.275 4.352 ( 16.465 -0.287 -5.707) 17.428 4.525 ( 4.700 3.182 17.252) 18.162 4.697 ( -2.847 -1.074 11.677) 12.067 5.064 ( -3.450 -8.019 5.279) 10.201 5.407 ( 6.875 -2.345 8.221) 10.970 5.833 ( 2.346 -2.214 0.027) 3.226 6.027 ( -3.993 1.304 3.948) 5.764 6.600 ( 8.345 0.706 -7.255) 11.080 6.814 ( -6.044 -0.770 -5.451) 8.176 7.347 ( -2.835 7.968 -2.815) 8.913 8.110 ( -9.158 -17.983 1.492) 20.236 8.823 ( 2.780 8.800 -0.568) 9.246 9.091 ( 3.235 -6.920 -1.038) 7.709 9.689 ( -2.112 1.551 10.004) 10.342 11.054 ( -12.699 1.898 -5.011) 13.783 11.206 ( 0.905 25.323 -7.173) 26.335 11.704 ( 0.311 5.724 8.685) 10.406 11.872 ( 7.520 -2.626 -5.321) 9.579 12.386 ( -2.000 -11.659 -1.353) 11.906 12.835 ( -3.331 5.303 3.024) 6.954 13.012 ( -3.796 -4.503 5.901) 8.338 14.080 ( -1.791 -6.391 -19.733) 20.819 17.934 ( 8.385 -3.674 16.131) 18.548 18.243 ( -4.964 -2.664 -13.824) 14.927 19.161 ( -11.772 -2.506 -9.261) 15.187 19.660 ( -10.904 3.676 4.057) 12.201 21.090 ( 8.728 11.810 -2.414) 14.882 21.782 ( 16.803 -7.447 13.982) 23.093 23.563 ( -4.389 -1.708 -2.447) 5.307 23.934 ( -2.579 3.394 -6.625) 7.878 ======================= Grid point 166 (75/361) ======================= q-point: (-0.20 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.211 ( -1.532 11.422 -6.699) 13.330 2.700 ( 15.289 0.478 13.633) 20.490 3.161 ( 4.562 -2.463 -5.275) 7.396 3.348 ( 1.742 -0.534 -1.772) 2.542 3.522 ( 2.513 -9.627 -4.652) 10.983 4.071 ( 3.084 3.633 27.257) 27.671 4.514 ( 17.825 -1.530 -11.590) 21.316 4.720 ( -3.094 2.257 12.380) 12.958 4.847 ( -3.349 -3.910 15.394) 16.232 5.123 ( -2.333 -6.010 6.305) 9.018 5.574 ( 0.571 1.028 7.095) 7.192 5.901 ( 4.149 -5.024 0.250) 6.520 6.010 ( -3.971 -0.460 4.026) 5.673 6.565 ( -2.301 4.107 -6.807) 8.276 6.711 ( 1.787 0.889 -3.526) 4.051 7.227 ( 1.049 3.238 -3.693) 5.022 8.144 ( -11.517 -18.758 0.596) 22.019 8.799 ( 3.494 8.060 1.694) 8.947 9.172 ( 1.735 -5.275 -1.193) 5.680 9.770 ( 0.528 2.742 8.841) 9.272 10.787 ( -9.685 0.180 -9.681) 13.695 10.914 ( -2.917 22.541 -3.701) 23.029 11.743 ( 0.490 7.986 6.858) 10.538 11.946 ( 7.978 -1.913 -4.079) 9.162 12.422 ( -4.198 -9.528 -2.297) 10.662 12.634 ( -9.198 1.026 -2.154) 9.503 13.261 ( 7.722 0.901 14.750) 16.673 13.859 ( -4.052 -7.230 -19.134) 20.852 18.051 ( -2.642 -1.031 -3.225) 4.294 18.290 ( 8.258 -7.227 5.033) 12.073 18.978 ( -7.818 -4.258 -3.027) 9.402 19.475 ( -15.806 9.230 5.212) 19.031 21.059 ( 8.561 7.057 -7.782) 13.552 22.195 ( 13.217 -2.892 11.240) 17.590 23.493 ( -3.401 -2.542 -2.734) 5.050 23.804 ( -0.326 3.658 -5.734) 6.810 ======================= Grid point 167 (76/361) ======================= q-point: (-0.10 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.039 ( -4.403 -1.163 -5.858) 7.420 3.016 ( -2.807 -4.660 3.752) 6.608 3.078 ( 3.956 -4.277 -4.212) 7.189 3.404 ( 2.461 -0.554 3.245) 4.110 3.612 ( 10.387 2.533 -1.892) 10.858 4.362 ( 2.132 4.364 16.521) 17.220 4.549 ( 11.025 -0.847 -17.232) 20.475 4.699 ( -6.215 6.295 7.014) 11.290 4.966 ( -8.078 -0.835 13.351) 15.626 5.246 ( 0.518 -0.589 1.684) 1.858 5.592 ( -11.431 -11.291 5.533) 16.993 5.988 ( -1.645 -0.789 -0.784) 1.986 6.088 ( 3.742 0.242 14.232) 14.718 6.398 ( -3.494 0.599 -4.282) 5.559 6.700 ( 1.085 5.893 1.668) 6.220 7.257 ( 7.845 -3.097 -3.069) 8.975 8.148 ( -11.001 -13.111 3.759) 17.523 8.801 ( 2.027 5.496 0.988) 5.941 9.201 ( 0.838 -2.052 -1.255) 2.547 9.852 ( 1.217 3.203 4.973) 6.040 10.573 ( -12.176 -10.223 -7.228) 17.464 10.685 ( 6.109 20.633 -3.313) 21.772 11.750 ( -1.753 5.406 6.099) 8.336 12.015 ( 5.566 -1.242 -2.937) 6.414 12.376 ( -5.282 -5.537 -1.664) 7.832 12.583 ( -0.142 0.679 2.365) 2.464 13.409 ( -0.570 0.761 -5.788) 5.866 13.752 ( 3.960 -3.719 1.923) 5.762 18.019 ( 0.079 -0.521 -0.779) 0.940 18.454 ( 6.183 -8.116 -6.758) 12.238 18.958 ( -0.464 -3.047 3.415) 4.600 19.188 ( -18.436 14.453 5.664) 24.101 21.040 ( 6.854 -1.100 -8.263) 10.792 22.445 ( 6.631 4.033 7.410) 10.731 23.460 ( -0.143 -1.664 -1.470) 2.225 23.734 ( 0.902 0.212 -3.554) 3.673 ======================= Grid point 174 (77/361) ======================= q-point: (-0.40 0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.390 ( 11.435 -0.000 6.773) 13.290 2.607 ( -4.111 0.000 -7.202) 8.293 3.081 ( 10.203 -0.000 8.293) 13.148 3.091 ( 15.539 -0.000 0.963) 15.568 3.512 ( -9.948 0.000 -7.725) 12.596 3.735 ( 0.261 -0.000 23.660) 23.661 4.338 ( 21.038 -0.000 -13.546) 25.021 4.521 ( -0.750 0.000 17.275) 17.291 4.812 ( 2.255 -0.000 5.748) 6.175 4.915 ( -5.835 0.000 17.260) 18.220 5.384 ( 7.901 -0.000 8.663) 11.725 5.815 ( 1.596 -0.000 -1.148) 1.966 6.039 ( -3.777 0.000 3.624) 5.235 6.605 ( 11.343 -0.000 -8.355) 14.088 6.805 ( -6.576 0.000 -6.745) 9.420 7.462 ( -2.888 0.000 1.663) 3.332 7.906 ( -11.057 0.000 -0.388) 11.063 8.940 ( 2.404 -0.000 -0.865) 2.554 8.992 ( 3.578 -0.000 -0.671) 3.640 9.703 ( -1.997 0.000 10.920) 11.101 11.061 ( -15.388 0.000 -3.379) 15.754 11.522 ( 4.680 -0.000 -14.017) 14.778 11.758 ( 0.014 -0.000 9.174) 9.174 11.803 ( 6.562 -0.000 -6.030) 8.912 12.249 ( -2.932 0.000 3.505) 4.569 12.913 ( -17.480 0.000 -7.098) 18.866 12.939 ( 9.435 -0.000 16.707) 19.187 14.021 ( -1.238 0.000 -19.488) 19.528 17.902 ( 9.409 -0.000 16.233) 18.763 18.220 ( -5.619 0.000 -14.330) 15.392 19.138 ( -10.792 0.000 -11.104) 15.484 19.690 ( -9.743 0.000 4.072) 10.560 21.220 ( 6.682 -0.000 -5.741) 8.809 21.697 ( 17.091 -0.000 19.283) 25.767 23.546 ( -4.871 0.000 -2.472) 5.462 23.964 ( -2.268 0.000 -6.830) 7.197 ======================= Grid point 176 (78/361) ======================= q-point: (-0.30 0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( -5.594 4.263 -16.558) 17.990 2.702 ( 16.423 0.011 11.040) 19.789 3.171 ( -4.642 2.605 -6.894) 8.710 3.324 ( 1.406 -2.367 1.236) 3.018 3.400 ( 17.088 -3.433 1.100) 17.464 4.105 ( 1.758 0.650 32.275) 32.329 4.476 ( 19.645 -1.747 -14.334) 24.381 4.660 ( -6.806 -4.247 11.883) 14.337 4.905 ( 1.397 6.662 11.422) 13.296 5.026 ( -3.996 -5.427 8.361) 10.740 5.582 ( -0.123 0.148 6.255) 6.258 5.843 ( 6.109 -1.616 3.172) 7.070 6.013 ( -4.286 0.246 1.919) 4.703 6.612 ( -4.373 1.653 -9.191) 10.311 6.712 ( 12.619 -0.874 -5.491) 13.790 7.365 ( -4.953 10.350 0.315) 11.478 7.808 ( -12.773 -15.968 0.319) 20.451 8.937 ( 3.533 6.772 0.477) 7.653 9.073 ( 3.037 -5.563 -0.101) 6.339 9.810 ( -0.218 1.358 10.363) 10.454 10.761 ( -17.236 -0.905 -8.027) 19.035 11.326 ( 3.238 18.036 -11.552) 21.662 11.843 ( -0.568 2.337 5.944) 6.413 11.871 ( 6.222 -5.721 -3.500) 9.149 12.275 ( -3.496 -5.289 2.578) 6.844 12.627 ( -13.000 -0.844 -2.806) 13.326 13.273 ( 8.983 0.405 16.728) 18.992 13.764 ( -2.737 -2.947 -19.846) 20.250 18.046 ( -0.822 0.216 -6.061) 6.121 18.195 ( 6.149 -3.016 9.791) 11.949 18.927 ( -5.155 -1.420 -5.510) 7.678 19.578 ( -13.664 2.647 5.673) 15.030 21.179 ( 6.498 4.696 -11.643) 14.136 22.145 ( 12.692 -2.053 18.188) 22.274 23.451 ( -4.910 -1.532 -2.771) 5.842 23.853 ( -0.031 1.537 -7.404) 7.562 ======================= Grid point 177 (79/361) ======================= q-point: (-0.20 -0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.031 ( -7.622 -0.111 -17.484) 19.073 2.867 ( -17.258 -8.153 -10.391) 21.733 3.072 ( 14.750 1.200 7.522) 16.601 3.444 ( 6.493 4.752 5.139) 9.547 3.670 ( 19.037 2.012 0.023) 19.143 4.418 ( -0.312 2.844 10.006) 10.407 4.519 ( 5.992 -1.765 -7.563) 9.809 4.746 ( -7.575 -4.414 15.669) 17.955 4.953 ( -3.616 2.744 9.607) 10.626 5.187 ( 2.074 -5.104 9.884) 11.315 5.467 ( -11.360 -2.480 -7.059) 13.602 5.975 ( -3.413 -0.818 1.612) 3.862 6.089 ( 6.029 0.115 11.744) 13.201 6.436 ( -0.831 2.638 -5.589) 6.235 6.821 ( 9.141 5.877 -1.408) 10.958 7.245 ( 0.406 3.722 -0.546) 3.784 7.820 ( -12.082 -20.729 2.941) 24.172 8.934 ( 3.363 7.692 0.996) 8.454 9.148 ( 2.303 -3.961 -0.714) 4.638 9.916 ( 1.606 3.286 8.018) 8.812 10.441 ( -16.121 -4.694 -8.969) 19.035 11.069 ( 4.313 20.698 -9.471) 23.167 11.822 ( -9.402 2.617 5.611) 11.258 11.963 ( 5.906 -5.188 -3.695) 8.686 12.286 ( -2.853 -4.000 1.688) 5.195 12.553 ( -1.720 -2.825 3.378) 4.728 13.409 ( -3.554 -0.559 -11.514) 12.063 13.699 ( 9.660 -1.935 8.668) 13.122 18.024 ( 2.733 0.838 -0.409) 2.888 18.329 ( 2.596 -5.511 -3.857) 7.210 18.915 ( 2.290 -1.592 4.135) 4.987 19.389 ( -17.187 7.564 5.922) 19.690 21.066 ( 5.625 2.976 -14.417) 15.759 22.496 ( 6.846 1.749 16.244) 17.714 23.387 ( -3.662 -4.677 -1.462) 6.117 23.765 ( 2.283 2.138 -7.041) 7.705 ======================= Grid point 178 (80/361) ======================= q-point: (-0.10 -0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.770 ( -8.539 -9.726 -13.157) 18.456 2.559 ( -20.284 -14.826 -12.241) 27.948 3.290 ( 8.457 4.287 3.677) 10.170 3.514 ( 2.022 5.473 4.323) 7.261 3.874 ( 13.338 7.962 1.803) 15.638 4.244 ( -6.805 -2.620 -20.161) 21.439 4.498 ( -9.287 -0.350 1.313) 9.386 4.907 ( -2.743 0.141 15.300) 15.544 4.979 ( -7.780 4.281 10.182) 13.510 5.227 ( -4.698 4.271 -2.505) 6.825 5.370 ( -0.856 -7.582 2.995) 8.197 5.942 ( -5.335 -0.411 -0.069) 5.351 6.190 ( -1.421 -9.983 2.502) 10.390 6.497 ( 0.758 10.741 13.985) 17.650 6.831 ( 3.819 8.514 4.465) 10.344 7.310 ( 7.638 -3.511 -0.889) 8.453 7.923 ( -6.625 -21.640 5.188) 23.218 8.890 ( 0.609 9.791 -1.138) 9.876 9.212 ( 4.298 -2.363 0.175) 4.908 9.910 ( -6.074 6.630 -0.023) 8.991 10.272 ( -4.593 -11.136 -3.022) 12.420 10.886 ( 7.516 15.365 -7.106) 18.522 11.711 ( -15.002 -1.868 6.766) 16.563 12.015 ( 2.375 -2.372 -3.282) 4.694 12.366 ( 4.302 -4.086 4.642) 7.533 12.633 ( 1.795 -0.562 5.342) 5.664 13.160 ( -5.666 -1.516 -17.045) 18.026 14.021 ( 13.131 1.507 14.079) 19.311 18.037 ( 1.421 2.956 -3.085) 4.503 18.350 ( 7.387 -7.600 -9.789) 14.427 19.048 ( 3.260 2.340 3.849) 5.561 19.133 ( -15.015 9.021 8.687) 19.552 20.960 ( 3.524 -3.185 -13.530) 14.340 22.662 ( -1.335 9.427 12.277) 15.536 23.422 ( -0.219 -7.880 2.988) 8.430 23.711 ( 3.133 1.196 -5.806) 6.705 ======================= Grid point 186 (81/361) ======================= q-point: (-0.30 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( -8.023 0.000 -22.280) 23.680 2.788 ( -20.403 0.000 -10.794) 23.082 3.087 ( 16.527 -0.000 8.128) 18.418 3.512 ( 6.953 -0.000 6.775) 9.708 3.672 ( 22.100 -0.000 -0.236) 22.101 4.458 ( 9.103 -0.000 -11.792) 14.897 4.515 ( -3.266 0.000 20.486) 20.745 4.642 ( -8.913 0.000 9.040) 12.695 5.021 ( -6.246 0.000 15.186) 16.420 5.117 ( 4.527 -0.000 6.514) 7.933 5.453 ( -10.558 0.000 -6.866) 12.594 5.966 ( -4.135 0.000 0.680) 4.191 6.091 ( 5.997 -0.000 10.415) 12.018 6.464 ( 1.044 -0.000 -4.390) 4.512 6.869 ( 17.508 -0.000 -5.858) 18.462 7.375 ( -5.071 0.000 2.642) 5.718 7.534 ( -15.514 0.000 3.146) 15.829 9.042 ( 4.798 -0.000 0.769) 4.860 9.074 ( 1.980 -0.000 -0.558) 2.057 9.948 ( 2.183 -0.000 9.086) 9.345 10.400 ( -18.092 0.000 -9.289) 20.338 11.298 ( 4.765 -0.000 -16.002) 16.696 11.845 ( -12.172 0.000 5.744) 13.459 11.880 ( 5.387 -0.000 -0.937) 5.468 12.249 ( -3.868 0.000 4.133) 5.660 12.523 ( -0.815 0.000 3.283) 3.383 13.401 ( -4.105 0.000 -14.155) 14.738 13.683 ( 11.273 -0.000 11.630) 16.197 18.035 ( 4.515 -0.000 -0.340) 4.527 18.276 ( 0.301 -0.000 -2.703) 2.720 18.901 ( 3.692 -0.000 3.892) 5.365 19.455 ( -16.353 0.000 6.306) 17.527 21.101 ( 4.809 -0.000 -16.911) 17.582 22.510 ( 7.071 -0.000 20.459) 21.646 23.340 ( -5.164 0.000 -2.354) 5.675 23.786 ( 2.741 -0.000 -7.962) 8.420 ======================= Grid point 187 (82/361) ======================= q-point: (-0.20 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -9.822 -3.372 -20.545) 23.020 2.354 ( -24.207 -6.724 -12.639) 28.124 3.367 ( 12.437 3.172 4.889) 13.735 3.614 ( 1.230 4.221 3.114) 5.387 3.947 ( 15.023 0.506 0.306) 15.035 4.248 ( -1.312 2.403 -24.414) 24.567 4.505 ( -18.179 2.750 7.247) 19.762 4.714 ( -9.772 -12.805 8.849) 18.378 5.145 ( 0.876 8.574 13.151) 15.724 5.255 ( 2.110 -2.912 -1.581) 3.928 5.317 ( -4.969 0.841 15.953) 16.730 5.935 ( -4.218 -0.382 2.378) 4.857 6.061 ( -4.712 -3.973 -7.062) 9.373 6.655 ( 8.300 5.521 16.930) 19.647 6.995 ( 11.533 7.887 -4.040) 14.544 7.287 ( -0.974 3.841 2.527) 4.699 7.527 ( -10.523 -20.712 5.516) 23.878 9.041 ( 1.815 6.573 -0.947) 6.885 9.154 ( 5.034 -3.915 -0.124) 6.378 10.018 ( -9.174 5.394 -2.144) 10.856 10.128 ( -2.533 -5.880 0.952) 6.472 11.123 ( 6.167 8.647 -16.708) 19.798 11.708 ( -17.472 1.494 9.031) 19.724 11.958 ( 3.400 -3.583 -1.663) 5.212 12.271 ( -3.576 -4.508 6.790) 8.900 12.626 ( 5.415 -0.032 5.424) 7.665 13.140 ( -4.045 -0.595 -17.363) 17.838 14.037 ( 13.862 0.373 15.319) 20.663 18.109 ( 3.818 5.072 -2.710) 6.903 18.218 ( 4.935 -6.874 -7.641) 11.402 19.060 ( 6.648 0.198 7.711) 10.183 19.270 ( -17.750 4.350 5.830) 19.182 20.937 ( 3.010 -0.157 -18.315) 18.561 22.802 ( 0.469 5.363 20.957) 21.638 23.277 ( -4.070 -6.175 0.119) 7.397 23.738 ( 4.452 1.076 -7.721) 8.977 ======================= Grid point 188 (83/361) ======================= q-point: (-0.10 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -11.541 -12.403 -12.774) 21.218 1.965 ( -24.678 -15.996 -10.994) 31.397 3.405 ( -5.958 4.903 -11.043) 13.472 3.584 ( 1.389 1.778 -0.763) 2.382 3.821 ( -18.223 3.383 -9.591) 20.869 4.019 ( -1.855 3.485 -2.307) 4.573 4.345 ( -10.119 -2.200 2.339) 10.616 4.799 ( -3.894 -5.887 7.125) 10.029 5.210 ( 5.627 6.527 3.086) 9.154 5.265 ( 3.739 3.332 -0.082) 5.009 5.486 ( -4.564 6.654 20.172) 21.726 5.824 ( -4.620 -0.393 -5.843) 7.459 6.121 ( -2.692 -12.556 8.891) 15.619 6.694 ( -8.762 18.804 6.822) 21.838 7.075 ( 5.428 6.947 11.063) 14.146 7.399 ( 8.278 -3.827 2.862) 9.558 7.697 ( -2.873 -27.058 3.528) 27.438 8.956 ( -0.680 9.999 -2.741) 10.390 9.275 ( 7.828 -3.395 0.144) 8.533 9.777 ( -9.982 1.006 -3.966) 10.788 10.234 ( 3.795 -1.433 2.693) 4.869 10.960 ( 7.339 5.875 -14.455) 17.243 11.577 ( -19.035 1.596 14.068) 23.723 11.967 ( -0.257 -1.930 -3.561) 4.059 12.420 ( -1.004 -11.668 10.583) 15.785 12.763 ( 5.819 2.024 5.039) 7.959 12.899 ( -1.542 0.005 -15.907) 15.981 14.403 ( 15.192 2.129 13.044) 20.136 17.939 ( 2.477 2.763 -21.823) 22.137 18.391 ( 11.089 -4.366 2.828) 12.248 19.027 ( -14.448 8.116 3.780) 16.997 19.248 ( 5.570 -0.057 7.475) 9.322 20.773 ( 0.612 -4.180 -15.991) 16.540 22.859 ( -8.566 15.496 13.038) 21.989 23.404 ( -0.217 -13.436 11.257) 17.529 23.704 ( 4.399 1.719 -6.233) 7.820 ======================= Grid point 197 (84/361) ======================= q-point: (-0.20 -0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.252 ( -12.696 0.000 -15.866) 20.320 1.808 ( -27.598 0.000 -11.959) 30.078 3.461 ( -16.370 0.000 -21.702) 27.184 3.584 ( 9.166 -0.000 3.188) 9.705 3.892 ( -18.901 0.000 -6.012) 19.834 4.034 ( -2.075 0.000 -1.427) 2.519 4.315 ( -11.309 0.000 4.008) 11.999 4.733 ( 2.828 -0.000 8.287) 8.756 5.273 ( 5.451 -0.000 -0.907) 5.526 5.287 ( 6.460 -0.000 -2.315) 6.863 5.567 ( -8.531 0.000 30.406) 31.580 5.854 ( -5.368 0.000 -7.053) 8.863 5.961 ( -1.883 0.000 7.825) 8.048 6.988 ( -3.000 0.000 22.046) 22.249 7.155 ( 14.998 -0.000 -9.864) 17.951 7.261 ( -9.785 0.000 6.018) 11.487 7.408 ( 1.031 -0.000 5.407) 5.505 9.055 ( -0.616 0.000 -2.343) 2.422 9.232 ( 8.299 -0.000 -0.153) 8.300 9.783 ( -10.391 0.000 -5.429) 11.724 10.232 ( 4.794 -0.000 5.399) 7.220 11.013 ( 6.148 -0.000 -19.835) 20.765 11.629 ( -17.664 0.000 16.829) 24.397 11.944 ( 0.524 -0.000 -3.017) 3.063 12.281 ( -5.680 0.000 10.582) 12.010 12.782 ( 6.853 -0.000 4.801) 8.368 12.898 ( -1.752 0.000 -15.858) 15.954 14.421 ( 15.395 -0.000 13.701) 20.609 17.968 ( 4.095 -0.000 -24.706) 25.043 18.345 ( 9.758 -0.000 6.707) 11.841 19.110 ( -16.244 0.000 3.949) 16.717 19.245 ( 6.225 -0.000 6.873) 9.272 20.736 ( 0.870 -0.000 -18.031) 18.052 23.108 ( -4.116 0.000 27.690) 27.994 23.169 ( -4.923 0.000 -0.319) 4.934 23.721 ( 4.833 -0.000 -6.638) 8.211 ======================= Grid point 198 (85/361) ======================= q-point: (-0.10 -0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.960 ( -17.637 -9.491 -3.494) 20.331 1.348 ( -27.739 -13.727 -8.039) 31.977 2.710 ( -39.042 -3.825 -31.991) 50.620 3.678 ( -9.807 4.645 8.103) 13.543 3.722 ( 1.506 2.215 5.390) 6.018 3.902 ( -9.965 0.552 -3.139) 10.463 4.286 ( -5.304 0.414 7.782) 9.427 4.860 ( 2.751 -0.769 3.480) 4.502 5.332 ( 3.871 1.298 0.429) 4.105 5.347 ( 7.167 2.436 -1.665) 7.751 5.698 ( -3.029 -0.571 2.965) 4.278 5.751 ( -8.501 9.935 15.780) 20.493 6.118 ( -0.411 -9.507 11.180) 14.681 6.826 ( -11.671 29.489 5.674) 32.219 7.275 ( -3.482 3.980 6.725) 8.556 7.459 ( 2.551 -32.486 5.622) 33.067 7.533 ( 8.112 -3.176 4.581) 9.843 8.974 ( -2.545 6.388 -2.745) 7.405 9.370 ( 10.156 -2.694 -0.556) 10.522 9.641 ( -3.473 -0.776 -2.707) 4.472 10.335 ( 3.927 3.109 2.528) 5.611 10.865 ( 5.746 -0.931 -18.279) 19.183 11.591 ( -19.671 10.337 25.508) 33.830 11.904 ( -0.715 -0.829 -3.228) 3.409 12.392 ( -5.200 -11.408 10.208) 16.167 12.730 ( 2.275 -4.600 -11.060) 12.192 12.915 ( 5.590 1.276 3.551) 6.744 14.770 ( 14.891 1.484 9.378) 17.661 17.666 ( 5.799 1.962 -36.735) 37.241 18.572 ( 8.919 -2.382 6.805) 11.468 18.929 ( -10.736 2.757 1.269) 11.156 19.393 ( 4.564 -0.845 5.016) 6.834 20.555 ( -0.468 -2.396 -13.929) 14.141 23.000 ( -9.823 18.245 6.454) 21.703 23.472 ( -2.071 -13.720 23.729) 27.488 23.721 ( 2.363 0.645 0.579) 2.517 ======================= Grid point 208 (86/361) ======================= q-point: (-0.10 -0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.686 ( -27.137 0.000 19.865) 33.631 0.805 ( -29.813 0.000 -1.308) 29.842 1.684 ( -52.028 0.000 -26.365) 58.327 3.672 ( -6.822 0.000 6.863) 9.676 3.713 ( -11.546 0.000 -1.515) 11.645 3.848 ( 3.672 -0.000 4.374) 5.711 4.426 ( -3.391 0.000 28.353) 28.555 4.886 ( 1.179 -0.000 -2.333) 2.614 5.395 ( 2.991 -0.000 1.515) 3.353 5.438 ( 6.155 -0.000 -1.039) 6.243 5.659 ( -2.286 0.000 -1.629) 2.807 5.893 ( -9.108 0.000 18.367) 20.501 6.212 ( 3.263 -0.000 7.066) 7.783 6.961 ( -12.716 0.000 6.275) 14.180 7.203 ( 3.965 -0.000 -4.894) 6.298 7.451 ( -6.457 0.000 22.173) 23.094 7.669 ( 9.056 -0.000 0.760) 9.088 8.932 ( -4.002 0.000 -0.931) 4.109 9.485 ( 10.271 -0.000 -3.862) 10.973 9.589 ( 1.479 -0.000 -2.994) 3.340 10.433 ( 2.502 -0.000 2.406) 3.471 10.680 ( 2.324 -0.000 -22.780) 22.899 11.863 ( 0.178 -0.000 -2.310) 2.317 11.865 ( -11.807 0.000 43.741) 45.306 12.353 ( -4.304 0.000 4.024) 5.892 12.586 ( 0.290 -0.000 -6.659) 6.665 13.018 ( 3.635 -0.000 1.964) 4.131 15.041 ( 11.516 -0.000 3.214) 11.956 17.248 ( 0.781 -0.000 -38.739) 38.746 18.689 ( -2.698 0.000 3.079) 4.094 18.858 ( 1.644 -0.000 0.815) 1.835 19.481 ( 2.028 -0.000 3.136) 3.735 20.406 ( 0.489 -0.000 -9.098) 9.112 23.039 ( -4.992 0.000 1.377) 5.178 23.618 ( 3.022 -0.000 3.268) 4.451 23.925 ( -3.997 0.000 44.864) 45.042 ======================= Grid point 209 (87/361) ======================= q-point: ( 0.00 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.214 ( -2.385 0.000 31.267) 31.358 1.227 ( 19.985 -0.000 27.080) 33.656 2.376 ( -5.468 0.000 51.558) 51.848 3.430 ( -0.497 0.000 -4.724) 4.750 3.848 ( -1.706 0.000 9.796) 9.944 4.097 ( -4.207 0.000 4.153) 5.911 4.721 ( 4.401 -0.000 -6.365) 7.738 4.922 ( -10.588 0.000 9.205) 14.029 5.265 ( -3.284 0.000 -5.632) 6.520 5.334 ( 0.217 -0.000 -7.665) 7.668 5.633 ( -25.719 0.000 -1.715) 25.776 6.262 ( -3.587 0.000 2.924) 4.628 6.271 ( -21.249 0.000 15.632) 26.379 6.527 ( 9.155 -0.000 2.289) 9.437 7.015 ( -3.781 0.000 9.229) 9.974 7.229 ( 1.086 -0.000 -11.337) 11.389 7.767 ( 2.456 -0.000 9.134) 9.458 9.110 ( -0.949 0.000 6.651) 6.718 9.371 ( -1.553 0.000 -8.706) 8.844 9.588 ( -4.549 0.000 -1.144) 4.691 10.092 ( 14.983 -0.000 3.742) 15.443 10.459 ( -3.285 0.000 -1.536) 3.626 11.753 ( 2.246 -0.000 -6.694) 7.060 11.897 ( -8.633 0.000 12.963) 15.575 11.967 ( 0.101 -0.000 -9.240) 9.240 12.823 ( 5.338 -0.000 5.972) 8.010 13.020 ( -1.480 0.000 -2.352) 2.779 14.781 ( -0.354 0.000 -19.438) 19.442 18.394 ( 5.690 -0.000 -9.181) 10.801 19.018 ( -11.762 0.000 2.430) 12.010 19.218 ( 0.327 -0.000 -8.183) 8.190 19.530 ( 22.862 -0.000 -0.024) 22.862 20.392 ( 14.631 -0.000 2.388) 14.825 22.866 ( -52.886 0.000 -7.914) 53.475 23.091 ( -3.436 0.000 4.885) 5.973 23.654 ( 5.447 -0.000 -1.812) 5.741 ======================= Grid point 210 (88/361) ======================= q-point: ( 0.10 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 4.180 2.275 29.936) 30.312 1.804 ( 18.229 -5.985 20.993) 28.440 3.012 ( 8.737 -7.182 38.997) 40.604 3.381 ( 4.396 2.282 -6.555) 8.216 3.895 ( -7.749 1.572 12.894) 15.125 4.033 ( -3.487 3.795 -3.077) 6.002 4.658 ( 0.319 5.004 -7.805) 9.277 4.914 ( -26.246 2.701 13.139) 29.475 5.168 ( 11.596 -0.193 -1.357) 11.677 5.248 ( -8.103 -0.095 -2.264) 8.414 5.288 ( -6.558 -1.437 -1.324) 6.843 6.232 ( -8.660 2.419 7.474) 11.692 6.295 ( -9.010 -0.310 17.340) 19.544 6.633 ( 4.927 9.678 5.491) 12.169 7.006 ( -0.499 7.562 -4.288) 8.707 7.179 ( -1.509 -7.817 -1.152) 8.045 7.950 ( -2.252 -10.534 11.395) 15.681 9.124 ( -1.477 5.337 2.352) 6.017 9.314 ( 3.770 -3.233 -6.430) 8.124 9.517 ( -5.261 -3.673 0.038) 6.416 10.217 ( 8.179 15.808 -1.735) 17.883 10.561 ( 7.167 -20.804 -0.340) 22.007 11.685 ( 2.545 2.633 -9.678) 10.348 11.821 ( 0.219 8.212 1.586) 8.367 12.058 ( -2.921 -13.371 6.680) 15.229 12.937 ( -2.033 2.474 -1.455) 3.517 12.998 ( 5.019 -2.925 3.927) 7.012 14.486 ( -4.962 3.220 -19.986) 20.843 18.382 ( 9.928 3.306 -7.817) 13.061 18.740 ( -14.846 14.274 -3.075) 20.823 19.070 ( -12.749 -15.450 -7.422) 21.361 19.669 ( -4.091 -0.104 0.115) 4.094 20.667 ( 16.555 3.674 9.039) 19.217 22.251 ( -13.219 13.570 -3.885) 19.339 23.180 ( -3.945 -14.547 0.498) 15.080 23.713 ( 5.627 0.013 -1.506) 5.825 ======================= Grid point 211 (89/361) ======================= q-point: ( 0.20 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.974 ( 6.566 5.206 24.448) 25.844 2.352 ( 17.187 -9.308 17.727) 26.387 3.336 ( 6.341 5.729 -7.481) 11.358 3.518 ( 1.818 -3.590 17.099) 17.566 3.844 ( -3.332 6.335 -5.992) 9.335 4.011 ( 0.637 0.236 12.981) 12.998 4.446 ( -3.941 6.338 -10.978) 13.275 4.676 ( -11.528 -2.810 -1.030) 11.910 5.134 ( -10.389 -7.176 1.330) 12.696 5.291 ( -1.296 1.176 4.866) 5.171 5.482 ( 9.910 -0.460 20.968) 23.197 6.179 ( -8.925 2.491 8.437) 12.532 6.379 ( -8.549 -4.742 11.307) 14.947 6.616 ( -0.039 12.760 3.117) 13.135 6.826 ( -0.890 7.753 -9.544) 12.329 7.231 ( -0.825 3.943 7.807) 8.785 8.130 ( -8.834 -16.887 10.525) 21.771 9.049 ( -0.836 9.594 0.091) 9.631 9.297 ( -1.082 -1.142 -4.747) 5.001 9.587 ( 5.988 -6.069 4.188) 9.499 10.140 ( 0.096 2.479 -3.750) 4.496 10.846 ( 10.285 -10.420 -0.153) 14.641 11.550 ( 0.346 5.021 -7.299) 8.866 11.833 ( 7.094 2.113 -1.959) 7.657 12.229 ( -2.291 -13.702 7.193) 15.643 12.819 ( -6.756 3.231 -2.256) 7.821 13.162 ( 7.879 -1.729 3.113) 8.646 14.138 ( -7.176 4.999 -16.342) 18.536 18.347 ( -2.647 8.751 -10.008) 13.555 18.460 ( 3.156 6.715 -0.603) 7.444 18.949 ( -12.710 -16.227 -6.972) 21.759 19.512 ( -18.242 1.160 3.989) 18.709 20.961 ( 14.213 8.017 10.261) 19.276 22.069 ( 5.619 2.047 -8.922) 10.740 23.247 ( -1.200 -10.074 -1.082) 10.203 23.765 ( 4.846 1.251 -1.505) 5.226 ======================= Grid point 212 (90/361) ======================= q-point: ( 0.30 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 1.882 8.661 15.723) 18.049 2.858 ( 15.230 -8.471 14.917) 22.940 3.259 ( 2.291 6.927 -6.217) 9.585 3.504 ( -3.178 8.464 -2.838) 9.476 3.694 ( -4.552 4.785 -5.317) 8.479 4.209 ( 9.451 -1.025 -6.900) 11.746 4.303 ( -1.192 -4.657 6.804) 8.331 4.607 ( -3.262 -6.570 -2.294) 7.685 5.097 ( -11.702 -9.740 4.395) 15.847 5.294 ( -6.758 2.163 6.509) 9.629 5.892 ( 7.940 -2.891 18.650) 20.475 6.138 ( -6.806 0.999 4.445) 8.191 6.304 ( -16.315 6.263 8.320) 19.355 6.590 ( -0.425 1.144 6.835) 6.943 6.673 ( 1.236 11.314 -1.807) 11.524 7.261 ( 2.878 7.983 4.011) 9.386 8.255 ( -13.074 -17.311 10.658) 24.170 8.950 ( -0.430 11.901 0.903) 11.942 9.226 ( -1.673 0.285 -2.917) 3.375 9.779 ( 5.552 -1.301 2.550) 6.246 10.159 ( 2.686 -12.191 0.152) 12.484 10.916 ( 2.829 10.207 -5.417) 11.897 11.553 ( 7.026 -5.436 1.735) 9.051 11.903 ( 8.917 0.840 -3.661) 9.676 12.395 ( -1.857 -12.809 5.083) 13.906 12.647 ( -8.734 5.572 -1.251) 10.435 13.286 ( 5.388 -2.488 -4.275) 7.314 13.862 ( -3.703 4.686 -5.814) 8.335 18.123 ( -4.307 6.498 -3.883) 8.709 18.466 ( 6.315 3.004 -9.084) 11.464 18.854 ( -6.844 -11.890 -4.797) 14.533 19.308 ( -19.357 -1.819 7.248) 20.749 21.110 ( 9.305 14.159 2.709) 17.159 22.132 ( 10.054 -9.550 -4.985) 14.735 23.311 ( 2.030 -6.518 -1.200) 6.931 23.785 ( 3.403 3.306 -1.343) 4.931 ======================= Grid point 213 (91/361) ======================= q-point: (-0.60 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( -6.931 14.667 5.829) 17.238 3.079 ( -10.986 8.458 -3.736) 14.360 3.217 ( 5.570 0.131 6.937) 8.898 3.460 ( 8.955 -0.887 -2.050) 9.229 3.534 ( -1.835 0.571 -0.702) 2.046 4.146 ( 9.407 2.044 -19.312) 21.579 4.486 ( -2.738 -4.500 5.573) 7.668 4.663 ( 3.765 -12.174 1.584) 12.841 5.071 ( -14.595 -11.333 5.957) 19.415 5.232 ( -9.721 -0.058 5.573) 11.205 5.842 ( -12.825 7.149 -6.808) 16.185 6.054 ( -6.768 1.146 -1.071) 6.947 6.441 ( -2.825 0.518 27.880) 28.027 6.620 ( 0.414 8.363 9.137) 12.394 6.680 ( -0.388 -0.561 7.958) 7.987 7.283 ( 7.357 5.635 -1.259) 9.352 8.328 ( -12.452 -10.817 9.954) 19.265 8.846 ( -2.088 10.587 1.426) 10.885 9.199 ( 1.756 0.437 -0.915) 2.028 9.793 ( -4.528 -5.412 -3.153) 7.729 10.410 ( 9.262 -12.044 4.865) 15.953 10.710 ( 0.997 20.989 -5.951) 21.839 11.799 ( 6.892 -6.647 8.841) 13.032 11.961 ( 7.204 0.854 -4.586) 8.582 12.455 ( -6.641 2.969 1.537) 7.435 12.546 ( 0.921 -6.579 1.592) 6.831 13.181 ( -5.279 0.453 -12.552) 13.624 13.891 ( 8.392 -1.409 5.119) 9.931 17.997 ( -3.266 1.220 -6.231) 7.140 18.355 ( 2.217 2.632 -9.601) 10.199 18.878 ( 0.081 -8.150 -0.218) 8.154 19.203 ( -13.035 -4.859 7.928) 16.012 21.050 ( 6.285 15.550 -7.297) 18.291 22.354 ( 5.799 -15.229 2.957) 16.562 23.391 ( 4.868 -3.605 -0.823) 6.113 23.772 ( 2.276 5.605 -0.520) 6.072 ======================= Grid point 214 (92/361) ======================= q-point: (-0.50 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( -12.860 18.153 2.829) 22.426 2.704 ( -20.501 14.794 -2.512) 25.406 3.280 ( 3.323 -0.043 1.210) 3.537 3.501 ( -1.420 -2.750 0.163) 3.099 3.716 ( 7.453 -10.766 -2.146) 13.268 3.951 ( -1.085 7.683 -13.223) 15.331 4.457 ( -8.405 -3.412 -0.070) 9.071 4.875 ( 9.908 -10.310 -2.727) 14.557 5.023 ( -13.261 -8.159 3.772) 16.020 5.205 ( -7.279 -4.497 6.313) 10.633 5.591 ( -11.188 2.602 5.958) 12.940 5.911 ( -6.303 1.533 -4.521) 7.907 6.511 ( -2.740 4.928 4.508) 7.219 6.694 ( -11.667 4.174 15.780) 20.064 6.907 ( 3.206 -6.667 17.343) 18.854 7.359 ( 10.234 2.131 -0.094) 10.454 8.328 ( -8.393 2.271 7.116) 11.235 8.754 ( -4.098 2.726 1.498) 5.145 9.235 ( 4.827 0.570 -0.657) 4.905 9.724 ( -7.627 -9.346 -3.746) 12.631 10.478 ( 3.571 22.093 -4.843) 22.898 10.674 ( 7.782 -5.708 4.379) 10.598 11.930 ( -7.403 1.024 7.297) 10.445 11.978 ( 0.714 2.482 -0.216) 2.592 12.483 ( 11.207 0.216 3.905) 11.870 12.651 ( 3.671 -6.274 -0.854) 7.319 12.923 ( -9.819 2.189 -8.085) 12.906 14.149 ( 13.951 -6.207 4.179) 15.831 17.778 ( -6.087 -0.819 -18.457) 19.452 18.371 ( 7.361 1.991 4.050) 8.635 18.941 ( -4.153 -8.351 1.790) 9.497 19.224 ( -1.346 -3.693 5.931) 7.115 20.861 ( 4.105 14.040 -13.664) 20.017 22.588 ( -2.926 -17.432 6.959) 18.996 23.494 ( 7.342 -1.965 -0.509) 7.618 23.752 ( 2.338 7.366 2.897) 8.253 ======================= Grid point 215 (93/361) ======================= q-point: (-0.40 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( -17.174 17.689 6.393) 25.470 2.229 ( -23.271 19.455 0.364) 30.334 3.160 ( -17.751 11.353 -11.944) 24.221 3.529 ( 3.952 -7.042 3.720) 8.891 3.694 ( -4.506 -4.847 -3.083) 7.301 3.874 ( -4.456 -6.103 0.796) 7.599 4.369 ( -8.426 -4.003 1.790) 9.499 4.972 ( -4.023 0.045 3.466) 5.311 5.054 ( 10.756 -7.680 -4.244) 13.881 5.243 ( -1.953 -3.819 4.807) 6.443 5.629 ( -8.987 -12.327 11.677) 19.211 5.769 ( -4.859 1.192 -3.324) 6.007 6.469 ( -3.745 0.983 0.363) 3.889 6.644 ( -15.272 3.404 14.528) 21.351 7.159 ( -0.284 -7.957 9.902) 12.706 7.502 ( 7.837 -0.700 1.211) 7.961 8.226 ( -2.975 15.713 3.825) 16.444 8.749 ( -4.650 -7.137 4.962) 9.858 9.288 ( 6.598 1.212 -3.178) 7.423 9.686 ( -3.874 -6.261 -0.229) 7.366 10.299 ( 2.792 14.764 -5.100) 15.868 10.820 ( 4.406 1.533 2.368) 5.232 11.848 ( -14.818 0.477 8.894) 17.289 11.931 ( -1.542 3.485 -0.420) 3.834 12.595 ( -2.697 -0.879 -13.360) 13.658 12.765 ( 11.398 -0.171 7.663) 13.736 12.838 ( 3.859 1.161 7.104) 8.168 14.457 ( 16.079 -8.687 0.263) 18.277 17.450 ( -6.274 -0.195 -20.916) 21.837 18.561 ( 9.177 1.678 8.977) 12.947 18.947 ( -6.397 -5.388 1.504) 8.498 19.352 ( 6.087 -2.078 4.099) 7.627 20.606 ( 1.899 11.272 -15.943) 19.617 22.727 ( -11.675 -18.630 6.533) 22.936 23.577 ( 6.609 0.720 -4.684) 8.132 23.840 ( 5.247 4.220 13.789) 15.345 ======================= Grid point 216 (94/361) ======================= q-point: (-0.30 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( -21.274 14.668 11.800) 28.407 1.736 ( -25.994 19.131 2.658) 32.384 2.497 ( -33.989 21.950 -3.899) 40.648 3.636 ( -4.739 -6.252 -0.702) 7.876 3.761 ( 0.487 -8.164 8.330) 11.674 3.842 ( -6.888 -4.028 -0.028) 7.979 4.406 ( -0.887 -8.784 8.430) 12.207 4.972 ( 0.307 3.518 2.338) 4.235 5.212 ( 8.598 -6.164 -2.599) 10.894 5.332 ( -0.067 -5.331 5.221) 7.462 5.682 ( -3.604 -0.785 -2.421) 4.412 5.765 ( -6.787 -15.334 8.542) 18.819 6.404 ( -5.319 -4.587 -2.547) 7.472 6.590 ( -16.006 -1.031 15.044) 21.990 7.268 ( -6.991 -6.941 4.399) 10.789 7.565 ( 5.141 -0.113 -5.279) 7.370 8.107 ( 5.237 18.811 -0.194) 19.527 8.860 ( -3.508 -7.776 10.278) 13.357 9.317 ( 7.118 1.282 -5.267) 8.947 9.703 ( 2.688 5.252 1.484) 6.084 10.181 ( -2.231 -2.385 -5.232) 6.168 10.829 ( -0.099 8.477 1.812) 8.669 11.756 ( -13.253 -5.258 5.457) 15.267 11.891 ( -4.819 0.016 4.211) 6.400 12.407 ( -5.172 -0.923 -7.433) 9.102 12.924 ( 4.073 -3.855 1.470) 5.798 13.045 ( 16.203 13.774 6.147) 22.137 14.734 ( 15.425 -9.408 -4.898) 18.720 17.167 ( -4.546 0.762 -8.286) 9.481 18.771 ( 6.850 1.766 8.239) 10.859 18.897 ( -1.760 2.238 -2.161) 3.574 19.497 ( 6.458 0.819 3.519) 7.400 20.363 ( 1.087 5.910 -13.825) 15.075 22.772 ( -17.120 -21.603 5.987) 28.207 23.580 ( 5.727 2.624 -5.110) 8.111 24.114 ( 5.996 -1.617 17.759) 18.814 ======================= Grid point 217 (95/361) ======================= q-point: (-0.20 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( -21.865 12.677 15.973) 29.899 1.166 ( -34.298 13.400 -3.467) 36.986 1.976 ( -30.363 24.419 33.957) 51.685 3.588 ( -7.390 -6.013 -1.626) 9.665 3.747 ( -5.627 1.038 0.490) 5.743 3.941 ( -1.026 -6.819 8.817) 11.193 4.636 ( 4.373 -12.154 2.022) 13.074 5.016 ( 4.421 2.375 7.961) 9.411 5.322 ( 3.748 -5.431 -2.842) 7.185 5.460 ( 1.408 -4.473 7.808) 9.108 5.558 ( -5.918 0.987 -8.266) 10.214 5.937 ( -2.701 -16.168 8.294) 18.371 6.359 ( -2.701 -4.012 -1.546) 5.077 6.585 ( -18.735 -16.551 11.186) 27.387 7.191 ( -15.983 -4.283 3.677) 16.951 7.578 ( 6.962 -0.457 -7.494) 10.240 7.974 ( 9.730 23.706 -12.303) 28.426 8.971 ( -2.374 -2.961 5.330) 6.543 9.379 ( 8.126 1.925 2.219) 8.640 9.662 ( 4.432 12.891 -2.715) 13.899 10.137 ( -12.449 -17.758 -3.675) 21.996 10.718 ( -3.575 14.268 1.397) 14.775 11.725 ( -7.454 -11.176 1.823) 13.557 11.881 ( -9.072 -6.372 4.046) 11.801 12.307 ( -2.147 -0.526 -2.745) 3.524 12.986 ( 3.547 3.063 -6.705) 8.181 13.062 ( 9.650 19.922 -6.025) 22.941 14.914 ( 11.373 -8.051 -9.849) 17.063 17.333 ( 13.962 -8.531 29.842) 34.033 18.765 ( 5.196 13.026 -6.555) 15.480 18.952 ( 3.174 -0.511 6.564) 7.309 19.576 ( 2.670 5.384 2.611) 6.553 20.225 ( 3.479 -0.217 -9.857) 10.455 22.811 ( -19.119 -27.685 7.074) 34.381 23.582 ( 5.602 1.962 -3.971) 7.142 24.358 ( -0.314 -5.311 2.997) 6.107 ======================= Grid point 218 (96/361) ======================= q-point: (-0.10 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( -5.778 10.055 22.627) 25.426 0.998 ( -13.748 7.367 26.149) 30.448 1.999 ( -22.145 11.719 52.456) 58.132 3.507 ( -5.425 -2.735 -2.905) 6.734 3.735 ( 0.106 0.355 6.437) 6.448 4.060 ( -2.935 -3.739 7.357) 8.759 4.717 ( 3.918 -5.011 -6.683) 9.227 5.089 ( -8.617 -3.826 -6.349) 11.367 5.317 ( -1.109 0.450 -0.229) 1.219 5.406 ( 1.505 0.192 -6.680) 6.850 5.664 ( 3.170 1.057 14.938) 15.307 6.163 ( -0.974 -21.375 3.002) 21.607 6.373 ( 1.196 3.024 5.960) 6.789 6.568 ( -27.503 -30.575 -3.367) 41.262 7.041 ( -15.168 -1.983 4.629) 15.982 7.462 ( -0.002 19.438 -13.755) 23.812 7.713 ( 6.466 16.913 -2.449) 18.272 9.023 ( -1.534 -2.416 6.580) 7.175 9.500 ( 2.383 2.641 -3.318) 4.865 9.593 ( 8.262 8.644 0.215) 11.959 10.002 ( -18.572 -14.095 -0.287) 23.316 10.561 ( -1.498 13.511 0.893) 13.623 11.772 ( 0.864 -5.949 -2.024) 6.343 11.849 ( -11.671 -12.020 3.570) 17.130 12.188 ( -2.388 10.456 -8.863) 13.913 12.765 ( 2.401 14.080 -1.255) 14.339 13.046 ( 1.114 0.412 -1.346) 1.795 14.938 ( 5.523 -4.325 -15.293) 16.825 18.255 ( 20.125 -29.467 13.049) 37.994 18.766 ( 37.286 23.412 6.948) 44.571 19.046 ( -3.752 -4.561 5.050) 7.771 19.523 ( -2.154 7.974 -1.856) 8.466 20.231 ( 8.756 -2.066 -4.833) 10.212 22.913 ( -17.645 -33.907 6.535) 38.778 23.605 ( 5.205 0.805 -2.899) 6.012 23.978 ( -36.198 13.588 -23.694) 45.347 ======================= Grid point 220 (97/361) ======================= q-point: ( 0.10 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( 8.704 -0.000 29.428) 30.688 2.216 ( 13.473 -0.000 17.161) 21.818 3.391 ( 7.359 -0.000 -7.893) 10.791 3.470 ( 6.662 -0.000 20.250) 21.318 3.918 ( -4.240 0.000 -9.444) 10.352 4.008 ( -1.320 0.000 14.892) 14.950 4.555 ( -2.938 0.000 -9.965) 10.389 4.609 ( -13.821 0.000 -7.667) 15.805 5.058 ( -13.707 0.000 2.425) 13.919 5.300 ( -0.344 0.000 4.783) 4.795 5.480 ( 9.949 -0.000 20.066) 22.397 6.204 ( -9.509 0.000 6.306) 11.410 6.332 ( -9.741 0.000 14.924) 17.822 6.717 ( -0.582 0.000 -5.282) 5.314 6.936 ( 3.231 -0.000 -12.982) 13.378 7.279 ( -3.778 0.000 24.354) 24.645 7.940 ( -10.413 0.000 8.735) 13.591 9.147 ( -0.416 0.000 0.298) 0.512 9.280 ( 0.871 -0.000 -5.763) 5.829 9.517 ( 6.137 -0.000 5.404) 8.178 10.199 ( -8.245 0.000 -6.562) 10.538 10.722 ( 21.932 -0.000 2.127) 22.035 11.621 ( 6.640 -0.000 -14.318) 15.782 11.884 ( 5.158 -0.000 -2.831) 5.884 12.053 ( -7.885 0.000 14.793) 16.763 12.849 ( -6.441 0.000 -2.104) 6.776 13.146 ( 8.382 -0.000 2.844) 8.851 14.183 ( -8.220 0.000 -16.151) 18.123 18.427 ( 8.850 -0.000 -11.110) 14.204 18.643 ( -11.902 0.000 4.344) 12.670 18.673 ( -11.354 0.000 -11.076) 15.862 19.524 ( -16.885 0.000 2.082) 17.013 21.044 ( 15.476 -0.000 12.732) 20.041 22.096 ( 0.082 -0.000 -14.040) 14.041 23.141 ( 1.239 -0.000 2.284) 2.598 23.776 ( 5.734 -0.000 -1.590) 5.950 ======================= Grid point 221 (98/361) ======================= q-point: ( 0.20 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( 6.176 13.013 19.735) 24.432 2.663 ( 10.654 -12.954 18.573) 25.025 3.359 ( 2.537 3.482 -8.005) 9.091 3.625 ( -2.140 4.124 1.100) 4.775 3.732 ( -1.049 0.154 -10.839) 10.891 4.175 ( 1.653 -2.279 10.886) 11.244 4.326 ( -1.155 7.136 -10.609) 12.838 4.481 ( -1.555 -8.413 -7.900) 11.645 4.959 ( -11.980 -4.507 6.524) 14.367 5.319 ( -6.895 0.696 5.657) 8.945 5.855 ( 7.322 -1.170 17.788) 19.272 6.126 ( -8.958 -0.839 1.951) 9.206 6.366 ( -13.790 1.184 16.474) 21.516 6.611 ( -1.378 1.214 -2.646) 3.221 6.854 ( 5.815 5.738 -6.196) 10.253 7.458 ( -4.086 13.111 19.067) 23.498 7.921 ( -14.887 -17.491 8.541) 24.505 9.121 ( 0.010 6.351 0.341) 6.360 9.218 ( -1.905 -1.104 -2.496) 3.328 9.770 ( 12.960 -0.148 7.505) 14.977 10.002 ( -6.604 -4.774 -6.694) 10.546 11.045 ( 18.427 3.170 2.663) 18.886 11.544 ( 8.116 3.093 -9.761) 13.066 11.928 ( 7.011 2.123 -2.213) 7.652 12.160 ( -6.344 -11.137 10.201) 16.381 12.716 ( -8.653 2.037 -0.900) 8.935 13.255 ( 6.477 -0.930 -4.734) 8.076 13.918 ( -6.670 1.574 -6.715) 9.594 18.269 ( -6.121 9.649 -6.019) 12.914 18.448 ( -2.540 -6.646 -12.780) 14.627 18.676 ( 2.138 -4.917 1.090) 5.471 19.299 ( -18.502 -0.033 3.507) 18.831 21.352 ( 10.591 10.148 11.964) 18.929 21.971 ( 5.647 -7.072 -15.687) 18.111 23.216 ( 3.514 -3.239 1.671) 5.062 23.827 ( 4.674 1.243 -1.384) 5.030 ======================= Grid point 222 (99/361) ======================= q-point: ( 0.30 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( -2.613 16.302 9.058) 18.831 3.104 ( 4.698 -10.606 9.653) 15.091 3.203 ( -4.693 4.181 -0.674) 6.322 3.509 ( 2.292 5.370 -6.274) 8.571 3.573 ( -5.908 2.212 -8.215) 10.358 4.191 ( 9.098 4.062 -13.229) 16.561 4.376 ( -2.560 -7.485 12.212) 14.550 4.477 ( 3.285 -9.146 -6.370) 11.620 4.911 ( -11.551 -5.573 4.289) 13.523 5.228 ( -12.841 -0.380 3.787) 13.393 5.919 ( -7.305 2.709 -6.401) 10.083 6.035 ( -6.198 -2.756 -3.226) 7.512 6.461 ( -11.852 1.633 34.791) 36.791 6.639 ( 2.614 -0.242 3.018) 4.000 6.832 ( 3.587 9.007 1.924) 9.884 7.421 ( -2.054 10.775 4.807) 11.976 8.040 ( -12.178 -18.986 12.256) 25.671 9.047 ( -2.067 9.615 1.946) 10.025 9.197 ( 0.121 -0.713 -0.399) 0.826 9.735 ( -6.750 -1.102 -7.934) 10.475 10.221 ( 14.112 -8.605 9.248) 18.940 11.116 ( 9.496 22.957 -2.615) 24.981 11.683 ( 12.759 -6.364 4.707) 15.015 11.977 ( 6.758 1.061 -3.815) 7.833 12.307 ( -2.754 -13.711 6.231) 15.310 12.562 ( -8.548 3.260 0.410) 9.158 13.178 ( -2.717 -0.449 -12.842) 13.134 13.871 ( 3.724 -0.827 2.479) 4.550 18.041 ( -5.149 3.503 -10.821) 12.485 18.339 ( -1.949 -4.368 -5.950) 7.634 18.776 ( 5.830 -2.219 -0.366) 6.249 19.143 ( -11.561 -2.392 5.115) 12.866 21.368 ( 4.959 19.609 -3.558) 20.537 22.062 ( 4.648 -17.724 -1.777) 18.410 23.327 ( 5.415 -3.060 1.626) 6.429 23.851 ( 3.414 3.124 -0.573) 4.662 ======================= Grid point 223 (100/361) ======================= q-point: (-0.60 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.308 ( -8.781 19.570 1.894) 21.533 2.891 ( -17.172 5.954 -3.431) 18.496 3.338 ( -0.151 5.195 -0.973) 5.287 3.468 ( -0.040 -3.873 -3.971) 5.547 3.507 ( 3.008 -8.995 4.017) 10.300 4.094 ( 4.205 7.840 -13.309) 16.008 4.400 ( -10.378 -2.816 3.146) 11.204 4.647 ( 3.391 -15.013 2.434) 15.582 4.864 ( -5.233 -6.226 0.989) 8.193 5.124 ( -9.830 -5.098 3.927) 11.749 5.674 ( -11.390 5.207 -2.343) 12.741 5.911 ( -6.372 -1.508 -5.210) 8.368 6.574 ( -10.056 3.828 10.736) 15.200 6.800 ( -3.880 -3.229 19.216) 19.867 6.836 ( -0.365 6.857 7.970) 10.520 7.399 ( 4.378 2.871 -0.057) 5.236 8.168 ( -8.676 -14.161 8.316) 18.573 8.943 ( -3.168 12.563 3.139) 13.331 9.224 ( 2.012 -1.703 0.471) 2.677 9.572 ( -7.200 -6.679 -7.319) 12.248 10.580 ( 12.746 -4.339 8.083) 15.704 10.951 ( 6.148 29.248 -2.030) 29.956 11.937 ( 0.593 -1.082 6.472) 6.589 12.006 ( 3.347 0.809 0.142) 3.447 12.471 ( 2.727 -8.632 5.488) 10.586 12.502 ( 3.679 -3.217 -0.544) 4.917 12.943 ( -8.789 0.330 -10.529) 13.719 14.038 ( 11.249 -5.780 1.126) 12.698 17.767 ( -6.475 -0.387 -18.667) 19.762 18.379 ( 4.255 -1.213 5.621) 7.153 18.849 ( 2.561 -1.489 0.126) 2.965 19.155 ( 0.387 -4.149 4.319) 6.001 21.141 ( 1.889 17.035 -13.079) 21.560 22.271 ( -3.006 -17.954 5.709) 19.079 23.456 ( 6.566 -2.079 1.975) 7.165 23.861 ( 3.029 4.766 1.304) 5.795 ======================= Grid point 224 (101/361) ======================= q-point: (-0.50 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.997 ( -12.239 20.763 1.923) 24.178 2.509 ( -20.758 12.056 -2.618) 24.147 3.354 ( 1.531 2.393 2.663) 3.894 3.398 ( -6.442 -3.652 -2.473) 7.807 3.598 ( -2.057 -4.580 -6.138) 7.930 3.851 ( -10.174 5.193 -2.049) 11.605 4.289 ( -11.131 -4.132 1.346) 11.949 4.828 ( -0.290 -14.364 2.189) 14.533 4.940 ( 5.859 -5.785 1.045) 8.300 5.147 ( -3.939 -7.297 4.417) 9.395 5.505 ( -10.660 -1.539 3.234) 11.246 5.780 ( -4.221 0.261 -4.134) 5.914 6.471 ( -12.902 2.092 4.227) 13.737 6.777 ( -11.444 7.327 11.858) 18.035 7.028 ( -0.676 -6.094 11.376) 12.923 7.474 ( 6.491 -2.130 -1.689) 7.037 8.250 ( -5.285 -9.304 4.346) 11.549 8.826 ( -2.505 12.739 4.419) 13.715 9.282 ( 3.379 -1.884 -0.454) 3.896 9.504 ( -4.776 -11.121 -2.727) 12.406 10.714 ( 5.212 26.538 -3.631) 27.287 10.850 ( 8.000 4.302 6.954) 11.440 11.890 ( -9.892 3.250 3.581) 11.011 11.993 ( -5.076 3.122 2.829) 6.596 12.556 ( 0.379 -4.892 -11.363) 12.377 12.707 ( 3.995 -3.919 2.567) 6.157 12.833 ( 8.801 -2.500 9.295) 13.043 14.282 ( 14.617 -10.316 -3.315) 18.195 17.447 ( -6.214 -0.127 -19.079) 20.066 18.579 ( 8.257 0.126 10.435) 13.307 18.892 ( 2.382 -0.454 0.424) 2.462 19.302 ( 8.082 -3.468 3.584) 9.497 20.829 ( -1.170 13.380 -16.529) 21.298 22.398 ( -12.454 -17.927 6.158) 22.680 23.579 ( 6.026 -0.354 0.662) 6.073 23.911 ( 4.354 3.629 6.521) 8.640 ======================= Grid point 225 (102/361) ======================= q-point: (-0.40 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -14.604 20.638 6.073) 26.001 2.037 ( -24.495 15.341 -4.027) 29.182 2.974 ( -20.407 28.763 0.178) 35.268 3.502 ( -9.001 -8.675 -1.622) 12.606 3.571 ( 1.925 -11.867 7.725) 14.291 3.775 ( -4.535 -3.316 1.599) 5.842 4.257 ( -4.515 -7.990 4.696) 10.309 4.938 ( 0.041 -8.618 -1.486) 8.745 5.107 ( 6.171 -5.289 3.259) 8.756 5.204 ( -5.159 -8.128 4.401) 10.585 5.474 ( -10.511 -13.093 3.342) 17.119 5.717 ( 0.357 2.072 0.511) 2.164 6.294 ( -18.863 -3.147 3.430) 19.429 6.694 ( -9.118 6.103 8.415) 13.827 7.151 ( -4.960 -5.388 5.850) 9.373 7.530 ( 5.856 -3.416 -7.556) 10.152 8.286 ( -0.680 -0.058 1.422) 1.577 8.804 ( -0.543 3.817 8.245) 9.101 9.330 ( 4.050 0.005 -0.925) 4.154 9.566 ( -2.920 -15.021 1.193) 15.348 10.462 ( 2.445 28.282 -5.156) 28.852 10.965 ( 3.740 6.896 5.257) 9.443 11.743 ( -14.741 2.895 6.355) 16.311 11.924 ( -3.929 2.316 0.808) 4.632 12.390 ( -4.424 -0.921 -8.834) 9.922 12.826 ( 2.664 -7.492 1.205) 8.042 13.179 ( 17.643 2.354 7.830) 19.445 14.528 ( 15.060 -13.189 -8.331) 21.683 17.181 ( -4.089 0.824 -9.742) 10.598 18.800 ( 7.650 1.477 6.708) 10.281 18.946 ( 6.392 3.162 1.076) 7.212 19.506 ( 11.587 0.062 4.286) 12.355 20.495 ( -3.528 8.661 -16.116) 18.633 22.396 ( -20.990 -19.735 5.273) 29.289 23.628 ( 4.443 2.641 -2.153) 5.600 24.085 ( 4.884 -1.539 11.410) 12.506 ======================= Grid point 226 (103/361) ======================= q-point: (-0.30 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -15.176 19.779 11.965) 27.653 1.463 ( -27.010 19.499 -3.352) 33.481 2.513 ( -20.726 33.502 21.730) 44.991 3.451 ( -8.798 -9.403 -0.233) 12.879 3.751 ( -4.055 -1.545 1.964) 4.763 3.775 ( -0.535 -10.408 6.800) 12.445 4.418 ( 3.349 -11.988 4.504) 13.237 4.968 ( -0.843 -7.683 -2.310) 8.067 5.251 ( 3.610 -3.286 2.229) 5.366 5.290 ( -9.107 -14.006 11.460) 20.260 5.469 ( -8.634 -12.339 -2.401) 15.250 5.741 ( -3.920 -0.922 5.706) 6.984 6.144 ( -15.063 -9.247 5.255) 18.439 6.613 ( -5.416 5.438 3.262) 8.339 7.115 ( -11.899 -3.098 2.819) 12.614 7.543 ( 6.677 -3.436 -9.447) 12.068 8.269 ( 5.334 9.821 -3.043) 11.583 8.882 ( -1.342 -5.467 2.340) 6.096 9.411 ( 5.596 1.286 5.787) 8.152 9.666 ( -6.044 -16.694 0.155) 17.755 10.169 ( -0.208 25.681 -5.486) 26.261 10.958 ( -0.414 12.584 4.569) 13.395 11.613 ( -13.409 -0.072 8.278) 15.759 11.865 ( -3.407 0.895 0.121) 3.525 12.290 ( -1.099 -1.055 -2.869) 3.249 12.917 ( 2.046 -6.334 -2.334) 7.054 13.361 ( 12.898 9.757 -7.886) 17.993 14.716 ( 12.082 -13.643 -12.216) 21.940 17.204 ( 5.083 -5.368 14.778) 16.524 18.905 ( 5.664 0.026 -1.990) 6.003 19.029 ( 11.597 10.724 0.535) 15.805 19.696 ( 9.924 7.517 6.031) 13.833 20.229 ( -2.141 0.984 -12.449) 12.670 22.320 ( -27.948 -24.788 7.091) 38.024 23.629 ( 4.037 3.139 -2.546) 5.712 24.270 ( -0.434 -4.578 5.332) 7.040 ======================= Grid point 227 (104/361) ======================= q-point: (-0.20 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.054 ( -5.899 21.796 15.405) 27.335 1.215 ( -12.108 16.235 19.401) 28.047 2.365 ( -15.341 27.132 39.914) 50.642 3.415 ( -5.597 -7.383 -1.476) 9.381 3.745 ( -1.224 0.624 5.373) 5.546 3.935 ( -1.989 -9.900 6.204) 11.852 4.569 ( 3.603 -10.569 -4.419) 12.009 4.973 ( -8.066 -8.508 -2.665) 12.023 5.318 ( -0.259 -1.230 1.264) 1.783 5.391 ( -2.319 -2.600 -5.578) 6.576 5.510 ( -17.390 -32.045 20.154) 41.659 5.735 ( -8.633 -1.101 9.202) 12.666 6.187 ( -4.792 -9.628 6.890) 12.772 6.531 ( -0.515 5.203 -1.118) 5.347 7.001 ( -11.780 -1.914 4.341) 12.700 7.527 ( 2.781 -2.282 -10.253) 10.865 8.145 ( 5.461 20.760 -8.072) 22.934 8.925 ( -1.749 -8.385 1.261) 8.658 9.558 ( 3.319 2.928 2.455) 5.061 9.677 ( -9.286 -17.595 -0.237) 19.896 9.903 ( 1.497 22.874 -2.112) 23.020 10.856 ( -1.592 17.420 3.917) 17.926 11.599 ( -8.638 -5.054 11.200) 15.020 11.812 ( -1.893 0.374 -2.016) 2.791 12.275 ( 1.284 1.690 -2.151) 3.021 12.922 ( 1.160 -2.000 -7.708) 8.047 13.191 ( 2.816 15.686 -11.628) 19.728 14.794 ( 6.455 -11.493 -15.715) 20.512 17.768 ( 14.951 -23.247 23.342) 36.177 18.928 ( -1.488 -5.807 -4.210) 7.325 19.128 ( 26.090 15.774 -2.811) 30.617 19.727 ( -0.898 13.012 3.162) 13.421 20.173 ( 7.010 -3.633 -4.427) 9.052 22.260 ( -31.912 -32.046 11.383) 46.636 23.632 ( 4.026 2.125 -2.166) 5.041 24.153 ( -15.191 4.953 -10.408) 19.069 ======================= Grid point 228 (105/361) ======================= q-point: (-0.10 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( -4.575 6.884 26.922) 28.162 1.316 ( 19.299 9.508 24.880) 32.891 2.552 ( -3.694 18.080 46.330) 49.870 3.390 ( -0.695 -4.476 -4.113) 6.118 3.830 ( -3.027 -1.710 10.003) 10.590 4.030 ( -2.890 -7.146 2.492) 8.101 4.642 ( 4.458 -7.986 -5.874) 10.870 4.893 ( -13.689 -3.787 12.383) 18.843 5.255 ( -4.256 -3.493 -7.959) 9.678 5.338 ( 0.204 1.919 -4.741) 5.119 5.518 ( -27.456 -15.199 1.897) 31.440 6.014 ( 3.238 -13.249 22.964) 26.709 6.241 ( -7.673 -4.773 5.398) 10.526 6.508 ( 0.477 0.619 1.775) 1.940 6.967 ( -2.435 -2.668 3.283) 4.881 7.375 ( -2.161 4.567 -12.927) 13.879 7.969 ( 2.519 20.207 4.742) 20.908 9.030 ( -0.381 -8.325 4.464) 9.454 9.436 ( -3.268 5.285 -6.847) 9.246 9.649 ( -7.829 1.741 -1.330) 8.130 9.938 ( 13.845 -3.893 2.240) 14.556 10.711 ( -0.215 19.879 1.662) 19.949 11.698 ( -7.050 -9.198 10.249) 15.471 11.757 ( 2.323 0.367 -6.345) 6.766 12.184 ( 0.322 11.184 -4.445) 12.039 12.869 ( 3.697 2.377 -0.436) 4.417 13.041 ( -1.530 4.270 -2.134) 5.013 14.713 ( 0.338 -7.429 -19.380) 20.758 18.251 ( 7.917 -14.587 0.219) 16.598 18.858 ( -10.759 -11.397 -4.984) 16.447 19.346 ( 9.467 8.761 -4.708) 13.731 19.629 ( 8.447 8.724 -1.040) 12.187 20.340 ( 11.941 -4.060 4.512) 13.394 22.277 ( -27.115 -33.063 9.876) 43.886 23.575 ( -15.663 20.803 -8.991) 27.549 23.674 ( 1.398 4.802 -2.660) 5.665 ======================= Grid point 231 (106/361) ======================= q-point: ( 0.20 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.714 ( -2.243 0.000 9.102) 9.374 2.928 ( 7.195 -0.000 13.911) 15.662 3.247 ( -7.236 0.000 -3.605) 8.084 3.573 ( -5.046 0.000 -5.964) 7.812 3.589 ( 1.907 -0.000 -11.459) 11.616 4.288 ( -7.311 0.000 12.846) 14.781 4.307 ( 2.451 -0.000 -4.956) 5.529 4.322 ( 12.517 -0.000 -14.423) 19.097 4.868 ( -9.744 0.000 5.394) 11.137 5.224 ( -14.040 0.000 2.529) 14.266 5.951 ( -4.146 0.000 -4.904) 6.422 5.996 ( -7.076 0.000 -3.182) 7.758 6.478 ( -14.371 0.000 34.424) 37.303 6.639 ( 2.841 -0.000 3.601) 4.587 6.913 ( 7.346 -0.000 -4.679) 8.709 7.633 ( -15.481 0.000 2.643) 15.705 7.751 ( -4.826 0.000 20.525) 21.084 9.157 ( -0.191 0.000 -0.021) 0.192 9.169 ( -2.809 0.000 1.442) 3.158 9.734 ( -8.700 0.000 -10.729) 13.813 10.136 ( 17.691 -0.000 11.835) 21.285 11.399 ( 17.719 -0.000 7.155) 19.109 11.584 ( 13.366 -0.000 -9.512) 16.405 11.998 ( 5.798 -0.000 -3.232) 6.638 12.136 ( -6.620 0.000 11.383) 13.168 12.593 ( -9.609 0.000 0.555) 9.625 13.173 ( -1.652 0.000 -13.107) 13.210 13.863 ( 1.706 -0.000 1.665) 2.383 18.090 ( -7.099 0.000 -17.997) 19.346 18.272 ( -3.076 0.000 3.044) 4.328 18.768 ( 10.730 -0.000 -2.844) 11.101 19.120 ( -12.596 0.000 4.370) 13.332 21.701 ( 4.935 -0.000 15.991) 16.735 21.748 ( 3.431 -0.000 -21.931) 22.198 23.298 ( 5.774 -0.000 2.748) 6.395 23.879 ( 3.818 -0.000 -0.690) 3.880 ======================= Grid point 232 (107/361) ======================= q-point: (-0.70 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( -7.584 15.265 2.609) 17.244 2.915 ( -12.806 -3.532 -5.207) 14.268 3.279 ( 1.297 -7.890 -1.269) 8.096 3.393 ( -7.643 0.667 -7.395) 10.655 3.533 ( 1.266 3.427 5.899) 6.938 4.224 ( 7.638 6.875 -13.558) 17.013 4.347 ( -7.536 -2.755 8.947) 12.018 4.406 ( 1.029 -10.547 0.753) 10.624 4.830 ( -0.910 1.253 1.574) 2.208 5.029 ( -15.500 -4.479 0.130) 16.135 5.749 ( -11.232 2.710 -4.718) 12.481 5.876 ( -4.683 -1.677 -4.791) 6.906 6.638 ( -16.640 2.272 23.420) 28.819 6.757 ( 1.344 -0.701 11.443) 11.543 6.923 ( 2.200 1.813 -2.792) 3.990 7.473 ( -6.283 4.453 3.203) 8.340 7.939 ( -5.607 -9.204 13.058) 16.931 9.112 ( -2.706 6.122 2.942) 7.311 9.183 ( -1.330 -2.754 1.473) 3.394 9.503 ( -5.975 -1.469 -10.819) 12.446 10.523 ( 15.488 -1.810 11.017) 19.092 11.467 ( 9.863 27.245 -0.410) 28.978 11.840 ( 10.661 -12.389 3.593) 16.735 12.017 ( 3.439 0.450 -2.958) 4.558 12.251 ( -4.292 -9.472 9.517) 14.096 12.509 ( -0.002 0.578 2.448) 2.516 12.944 ( -7.640 -0.057 -12.560) 14.702 13.963 ( 8.882 -2.318 -0.453) 9.191 17.763 ( -6.832 -0.066 -19.515) 20.676 18.348 ( 2.091 -1.357 9.465) 9.788 18.865 ( 10.483 1.775 -4.927) 11.718 19.087 ( -1.567 -2.816 5.211) 6.127 21.430 ( 0.113 13.277 -19.181) 23.328 21.976 ( -2.813 -13.297 10.948) 17.452 23.428 ( 6.429 -0.904 3.659) 7.452 23.918 ( 3.316 1.656 0.481) 3.738 ======================= Grid point 233 (108/361) ======================= q-point: (-0.60 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.359 ( -9.732 19.316 -0.393) 21.632 2.664 ( -16.134 5.144 -2.535) 17.123 3.243 ( -6.461 -6.646 -2.620) 9.632 3.277 ( -5.194 -11.672 -4.950) 13.701 3.638 ( 2.686 4.476 7.341) 9.008 4.005 ( -5.326 7.766 -13.466) 16.432 4.275 ( -14.589 4.826 5.753) 16.408 4.574 ( 1.300 -12.237 5.988) 13.686 4.828 ( -0.308 -6.836 -0.470) 6.859 4.998 ( -1.616 -8.213 2.013) 8.610 5.517 ( -13.523 1.382 -1.596) 13.687 5.786 ( -1.441 0.491 -3.367) 3.695 6.543 ( -19.529 4.983 10.228) 22.602 6.843 ( -9.339 0.799 6.588) 11.457 6.958 ( 2.010 -2.859 7.121) 7.932 7.449 ( 0.885 -0.154 0.617) 1.089 8.073 ( -4.519 -8.479 8.591) 12.889 9.041 ( -3.106 9.809 3.412) 10.840 9.215 ( -1.049 -5.055 1.029) 5.264 9.363 ( -1.915 -4.441 -6.771) 8.321 10.834 ( 11.268 0.395 8.075) 13.869 11.304 ( 6.139 31.869 -0.266) 32.456 11.936 ( -3.069 1.167 -1.185) 3.491 12.031 ( -7.126 0.590 5.414) 8.968 12.368 ( 0.738 -15.488 -1.459) 15.574 12.675 ( -2.754 0.142 -5.707) 6.339 12.775 ( 11.904 -3.324 8.472) 14.984 14.121 ( 12.820 -6.926 -5.563) 15.597 17.446 ( -5.962 -0.057 -17.992) 18.954 18.569 ( 7.127 -0.797 13.774) 15.529 18.920 ( 9.907 2.776 -5.179) 11.519 19.235 ( 8.788 -3.664 5.158) 10.828 21.058 ( -3.628 11.438 -20.143) 23.446 22.112 ( -11.853 -13.393 8.589) 19.840 23.569 ( 5.488 -0.535 4.304) 6.995 23.964 ( 3.793 2.149 2.440) 4.996 ======================= Grid point 234 (109/361) ======================= q-point: (-0.50 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -10.640 20.652 1.808) 23.302 2.298 ( -18.796 14.200 -3.430) 23.806 3.190 ( -10.819 -10.173 -0.697) 14.867 3.350 ( -0.923 -13.186 5.171) 14.193 3.582 ( -8.308 21.810 -1.983) 23.423 3.736 ( -4.959 -1.025 1.122) 5.187 4.138 ( -8.629 -3.568 4.028) 10.169 4.737 ( -0.449 -11.196 0.951) 11.246 4.960 ( 1.152 -12.813 5.112) 13.843 5.061 ( -3.465 -7.146 -0.108) 7.942 5.336 ( -12.637 -2.863 2.794) 13.255 5.761 ( 2.578 2.649 0.376) 3.715 6.289 ( -25.124 1.631 5.764) 25.828 6.753 ( -7.875 0.963 1.730) 8.120 7.085 ( -0.928 -2.804 6.293) 6.951 7.470 ( 3.024 -2.449 -4.595) 6.022 8.189 ( -3.125 -7.457 8.304) 11.590 8.946 ( -1.532 9.498 1.205) 9.695 9.270 ( -2.617 -9.465 1.548) 9.941 9.360 ( 1.920 -4.047 -0.862) 4.562 10.968 ( 6.200 17.896 -0.910) 18.961 11.127 ( 4.359 20.014 5.465) 21.200 11.815 ( -10.862 4.298 3.087) 12.082 11.957 ( -6.988 1.321 2.310) 7.477 12.367 ( -2.394 -2.464 -9.540) 10.140 12.650 ( -0.355 -12.106 1.049) 12.157 13.171 ( 17.451 -2.093 9.723) 20.086 14.298 ( 14.280 -11.607 -10.545) 21.209 17.194 ( -3.471 0.591 -10.814) 11.372 18.822 ( 7.257 0.943 6.742) 9.950 19.001 ( 12.975 2.825 -0.614) 13.293 19.500 ( 15.501 -0.663 6.843) 16.957 20.655 ( -6.923 8.704 -19.321) 22.293 22.091 ( -20.556 -14.244 5.693) 25.648 23.668 ( 3.131 1.784 2.340) 4.296 24.063 ( 4.267 -0.922 5.588) 7.091 ======================= Grid point 235 (110/361) ======================= q-point: (-0.40 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.751 ( -11.912 20.625 5.501) 24.444 1.844 ( -16.519 22.880 0.018) 28.220 3.054 ( -12.631 18.889 9.767) 24.734 3.293 ( -12.153 -1.638 1.877) 12.406 3.535 ( -2.565 -14.566 7.083) 16.399 3.753 ( 0.748 0.488 1.934) 2.131 4.216 ( 0.504 -10.445 5.678) 11.899 4.791 ( -3.595 -10.651 -1.819) 11.387 5.002 ( -13.016 -14.317 -1.792) 19.432 5.165 ( -2.301 -11.162 9.369) 14.754 5.305 ( -6.291 -3.154 6.742) 9.746 5.784 ( -1.647 3.643 3.405) 5.251 6.039 ( -15.732 -3.723 4.393) 16.753 6.663 ( -4.161 0.181 -1.927) 4.590 7.100 ( -6.491 0.832 3.156) 7.265 7.473 ( 4.851 -3.566 -7.894) 9.928 8.316 ( -0.391 -3.962 7.865) 8.815 8.858 ( -1.801 3.634 -3.085) 5.096 9.334 ( -5.937 -13.521 1.338) 14.828 9.456 ( 4.422 -1.611 4.811) 6.730 10.720 ( 3.055 33.050 -5.151) 33.588 11.156 ( 1.349 9.874 7.478) 12.460 11.669 ( -11.040 4.932 6.098) 13.543 11.882 ( -5.085 0.768 0.794) 5.204 12.275 ( 0.147 -0.607 -3.433) 3.489 12.765 ( 1.235 -11.117 -2.059) 11.373 13.444 ( 10.979 0.946 -0.950) 11.061 14.458 ( 12.771 -14.518 -14.159) 23.966 17.141 ( 2.550 -2.075 4.889) 5.891 18.887 ( 4.501 -1.290 -6.745) 8.211 19.199 ( 16.025 7.740 3.420) 18.122 19.818 ( 18.294 5.656 9.208) 21.247 20.270 ( -8.691 3.706 -16.174) 18.731 21.958 ( -26.688 -16.166 5.921) 31.760 23.689 ( 1.820 3.436 0.090) 3.889 24.194 ( 0.808 -3.966 4.075) 5.743 ======================= Grid point 236 (111/361) ======================= q-point: (-0.30 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( -6.470 23.719 11.251) 27.038 1.565 ( -6.165 22.988 10.203) 25.895 2.871 ( -10.380 27.429 25.602) 38.930 3.252 ( -6.498 -10.659 0.364) 12.489 3.700 ( -4.641 -11.385 8.323) 14.847 3.787 ( 2.233 -0.170 2.231) 3.161 4.372 ( 2.970 -10.917 -1.961) 11.482 4.804 ( -11.259 -10.259 4.085) 15.771 4.980 ( -17.406 -23.768 7.411) 30.378 5.272 ( -7.331 -6.301 6.239) 11.505 5.339 ( -1.608 -2.658 3.753) 4.872 5.760 ( -3.514 1.377 8.760) 9.538 6.057 ( -0.550 -5.189 4.880) 7.144 6.587 ( -0.297 0.513 -4.812) 4.848 7.002 ( -8.561 2.426 2.815) 9.332 7.466 ( 2.827 -3.771 -8.850) 10.026 8.403 ( 3.159 7.298 2.816) 8.436 8.771 ( -3.981 -6.007 -2.908) 7.772 9.373 ( -7.113 -15.538 -0.949) 17.115 9.591 ( 2.839 0.802 6.433) 7.077 10.404 ( 2.625 31.761 -4.674) 32.211 11.137 ( -1.619 13.442 6.936) 15.212 11.593 ( -7.076 2.946 8.584) 11.508 11.822 ( -3.005 0.631 -0.547) 3.118 12.294 ( 3.886 0.933 0.708) 4.059 12.821 ( 0.675 -8.394 -5.099) 9.844 13.407 ( 1.939 7.716 -11.978) 14.379 14.553 ( 8.136 -14.819 -16.679) 23.749 17.453 ( 10.308 -12.591 18.991) 25.010 18.830 ( -1.454 -4.939 -10.875) 12.032 19.363 ( 20.728 10.809 -3.997) 23.716 19.922 ( -8.424 6.518 -3.365) 11.170 20.152 ( 14.551 3.732 3.507) 15.426 21.824 ( -26.271 -18.167 9.940) 33.451 23.677 ( 1.613 2.825 -0.846) 3.361 24.183 ( -7.300 -0.640 -4.128) 8.411 ======================= Grid point 237 (112/361) ======================= q-point: (-0.20 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.478 ( -2.570 16.778 16.630) 23.763 1.545 ( 13.918 15.651 19.455) 28.587 2.931 ( -1.819 21.988 34.586) 41.024 3.276 ( -1.198 -8.081 -1.996) 8.410 3.792 ( -7.644 -3.599 11.386) 14.178 3.876 ( 1.665 -7.890 -0.591) 8.086 4.469 ( 5.412 -10.899 -6.586) 13.837 4.771 ( -24.084 -10.247 20.721) 33.383 5.073 ( -4.467 -16.101 -1.358) 16.765 5.274 ( -8.824 -7.081 4.567) 12.201 5.375 ( 0.356 1.083 1.108) 1.590 5.904 ( 2.294 -2.781 15.424) 15.839 6.141 ( -4.304 -5.602 5.316) 8.842 6.533 ( 0.087 1.074 -3.170) 3.348 6.934 ( -3.578 -0.468 2.080) 4.165 7.379 ( -2.074 -2.023 -11.050) 11.423 8.323 ( 1.576 17.697 1.300) 17.815 8.837 ( -1.422 -12.919 3.177) 13.380 9.394 ( -4.229 -11.355 -2.611) 12.395 9.635 ( -0.438 2.827 0.776) 2.964 10.159 ( 4.534 23.271 -1.904) 23.785 11.047 ( -1.922 16.696 4.862) 17.496 11.611 ( -6.088 -0.942 9.485) 11.310 11.767 ( 0.875 0.765 -5.018) 5.151 12.333 ( 4.660 6.278 -0.828) 7.863 12.836 ( 1.421 -5.273 -3.080) 6.270 13.181 ( -2.765 8.977 -7.387) 11.950 14.531 ( 2.237 -12.538 -19.493) 23.284 17.956 ( 10.222 -16.593 12.654) 23.236 18.681 ( -8.288 -8.415 -11.556) 16.524 19.481 ( 13.178 6.143 -7.980) 16.586 19.734 ( -6.493 1.412 -1.362) 6.783 20.349 ( 10.655 7.246 8.260) 15.306 21.832 ( -13.669 -17.957 11.338) 25.255 23.668 ( 1.315 1.309 -1.615) 2.460 23.902 ( -12.410 10.310 -9.375) 18.660 ======================= Grid point 238 (113/361) ======================= q-point: (-0.10 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.615 ( 2.840 5.813 22.891) 23.788 1.938 ( 20.766 8.255 18.772) 29.185 3.210 ( 5.889 10.266 26.267) 28.810 3.314 ( 2.682 -2.470 0.557) 3.689 3.837 ( -10.428 -4.937 11.754) 16.470 3.930 ( 0.641 -6.145 -2.967) 6.854 4.524 ( 0.154 -9.392 -7.690) 12.140 4.814 ( -22.371 -7.371 18.650) 30.044 5.138 ( 9.436 -2.869 0.692) 9.887 5.264 ( -6.793 -3.791 4.255) 8.867 5.328 ( -1.957 6.321 -1.129) 6.713 6.168 ( -8.609 -4.254 7.943) 12.462 6.228 ( 2.663 -9.491 19.776) 22.097 6.491 ( -3.802 -1.593 1.541) 4.401 6.919 ( -1.241 -3.435 -5.633) 6.713 7.230 ( -1.965 -0.754 -7.008) 7.318 8.229 ( -1.437 17.645 8.474) 19.627 8.964 ( -1.249 -11.946 1.442) 12.097 9.369 ( -1.473 -0.464 -3.666) 3.978 9.588 ( -0.655 3.847 -0.456) 3.929 10.098 ( 7.090 5.285 -1.355) 8.947 10.915 ( 0.585 17.908 1.338) 17.968 11.608 ( -7.023 -3.371 0.909) 7.843 11.755 ( 6.873 -0.935 -4.574) 8.308 12.293 ( 1.944 12.078 1.605) 12.338 12.877 ( -1.369 -4.128 -0.975) 4.457 13.066 ( 1.896 4.257 1.389) 4.863 14.377 ( -3.289 -8.839 -20.150) 22.248 18.274 ( 9.904 -8.473 -0.300) 13.037 18.505 ( -11.904 -11.303 -7.617) 18.096 19.323 ( -8.423 10.764 -7.883) 15.778 19.664 ( -9.340 -0.791 2.292) 9.649 20.594 ( 13.929 -1.866 9.322) 16.865 21.986 ( 0.801 -12.839 2.705) 13.145 23.476 ( -8.796 14.613 -6.370) 18.207 23.718 ( 3.520 0.987 -1.584) 3.984 ======================= Grid point 242 (114/361) ======================= q-point: ( 0.30 -0.70 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.630 ( -9.692 0.000 2.989) 10.142 2.644 ( -11.509 0.000 -5.649) 12.820 3.143 ( -5.252 0.000 -3.621) 6.379 3.174 ( -11.575 0.000 -6.133) 13.100 3.680 ( 1.005 -0.000 8.086) 8.148 4.059 ( -5.385 0.000 -15.464) 16.375 4.407 ( -3.754 0.000 12.804) 13.343 4.434 ( 2.423 -0.000 4.524) 5.132 4.731 ( -15.884 0.000 -4.433) 16.491 4.917 ( 5.510 -0.000 1.501) 5.711 5.531 ( -14.792 0.000 -2.669) 15.031 5.792 ( 0.137 -0.000 -2.980) 2.983 6.598 ( -26.681 0.000 16.963) 31.616 6.870 ( -0.694 0.000 -6.515) 6.552 6.899 ( 0.894 -0.000 9.900) 9.941 7.456 ( -3.643 0.000 3.491) 5.046 7.991 ( -2.951 0.000 10.448) 10.856 9.147 ( -4.543 0.000 3.656) 5.831 9.151 ( -2.267 0.000 1.906) 2.962 9.323 ( -0.060 0.000 -9.289) 9.289 10.837 ( 12.174 -0.000 9.497) 15.441 11.791 ( -2.325 0.000 5.506) 5.976 11.830 ( 13.805 -0.000 -6.203) 15.135 12.003 ( 0.793 -0.000 -2.681) 2.796 12.178 ( -14.122 0.000 8.022) 16.241 12.685 ( -9.289 0.000 -9.923) 13.593 12.737 ( 18.146 -0.000 10.300) 20.866 14.057 ( 12.000 -0.000 -6.253) 13.531 17.445 ( -5.831 0.000 -17.661) 18.598 18.561 ( 7.059 -0.000 15.143) 16.708 18.953 ( 13.018 -0.000 -9.574) 16.160 19.195 ( 8.261 -0.000 7.834) 11.385 21.176 ( -4.655 0.000 -24.250) 24.692 21.977 ( -11.368 0.000 12.191) 16.669 23.564 ( 5.313 -0.000 5.513) 7.656 23.984 ( 3.588 -0.000 1.215) 3.788 ======================= Grid point 244 (115/361) ======================= q-point: (-0.60 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( -9.193 13.988 -1.895) 16.845 2.508 ( -10.779 6.920 0.100) 12.809 2.985 ( -12.789 -8.452 -0.648) 15.344 3.125 ( -4.651 -10.082 4.868) 12.123 3.725 ( -2.873 -0.032 1.871) 3.429 3.819 ( -4.166 2.433 -10.469) 11.528 4.273 ( -11.502 18.690 5.637) 22.658 4.594 ( 0.292 -4.405 4.561) 6.347 4.661 ( -4.431 -19.340 5.541) 20.600 4.978 ( -0.233 -2.280 -3.437) 4.131 5.318 ( -13.798 -0.152 3.979) 14.361 5.799 ( 3.865 1.287 0.095) 4.074 6.319 ( -32.153 1.146 8.349) 33.239 6.764 ( -2.379 0.706 -6.373) 6.839 7.028 ( 1.261 -2.874 5.849) 6.638 7.455 ( -1.519 0.224 1.943) 2.476 8.087 ( -2.707 -3.243 9.546) 10.439 9.084 ( -3.776 4.794 -0.972) 6.179 9.127 ( -3.451 -4.366 -0.587) 5.596 9.319 ( 3.757 -1.668 1.319) 4.317 11.074 ( 8.167 1.707 7.279) 11.072 11.631 ( 1.214 26.043 -0.099) 26.072 11.871 ( -3.554 1.251 -2.854) 4.727 11.981 ( -8.430 2.714 4.792) 10.069 12.210 ( 1.336 -17.119 -2.418) 17.341 12.484 ( -7.111 -3.641 -4.030) 8.948 13.137 ( 17.423 -1.231 10.577) 20.420 14.149 ( 13.640 -4.546 -11.517) 18.422 17.202 ( -3.032 0.211 -11.349) 11.749 18.833 ( 6.988 0.325 7.142) 9.997 19.039 ( 16.282 1.170 -3.808) 16.763 19.488 ( 17.384 -0.436 9.713) 19.918 20.776 ( -8.587 4.053 -22.695) 24.601 21.909 ( -19.446 -5.652 7.637) 21.643 23.689 ( 2.337 0.586 5.884) 6.358 24.053 ( 3.960 -0.263 1.647) 4.297 ======================= Grid point 245 (116/361) ======================= q-point: (-0.50 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -8.941 17.830 1.960) 20.042 2.242 ( -8.667 20.596 1.887) 22.425 2.958 ( -9.942 -13.120 4.961) 17.193 3.257 ( -5.582 -15.442 5.724) 17.389 3.551 ( -8.445 12.162 -1.647) 14.898 3.767 ( 1.304 -1.158 2.224) 2.827 4.130 ( -3.331 5.258 7.807) 9.985 4.639 ( -4.117 -5.557 2.861) 7.485 4.808 ( -11.041 -7.766 -10.385) 17.031 4.910 ( -4.130 -15.681 11.088) 19.644 5.291 ( -7.617 0.140 11.807) 14.051 5.849 ( -0.791 3.416 2.789) 4.481 5.986 ( -19.311 -2.609 3.420) 19.784 6.650 ( -1.457 -0.805 -7.776) 7.952 7.101 ( -1.476 -1.262 2.424) 3.106 7.447 ( 0.390 0.672 -1.302) 1.517 8.207 ( -2.914 -6.147 10.122) 12.195 8.960 ( -2.954 5.870 -3.940) 7.662 9.126 ( -4.031 -8.401 -0.755) 9.349 9.441 ( 4.142 -1.008 6.809) 8.033 11.182 ( 5.111 11.463 1.642) 12.658 11.403 ( -0.762 23.407 1.710) 23.482 11.754 ( -6.876 4.105 1.293) 8.112 11.896 ( -7.867 1.482 3.944) 8.924 12.258 ( 2.091 -2.414 -3.785) 4.953 12.520 ( -0.557 -15.567 -0.536) 15.587 13.434 ( 9.555 -1.233 3.715) 10.326 14.237 ( 13.276 -9.332 -15.470) 22.420 17.119 ( 2.233 -0.556 -0.046) 2.301 18.866 ( 4.883 -0.897 -11.136) 12.193 19.301 ( 16.843 3.765 6.166) 18.327 19.888 ( 22.314 2.320 10.647) 24.832 20.347 ( -10.962 4.228 -18.743) 22.121 21.739 ( -24.359 -8.488 5.981) 26.480 23.743 ( -0.574 2.478 3.445) 4.282 24.133 ( 2.354 -2.675 1.250) 3.776 ======================= Grid point 246 (117/361) ======================= q-point: (-0.40 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.869 ( -5.611 21.084 7.738) 23.150 2.008 ( -1.747 25.744 5.795) 26.446 3.028 ( -6.133 -12.471 5.103) 14.805 3.234 ( -10.030 4.163 5.488) 12.167 3.503 ( -0.719 -3.422 9.650) 10.264 3.826 ( 0.637 1.829 4.301) 4.717 4.217 ( 1.380 -4.458 3.980) 6.133 4.587 ( -22.488 -13.395 4.432) 26.548 4.699 ( -1.235 -7.662 2.595) 8.184 5.112 ( -2.874 -11.441 6.740) 13.586 5.302 ( -9.661 -1.569 10.368) 14.258 5.768 ( -5.693 -0.374 6.072) 8.332 6.002 ( 2.300 -1.307 3.526) 4.408 6.560 ( 0.867 -2.684 -8.818) 9.258 7.061 ( -5.211 2.768 0.792) 5.953 7.425 ( 1.279 -0.025 -4.414) 4.596 8.359 ( -1.859 -8.909 9.459) 13.126 8.803 ( -3.430 7.015 -4.830) 9.182 9.142 ( -3.752 -10.266 -1.249) 11.001 9.592 ( 2.291 -0.538 8.446) 8.768 10.978 ( 2.707 31.027 -6.886) 31.898 11.325 ( -3.204 8.271 7.931) 11.899 11.663 ( -4.402 4.010 3.125) 6.725 11.835 ( -5.545 1.033 3.144) 6.457 12.312 ( 6.082 0.805 2.040) 6.465 12.628 ( 0.228 -13.184 -2.953) 13.513 13.483 ( -0.066 1.682 -6.016) 6.247 14.301 ( 10.084 -12.651 -18.011) 24.210 17.299 ( 8.777 -5.420 12.529) 16.229 18.756 ( 0.069 -3.417 -16.054) 16.413 19.516 ( 15.694 6.475 -1.290) 17.026 19.947 ( -12.194 -1.163 -14.261) 18.800 20.306 ( 21.044 10.473 12.742) 26.738 21.576 ( -21.437 -10.469 8.376) 25.285 23.727 ( -1.632 2.624 0.965) 3.237 24.154 ( -2.595 -2.140 -2.724) 4.328 ======================= Grid point 247 (118/361) ======================= q-point: (-0.30 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( 5.904 18.300 10.437) 21.878 1.876 ( 2.590 22.975 10.809) 25.523 3.089 ( -2.160 -9.764 -1.047) 10.055 3.249 ( -1.890 6.954 18.320) 19.686 3.658 ( -1.096 -7.003 7.874) 10.595 3.854 ( -4.160 3.016 8.463) 9.901 4.278 ( 5.115 -9.760 -9.181) 14.342 4.551 ( -23.522 -12.337 23.530) 35.484 4.841 ( 1.113 -9.434 7.581) 12.154 5.178 ( -3.603 -5.089 2.052) 6.564 5.360 ( -1.520 -2.975 6.650) 7.443 5.851 ( -0.554 -3.376 9.928) 10.501 6.074 ( -0.862 -1.666 4.079) 4.490 6.515 ( 2.787 -3.120 -7.383) 8.486 6.962 ( -5.119 2.960 0.281) 5.920 7.353 ( -1.719 0.314 -7.392) 7.595 8.526 ( 1.064 -5.236 6.796) 8.645 8.650 ( -4.727 2.947 -1.379) 5.738 9.184 ( -0.933 -10.595 -1.339) 10.720 9.686 ( -1.083 2.000 6.163) 6.570 10.647 ( 2.192 29.967 -6.985) 30.848 11.278 ( -5.620 9.077 6.534) 12.517 11.637 ( -2.166 2.884 4.705) 5.928 11.786 ( -2.274 1.499 -0.922) 2.876 12.421 ( 7.193 3.314 1.259) 8.019 12.710 ( 1.683 -8.286 -0.009) 8.456 13.305 ( -6.100 4.577 -8.486) 11.409 14.294 ( 4.840 -13.371 -20.154) 24.665 17.706 ( 11.350 -11.038 16.070) 22.559 18.556 ( -5.757 -5.797 -16.328) 18.258 19.552 ( 4.370 1.650 -13.315) 14.111 19.719 ( -5.528 -1.060 -0.483) 5.649 20.570 ( 11.709 15.558 11.034) 22.381 21.586 ( -5.570 -11.110 9.741) 15.791 23.688 ( -1.776 0.976 -0.673) 2.135 24.015 ( -7.161 3.450 -7.531) 10.950 ======================= Grid point 248 (119/361) ======================= q-point: (-0.20 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( 3.821 16.867 12.320) 21.234 2.086 ( 17.974 8.263 15.299) 25.008 3.145 ( 3.051 -8.632 -4.723) 10.302 3.407 ( -1.717 0.568 14.470) 14.582 3.754 ( -0.904 -4.095 1.893) 4.602 3.888 ( -5.949 3.990 16.551) 18.035 4.338 ( 3.632 -11.096 -7.897) 14.095 4.688 ( -12.474 -6.247 22.821) 26.747 5.049 ( 2.145 -7.575 9.948) 12.686 5.196 ( -1.915 -2.754 4.045) 5.255 5.416 ( 0.566 2.890 2.884) 4.122 6.028 ( -0.957 -9.949 9.767) 13.974 6.117 ( -4.035 -2.296 8.765) 9.919 6.501 ( 0.544 -0.131 -1.942) 2.021 6.876 ( -3.767 -1.272 -4.937) 6.339 7.215 ( -2.753 0.702 -6.977) 7.534 8.513 ( -1.808 13.588 5.220) 14.668 8.713 ( -2.082 -15.844 2.150) 16.124 9.261 ( 0.522 -8.966 -1.238) 9.066 9.683 ( -1.018 5.899 3.321) 6.846 10.372 ( 3.233 22.650 -5.094) 23.440 11.159 ( -7.298 9.115 2.225) 11.887 11.622 ( -6.048 4.886 5.405) 9.469 11.749 ( 7.207 -0.010 -7.048) 10.080 12.460 ( 4.480 5.644 -0.628) 7.233 12.806 ( -0.542 -2.809 1.980) 3.479 13.129 ( -2.215 2.446 -0.828) 3.402 14.188 ( -0.597 -11.869 -20.709) 23.876 18.108 ( 9.982 -9.408 8.815) 16.306 18.341 ( -8.114 -7.398 -11.878) 16.176 19.383 ( -7.463 -3.728 -9.749) 12.831 19.677 ( -6.581 2.797 2.679) 7.636 20.671 ( 7.252 10.525 7.580) 14.860 21.813 ( 9.847 -7.478 5.688) 13.610 23.622 ( -4.870 2.049 -4.036) 6.649 23.785 ( -2.733 6.346 -5.815) 9.031 ======================= Grid point 249 (120/361) ======================= q-point: (-0.10 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( 4.161 4.065 16.556) 17.548 2.489 ( 20.415 5.864 14.885) 25.937 3.207 ( 5.190 -8.086 -6.762) 11.749 3.493 ( -5.911 -6.942 4.669) 10.244 3.754 ( -2.259 -4.831 -4.006) 6.670 4.047 ( 2.014 6.406 19.992) 21.089 4.349 ( 2.249 -5.231 -9.806) 11.339 4.725 ( -7.820 3.502 5.092) 9.967 5.215 ( -8.413 -2.308 13.495) 16.070 5.271 ( -1.136 1.222 0.958) 1.924 5.511 ( 8.890 3.108 18.656) 20.898 6.117 ( -6.671 -5.002 7.625) 11.299 6.322 ( -2.272 -16.435 9.078) 18.913 6.474 ( -4.675 4.922 7.195) 9.892 6.732 ( -3.901 -3.471 -10.933) 12.115 7.162 ( 1.760 -3.033 -1.951) 4.012 8.419 ( -7.417 13.685 8.856) 17.908 8.838 ( -0.732 -13.470 0.370) 13.495 9.284 ( -2.143 -3.234 -2.781) 4.774 9.687 ( 4.184 5.434 3.602) 7.747 10.227 ( 4.584 12.770 -2.548) 13.806 10.987 ( -6.156 4.207 -3.447) 8.214 11.547 ( -0.528 5.761 0.521) 5.809 11.811 ( 9.497 -0.794 -4.155) 10.396 12.449 ( 1.510 9.470 2.880) 10.013 12.747 ( -8.512 -3.996 -2.237) 9.666 13.200 ( 7.116 2.247 4.576) 8.753 14.011 ( -4.626 -9.111 -16.941) 19.784 18.193 ( -5.658 -7.525 -7.558) 12.073 18.358 ( 8.239 -5.527 1.272) 10.002 19.157 ( -8.775 4.285 -10.048) 14.012 19.519 ( -19.337 3.921 7.864) 21.240 20.837 ( 10.751 -3.715 4.466) 12.220 22.049 ( 13.089 -0.175 -0.898) 13.121 23.427 ( -3.478 8.702 -4.921) 10.585 23.739 ( 2.517 -1.185 -1.917) 3.379 ======================= Grid point 254 (121/361) ======================= q-point: ( 0.40 -0.60 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( -6.720 0.000 -0.368) 6.730 2.470 ( -3.947 0.000 2.445) 4.643 2.801 ( -11.660 0.000 6.754) 13.475 3.073 ( -7.643 0.000 6.418) 9.981 3.669 ( -3.446 0.000 0.018) 3.446 3.702 ( -1.165 0.000 -4.040) 4.204 4.279 ( -7.703 0.000 2.987) 8.261 4.637 ( 1.489 -0.000 7.881) 8.021 4.641 ( -2.094 0.000 8.758) 9.005 4.763 ( -15.718 0.000 -7.557) 17.440 5.294 ( -8.350 0.000 12.978) 15.432 5.890 ( 5.291 -0.000 2.465) 5.837 5.952 ( -26.931 0.000 3.215) 27.122 6.644 ( -0.120 0.000 -10.767) 10.767 7.081 ( 0.614 -0.000 2.218) 2.302 7.462 ( -1.700 0.000 2.474) 3.002 8.146 ( -3.825 0.000 9.739) 10.463 9.013 ( -0.870 0.000 -5.943) 6.006 9.056 ( -5.714 0.000 0.940) 5.791 9.428 ( 4.103 -0.000 7.236) 8.318 11.255 ( 4.697 -0.000 6.257) 7.824 11.690 ( -9.254 0.000 2.881) 9.692 11.798 ( 0.459 -0.000 -7.699) 7.712 11.998 ( -8.470 0.000 3.123) 9.028 12.115 ( 7.093 -0.000 -0.164) 7.095 12.362 ( -3.082 0.000 0.140) 3.085 13.420 ( 9.119 -0.000 5.188) 10.492 14.151 ( 13.431 -0.000 -15.939) 20.843 17.115 ( 2.286 -0.000 -1.498) 2.733 18.858 ( 5.101 -0.000 -12.807) 13.786 19.334 ( 16.963 -0.000 7.130) 18.401 19.907 ( 22.804 -0.000 10.829) 25.245 20.390 ( -10.636 0.000 -19.577) 22.280 21.662 ( -23.579 0.000 6.395) 24.431 23.767 ( -1.816 0.000 5.347) 5.647 24.108 ( 3.246 -0.000 -0.504) 3.285 ======================= Grid point 256 (122/361) ======================= q-point: (-0.50 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.186 ( -4.227 12.444 4.272) 13.819 2.426 ( 1.813 18.447 5.962) 19.471 2.814 ( -7.006 -9.316 7.268) 13.737 3.048 ( -8.857 -14.213 0.828) 16.767 3.610 ( 0.022 8.459 4.343) 9.509 3.762 ( 0.527 -8.012 3.322) 8.689 4.260 ( -3.007 5.172 10.841) 12.382 4.419 ( -17.445 -4.920 -7.651) 19.674 4.669 ( -1.597 4.976 9.104) 10.497 4.881 ( -0.040 -13.525 10.212) 16.947 5.284 ( -15.052 -0.488 12.056) 19.291 5.759 ( -6.274 -0.334 4.294) 7.610 5.993 ( 3.673 -0.092 3.437) 5.031 6.520 ( 1.822 -1.310 -11.910) 12.120 7.079 ( -2.021 -0.128 -1.458) 2.496 7.459 ( -0.440 2.381 0.893) 2.580 8.214 ( -5.602 -5.303 8.924) 11.796 8.917 ( -1.794 4.611 -3.786) 6.230 9.011 ( -3.127 -4.507 -0.694) 5.529 9.579 ( 2.088 -0.554 9.548) 9.789 11.341 ( 2.218 5.788 3.073) 6.919 11.523 ( -5.400 14.319 -2.094) 15.446 11.712 ( 0.154 1.264 -5.005) 5.164 11.878 ( -8.810 4.618 6.071) 11.653 12.271 ( 5.893 -8.386 -0.099) 10.250 12.415 ( 1.702 -5.702 4.739) 7.607 13.493 ( -1.514 -0.013 -2.015) 2.520 14.138 ( 11.499 -4.963 -19.156) 22.887 17.241 ( 8.470 -1.429 8.894) 12.364 18.713 ( 1.109 -1.269 -18.959) 19.033 19.593 ( 12.763 2.219 1.835) 13.084 19.927 ( -11.694 -0.676 -17.658) 21.190 20.452 ( 24.317 4.801 13.637) 28.290 21.446 ( -20.772 -3.945 7.992) 22.603 23.763 ( -4.514 1.162 2.623) 5.349 24.122 ( 0.588 -1.126 -3.222) 3.463 ======================= Grid point 257 (123/361) ======================= q-point: (-0.40 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.105 ( 1.852 14.041 7.140) 15.861 2.322 ( 2.498 25.743 4.964) 26.336 2.899 ( -1.459 -10.281 2.053) 10.585 3.149 ( -1.650 -15.406 4.230) 16.061 3.641 ( 0.638 3.320 7.000) 7.773 3.867 ( -3.544 -3.980 9.588) 10.970 4.153 ( -6.278 -4.650 -6.331) 10.056 4.428 ( -6.081 -0.287 21.513) 22.358 4.742 ( -1.868 -0.864 10.569) 10.768 5.073 ( 0.659 -7.293 4.522) 8.607 5.282 ( -6.252 -4.573 11.639) 13.981 5.804 ( -0.529 -1.494 6.351) 6.546 6.066 ( 0.824 0.211 3.447) 3.550 6.449 ( 4.510 -3.366 -10.252) 11.695 6.996 ( -4.791 0.459 -3.639) 6.034 7.413 ( -0.968 5.742 -1.628) 6.047 8.303 ( -6.221 -12.422 6.456) 15.319 8.806 ( -1.619 8.373 -0.483) 8.542 9.033 ( -0.006 -6.653 -0.397) 6.665 9.706 ( -0.804 0.478 9.430) 9.476 11.164 ( 2.231 26.249 -11.162) 28.611 11.381 ( -8.341 3.246 5.914) 10.728 11.676 ( 3.113 0.785 -3.128) 4.482 11.823 ( -6.977 2.405 6.786) 10.025 12.393 ( 3.184 -8.028 -2.858) 9.097 12.604 ( 7.212 -1.584 10.176) 12.573 13.351 ( -9.362 1.075 -6.359) 11.368 14.090 ( 7.383 -8.689 -21.253) 24.118 17.566 ( 11.933 -4.971 14.979) 19.786 18.476 ( -3.806 -3.186 -19.445) 20.068 19.551 ( -9.321 -0.924 -15.589) 18.186 19.721 ( 3.763 0.822 -0.899) 3.955 20.846 ( 16.231 14.407 12.905) 25.250 21.406 ( -4.962 -9.486 8.971) 13.967 23.701 ( -5.000 0.524 0.062) 5.028 24.049 ( -3.003 0.801 -6.663) 7.352 ======================= Grid point 258 (124/361) ======================= q-point: (-0.30 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 6.446 20.703 3.508) 21.965 2.228 ( 8.395 8.604 11.380) 16.553 2.992 ( 3.712 -7.776 -2.853) 9.076 3.300 ( -1.213 -10.090 3.233) 10.665 3.670 ( -3.695 -4.618 -0.736) 5.960 4.009 ( -4.261 4.502 23.866) 24.658 4.150 ( 5.652 -9.020 -5.803) 12.123 4.631 ( -2.295 1.152 22.653) 22.798 4.898 ( -2.722 -8.158 13.707) 16.182 5.159 ( 0.368 -2.005 3.527) 4.073 5.423 ( 1.446 -1.841 9.689) 9.968 5.890 ( -1.900 -5.190 5.584) 7.856 6.099 ( -2.402 -0.132 4.640) 5.226 6.461 ( 6.005 -3.637 -5.582) 8.970 6.861 ( -5.929 -0.860 -6.713) 8.997 7.293 ( -3.036 7.998 -2.622) 8.947 8.404 ( -7.245 -17.219 3.083) 18.934 8.728 ( 0.022 9.854 3.425) 10.432 9.113 ( 1.965 -7.348 0.408) 7.617 9.769 ( -2.157 3.661 7.908) 8.977 10.816 ( 2.196 25.302 -11.534) 27.893 11.260 ( -12.285 3.637 2.016) 12.970 11.708 ( 5.990 1.047 -1.195) 6.197 11.779 ( -3.067 5.340 2.961) 6.833 12.449 ( 1.968 -6.355 -3.351) 7.449 12.822 ( 4.205 4.279 8.595) 10.482 13.143 ( -7.444 -0.932 -1.714) 7.696 13.982 ( 2.270 -10.378 -21.789) 24.240 17.962 ( 10.977 -6.561 13.491) 18.589 18.236 ( -5.418 -4.540 -14.148) 15.815 19.282 ( -10.054 -5.753 -10.810) 15.844 19.727 ( -0.661 2.209 -0.358) 2.333 20.918 ( 1.227 15.553 6.149) 16.770 21.692 ( 15.263 -6.761 8.699) 18.824 23.623 ( -4.895 -0.765 -1.931) 5.317 23.883 ( -3.443 4.079 -8.165) 9.755 ======================= Grid point 259 (125/361) ======================= q-point: (-0.20 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.108 ( 0.172 11.585 5.942) 13.021 2.559 ( 19.205 2.162 12.964) 23.272 3.076 ( 6.179 -6.009 -4.781) 9.856 3.360 ( -2.628 -6.296 -0.149) 6.824 3.625 ( -7.104 -9.090 -3.318) 12.004 4.190 ( 8.472 3.715 3.276) 9.814 4.266 ( 2.095 -0.408 9.457) 9.695 4.804 ( -2.264 5.112 10.129) 11.570 5.096 ( -4.583 -9.595 13.053) 16.836 5.269 ( -3.131 -2.212 13.664) 14.192 5.580 ( 6.205 3.769 13.378) 15.220 5.970 ( -3.539 -9.607 2.467) 10.531 6.143 ( -4.559 -4.273 8.507) 10.555 6.521 ( 1.936 0.024 1.055) 2.205 6.686 ( -4.392 -2.173 -10.563) 11.644 7.169 ( -1.147 4.823 -1.732) 5.251 8.459 ( -10.390 -13.742 3.133) 17.510 8.722 ( 1.987 5.686 4.633) 7.599 9.197 ( 0.556 -5.776 -0.510) 5.825 9.791 ( 0.106 5.885 6.277) 8.605 10.536 ( 4.530 19.604 -8.600) 21.882 11.028 ( -15.238 2.383 -3.462) 15.807 11.714 ( -0.530 11.049 4.887) 12.093 11.795 ( 10.104 -1.193 -4.795) 11.248 12.493 ( 1.272 -4.780 -1.339) 5.125 12.738 ( -10.584 3.248 -0.985) 11.115 13.236 ( 7.434 1.780 8.426) 11.377 13.830 ( -1.765 -10.587 -18.226) 21.152 18.086 ( -3.499 -4.607 -7.107) 9.164 18.265 ( 7.814 -4.736 5.771) 10.806 19.107 ( -8.131 -6.813 -7.377) 12.921 19.634 ( -11.105 6.471 3.956) 13.448 20.866 ( 3.675 6.522 -1.056) 7.561 22.052 ( 17.553 0.128 6.041) 18.564 23.520 ( -3.964 1.646 -4.299) 6.075 23.741 ( -0.149 1.658 -5.236) 5.495 ======================= Grid point 260 (126/361) ======================= q-point: (-0.10 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( -3.866 -2.949 7.381) 8.839 2.950 ( 15.515 1.877 11.674) 19.507 3.144 ( 2.034 -5.416 -3.395) 6.708 3.374 ( 2.133 -4.889 -2.804) 6.026 3.570 ( -6.239 -8.179 -2.748) 10.648 4.221 ( 12.384 -0.499 -18.158) 21.984 4.421 ( 0.855 7.556 15.233) 17.026 4.744 ( -3.811 9.278 2.366) 10.305 5.226 ( -9.381 -3.832 12.221) 15.876 5.272 ( -7.254 7.129 4.428) 11.093 5.936 ( 3.822 -3.230 27.108) 27.566 5.992 ( -6.730 -10.132 -4.159) 12.855 6.215 ( -6.354 -2.758 8.464) 10.937 6.475 ( -4.951 -5.905 2.493) 8.099 6.648 ( 2.031 2.624 1.866) 3.807 7.164 ( 5.317 -2.671 -2.023) 6.285 8.435 ( -12.798 -1.938 8.197) 15.321 8.776 ( 1.040 -2.854 2.049) 3.664 9.206 ( -0.953 -2.009 -2.178) 3.113 9.830 ( 2.409 4.479 3.832) 6.368 10.405 ( 7.310 13.998 -2.502) 15.988 10.760 ( -12.084 -4.858 -7.543) 15.050 11.704 ( 4.785 10.315 5.339) 12.561 11.890 ( 9.410 -0.789 -4.169) 10.323 12.521 ( -4.565 -6.912 -1.245) 8.377 12.576 ( -5.087 5.749 1.961) 7.923 13.336 ( 2.845 2.716 -4.916) 6.296 13.759 ( 1.607 -6.566 -2.530) 7.218 18.037 ( -1.622 -3.268 -2.000) 4.160 18.392 ( 4.315 -4.574 -5.591) 8.415 18.979 ( -3.285 0.957 -5.434) 6.421 19.409 ( -19.419 9.619 8.361) 23.228 20.914 ( 7.617 -6.924 -4.724) 11.326 22.290 ( 13.232 8.030 3.322) 15.831 23.414 ( 0.649 4.278 -3.623) 5.643 23.719 ( 1.450 -3.598 -2.377) 4.550 ======================= Grid point 266 (127/361) ======================= q-point: (-0.50 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( -1.798 -0.000 4.102) 4.479 2.693 ( 3.217 0.000 6.060) 6.861 2.788 ( 1.520 0.000 6.067) 6.254 2.865 ( -1.918 -0.000 -0.582) 2.005 3.704 ( -2.027 -0.000 -0.225) 2.040 3.784 ( 0.408 -0.000 11.641) 11.648 4.105 ( -11.507 -0.000 -2.931) 11.875 4.446 ( -1.076 -0.000 20.019) 20.048 4.788 ( -1.975 -0.000 6.566) 6.856 4.958 ( 2.062 -0.000 11.182) 11.371 5.238 ( -8.244 -0.000 11.970) 14.534 5.793 ( -0.106 -0.000 5.346) 5.347 6.069 ( 1.168 -0.000 3.328) 3.527 6.417 ( 5.166 -0.000 -11.448) 12.560 6.996 ( -4.411 -0.000 -4.957) 6.636 7.484 ( 0.364 -0.000 0.504) 0.622 8.175 ( -9.239 -0.000 6.582) 11.344 8.915 ( 1.889 -0.000 -1.794) 2.605 8.941 ( -3.067 0.000 1.177) 3.285 9.709 ( -0.603 -0.000 10.582) 10.599 11.404 ( -5.891 -0.000 5.793) 8.262 11.456 ( -0.212 0.000 -13.884) 13.886 11.667 ( 4.426 -0.000 -7.762) 8.935 11.850 ( -8.863 -0.000 9.034) 12.655 12.270 ( 1.232 -0.000 0.929) 1.543 12.603 ( 9.650 -0.000 12.205) 15.559 13.358 ( -10.812 -0.000 -5.175) 11.987 14.010 ( 8.540 -0.000 -21.866) 23.475 17.523 ( 12.127 -0.000 14.131) 18.621 18.447 ( -3.064 -0.000 -20.561) 20.788 19.541 ( -13.029 -0.000 -15.678) 20.385 19.730 ( 5.943 -0.000 -1.643) 6.166 21.011 ( 26.237 -0.000 14.763) 30.105 21.289 ( -13.241 0.000 7.639) 15.287 23.706 ( -6.386 -0.000 0.368) 6.397 24.055 ( -1.375 -0.000 -6.505) 6.649 ======================= Grid point 268 (128/361) ======================= q-point: (-0.40 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( 6.321 3.074 7.144) 10.022 2.553 ( -3.884 15.819 -2.674) 16.507 2.902 ( 7.573 -0.866 0.354) 7.631 3.084 ( 6.515 -12.943 5.051) 15.345 3.614 ( -8.673 -1.514 -2.169) 9.067 3.974 ( 14.620 -4.129 -5.288) 16.086 4.077 ( -10.244 -0.959 25.874) 27.845 4.692 ( 0.491 2.088 21.826) 21.931 4.813 ( -2.072 -0.114 5.013) 5.426 5.114 ( -0.625 -2.671 8.639) 9.064 5.378 ( 2.566 -2.018 14.999) 15.351 5.839 ( -1.986 -1.084 3.394) 4.079 6.101 ( -1.674 0.181 2.862) 3.321 6.406 ( 8.634 -1.881 -7.608) 11.661 6.845 ( -6.452 -0.656 -7.666) 10.041 7.451 ( -0.823 7.317 -0.866) 7.414 8.141 ( -11.541 -10.122 5.006) 16.147 8.878 ( 0.143 7.209 1.951) 7.470 8.996 ( 1.692 -6.178 1.182) 6.514 9.812 ( -2.089 1.164 10.337) 10.610 11.160 ( -5.239 9.076 -16.282) 19.363 11.349 ( -5.170 7.831 0.451) 9.394 11.675 ( 7.599 -3.482 -7.431) 11.184 11.870 ( -5.516 3.160 11.758) 13.367 12.313 ( 0.320 -6.180 -0.875) 6.250 12.903 ( 9.566 3.459 13.667) 17.037 13.109 ( -14.076 -2.006 -4.196) 14.825 13.849 ( 4.285 -4.067 -22.759) 23.513 17.883 ( 11.755 -2.264 14.839) 19.066 18.181 ( -3.888 -1.603 -15.235) 15.804 19.210 ( -11.087 -2.099 -12.326) 16.711 19.751 ( 1.003 0.646 -1.595) 1.992 21.163 ( -4.752 9.889 3.301) 11.457 21.571 ( 21.522 -5.844 13.056) 25.842 23.611 ( -6.196 -0.447 -1.473) 6.384 23.929 ( -2.426 1.214 -8.710) 9.122 ======================= Grid point 269 (129/361) ======================= q-point: (-0.30 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( -7.495 9.760 -3.825) 12.886 2.575 ( 15.663 -0.054 11.574) 19.475 3.022 ( 10.552 0.552 -2.144) 10.782 3.282 ( 5.335 -3.114 1.094) 6.273 3.467 ( -11.587 -7.660 -2.752) 14.160 4.117 ( 17.502 -5.514 -14.130) 23.160 4.358 ( -2.638 4.524 30.008) 30.462 4.886 ( 4.877 -1.146 5.643) 7.546 4.919 ( -7.088 -3.877 17.041) 18.859 5.218 ( -4.819 -2.868 14.636) 15.674 5.628 ( 4.264 1.657 13.627) 14.374 5.854 ( -1.790 -3.546 3.127) 5.055 6.101 ( -4.281 -1.209 4.285) 6.176 6.495 ( 9.324 -2.103 -3.027) 10.026 6.651 ( -6.094 -1.549 -10.613) 12.336 7.324 ( -3.237 11.190 -0.327) 11.654 8.156 ( -12.184 -17.016 4.554) 21.418 8.854 ( 1.011 7.308 3.478) 8.156 9.094 ( 1.840 -5.805 1.110) 6.189 9.878 ( -1.579 3.577 8.686) 9.526 10.810 ( -3.461 8.442 -17.261) 19.524 11.148 ( -9.761 12.309 -1.094) 15.748 11.749 ( 9.691 -3.952 -6.471) 12.305 11.896 ( -2.335 8.107 9.759) 12.900 12.364 ( -0.156 -7.785 -1.511) 7.932 12.794 ( -13.777 2.135 -2.445) 14.155 13.259 ( 9.332 0.734 13.566) 16.482 13.664 ( 0.380 -7.192 -20.430) 21.663 18.026 ( -1.514 -2.256 -6.986) 7.495 18.198 ( 7.417 -2.669 9.480) 12.329 18.991 ( -6.933 -5.132 -7.701) 11.564 19.712 ( -4.771 2.446 1.051) 5.463 21.017 ( -2.263 8.535 -4.828) 10.064 22.046 ( 20.087 -0.754 12.105) 23.465 23.514 ( -5.127 -1.237 -2.476) 5.827 23.779 ( -0.974 1.884 -8.825) 9.076 ======================= Grid point 270 (130/361) ======================= q-point: (-0.20 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( -11.275 -0.253 -1.576) 11.388 2.946 ( 13.368 -1.153 9.666) 16.537 3.070 ( -4.510 -3.370 -1.896) 5.941 3.330 ( 7.642 -1.049 -1.009) 7.779 3.461 ( 4.197 -2.596 -0.424) 4.953 4.183 ( 14.054 -3.352 -19.356) 24.153 4.548 ( 0.154 6.486 11.957) 13.604 4.927 ( -2.024 10.493 6.557) 12.538 5.087 ( -4.308 -11.163 11.602) 16.667 5.372 ( -8.678 1.976 18.609) 20.628 5.687 ( -11.965 -11.228 2.573) 16.609 6.016 ( 5.083 2.733 11.582) 12.940 6.157 ( -1.478 -3.910 11.674) 12.400 6.426 ( -5.199 -0.398 -4.598) 6.952 6.661 ( 9.225 -1.702 -1.075) 9.442 7.200 ( -0.839 7.163 -0.051) 7.212 8.205 ( -12.640 -18.302 6.236) 23.100 8.853 ( 1.053 6.975 3.683) 7.957 9.156 ( 0.506 -3.590 -0.704) 3.693 9.921 ( 0.544 5.073 6.065) 7.926 10.528 ( -2.984 -0.162 -15.320) 15.609 10.866 ( -8.534 15.803 -1.616) 18.032 11.843 ( 8.374 -0.306 -2.785) 8.830 11.906 ( 1.009 7.025 5.551) 9.011 12.384 ( -4.623 -7.250 -1.649) 8.755 12.632 ( -5.316 0.419 1.354) 5.501 13.362 ( -1.673 -0.423 -10.935) 11.071 13.657 ( 8.609 -3.989 5.967) 11.209 18.000 ( 0.881 -1.215 -0.356) 1.542 18.318 ( 0.799 -3.492 -3.565) 5.054 18.939 ( 0.131 -3.750 -0.458) 3.780 19.578 ( -13.568 7.635 4.684) 16.258 20.873 ( 3.253 1.653 -10.986) 11.576 22.412 ( 15.329 5.586 10.555) 19.432 23.442 ( -1.877 -1.170 -2.641) 3.445 23.678 ( 0.852 -0.758 -6.527) 6.626 ======================= Grid point 271 (131/361) ======================= q-point: (-0.10 -0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( -13.056 -10.972 1.841) 17.153 2.891 ( -17.151 -11.959 -4.663) 21.423 3.201 ( 5.518 -0.078 4.320) 7.009 3.473 ( 5.013 1.576 3.220) 6.163 3.596 ( 16.166 5.532 2.072) 17.212 4.095 ( 6.322 -3.688 -22.644) 23.797 4.559 ( -2.323 4.044 1.485) 4.894 4.886 ( 3.579 12.153 2.209) 12.860 5.175 ( -10.563 -3.199 7.375) 13.274 5.317 ( -11.703 11.237 9.533) 18.818 5.642 ( -14.495 -13.842 2.528) 20.201 6.026 ( -6.569 -1.039 -1.544) 6.827 6.361 ( -1.006 -8.947 10.615) 13.920 6.559 ( 1.928 2.865 25.281) 25.516 6.743 ( 3.596 4.034 2.585) 5.990 7.213 ( 7.775 -1.573 -1.639) 8.101 8.278 ( -11.780 -15.441 8.836) 21.337 8.820 ( -1.826 7.031 1.456) 7.408 9.179 ( 2.424 -1.885 -1.199) 3.296 9.910 ( -2.779 7.155 0.528) 7.694 10.388 ( -1.871 -13.165 -10.282) 16.809 10.661 ( 1.154 14.333 0.921) 14.409 11.905 ( -0.794 4.571 7.949) 9.204 11.944 ( 5.198 -0.996 -3.062) 6.114 12.369 ( -1.396 -4.633 0.494) 4.864 12.635 ( 1.752 2.105 2.135) 3.473 13.153 ( -7.007 -2.814 -13.277) 15.274 13.920 ( 12.181 1.753 8.939) 15.211 17.997 ( -1.974 1.106 -4.108) 4.690 18.277 ( 2.417 -5.388 -7.376) 9.449 18.991 ( 3.813 3.597 1.236) 5.386 19.337 ( -17.279 9.800 7.429) 21.208 20.833 ( 6.453 -8.590 -12.690) 16.628 22.604 ( 7.019 12.951 8.672) 17.093 23.434 ( 4.007 0.360 -1.649) 4.348 23.666 ( 1.217 -5.564 -2.460) 6.204 ======================= Grid point 278 (132/361) ======================= q-point: (-0.40 0.60 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.405 ( -12.778 0.000 -8.085) 15.121 2.572 ( 14.084 -0.000 11.050) 17.901 3.057 ( 14.840 -0.000 -4.007) 15.372 3.239 ( 9.918 -0.000 6.998) 12.138 3.394 ( -14.769 0.000 -3.638) 15.210 4.061 ( 19.368 -0.000 -14.022) 23.911 4.397 ( -2.255 0.000 34.134) 34.209 4.801 ( -3.636 0.000 3.229) 4.863 4.956 ( 2.766 -0.000 14.866) 15.121 5.187 ( -6.352 0.000 13.462) 14.885 5.642 ( 3.837 -0.000 14.982) 15.466 5.826 ( -1.086 0.000 4.494) 4.623 6.091 ( -4.146 0.000 2.370) 4.775 6.473 ( 12.162 -0.000 -4.618) 13.009 6.637 ( -7.260 0.000 -10.140) 12.471 7.464 ( -0.846 0.000 -1.847) 2.031 7.964 ( -16.215 0.000 7.353) 17.804 8.953 ( 0.686 -0.000 2.058) 2.169 9.008 ( 2.453 -0.000 2.231) 3.316 9.911 ( -1.849 0.000 9.550) 9.727 10.869 ( -10.316 0.000 -17.161) 20.023 11.319 ( -2.726 0.000 -5.405) 6.054 11.683 ( 8.786 -0.000 -5.834) 10.547 11.976 ( -3.823 0.000 12.421) 12.996 12.280 ( 0.707 -0.000 -1.307) 1.486 12.811 ( -16.508 0.000 -3.154) 16.806 13.264 ( 10.808 -0.000 15.729) 19.085 13.598 ( 1.090 -0.000 -21.598) 21.626 18.005 ( -0.768 0.000 -6.905) 6.948 18.174 ( 7.409 -0.000 10.793) 13.091 18.944 ( -6.368 0.000 -8.440) 10.573 19.732 ( -3.020 0.000 0.203) 3.027 21.103 ( -4.200 0.000 -6.664) 7.877 22.036 ( 21.101 -0.000 15.104) 25.949 23.501 ( -5.898 0.000 -2.129) 6.270 23.797 ( -0.928 0.000 -9.873) 9.916 ======================= Grid point 280 (133/361) ======================= q-point: (-0.30 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( -16.724 -0.119 -6.273) 17.862 2.933 ( 15.406 -0.286 10.686) 18.751 3.015 ( -16.424 -2.179 -5.530) 17.466 3.339 ( 17.215 1.583 -1.728) 17.373 3.455 ( 9.906 0.322 5.014) 11.108 4.127 ( 15.202 -2.148 -19.162) 24.554 4.662 ( -0.615 6.861 12.008) 13.844 4.861 ( -1.774 -11.853 7.112) 13.937 5.092 ( -0.872 6.644 9.638) 11.739 5.326 ( -8.787 -4.511 24.821) 26.714 5.612 ( -12.956 0.088 1.688) 13.066 6.051 ( -1.262 1.186 7.458) 7.657 6.097 ( 3.960 -2.232 12.047) 12.876 6.434 ( -3.038 0.653 -5.312) 6.154 6.617 ( 13.620 -2.065 -3.853) 14.305 7.376 ( -2.624 9.789 -0.217) 10.137 7.898 ( -16.680 -13.465 9.408) 23.411 8.966 ( 1.968 5.376 2.243) 6.148 9.083 ( 1.165 -4.254 0.965) 4.515 9.989 ( -0.005 2.119 7.317) 7.618 10.512 ( -10.639 -0.688 -17.233) 20.264 11.141 ( -3.923 11.172 -6.296) 13.410 11.780 ( 9.546 -4.172 -3.747) 11.071 12.023 ( -6.292 3.985 9.656) 12.195 12.290 ( 0.396 -2.836 -1.598) 3.280 12.617 ( -8.444 -1.078 1.643) 8.669 13.331 ( -3.138 -1.749 -17.075) 17.449 13.624 ( 11.786 -0.372 13.018) 17.565 17.988 ( 2.631 -0.259 0.753) 2.749 18.275 ( -1.781 -1.279 -2.776) 3.538 18.884 ( 2.977 -1.779 1.663) 3.846 19.662 ( -8.948 2.131 2.904) 9.645 20.923 ( -0.380 2.434 -14.695) 14.900 22.481 ( 16.699 2.046 15.897) 23.147 23.406 ( -4.953 -1.662 -1.676) 5.487 23.679 ( 1.595 0.277 -9.877) 10.009 ======================= Grid point 281 (134/361) ======================= q-point: (-0.20 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( -18.797 -6.003 -0.626) 19.742 2.692 ( -23.454 -9.230 -6.340) 25.989 3.220 ( 10.321 1.776 5.999) 12.069 3.545 ( 8.590 6.076 4.377) 11.396 3.675 ( 19.676 2.377 2.048) 19.925 4.030 ( 5.374 -2.991 -23.967) 24.743 4.638 ( -3.879 5.406 1.478) 6.816 5.013 ( -0.716 -10.672 1.090) 10.751 5.086 ( -3.600 6.111 4.788) 8.557 5.384 ( -15.384 -6.311 -0.813) 16.648 5.565 ( -8.518 8.405 26.486) 29.064 6.023 ( -7.266 0.635 -2.458) 7.697 6.194 ( -4.752 -9.095 8.495) 13.321 6.629 ( 9.184 4.009 20.923) 23.199 6.775 ( 12.254 -0.789 -1.583) 12.381 7.267 ( -0.619 7.936 1.630) 8.125 7.944 ( -14.727 -19.341 9.860) 26.233 8.960 ( 0.550 7.135 1.798) 7.378 9.132 ( 2.041 -3.237 -0.963) 3.946 10.028 ( -1.379 5.674 1.754) 6.097 10.217 ( -6.223 -6.452 -12.255) 15.184 10.914 ( -1.985 12.582 -5.055) 13.704 11.892 ( 7.125 -3.439 -4.254) 8.983 11.980 ( -11.630 2.751 10.320) 15.790 12.314 ( 3.528 -1.598 0.532) 3.910 12.633 ( 1.270 -1.528 4.194) 4.641 13.094 ( -6.010 -3.136 -14.944) 16.410 13.948 ( 13.249 1.285 11.931) 17.876 18.033 ( -0.881 2.856 -3.276) 4.435 18.180 ( 1.188 -5.214 -5.299) 7.528 19.022 ( 6.288 0.604 5.888) 8.636 19.496 ( -15.883 6.738 4.666) 17.873 20.742 ( 4.567 -2.174 -18.502) 19.181 22.809 ( 9.075 9.719 15.151) 20.158 23.382 ( -0.781 -5.519 0.988) 5.661 23.606 ( 3.277 -1.160 -8.403) 9.093 ======================= Grid point 282 (135/361) ======================= q-point: (-0.10 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -18.555 -13.018 5.116) 23.236 2.409 ( -24.674 -16.843 -3.324) 30.059 3.332 ( 3.484 5.043 0.342) 6.139 3.563 ( -2.158 3.256 -1.729) 4.272 3.818 ( 1.795 -1.252 -14.442) 14.607 3.904 ( 8.425 5.154 0.645) 9.898 4.510 ( -9.072 2.498 -0.432) 9.420 5.019 ( -6.817 -0.166 1.835) 7.061 5.046 ( 3.757 0.976 -4.519) 5.957 5.258 ( -6.767 0.510 3.613) 7.688 5.659 ( -7.548 9.953 19.862) 23.464 5.874 ( -6.553 -1.710 -4.415) 8.085 6.362 ( -3.254 -10.544 10.527) 15.251 6.734 ( -6.376 6.639 5.727) 10.841 7.030 ( 6.685 6.771 17.103) 19.572 7.322 ( 9.164 -1.445 2.977) 9.743 8.062 ( -10.627 -21.646 8.795) 25.668 8.875 ( -3.157 10.646 0.530) 11.117 9.200 ( 5.880 -3.227 -1.597) 6.895 9.846 ( -8.168 2.628 -6.168) 10.567 10.213 ( 3.585 -6.425 -2.958) 7.930 10.785 ( 2.216 6.251 -1.713) 6.850 11.920 ( -14.325 -0.713 12.800) 19.224 11.929 ( 2.466 -1.512 -4.941) 5.725 12.466 ( 11.478 -2.368 4.218) 12.456 12.719 ( 4.453 1.829 1.436) 5.023 12.868 ( -8.979 -3.496 -9.165) 13.298 14.243 ( 15.208 4.105 7.560) 17.472 17.794 ( -5.718 0.899 -19.484) 20.326 18.326 ( 7.964 -2.562 6.537) 10.617 19.103 ( -1.976 8.443 2.174) 8.940 19.291 ( -8.120 3.936 6.299) 11.005 20.654 ( 5.595 -9.028 -17.288) 20.290 22.885 ( -2.496 15.954 9.804) 18.892 23.514 ( 8.627 -0.788 1.388) 8.773 23.609 ( 1.423 -7.729 1.123) 7.938 ======================= Grid point 290 (136/361) ======================= q-point: (-0.30 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( -21.219 0.000 -1.166) 21.251 2.603 ( -25.715 0.000 -7.241) 26.715 3.241 ( 12.818 -0.000 6.560) 14.399 3.641 ( 4.294 -0.000 5.770) 7.192 3.663 ( 24.401 -0.000 0.448) 24.405 4.005 ( 7.193 -0.000 -24.364) 25.404 4.767 ( -6.526 0.000 1.309) 6.656 4.796 ( -3.913 0.000 5.862) 7.048 5.169 ( 0.471 -0.000 -1.236) 1.323 5.314 ( -12.532 0.000 2.321) 12.745 5.666 ( -8.913 0.000 30.196) 31.484 6.050 ( -5.877 0.000 8.328) 10.193 6.076 ( -7.482 0.000 -5.069) 9.038 6.676 ( 12.872 -0.000 21.821) 25.335 6.751 ( 14.768 -0.000 -5.690) 15.826 7.402 ( -0.144 0.000 -0.662) 0.678 7.709 ( -20.905 0.000 14.385) 25.377 9.054 ( 4.207 -0.000 0.194) 4.212 9.073 ( -0.659 0.000 0.781) 1.021 10.095 ( 2.700 -0.000 5.611) 6.227 10.147 ( -10.893 0.000 -16.551) 19.814 11.041 ( -3.990 0.000 -8.706) 9.577 11.850 ( 7.583 -0.000 -2.851) 8.102 12.008 ( -13.377 0.000 10.566) 17.046 12.301 ( 2.918 -0.000 0.600) 2.979 12.614 ( 1.445 -0.000 5.470) 5.658 13.063 ( -4.778 0.000 -15.863) 16.567 13.960 ( 13.218 -0.000 12.971) 18.519 18.095 ( 5.814 -0.000 6.424) 8.664 18.098 ( -5.637 0.000 -14.039) 15.129 19.026 ( 7.114 -0.000 7.610) 10.418 19.556 ( -14.239 0.000 3.931) 14.772 20.729 ( 3.186 -0.000 -21.135) 21.374 22.910 ( 11.837 -0.000 20.027) 23.264 23.312 ( -5.201 0.000 -0.315) 5.210 23.600 ( 4.627 -0.000 -10.493) 11.468 ======================= Grid point 291 (137/361) ======================= q-point: (-0.20 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( -23.297 -4.608 8.324) 25.165 2.173 ( -28.537 -7.834 -5.653) 30.127 3.433 ( 5.961 5.489 0.254) 8.107 3.557 ( -8.844 -3.570 -11.713) 15.105 3.863 ( 6.277 5.755 -5.942) 10.384 3.959 ( 12.175 -0.504 -0.172) 12.187 4.560 ( -15.015 3.260 0.427) 15.371 4.863 ( -6.762 -8.738 6.150) 12.645 5.138 ( 6.027 3.599 -5.700) 9.042 5.251 ( -2.176 -0.755 3.182) 3.928 5.791 ( -5.023 1.492 6.092) 8.035 5.935 ( -8.866 10.240 11.513) 17.777 6.165 ( -5.578 -11.229 12.879) 17.974 6.855 ( 10.114 4.926 -4.401) 12.080 7.115 ( 9.420 1.821 22.025) 24.024 7.359 ( 0.146 6.879 3.119) 7.554 7.687 ( -17.762 -17.939 12.497) 28.169 9.032 ( -1.173 6.061 0.726) 6.216 9.137 ( 5.550 -3.273 -1.654) 6.652 9.835 ( -7.612 -1.525 -13.677) 15.727 10.198 ( 4.487 1.305 3.258) 5.696 10.872 ( -2.839 2.845 -7.079) 8.140 11.886 ( 3.438 -1.197 -4.867) 6.078 11.961 ( -13.667 2.600 15.099) 20.531 12.396 ( 4.449 -4.042 4.993) 7.814 12.733 ( 5.197 0.200 4.845) 7.108 12.824 ( -5.538 -1.191 -13.000) 14.181 14.292 ( 15.315 1.353 9.711) 18.185 17.806 ( -5.425 0.399 -20.799) 21.499 18.292 ( 7.650 -1.052 9.111) 11.943 19.203 ( 5.324 2.681 6.657) 8.936 19.356 ( -16.542 2.571 2.486) 16.924 20.546 ( 5.966 -3.069 -21.080) 22.121 23.150 ( -2.084 13.716 10.144) 17.186 23.387 ( 2.857 -11.194 15.168) 19.066 23.559 ( 7.586 -0.046 -10.158) 12.679 ======================= Grid point 292 (138/361) ======================= q-point: (-0.10 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -23.374 -8.821 13.902) 28.591 1.864 ( -27.416 -19.215 0.996) 33.493 3.015 ( -27.792 -5.085 -19.952) 34.588 3.618 ( 7.175 3.119 3.482) 8.563 3.805 ( -3.602 7.214 2.318) 8.390 3.980 ( -4.014 4.207 -1.258) 5.949 4.420 ( -7.034 1.918 5.429) 9.090 4.911 ( -2.650 -5.043 3.523) 6.698 5.161 ( 10.733 4.251 -4.817) 12.509 5.293 ( 1.033 1.839 4.474) 4.946 5.739 ( -4.115 -1.601 -1.509) 4.666 5.882 ( -7.727 14.365 13.971) 21.477 6.338 ( -2.897 -10.811 8.461) 14.031 6.776 ( -7.185 14.712 3.218) 16.686 7.292 ( 2.229 6.538 5.938) 9.109 7.496 ( 5.719 -1.410 6.211) 8.560 7.831 ( -8.080 -24.721 11.317) 28.364 8.936 ( -3.850 10.340 2.054) 11.223 9.240 ( 8.856 -3.615 -3.766) 10.281 9.666 ( -2.440 -5.334 -6.727) 8.924 10.248 ( 3.419 4.918 -0.629) 6.023 10.784 ( -0.758 -2.522 -2.448) 3.595 11.869 ( 1.572 -1.517 -6.433) 6.794 11.919 ( -15.298 7.027 18.644) 25.120 12.605 ( -5.779 0.023 -11.013) 12.437 12.639 ( 8.907 -11.897 8.926) 17.336 12.853 ( 4.989 1.515 3.799) 6.451 14.575 ( 16.486 4.439 3.791) 17.489 17.454 ( -6.040 0.169 -22.836) 23.622 18.531 ( 8.355 -1.332 10.037) 13.127 19.057 ( -12.798 6.041 -1.501) 14.231 19.373 ( 4.415 0.384 5.266) 6.882 20.443 ( 4.802 -6.715 -16.810) 18.728 23.035 ( -8.641 14.993 6.095) 18.347 23.550 ( 5.888 -2.331 -7.051) 9.477 23.768 ( 6.813 -3.659 21.018) 22.396 ======================= Grid point 301 (139/361) ======================= q-point: (-0.20 -0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( -26.218 0.000 21.266) 33.759 1.663 ( -30.785 0.000 -2.690) 30.903 2.971 ( -30.599 0.000 -22.230) 37.821 3.646 ( 8.863 -0.000 3.210) 9.427 3.890 ( -5.721 0.000 1.720) 5.974 4.008 ( -3.098 0.000 -0.777) 3.194 4.440 ( -6.903 0.000 8.694) 11.102 4.853 ( -0.840 0.000 3.309) 3.414 5.200 ( 10.418 -0.000 -5.086) 11.593 5.309 ( 2.013 -0.000 4.554) 4.979 5.722 ( -3.529 0.000 -0.465) 3.559 6.090 ( -8.683 0.000 13.388) 15.958 6.161 ( -2.885 0.000 10.298) 10.695 6.988 ( 12.782 -0.000 -6.272) 14.238 7.372 ( -8.697 0.000 5.585) 10.336 7.452 ( 5.499 -0.000 -1.275) 5.645 7.537 ( -14.283 0.000 29.346) 32.638 9.041 ( -3.459 0.000 1.515) 3.776 9.198 ( 9.376 -0.000 -3.455) 9.992 9.608 ( -1.570 0.000 -10.993) 11.104 10.312 ( 4.996 -0.000 2.639) 5.650 10.753 ( -3.897 0.000 -5.310) 6.586 11.850 ( 2.643 -0.000 -6.547) 7.061 12.043 ( -10.937 0.000 23.374) 25.807 12.469 ( -1.115 0.000 7.871) 7.950 12.609 ( -2.478 0.000 -12.547) 12.789 12.868 ( 5.821 -0.000 3.696) 6.895 14.614 ( 16.410 -0.000 5.281) 17.239 17.455 ( -5.867 0.000 -23.675) 24.391 18.519 ( 7.783 -0.000 10.733) 13.258 19.120 ( -15.815 0.000 -3.692) 16.240 19.373 ( 4.360 -0.000 6.187) 7.569 20.381 ( 6.132 -0.000 -17.393) 18.443 23.192 ( -6.043 0.000 2.807) 6.664 23.515 ( 4.089 -0.000 -2.659) 4.877 23.730 ( 8.284 -0.000 22.285) 23.775 ======================= Grid point 302 (140/361) ======================= q-point: (-0.10 -0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( -28.040 0.629 14.999) 31.806 1.387 ( -27.573 -17.476 15.171) 35.998 2.244 ( -43.601 -6.688 -10.831) 45.421 3.732 ( -0.701 4.253 -1.269) 4.493 3.816 ( -5.032 -0.699 2.234) 5.550 3.920 ( -6.721 3.222 5.460) 9.239 4.558 ( 2.955 6.996 15.806) 17.536 4.875 ( 0.475 -5.523 -1.043) 5.641 5.293 ( 10.183 2.543 -3.020) 10.922 5.386 ( 1.328 1.173 5.295) 5.584 5.686 ( -3.020 0.205 -0.612) 3.088 6.022 ( -6.091 11.753 6.562) 14.775 6.297 ( -0.605 -9.519 4.566) 10.574 6.908 ( -6.366 26.153 4.741) 27.331 7.319 ( -7.814 -7.022 2.213) 10.736 7.534 ( 7.015 -2.088 -3.485) 8.107 7.746 ( -1.808 -15.410 9.712) 18.305 8.985 ( -4.973 4.576 4.353) 8.039 9.289 ( 10.114 -1.448 -6.629) 12.180 9.552 ( 2.844 -5.871 -3.739) 7.519 10.354 ( 2.070 9.779 0.158) 9.997 10.676 ( -4.872 -7.601 -1.578) 9.165 11.814 ( 2.358 0.027 -5.681) 6.151 12.080 ( -11.594 20.212 17.996) 29.441 12.419 ( -5.474 0.396 -6.675) 8.642 12.692 ( 6.757 -23.190 5.439) 24.759 12.969 ( 4.579 1.226 1.588) 4.999 14.847 ( 15.128 3.226 -1.695) 15.561 17.157 ( -4.712 -0.318 -7.082) 8.512 18.744 ( 3.803 -0.932 9.891) 10.638 18.870 ( -6.724 -0.731 -7.050) 9.770 19.483 ( 2.654 -0.527 3.953) 4.790 20.292 ( 4.692 -2.042 -12.519) 13.524 23.091 ( -8.666 11.405 4.785) 15.102 23.541 ( 6.348 -1.503 -5.608) 8.603 24.137 ( 7.594 0.802 23.909) 25.099 ======================= Grid point 312 (141/361) ======================= q-point: (-0.10 -0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.973 ( -25.116 0.000 16.312) 29.948 1.030 ( -37.579 0.000 -2.342) 37.652 1.743 ( -36.983 0.000 41.170) 55.342 3.652 ( -7.449 0.000 -3.391) 8.184 3.728 ( -5.679 0.000 1.531) 5.882 4.003 ( -1.096 0.000 9.154) 9.220 4.788 ( 1.485 -0.000 -6.956) 7.112 4.951 ( 10.420 -0.000 19.519) 22.126 5.394 ( 7.118 -0.000 -3.479) 7.923 5.470 ( -1.175 0.000 5.830) 5.947 5.552 ( -5.939 0.000 -9.851) 11.503 6.129 ( 1.302 -0.000 9.462) 9.551 6.281 ( 0.945 -0.000 -0.141) 0.955 7.057 ( -16.325 0.000 6.221) 17.470 7.202 ( 4.713 -0.000 4.067) 6.225 7.550 ( -11.609 0.000 -16.170) 19.906 7.600 ( 9.562 -0.000 -6.395) 11.503 8.989 ( -4.553 0.000 6.090) 7.604 9.358 ( 9.353 -0.000 -1.121) 9.420 9.541 ( 3.792 -0.000 -3.141) 4.924 10.432 ( -18.359 0.000 -4.373) 18.873 10.469 ( 2.455 -0.000 1.042) 2.667 11.797 ( 3.233 -0.000 -4.371) 5.437 12.214 ( -11.370 0.000 -3.501) 11.897 12.259 ( -3.611 0.000 -9.352) 10.025 12.612 ( 0.362 -0.000 5.211) 5.224 13.031 ( 2.887 -0.000 -0.668) 2.963 14.987 ( 11.006 -0.000 -8.563) 13.945 17.434 ( 24.264 -0.000 40.185) 46.942 18.618 ( -5.367 0.000 -9.626) 11.021 18.960 ( 3.745 -0.000 9.182) 9.917 19.525 ( -0.255 0.000 0.788) 0.828 20.228 ( 5.546 -0.000 -9.019) 10.588 23.106 ( -6.695 0.000 5.317) 8.549 23.563 ( 6.215 -0.000 -4.245) 7.526 24.423 ( 2.078 -0.000 -1.295) 2.449 ======================= Grid point 313 (142/361) ======================= q-point: ( 0.00 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 14.225 -0.000 20.849) 25.239 1.829 ( -0.442 0.000 30.965) 30.968 3.247 ( -4.156 0.000 36.121) 36.359 3.314 ( -1.260 0.000 -7.012) 7.125 4.001 ( 3.769 -0.000 4.683) 6.011 4.051 ( -1.605 0.000 -9.218) 9.356 4.626 ( -0.207 0.000 -3.885) 3.890 4.939 ( 5.808 -0.000 -15.802) 16.835 5.253 ( 1.470 -0.000 1.305) 1.966 5.258 ( -10.403 0.000 11.488) 15.498 5.660 ( -28.526 0.000 8.783) 29.848 6.346 ( -0.623 0.000 4.570) 4.612 6.521 ( 11.727 -0.000 1.594) 11.835 6.638 ( -11.850 0.000 13.577) 18.021 6.960 ( -0.070 0.000 -14.166) 14.166 7.372 ( -11.612 0.000 27.303) 29.670 7.994 ( 1.771 -0.000 12.310) 12.436 9.189 ( -1.837 0.000 1.092) 2.137 9.213 ( 0.319 -0.000 -6.966) 6.973 9.597 ( -7.442 0.000 2.783) 7.945 10.185 ( 11.690 -0.000 5.963) 13.123 10.396 ( -3.299 0.000 -5.181) 6.143 11.564 ( 1.405 -0.000 -12.009) 12.091 11.820 ( 0.781 -0.000 -6.307) 6.355 12.153 ( -4.350 0.000 12.442) 13.181 12.897 ( 8.273 -0.000 1.108) 8.347 12.975 ( -1.992 0.000 -1.844) 2.714 14.377 ( 0.522 -0.000 -20.333) 20.340 18.196 ( 8.326 -0.000 -10.460) 13.369 19.015 ( -7.128 0.000 -12.490) 14.381 19.079 ( -16.760 0.000 4.176) 17.273 19.526 ( 18.835 -0.000 -0.318) 18.837 20.477 ( 21.120 -0.000 6.338) 22.050 22.679 ( -37.982 0.000 -10.962) 39.532 23.182 ( -5.412 0.000 4.225) 6.866 23.598 ( 7.714 -0.000 -3.886) 8.638 ======================= Grid point 314 (143/361) ======================= q-point: ( 0.10 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( 11.766 2.495 17.249) 21.029 2.237 ( 7.296 -2.401 27.261) 28.322 3.231 ( 4.068 2.472 -8.127) 9.418 3.613 ( 0.140 -4.151 20.707) 21.119 3.864 ( -2.486 4.784 -12.250) 13.384 4.089 ( 0.880 -0.566 4.361) 4.485 4.486 ( -3.574 7.232 -9.902) 12.772 4.697 ( -6.360 -5.498 -16.881) 18.859 5.268 ( -8.581 0.414 7.835) 11.627 5.358 ( -0.740 -2.707 9.700) 10.098 5.635 ( -5.656 -0.251 25.982) 26.592 6.353 ( -5.656 1.018 4.132) 7.078 6.600 ( -3.416 0.195 5.686) 6.636 6.646 ( -3.425 3.372 6.243) 7.879 6.792 ( 0.586 2.737 -10.956) 11.307 7.527 ( -8.329 12.764 26.727) 30.767 8.177 ( -4.961 -13.585 11.463) 18.454 9.127 ( -1.098 5.511 -1.519) 5.821 9.210 ( 3.446 -4.340 -4.155) 6.926 9.572 ( -3.881 -2.758 6.157) 7.783 10.172 ( 0.874 12.383 -3.735) 12.963 10.581 ( 10.139 -18.363 2.928) 21.180 11.438 ( 3.120 0.132 -13.968) 14.313 11.764 ( 4.436 3.519 -5.508) 7.899 12.263 ( -3.965 -5.669 10.445) 12.528 12.905 ( -4.112 1.835 -0.743) 4.564 13.032 ( 9.112 -1.846 -1.562) 9.427 14.124 ( -2.796 3.122 -15.817) 16.363 18.201 ( 9.814 1.603 -9.391) 13.678 18.647 ( -11.096 11.812 -8.995) 18.535 18.964 ( -15.151 -12.468 -0.785) 19.637 19.654 ( 0.488 -0.405 -1.102) 1.271 20.871 ( 19.729 2.615 11.675) 23.073 22.113 ( -18.095 6.245 -10.021) 21.607 23.200 ( -3.531 -7.193 1.159) 8.096 23.662 ( 7.571 -0.118 -3.582) 8.377 ======================= Grid point 315 (144/361) ======================= q-point: ( 0.20 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( 5.771 7.215 16.615) 19.011 2.693 ( 13.964 -4.252 17.813) 23.030 3.184 ( 6.586 4.538 -6.730) 10.453 3.593 ( -3.981 8.605 -10.154) 13.893 3.759 ( -5.356 -3.212 0.087) 6.246 4.094 ( 0.659 3.725 -8.336) 9.154 4.318 ( 0.364 -0.960 0.240) 1.054 4.555 ( -3.678 -8.144 -6.474) 11.035 5.254 ( -12.559 -4.820 11.417) 17.644 5.461 ( -5.384 -0.910 10.136) 11.513 5.911 ( 3.021 -1.796 13.916) 14.353 6.267 ( -8.897 -0.390 -0.756) 8.938 6.576 ( 0.594 2.528 -2.333) 3.491 6.656 ( -2.847 6.396 9.474) 11.780 6.730 ( -3.692 0.847 10.574) 11.232 7.508 ( -6.840 22.139 14.439) 27.302 8.359 ( -11.817 -19.370 12.921) 26.111 9.051 ( 0.239 8.290 0.461) 8.306 9.218 ( -0.486 -1.712 -3.043) 3.525 9.710 ( 5.908 -1.160 7.676) 9.756 10.071 ( -1.448 -4.348 -2.693) 5.316 10.859 ( 7.612 -2.355 1.008) 8.032 11.361 ( 8.627 -3.973 -9.414) 13.373 11.761 ( 8.991 3.067 -5.898) 11.182 12.381 ( -3.640 -9.308 6.602) 11.978 12.803 ( -7.426 3.678 1.102) 8.360 13.132 ( 7.556 -3.047 -5.613) 9.893 13.896 ( -2.461 4.772 -8.660) 10.189 18.172 ( 2.722 5.887 -6.909) 9.477 18.367 ( -2.350 1.841 -9.937) 10.376 18.860 ( -11.604 -8.922 -0.322) 14.641 19.567 ( -12.834 -1.602 1.982) 13.085 21.161 ( 9.225 13.899 8.984) 18.947 21.884 ( 4.049 -7.461 -8.928) 12.319 23.235 ( -0.064 -5.614 -0.302) 5.623 23.718 ( 6.621 1.159 -2.898) 7.320 ======================= Grid point 316 (145/361) ======================= q-point: ( 0.30 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.484 ( -4.249 12.250 9.818) 16.264 3.093 ( 14.435 -4.957 2.933) 15.542 3.185 ( 3.202 4.268 4.867) 7.222 3.370 ( -0.052 8.178 -6.738) 10.597 3.638 ( -8.373 -1.337 -4.256) 9.487 3.932 ( 4.355 5.538 -12.237) 14.120 4.436 ( 6.809 -10.011 -2.458) 12.353 4.553 ( -2.819 -5.397 1.826) 6.357 5.247 ( -16.590 -9.975 9.123) 21.400 5.446 ( -11.661 0.211 7.151) 13.681 5.949 ( -5.454 1.089 -4.378) 7.078 6.124 ( -7.634 -1.458 -3.848) 8.672 6.613 ( 3.252 0.012 0.909) 3.377 6.689 ( 3.257 7.087 9.379) 12.199 6.905 ( -6.760 1.144 29.762) 30.542 7.352 ( -2.689 18.801 3.777) 19.365 8.479 ( -14.677 -16.046 11.174) 24.449 8.989 ( -0.789 10.366 3.015) 10.824 9.187 ( -0.175 0.998 -0.562) 1.158 9.778 ( -2.268 -2.811 -3.034) 4.717 10.237 ( 7.481 -11.380 8.097) 15.843 10.804 ( 3.051 16.830 -5.808) 18.063 11.593 ( 16.018 -11.069 3.147) 19.723 11.802 ( 10.634 1.756 -7.037) 12.872 12.480 ( -2.548 -9.662 2.841) 10.388 12.663 ( -9.795 6.095 3.204) 11.973 13.129 ( -0.246 -3.097 -8.805) 9.337 13.809 ( 4.813 1.591 -2.631) 5.712 18.014 ( -5.770 1.769 -9.591) 11.332 18.277 ( 3.563 0.768 -5.700) 6.766 18.822 ( -3.392 -6.149 0.750) 7.063 19.425 ( -16.362 -4.866 4.811) 17.736 21.079 ( 3.268 19.257 -6.874) 20.706 22.113 ( 11.867 -15.983 3.984) 20.301 23.292 ( 3.682 -3.179 -0.906) 4.948 23.754 ( 5.103 3.219 -1.344) 6.182 ======================= Grid point 317 (146/361) ======================= q-point: (-0.60 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( -12.437 14.157 6.801) 20.034 3.021 ( -12.038 5.244 -3.536) 13.598 3.266 ( 2.184 6.256 0.184) 6.629 3.425 ( 9.278 -4.822 -1.167) 10.521 3.574 ( -0.673 -4.475 1.430) 4.746 3.856 ( 8.991 5.294 -7.550) 12.879 4.552 ( -5.997 -3.539 1.272) 7.078 4.601 ( 9.861 -7.617 -3.934) 13.067 5.171 ( -17.526 -11.228 1.524) 20.870 5.356 ( -11.908 -3.100 5.986) 13.684 5.780 ( -9.544 1.104 0.237) 9.610 5.983 ( -7.544 -0.505 -3.690) 8.413 6.610 ( -0.942 3.954 0.620) 4.112 6.827 ( 4.289 0.633 6.793) 8.059 7.141 ( -8.071 6.442 22.682) 24.922 7.273 ( 5.241 5.141 5.654) 9.267 8.507 ( -14.107 -10.083 7.884) 19.048 8.909 ( -4.088 10.386 4.840) 12.166 9.192 ( 2.129 1.483 0.720) 2.692 9.707 ( -7.013 -9.608 -5.151) 12.963 10.518 ( 8.964 4.582 3.343) 10.608 10.632 ( 4.243 12.833 0.674) 13.533 11.826 ( 9.507 1.025 -8.500) 12.794 11.991 ( 14.346 -7.555 8.772) 18.435 12.504 ( -8.259 5.408 3.798) 10.578 12.567 ( -0.376 -6.216 0.899) 6.292 12.995 ( -6.794 -1.096 -6.052) 9.164 13.921 ( 11.741 -5.541 -2.662) 13.253 17.741 ( -8.929 -0.785 -16.915) 19.143 18.338 ( 5.998 1.607 6.232) 8.797 18.878 ( 1.355 -7.223 -0.185) 7.352 19.331 ( -12.731 -6.237 5.208) 15.103 20.831 ( 4.166 17.504 -14.429) 23.064 22.472 ( 5.183 -17.567 8.654) 20.257 23.369 ( 7.370 -0.253 -1.775) 7.585 23.783 ( 4.073 4.554 2.367) 6.553 ======================= Grid point 318 (147/361) ======================= q-point: (-0.50 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.097 ( -17.742 13.158 9.985) 24.241 2.671 ( -20.112 11.632 -2.156) 23.333 3.324 ( 2.277 3.199 2.765) 4.803 3.471 ( -1.795 -2.575 -0.623) 3.200 3.591 ( 3.071 -4.377 -5.831) 7.911 3.902 ( 1.155 -0.745 2.141) 2.544 4.467 ( -9.109 -1.853 1.696) 9.449 4.773 ( 12.149 -8.421 -6.044) 15.970 5.042 ( -8.812 -4.306 -0.496) 9.821 5.331 ( -7.239 -4.254 5.800) 10.205 5.722 ( -8.965 -9.035 5.115) 13.718 5.844 ( -7.656 0.009 -1.657) 7.833 6.547 ( -3.681 3.241 -0.156) 4.907 6.914 ( -2.109 4.854 8.303) 9.846 7.168 ( 3.222 2.830 2.567) 4.998 7.443 ( -1.691 -3.938 9.646) 10.556 8.449 ( -12.107 1.341 5.479) 13.356 8.847 ( -5.274 1.961 7.468) 9.350 9.223 ( 3.098 2.346 0.741) 3.956 9.663 ( -4.939 -10.395 -2.281) 11.733 10.381 ( 4.865 23.174 -4.599) 24.121 10.798 ( 5.297 -0.663 7.669) 9.345 11.811 ( 6.665 2.385 -9.907) 12.176 12.219 ( -10.154 0.456 13.340) 16.771 12.437 ( 5.993 0.504 -7.217) 9.395 12.682 ( 5.814 -4.168 5.548) 9.053 12.883 ( -3.496 -0.803 1.337) 3.828 14.133 ( 14.610 -10.598 -5.550) 18.884 17.418 ( -8.628 -0.019 -15.430) 17.678 18.533 ( 7.776 1.096 10.742) 13.306 18.946 ( -1.438 -8.246 -1.897) 8.582 19.317 ( -2.813 -4.115 3.499) 6.090 20.556 ( 3.822 14.859 -16.061) 22.212 22.731 ( -5.143 -18.276 7.137) 20.283 23.444 ( 9.516 3.104 -4.246) 10.873 23.884 ( 5.508 2.251 10.043) 11.674 ======================= Grid point 319 (148/361) ======================= q-point: (-0.40 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.858 ( -21.412 11.405 13.538) 27.782 2.235 ( -24.457 12.680 -1.209) 27.576 3.075 ( -19.526 19.346 5.677) 28.067 3.607 ( 0.095 -4.984 0.421) 5.003 3.678 ( 7.187 -12.678 3.472) 14.981 3.892 ( -6.282 -3.171 0.453) 7.051 4.426 ( -6.470 -6.990 3.956) 10.314 4.903 ( 7.757 -5.153 -7.061) 11.687 5.051 ( 5.682 -1.389 1.691) 6.088 5.370 ( -3.045 -3.820 6.918) 8.469 5.722 ( -7.774 -4.868 -2.285) 9.452 5.789 ( -6.151 -10.280 5.588) 13.219 6.455 ( -5.180 1.458 -0.886) 5.454 6.901 ( -9.671 4.400 11.018) 15.306 7.251 ( 6.058 -2.115 -0.491) 6.435 7.474 ( -4.348 -5.698 -3.815) 8.120 8.285 ( -8.559 12.655 2.865) 15.543 8.915 ( -3.393 -6.563 7.608) 10.605 9.262 ( 3.029 3.329 4.085) 6.078 9.695 ( 0.778 -3.619 0.408) 3.724 10.203 ( 0.984 12.859 -3.918) 13.479 10.909 ( 1.856 5.282 5.725) 8.007 11.741 ( 4.355 2.602 -10.189) 11.382 12.154 ( -16.604 0.364 11.973) 20.474 12.379 ( -0.938 -2.276 -8.010) 8.379 12.839 ( 3.829 -4.335 0.338) 5.794 12.988 ( 10.600 5.642 5.936) 13.395 14.364 ( 15.337 -12.906 -8.563) 21.797 17.189 ( -4.681 -0.153 -4.129) 6.244 18.757 ( 6.399 0.158 9.898) 11.787 18.907 ( -3.065 -1.524 -6.348) 7.212 19.413 ( 6.517 -2.464 2.304) 7.338 20.308 ( 2.035 10.239 -12.851) 16.556 22.839 ( -12.484 -19.287 4.924) 23.496 23.470 ( 8.724 5.155 -5.722) 11.637 24.125 ( 6.606 -2.078 13.472) 15.147 ======================= Grid point 320 (149/361) ======================= q-point: (-0.30 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( -22.222 11.920 15.085) 29.385 1.715 ( -30.708 12.283 -1.702) 33.117 2.790 ( -22.424 19.449 28.727) 41.308 3.611 ( -5.047 -6.102 -1.476) 8.055 3.810 ( -4.945 -2.672 -2.774) 6.267 3.926 ( 2.761 -8.024 6.641) 10.776 4.508 ( -1.154 -11.983 1.696) 12.157 4.964 ( 6.271 -3.288 -2.050) 7.372 5.190 ( 8.640 -1.151 0.386) 8.725 5.467 ( 0.016 -3.903 4.596) 6.030 5.602 ( -6.639 -0.604 -3.514) 7.536 5.903 ( -2.994 -12.958 6.274) 14.704 6.383 ( -4.165 -1.030 1.620) 4.586 6.832 ( -17.157 -4.214 8.305) 19.521 7.321 ( -5.427 -5.861 0.208) 7.991 7.402 ( 5.090 -2.856 -8.525) 10.332 8.072 ( -3.028 21.056 -0.165) 21.273 8.984 ( -3.291 -7.154 1.571) 8.030 9.372 ( 4.217 3.532 10.188) 11.579 9.694 ( 4.611 11.737 -2.590) 12.873 10.121 ( -5.971 -8.768 -1.148) 10.670 10.889 ( -1.793 11.352 3.132) 11.912 11.668 ( 3.723 -0.048 -8.238) 9.040 12.056 ( -14.314 -2.838 5.600) 15.630 12.315 ( -3.342 -2.480 -1.055) 4.293 12.893 ( 2.984 -2.538 -5.952) 7.126 13.059 ( 7.390 12.851 -1.656) 14.917 14.562 ( 13.709 -12.022 -11.773) 21.704 17.294 ( 7.761 -6.355 16.890) 19.644 18.744 ( 0.946 6.669 -11.237) 13.102 18.946 ( 4.109 -1.115 6.798) 8.021 19.559 ( 8.241 1.749 2.885) 8.905 20.131 ( 0.812 4.502 -9.043) 10.135 22.881 ( -15.973 -22.742 5.198) 28.273 23.476 ( 8.369 4.633 -5.351) 10.961 24.341 ( 1.791 -2.926 4.892) 5.974 ======================= Grid point 321 (150/361) ======================= q-point: (-0.20 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.212 ( -23.033 13.113 11.441) 28.868 1.477 ( -16.569 10.381 21.497) 29.059 2.791 ( -22.182 11.328 42.743) 49.470 3.544 ( -7.219 -4.408 -2.869) 8.932 3.756 ( 0.606 -0.016 -0.153) 0.625 4.074 ( 0.754 -6.576 2.801) 7.187 4.578 ( 0.105 -8.994 -3.720) 9.734 5.055 ( 0.171 -6.313 -4.225) 7.598 5.297 ( 4.941 0.691 0.331) 5.000 5.379 ( -3.226 2.180 -6.119) 7.253 5.692 ( 8.092 -0.198 11.710) 14.236 6.062 ( -2.269 -14.890 4.444) 15.703 6.424 ( 0.205 0.070 8.335) 8.338 6.686 ( -23.670 -17.417 -1.437) 29.423 7.221 ( -9.480 -4.354 -2.523) 10.733 7.434 ( 1.687 0.020 -4.473) 4.780 7.850 ( 1.560 26.627 4.958) 27.130 9.035 ( -2.224 -8.116 3.406) 9.078 9.492 ( 2.221 4.668 1.332) 5.338 9.600 ( 6.907 15.062 0.671) 16.583 10.091 ( -15.445 -18.020 -1.808) 23.802 10.744 ( -2.748 17.430 0.566) 17.655 11.661 ( 4.961 -2.954 -5.838) 8.211 11.953 ( -10.725 -4.320 1.612) 11.674 12.254 ( -4.777 3.198 -1.801) 6.024 12.800 ( 1.978 6.664 -6.353) 9.417 13.029 ( 2.748 4.623 -0.683) 5.421 14.646 ( 9.796 -8.264 -17.089) 21.361 17.880 ( 19.558 -19.085 19.433) 33.532 18.609 ( 14.959 15.409 -6.801) 22.526 19.063 ( -2.326 -8.109 3.631) 9.184 19.629 ( 2.369 11.235 3.131) 11.901 20.051 ( 6.251 -0.830 -7.615) 9.887 22.938 ( -17.284 -27.397 5.729) 32.896 23.497 ( 8.209 2.941 -4.819) 9.963 24.231 ( -13.564 5.291 -11.714) 18.686 ======================= Grid point 322 (151/361) ======================= q-point: (-0.10 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.267 ( 5.929 5.126 26.398) 27.537 1.537 ( -8.108 3.907 28.064) 29.472 2.947 ( -17.513 5.432 42.159) 45.974 3.431 ( -5.826 -1.820 -4.882) 7.816 3.854 ( 7.764 -0.733 4.049) 8.787 4.124 ( -0.507 -3.742 -2.811) 4.708 4.616 ( 1.546 -5.224 -2.080) 5.832 4.977 ( -0.828 0.318 -5.117) 5.194 5.269 ( 1.244 0.064 -5.906) 6.036 5.329 ( -5.699 1.206 2.822) 6.473 5.920 ( -6.772 0.276 8.348) 10.753 6.218 ( 2.602 -14.047 3.335) 14.670 6.412 ( -3.891 0.189 -4.725) 6.124 6.605 ( -11.240 -9.526 12.297) 19.191 7.102 ( -3.959 -3.119 -7.115) 8.719 7.321 ( -10.640 6.600 9.230) 15.555 7.847 ( 4.287 12.090 12.977) 18.247 9.138 ( -0.853 -6.716 4.474) 8.115 9.357 ( -2.197 5.064 -8.728) 10.327 9.649 ( 3.377 9.419 4.133) 10.826 10.018 ( -10.435 -16.281 1.587) 19.403 10.557 ( -0.625 17.082 -1.516) 17.161 11.664 ( 2.888 -0.684 -8.082) 8.610 11.880 ( -4.443 -5.840 -4.051) 8.382 12.130 ( -5.253 7.496 5.966) 10.926 12.788 ( 5.002 1.568 1.284) 5.397 13.014 ( 0.468 1.241 -1.756) 2.200 14.573 ( 5.085 -3.903 -20.777) 21.743 18.209 ( 5.556 -6.749 -9.628) 13.004 18.950 ( 33.484 4.315 7.431) 34.569 19.110 ( -9.155 -16.144 1.216) 18.599 19.480 ( -4.274 16.429 -1.875) 17.079 20.171 ( 16.468 -1.017 -0.827) 16.520 23.003 ( -20.527 -32.482 1.827) 38.468 23.524 ( 2.724 4.486 -6.095) 8.043 23.625 ( -23.041 20.534 -11.464) 32.924 ======================= Grid point 324 (152/361) ======================= q-point: ( 0.10 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.486 ( 14.252 -0.000 11.350) 18.219 2.634 ( 5.627 -0.000 25.712) 26.320 3.228 ( 7.218 -0.000 -7.542) 10.440 3.685 ( -3.951 0.000 -12.301) 12.920 3.710 ( -4.612 0.000 2.283) 5.147 4.122 ( 3.932 -0.000 -5.344) 6.635 4.367 ( -3.700 0.000 -8.784) 9.532 4.427 ( -4.667 0.000 -3.474) 5.818 5.212 ( -15.216 0.000 12.899) 19.948 5.451 ( -3.238 0.000 9.081) 9.641 5.894 ( 2.809 -0.000 13.921) 14.201 6.261 ( -9.641 0.000 -1.419) 9.745 6.588 ( 0.719 -0.000 -2.871) 2.960 6.718 ( -11.360 0.000 24.310) 26.833 6.744 ( 5.019 -0.000 -5.876) 7.728 7.843 ( -8.851 0.000 29.171) 30.484 8.051 ( -12.619 0.000 2.169) 12.804 9.131 ( 1.311 -0.000 -1.542) 2.024 9.198 ( 1.933 -0.000 -2.261) 2.975 9.697 ( 6.889 -0.000 13.159) 14.853 10.041 ( -8.894 0.000 -9.489) 13.005 10.825 ( 19.366 -0.000 8.181) 21.023 11.336 ( 7.097 -0.000 -14.265) 15.933 11.800 ( 8.413 -0.000 -6.147) 10.420 12.280 ( -5.698 0.000 8.096) 9.900 12.837 ( -7.087 0.000 1.444) 7.233 13.104 ( 8.140 -0.000 -6.463) 10.394 13.939 ( -3.443 0.000 -9.080) 9.711 18.235 ( 8.309 -0.000 -7.510) 11.200 18.391 ( -9.316 0.000 -16.606) 19.041 18.758 ( -11.897 0.000 6.839) 13.723 19.554 ( -13.266 0.000 1.303) 13.330 21.314 ( 17.590 -0.000 14.868) 23.032 21.798 ( -6.003 0.000 -16.698) 17.744 23.179 ( 1.144 -0.000 1.583) 1.953 23.728 ( 7.489 -0.000 -2.955) 8.051 ======================= Grid point 325 (153/361) ======================= q-point: ( 0.20 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( 3.116 10.694 9.194) 14.443 2.975 ( 8.227 -7.409 6.341) 12.758 3.253 ( 2.767 2.590 2.648) 4.624 3.495 ( -1.500 4.364 -6.354) 7.853 3.597 ( -5.282 -2.067 -7.951) 9.767 4.037 ( 4.999 5.386 -13.235) 15.138 4.275 ( 2.177 -6.514 -6.170) 9.232 4.459 ( -1.792 -4.405 7.943) 9.257 5.138 ( -17.750 -2.571 9.561) 20.324 5.441 ( -11.589 -0.413 5.853) 12.990 5.960 ( -2.455 0.334 -2.880) 3.799 6.093 ( -9.191 -1.317 -3.941) 10.087 6.612 ( 3.744 0.117 1.967) 4.231 6.771 ( 6.393 1.901 -2.342) 7.069 6.925 ( -10.566 0.975 34.409) 36.008 7.719 ( -11.042 20.725 5.280) 24.069 8.150 ( -12.893 -19.526 15.079) 27.837 9.122 ( 1.449 3.924 -0.508) 4.214 9.201 ( -0.233 0.501 1.291) 1.404 9.775 ( -7.904 1.660 -8.630) 11.820 10.059 ( 11.317 -6.999 13.884) 19.231 11.111 ( 14.233 15.752 1.504) 21.283 11.393 ( 16.034 -11.445 -2.480) 19.855 11.842 ( 9.773 2.098 -6.670) 12.016 12.314 ( -4.492 -6.828 4.931) 9.545 12.739 ( -9.982 2.278 3.522) 10.827 13.084 ( 2.129 -1.494 -10.164) 10.492 13.833 ( 1.074 0.826 -4.598) 4.793 18.051 ( -8.064 1.725 -16.226) 18.201 18.273 ( 4.811 -0.738 -2.584) 5.511 18.735 ( -3.924 -2.857 4.137) 6.378 19.369 ( -16.672 -1.546 3.507) 17.107 21.429 ( 3.192 18.668 -10.770) 21.787 21.817 ( 9.854 -16.671 6.637) 20.471 23.247 ( 4.636 -1.555 1.356) 5.074 23.793 ( 6.339 1.118 -1.673) 6.650 ======================= Grid point 326 (154/361) ======================= q-point: (-0.70 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.604 ( -7.138 15.770 2.501) 17.490 3.039 ( -5.711 -3.514 -6.671) 9.458 3.319 ( 2.631 -5.378 -0.340) 5.997 3.397 ( -3.415 5.141 -4.142) 7.433 3.542 ( 1.091 1.631 8.192) 8.424 3.943 ( 9.832 4.733 -11.249) 15.672 4.363 ( 6.734 -11.009 -4.303) 13.604 4.574 ( -2.157 -2.845 7.907) 8.675 4.996 ( -17.083 -5.120 3.375) 18.150 5.304 ( -16.023 -3.129 3.343) 16.664 5.816 ( -7.959 2.440 -3.729) 9.122 5.951 ( -7.416 -2.507 -3.999) 8.791 6.674 ( 2.493 3.345 0.500) 4.201 6.832 ( 5.778 -0.446 0.577) 5.824 7.172 ( -13.097 -0.335 31.992) 34.570 7.482 ( -4.918 14.358 1.505) 15.252 8.275 ( -12.676 -13.810 11.111) 21.791 9.088 ( -0.393 7.507 1.627) 7.692 9.212 ( -0.306 1.014 2.399) 2.623 9.564 ( -8.556 -5.801 -8.935) 13.663 10.450 ( 12.200 -4.026 13.375) 18.546 11.060 ( 11.024 25.903 -3.316) 28.346 11.786 ( 14.931 -8.895 2.657) 17.581 11.891 ( 11.896 -0.956 -2.321) 12.158 12.405 ( 0.083 -9.103 3.855) 9.886 12.606 ( -11.504 3.902 4.061) 12.809 12.959 ( -5.028 -2.209 -8.719) 10.304 13.845 ( 8.004 -2.864 -5.858) 10.324 17.730 ( -8.625 -0.478 -17.283) 19.322 18.360 ( 5.544 0.810 6.019) 8.224 18.777 ( 1.213 -3.947 0.165) 4.133 19.241 ( -11.263 -3.657 4.708) 12.744 21.136 ( 2.703 15.533 -17.718) 23.717 22.178 ( 4.026 -14.735 11.168) 18.922 23.360 ( 7.406 -0.644 1.655) 7.616 23.846 ( 4.924 2.472 0.493) 5.532 ======================= Grid point 327 (155/361) ======================= q-point: (-0.60 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( -12.156 15.527 3.483) 20.024 2.811 ( -15.019 4.258 -5.529) 16.561 3.310 ( 1.492 -2.853 -0.047) 3.220 3.396 ( -1.302 -8.220 -1.845) 8.525 3.610 ( 0.112 6.763 4.686) 8.228 3.916 ( 2.532 1.385 -5.764) 6.446 4.446 ( -7.559 -1.417 2.257) 8.015 4.639 ( 5.158 -5.764 -1.098) 7.812 4.908 ( -6.978 -8.249 2.246) 11.036 5.211 ( -9.854 -8.513 4.430) 13.755 5.652 ( -9.684 -0.099 -0.677) 9.708 5.830 ( -6.705 -1.257 -2.088) 7.134 6.622 ( -2.809 5.476 -0.904) 6.221 6.938 ( 3.984 -1.959 1.887) 4.824 7.255 ( -16.653 3.172 18.053) 24.764 7.408 ( 0.340 2.706 3.260) 4.250 8.333 ( -10.340 -9.990 8.652) 16.780 9.001 ( -3.139 11.155 2.264) 11.807 9.242 ( 1.454 -0.464 1.900) 2.437 9.456 ( -6.078 -10.910 -3.932) 13.093 10.745 ( 8.770 4.252 7.043) 12.025 10.923 ( 8.839 26.080 0.428) 27.540 11.845 ( 6.536 1.334 -8.667) 10.937 12.184 ( 3.547 -5.736 7.133) 9.817 12.455 ( -8.493 0.814 -0.318) 8.538 12.602 ( 9.570 -3.784 6.782) 12.324 12.828 ( -5.041 -4.619 -1.650) 7.033 13.953 ( 12.676 -8.850 -9.345) 18.064 17.416 ( -8.187 -0.141 -14.917) 17.016 18.553 ( 8.066 1.120 10.550) 13.327 18.828 ( 2.013 -4.857 -1.981) 5.619 19.243 ( -1.090 -3.810 4.423) 5.938 20.814 ( 1.066 13.471 -18.549) 22.949 22.424 ( -5.352 -15.538 8.371) 18.443 23.491 ( 8.679 1.974 1.337) 9.000 23.918 ( 4.520 1.572 4.925) 6.867 ======================= Grid point 328 (156/361) ======================= q-point: (-0.50 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( -15.537 14.735 7.874) 22.815 2.437 ( -20.526 10.284 -4.250) 23.349 3.376 ( -8.561 1.618 2.220) 8.991 3.466 ( 6.850 -7.584 3.460) 10.789 3.538 ( -4.915 4.821 3.298) 7.634 3.842 ( -6.205 -2.325 -0.437) 6.641 4.319 ( -11.334 -3.918 1.557) 12.093 4.773 ( 6.675 -8.248 -4.304) 11.450 4.995 ( 4.355 -5.714 3.109) 7.829 5.261 ( -5.084 -9.240 6.103) 12.185 5.542 ( -10.435 -7.161 0.519) 12.667 5.758 ( -3.155 0.593 1.877) 3.719 6.497 ( -7.952 3.832 -0.252) 8.831 6.962 ( -8.472 0.256 3.918) 9.338 7.219 ( -7.893 -1.948 8.091) 11.470 7.400 ( 0.062 -0.550 -4.296) 4.332 8.373 ( -6.863 -3.045 7.182) 10.390 8.905 ( -2.532 6.058 2.717) 7.106 9.304 ( 2.713 1.067 4.261) 5.163 9.485 ( -3.784 -14.590 0.530) 15.082 10.634 ( 4.817 29.414 -4.393) 30.128 11.008 ( 6.306 6.589 8.682) 12.592 11.789 ( 3.483 2.547 -9.179) 10.143 12.193 ( -15.936 2.549 11.788) 19.986 12.338 ( -0.990 -2.266 -9.446) 9.765 12.736 ( 0.647 -7.213 -0.658) 7.271 13.024 ( 14.515 -0.948 8.684) 16.941 14.118 ( 14.589 -13.882 -11.937) 23.410 17.185 ( -5.062 -0.264 -6.456) 8.208 18.748 ( 5.289 -1.159 1.965) 5.760 18.895 ( 5.557 0.186 3.191) 6.411 19.375 ( 8.881 -1.789 3.772) 9.813 20.493 ( -1.720 10.141 -16.036) 19.052 22.508 ( -13.794 -17.077 4.548) 22.418 23.569 ( 7.242 5.620 -1.376) 9.269 24.081 ( 4.672 -2.695 9.894) 11.269 ======================= Grid point 329 (157/361) ======================= q-point: (-0.40 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -17.112 14.320 12.624) 25.636 1.966 ( -24.730 15.785 -1.310) 29.368 3.182 ( -15.577 21.484 17.651) 31.871 3.480 ( -6.433 -7.411 -0.412) 9.822 3.695 ( 2.912 -9.905 1.067) 10.379 3.816 ( -4.381 -3.925 5.708) 8.197 4.301 ( -1.601 -10.856 -1.095) 11.028 4.852 ( 3.095 -7.697 -4.207) 9.302 5.154 ( 5.097 -5.056 3.109) 7.824 5.365 ( -2.456 -8.107 6.342) 10.582 5.494 ( -9.138 -8.988 2.200) 13.005 5.783 ( 0.670 -0.265 4.707) 4.762 6.346 ( -13.123 -1.268 3.131) 13.551 6.814 ( -16.135 -1.509 1.125) 16.244 7.220 ( -6.634 -4.550 0.709) 8.076 7.366 ( 5.104 -0.309 -5.270) 7.343 8.354 ( -2.242 9.173 5.097) 10.731 8.876 ( -3.369 -2.970 0.204) 4.496 9.419 ( 4.330 1.782 8.977) 10.125 9.588 ( -4.246 -16.979 0.663) 17.514 10.362 ( 1.950 28.874 -4.631) 29.308 11.088 ( 2.839 10.729 6.414) 12.819 11.691 ( 1.516 2.460 -8.192) 8.687 12.066 ( -15.134 2.774 8.502) 17.579 12.267 ( -1.267 -2.796 -2.723) 4.103 12.798 ( 2.216 -7.495 -4.432) 8.985 13.237 ( 10.757 6.490 -1.189) 12.620 14.305 ( 13.609 -16.141 -12.758) 24.668 17.190 ( 2.741 -4.919 8.942) 10.567 18.774 ( 4.388 -2.920 -8.844) 10.295 19.009 ( 6.788 7.541 3.576) 10.757 19.598 ( 15.309 2.416 4.960) 16.272 20.219 ( -4.550 5.158 -10.580) 12.619 22.484 ( -19.612 -20.547 3.741) 28.650 23.577 ( 6.245 6.554 -2.863) 9.495 24.272 ( 0.812 -4.760 6.810) 8.348 ======================= Grid point 330 (158/361) ======================= q-point: (-0.30 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -18.148 20.632 9.633) 29.117 1.688 ( -15.826 12.991 18.003) 27.265 3.071 ( -16.191 18.705 30.671) 39.404 3.435 ( -7.936 -7.729 -1.546) 11.185 3.746 ( 3.411 -1.490 -2.166) 4.307 3.927 ( -3.419 -8.879 7.611) 12.184 4.381 ( 2.794 -12.146 -5.815) 13.753 4.922 ( 1.158 -8.101 -1.460) 8.312 5.288 ( 1.073 -4.666 4.386) 6.493 5.369 ( -3.840 -2.924 -5.234) 7.120 5.607 ( -2.018 -9.987 14.824) 17.988 5.860 ( -2.473 -3.984 5.430) 7.174 6.280 ( -13.007 -9.795 8.818) 18.517 6.605 ( -10.093 0.312 -4.371) 11.003 7.141 ( -7.987 -3.453 -1.096) 8.770 7.399 ( 2.980 -2.519 -3.651) 5.344 8.271 ( 0.167 19.274 4.901) 19.888 8.880 ( -3.062 -8.562 0.878) 9.135 9.566 ( 4.053 3.116 5.750) 7.694 9.642 ( -7.900 -16.158 -2.013) 18.098 10.092 ( -0.295 23.952 -2.093) 24.045 11.051 ( 0.657 16.787 4.070) 17.286 11.623 ( 2.629 -0.688 -5.648) 6.267 11.943 ( -10.959 2.093 4.720) 12.114 12.268 ( -0.866 -0.695 1.067) 1.540 12.807 ( 2.259 -4.513 -7.795) 9.286 13.197 ( 3.685 11.131 -5.639) 13.010 14.439 ( 9.673 -14.536 -15.899) 23.614 17.568 ( 11.872 -15.347 17.862) 26.373 18.756 ( 9.133 -2.352 -11.468) 14.848 19.029 ( 5.467 8.144 -1.086) 9.869 19.835 ( 12.544 11.090 7.565) 18.373 20.031 ( -1.848 -1.169 -7.464) 7.778 22.443 ( -23.192 -25.726 5.418) 35.058 23.571 ( 6.098 5.275 -3.426) 8.761 24.276 ( -8.481 -0.296 -3.641) 9.234 ======================= Grid point 331 (159/361) ======================= q-point: (-0.20 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 2.932 14.502 21.743) 26.300 1.651 ( -11.355 8.380 24.191) 28.006 3.122 ( -11.538 12.980 33.170) 37.442 3.368 ( -5.865 -4.946 -2.451) 8.054 3.828 ( 7.426 -2.385 -0.170) 7.802 4.019 ( -3.716 -6.478 4.275) 8.605 4.458 ( 3.307 -11.679 -5.299) 13.244 4.964 ( 0.941 -2.351 -1.068) 2.749 5.264 ( -4.072 -1.807 -4.253) 6.159 5.353 ( -3.475 0.843 4.301) 5.593 5.803 ( -23.812 -18.986 8.376) 31.586 5.977 ( 10.233 -3.635 13.520) 17.341 6.305 ( -6.918 -8.654 2.997) 11.477 6.527 ( -0.360 -1.051 5.157) 5.275 7.044 ( -7.262 -3.049 -2.584) 8.289 7.364 ( -4.074 -1.054 -3.093) 5.223 8.179 ( 0.370 20.934 11.052) 23.676 8.972 ( -0.624 -10.773 3.161) 11.244 9.489 ( -3.402 6.204 -7.089) 10.016 9.702 ( -7.089 -15.193 1.343) 16.819 9.911 ( 3.283 19.052 2.367) 19.477 10.918 ( -0.005 21.291 1.711) 21.359 11.630 ( 4.629 -2.864 -6.264) 8.298 11.822 ( -8.501 0.278 -0.626) 8.529 12.254 ( -1.113 5.359 2.960) 6.222 12.799 ( 4.200 -1.672 -3.311) 5.604 13.085 ( -0.079 7.149 -2.410) 7.544 14.439 ( 4.995 -10.873 -19.610) 22.972 18.014 ( 9.185 -13.693 2.872) 16.737 18.811 ( -2.486 -15.365 -5.811) 16.614 19.086 ( 21.855 8.824 -1.751) 23.634 19.753 ( -7.251 11.822 -0.957) 13.902 20.163 ( 17.144 2.004 3.244) 17.563 22.425 ( -24.960 -29.641 5.555) 39.146 23.574 ( 6.079 3.303 -3.857) 7.921 23.941 ( -17.715 12.203 -10.077) 23.754 ======================= Grid point 332 (160/361) ======================= q-point: (-0.10 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( 10.328 4.611 19.792) 22.796 1.841 ( 0.517 2.031 29.103) 29.178 3.253 ( -1.138 -2.622 1.109) 3.066 3.371 ( -2.662 8.570 24.691) 26.271 3.927 ( 3.537 -7.300 -6.532) 10.415 4.044 ( -3.366 -0.589 4.583) 5.717 4.533 ( 1.452 -9.567 -6.279) 11.535 4.956 ( 4.257 0.957 -12.909) 13.627 5.233 ( -0.028 -1.982 2.777) 3.412 5.299 ( -10.722 3.790 12.257) 16.720 5.626 ( -24.822 -3.939 10.892) 27.391 6.302 ( 2.854 -4.608 5.361) 7.624 6.420 ( 7.014 -9.637 8.030) 14.372 6.609 ( -8.418 -2.963 11.564) 14.607 6.923 ( -2.690 -2.636 -10.360) 11.024 7.321 ( -8.533 -4.589 11.580) 15.099 8.177 ( -0.299 16.757 14.767) 22.337 9.083 ( -1.263 -9.559 1.043) 9.698 9.304 ( -0.509 8.202 -5.950) 10.145 9.652 ( -9.621 0.314 1.752) 9.785 9.977 ( 9.397 -5.216 1.715) 10.884 10.727 ( 0.477 23.374 -0.331) 23.382 11.573 ( 1.515 1.050 -11.973) 12.114 11.749 ( -1.083 -5.628 -3.346) 6.636 12.244 ( -1.871 7.870 8.935) 12.053 12.877 ( 5.718 -2.302 -0.073) 6.165 13.010 ( -0.380 3.814 -1.315) 4.052 14.315 ( 0.617 -6.863 -19.885) 21.046 18.157 ( 8.670 -4.216 -8.118) 12.603 18.763 ( -12.588 -15.836 -4.828) 20.798 19.257 ( 0.467 7.359 -3.858) 8.322 19.594 ( 8.080 6.686 -2.287) 10.734 20.469 ( 18.593 0.149 8.281) 20.354 22.360 ( -25.377 -24.139 -0.696) 35.031 23.440 ( -12.377 17.376 -4.824) 21.872 23.616 ( 5.808 2.402 -3.752) 7.320 ======================= Grid point 335 (161/361) ======================= q-point: ( 0.20 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.851 ( -4.849 0.000 5.024) 6.983 2.899 ( -2.187 0.000 -11.111) 11.324 3.275 ( -4.300 0.000 0.132) 4.302 3.430 ( -4.697 0.000 -7.202) 8.598 3.582 ( 3.211 -0.000 11.597) 12.033 4.003 ( 11.039 -0.000 -16.187) 19.593 4.241 ( 6.350 -0.000 -0.838) 6.405 4.524 ( -3.294 0.000 8.817) 9.412 4.973 ( -14.670 0.000 5.202) 15.565 5.268 ( -18.608 0.000 1.521) 18.670 5.846 ( -6.704 0.000 -4.975) 8.349 5.920 ( -7.682 0.000 -3.257) 8.344 6.713 ( 4.795 -0.000 3.420) 5.890 6.820 ( 6.043 -0.000 -5.572) 8.220 7.168 ( -15.756 0.000 33.254) 36.798 7.652 ( -11.130 0.000 -0.588) 11.145 8.112 ( -9.676 0.000 15.922) 18.632 9.149 ( 1.574 -0.000 -0.666) 1.709 9.228 ( -2.087 0.000 4.612) 5.062 9.513 ( -9.061 0.000 -11.691) 14.791 10.412 ( 13.733 -0.000 15.630) 20.806 11.409 ( 16.976 -0.000 -8.410) 18.945 11.593 ( 15.088 -0.000 11.757) 19.128 11.897 ( 8.609 -0.000 -7.261) 11.262 12.306 ( 0.221 -0.000 6.506) 6.509 12.642 ( -12.208 0.000 4.407) 12.979 12.937 ( -4.058 0.000 -10.185) 10.964 13.820 ( 6.196 -0.000 -6.883) 9.261 17.726 ( -8.543 0.000 -17.598) 19.562 18.367 ( 4.989 -0.000 6.716) 8.366 18.742 ( 2.018 -0.000 -0.069) 2.019 19.208 ( -10.957 0.000 4.378) 11.800 21.301 ( 1.929 -0.000 -23.362) 23.442 22.021 ( 3.726 -0.000 16.213) 16.635 23.353 ( 7.465 -0.000 3.010) 8.049 23.868 ( 5.245 -0.000 -0.117) 5.246 ======================= Grid point 336 (162/361) ======================= q-point: (-0.70 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.621 ( -7.435 12.870 -4.812) 15.623 2.818 ( -9.424 -3.807 -3.671) 10.806 3.241 ( -4.302 -4.975 1.947) 6.859 3.282 ( -7.004 -1.913 -3.525) 8.071 3.721 ( 0.508 3.975 8.796) 9.666 3.934 ( 4.701 0.536 -14.368) 15.127 4.397 ( 7.221 -2.665 4.289) 8.812 4.560 ( -5.337 -3.410 5.726) 8.538 4.875 ( -7.390 5.142 3.103) 9.523 5.044 ( -15.185 -9.669 1.614) 18.074 5.668 ( -9.896 0.956 -3.728) 10.618 5.811 ( -4.857 -0.702 -1.199) 5.052 6.738 ( 0.432 7.200 -2.419) 7.608 6.862 ( 3.762 -6.183 -1.887) 7.480 7.251 ( -22.956 -1.051 24.252) 33.410 7.516 ( -4.304 5.297 1.355) 6.958 8.183 ( -8.288 -5.387 12.082) 15.610 9.164 ( 1.074 4.941 1.839) 5.380 9.219 ( -4.266 0.702 -0.056) 4.323 9.311 ( -4.612 -5.932 -5.501) 9.312 10.760 ( 11.026 0.073 12.546) 16.702 11.424 ( 13.342 24.688 -3.928) 28.336 11.854 ( 5.801 -0.944 -4.575) 7.448 11.990 ( 7.284 -14.130 0.736) 15.914 12.447 ( -10.845 -0.871 10.830) 15.351 12.583 ( 9.652 0.742 5.207) 10.993 12.753 ( -7.282 -2.918 -6.712) 10.325 13.842 ( 10.849 -3.287 -11.441) 16.106 17.414 ( -7.906 -0.081 -14.647) 16.645 18.568 ( 7.738 0.456 11.419) 13.801 18.773 ( 4.643 -1.471 -3.392) 5.935 19.193 ( -0.189 -1.595 5.247) 5.487 21.000 ( -0.548 6.191 -22.759) 23.593 22.215 ( -5.262 -6.829 11.389) 14.284 23.513 ( 8.099 0.613 5.270) 9.681 23.938 ( 4.225 0.613 1.658) 4.580 ======================= Grid point 337 (163/361) ======================= q-point: (-0.60 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( -9.726 13.354 -0.026) 16.520 2.599 ( -13.565 7.431 -2.994) 15.754 3.216 ( -6.882 -9.521 -0.171) 11.749 3.311 ( -1.562 -9.304 6.504) 11.459 3.738 ( -0.929 7.129 0.929) 7.249 3.805 ( -4.184 -1.876 -4.230) 6.239 4.355 ( -13.740 9.443 2.457) 16.852 4.643 ( 3.647 -5.635 2.106) 7.035 4.853 ( 0.164 -10.281 2.164) 10.508 5.075 ( -4.710 -9.512 6.033) 12.209 5.490 ( -10.383 -0.515 -0.683) 10.418 5.772 ( -0.888 0.834 1.811) 2.183 6.593 ( -7.460 6.885 -2.324) 10.415 6.891 ( -7.841 -7.220 -2.517) 10.952 7.178 ( -16.250 -2.054 11.842) 20.212 7.458 ( -0.626 4.859 0.555) 4.930 8.273 ( -6.036 -5.663 11.388) 14.078 9.045 ( -2.357 6.785 -3.910) 8.178 9.246 ( -2.678 -6.880 3.293) 8.084 9.319 ( 0.322 -2.864 2.871) 4.068 10.988 ( 7.443 6.466 6.173) 11.633 11.296 ( 8.110 27.902 0.357) 29.059 11.824 ( 3.208 1.386 -8.123) 8.843 12.163 ( -1.799 -8.857 1.378) 9.142 12.318 ( -12.146 0.725 1.802) 12.301 12.601 ( -5.221 -6.635 -2.475) 8.799 12.985 ( 17.840 -2.552 11.030) 21.129 13.908 ( 13.832 -8.784 -14.904) 22.150 17.180 ( -5.144 -0.212 -8.026) 9.535 18.726 ( 6.352 -1.066 -6.232) 8.963 18.905 ( 8.933 0.641 11.526) 14.597 19.350 ( 10.968 -0.991 5.856) 12.473 20.648 ( -3.985 6.763 -20.206) 21.677 22.260 ( -13.596 -10.245 5.697) 17.952 23.658 ( 5.860 4.076 4.448) 8.410 24.035 ( 3.697 -2.307 4.815) 6.494 ======================= Grid point 338 (164/361) ======================= q-point: (-0.50 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.117 ( -11.589 14.281 5.797) 19.284 2.263 ( -16.441 16.947 1.362) 23.651 3.226 ( -7.716 -11.069 2.798) 13.780 3.490 ( 0.057 -12.546 5.914) 13.870 3.585 ( -9.286 10.361 1.817) 14.032 3.785 ( -2.920 0.491 5.492) 6.240 4.173 ( -3.867 -0.053 -0.393) 3.887 4.727 ( 0.493 -5.894 -1.075) 6.012 4.983 ( -3.410 -12.472 2.267) 13.127 5.181 ( -4.784 -11.143 8.151) 14.611 5.419 ( -4.094 -0.605 5.708) 7.050 5.810 ( 2.695 2.097 3.627) 4.981 6.356 ( -19.443 2.248 1.851) 19.660 6.728 ( -13.767 -7.323 -5.411) 16.505 7.160 ( -3.544 -2.759 1.470) 4.726 7.409 ( 0.150 4.529 -0.828) 4.607 8.381 ( -3.541 -3.866 10.248) 11.511 8.919 ( -3.053 5.705 -2.468) 6.925 9.302 ( -6.201 -12.821 1.975) 14.378 9.438 ( 4.733 -0.194 7.681) 9.024 10.904 ( 4.483 28.208 -5.066) 29.008 11.276 ( 4.393 11.926 8.520) 15.301 11.737 ( 0.993 2.202 -8.161) 8.511 12.125 ( -16.225 3.097 10.685) 19.673 12.216 ( 1.552 -3.191 -5.672) 6.691 12.629 ( 0.123 -11.340 -3.194) 11.782 13.303 ( 12.299 1.583 3.219) 12.812 14.025 ( 14.064 -14.301 -15.371) 25.270 17.123 ( 0.712 -2.721 3.217) 4.273 18.707 ( 5.592 -3.674 -12.856) 14.493 19.142 ( 9.472 6.495 8.559) 14.323 19.638 ( 19.445 1.890 6.577) 20.614 20.305 ( -7.219 4.291 -14.813) 17.028 22.180 ( -19.638 -13.359 3.414) 23.995 23.701 ( 3.544 7.068 0.964) 7.966 24.177 ( 0.849 -5.685 5.467) 7.932 ======================= Grid point 339 (165/361) ======================= q-point: (-0.40 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -13.774 19.269 9.787) 25.628 1.952 ( -11.265 18.765 10.920) 24.459 3.255 ( -7.057 -9.303 3.562) 12.208 3.388 ( -13.445 10.804 10.912) 20.410 3.645 ( 1.233 -10.528 0.608) 10.618 3.843 ( -1.847 0.234 10.611) 10.773 4.200 ( 4.592 -5.504 -4.865) 8.663 4.778 ( 0.924 -8.088 -0.441) 8.153 5.056 ( -11.727 -16.938 7.982) 22.094 5.302 ( -2.689 -6.840 4.974) 8.875 5.491 ( -4.232 -1.726 11.375) 12.258 5.862 ( 0.254 2.114 3.600) 4.183 6.146 ( -15.850 -5.697 6.468) 18.042 6.565 ( -6.069 -4.903 -7.291) 10.679 7.114 ( -4.490 -0.404 -2.212) 5.021 7.378 ( 0.699 0.977 -1.609) 2.008 8.479 ( -0.585 1.980 8.727) 8.968 8.797 ( -5.458 2.065 -0.540) 5.861 9.341 ( -8.412 -15.199 0.318) 17.375 9.603 ( 4.579 1.031 7.719) 9.034 10.609 ( 2.707 31.261 -6.051) 31.956 11.315 ( 1.410 12.370 7.939) 14.766 11.635 ( 1.369 1.568 -7.669) 7.946 12.001 ( -11.671 4.018 6.822) 14.103 12.248 ( 2.787 -1.490 1.201) 3.380 12.682 ( 1.618 -9.224 -5.499) 10.860 13.358 ( 4.533 6.791 -5.736) 9.978 14.156 ( 10.366 -16.515 -15.657) 25.007 17.348 ( 8.265 -9.491 13.901) 18.752 18.647 ( 4.126 -6.968 -16.041) 17.969 19.236 ( 10.166 12.151 -0.868) 15.866 19.962 ( 14.289 0.472 -0.966) 14.330 20.056 ( -1.198 6.490 0.836) 6.653 22.064 ( -22.494 -16.783 4.950) 28.498 23.679 ( 2.877 6.643 -1.233) 7.343 24.232 ( -5.526 -4.216 -0.270) 6.955 ======================= Grid point 340 (166/361) ======================= q-point: (-0.30 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( -2.108 18.892 16.019) 24.859 1.840 ( -9.339 13.841 17.720) 24.347 3.223 ( -7.893 -6.828 -2.046) 10.635 3.372 ( -4.834 7.938 20.311) 22.337 3.737 ( 3.463 -7.735 -3.656) 9.230 3.972 ( -3.065 1.313 15.614) 15.966 4.243 ( 3.996 -10.062 -7.775) 13.329 4.885 ( 4.191 -7.021 -0.461) 8.190 5.130 ( -13.802 -13.319 9.429) 21.372 5.345 ( -5.362 -2.714 5.289) 8.006 5.542 ( -14.326 -6.681 12.983) 20.456 5.939 ( 3.479 -2.083 8.255) 9.197 6.167 ( -3.331 -6.720 5.634) 9.381 6.491 ( -0.805 -3.753 -2.453) 4.556 7.013 ( -5.254 -0.207 -3.177) 6.143 7.338 ( -2.744 -0.683 -3.503) 4.502 8.502 ( -0.964 13.842 8.940) 16.506 8.782 ( -3.505 -9.316 3.543) 10.565 9.349 ( -7.939 -14.046 -0.902) 16.160 9.684 ( 1.362 5.201 2.462) 5.913 10.320 ( 2.283 26.560 -3.714) 26.915 11.268 ( -1.197 16.944 5.366) 17.814 11.588 ( 4.447 -1.587 -6.759) 8.245 11.869 ( -9.147 4.369 0.151) 10.138 12.320 ( 3.375 2.277 3.302) 5.242 12.727 ( 3.424 -5.890 -2.591) 7.289 13.232 ( -1.000 8.182 -5.661) 9.999 14.203 ( 5.380 -15.092 -18.252) 24.287 17.768 ( 10.777 -13.068 11.854) 20.674 18.568 ( -1.305 -11.774 -13.799) 18.186 19.250 ( 14.984 9.371 -6.726) 18.910 19.836 ( -9.408 -1.375 -3.854) 10.259 20.302 ( 19.690 12.523 8.720) 24.911 21.991 ( -20.982 -19.338 6.822) 29.339 23.645 ( 2.996 4.540 -2.579) 6.020 24.068 ( -12.202 2.895 -7.024) 14.374 ======================= Grid point 341 (167/361) ======================= q-point: (-0.20 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( -0.905 7.384 18.375) 19.824 1.939 ( 6.936 9.295 21.785) 24.680 3.166 ( -2.200 -6.606 -5.406) 8.815 3.525 ( -0.688 4.720 18.865) 19.459 3.787 ( 1.600 -6.516 -4.898) 8.307 4.064 ( -5.178 3.900 13.385) 14.872 4.320 ( 4.338 -13.226 -8.560) 16.341 4.941 ( 1.616 -3.315 -9.012) 9.738 5.180 ( -4.239 -4.158 11.773) 13.185 5.349 ( -10.132 0.194 13.642) 16.994 5.548 ( -13.129 -2.947 12.990) 18.703 6.176 ( 5.066 -9.248 8.640) 13.632 6.267 ( -0.388 -6.628 7.502) 10.018 6.541 ( -2.710 -4.830 6.359) 8.433 6.890 ( -4.071 -1.040 -8.132) 9.154 7.250 ( -6.510 -2.305 0.191) 6.909 8.478 ( -2.283 15.504 13.245) 20.519 8.886 ( -2.448 -12.227 2.414) 12.701 9.355 ( -3.597 -7.209 -1.672) 8.228 9.633 ( -0.409 6.304 -0.160) 6.320 10.131 ( 2.741 17.264 -1.108) 17.516 11.121 ( -2.142 19.759 1.913) 19.967 11.590 ( 5.646 -0.117 -10.225) 11.680 11.688 ( -5.836 0.559 -4.104) 7.157 12.375 ( 1.739 5.902 6.100) 8.665 12.823 ( 4.217 -3.283 1.000) 5.437 13.097 ( -1.196 5.492 -2.531) 6.164 14.142 ( 1.073 -12.206 -18.917) 22.539 18.059 ( 9.555 -6.414 -2.013) 11.683 18.496 ( -8.919 -13.948 -5.170) 17.344 19.323 ( 8.771 0.783 -7.496) 11.565 19.690 ( -2.358 2.611 -3.374) 4.874 20.543 ( 13.366 9.308 10.718) 19.497 21.982 ( -14.029 -17.545 3.963) 22.811 23.613 ( 0.277 3.356 -3.960) 5.199 23.736 ( -9.390 9.393 -7.447) 15.227 ======================= Grid point 342 (168/361) ======================= q-point: (-0.10 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( 2.789 -0.815 20.430) 20.635 2.298 ( 14.918 4.216 19.375) 24.814 3.152 ( 3.282 -6.026 -7.443) 10.124 3.647 ( -2.846 -6.189 0.996) 6.884 3.791 ( -1.385 1.111 2.699) 3.231 4.109 ( -1.493 1.990 5.929) 6.430 4.338 ( -0.027 -8.016 -8.440) 11.640 4.781 ( -5.001 3.446 -10.382) 12.028 5.282 ( -0.645 1.335 5.078) 5.290 5.417 ( -6.941 3.839 14.639) 16.649 5.639 ( -3.999 0.137 26.113) 26.417 6.308 ( -4.402 -4.696 5.706) 8.602 6.491 ( 4.398 -11.691 2.323) 12.706 6.614 ( -6.731 -0.380 11.746) 13.544 6.733 ( -4.153 -3.052 -8.292) 9.763 7.276 ( -5.955 -12.049 9.803) 16.635 8.463 ( -5.299 15.615 14.516) 21.968 8.973 ( -2.046 -11.110 0.490) 11.308 9.303 ( -1.683 3.067 -3.272) 4.791 9.616 ( 0.945 2.723 3.385) 4.446 10.077 ( 4.688 4.357 -0.656) 6.433 10.928 ( -1.144 18.028 -0.334) 18.067 11.450 ( 1.828 2.534 -12.314) 12.704 11.688 ( 5.922 -3.846 -4.732) 8.500 12.405 ( -0.838 8.301 7.797) 11.419 12.857 ( -4.084 -2.935 -0.528) 5.057 13.083 ( 7.267 3.616 -0.823) 8.158 14.017 ( -2.069 -8.785 -15.417) 17.865 18.148 ( 7.826 -4.182 -8.814) 12.506 18.445 ( -8.143 -9.768 -1.615) 12.819 19.164 ( -10.427 7.568 -7.264) 14.791 19.666 ( 0.105 0.826 -1.339) 1.577 20.811 ( 10.669 -2.437 12.248) 16.425 21.971 ( -4.502 -7.581 -4.182) 9.759 23.378 ( -6.898 10.530 -3.876) 13.171 23.666 ( 5.575 0.447 -3.566) 6.633 ======================= Grid point 346 (169/361) ======================= q-point: ( 0.30 -0.70 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.500 ( -5.623 0.000 -7.280) 9.198 2.667 ( -9.361 0.000 0.661) 9.385 3.124 ( -10.393 0.000 0.738) 10.420 3.206 ( -5.199 0.000 7.847) 9.413 3.772 ( -1.411 0.000 -12.482) 12.562 3.797 ( -3.856 0.000 5.024) 6.333 4.573 ( 4.796 -0.000 8.735) 9.966 4.579 ( 0.815 -0.000 3.435) 3.530 4.659 ( -19.172 0.000 -2.706) 19.362 4.986 ( -1.145 0.000 6.837) 6.932 5.488 ( -10.340 0.000 -1.196) 10.409 5.781 ( 0.092 -0.000 1.736) 1.739 6.711 ( -0.481 0.000 -9.155) 9.167 6.766 ( -14.863 0.000 1.878) 14.981 7.159 ( -17.579 0.000 12.876) 21.790 7.509 ( -2.382 0.000 1.587) 2.863 8.218 ( -5.760 0.000 12.923) 14.149 9.080 ( -2.470 0.000 -8.970) 9.304 9.232 ( -7.095 0.000 5.616) 9.049 9.270 ( 4.896 -0.000 3.918) 6.271 11.033 ( 8.322 -0.000 9.697) 12.778 11.685 ( 12.681 -0.000 -8.138) 15.068 11.872 ( -3.253 0.000 2.095) 3.870 11.920 ( 6.834 -0.000 -6.321) 9.309 12.332 ( -16.863 0.000 8.022) 18.674 12.542 ( -8.213 0.000 -5.104) 9.670 12.959 ( 19.443 -0.000 11.756) 22.721 13.828 ( 13.443 -0.000 -16.045) 20.932 17.178 ( -5.131 0.000 -8.569) 9.988 18.716 ( 7.050 -0.000 -9.044) 11.468 18.912 ( 9.594 -0.000 14.210) 17.145 19.341 ( 11.852 -0.000 6.749) 13.639 20.712 ( -4.751 0.000 -22.369) 22.868 22.165 ( -13.323 0.000 6.723) 14.923 23.697 ( 5.246 -0.000 8.057) 9.614 24.011 ( 3.471 -0.000 1.518) 3.789 ======================= Grid point 348 (170/361) ======================= q-point: (-0.60 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.337 ( -6.170 8.570 0.401) 10.567 2.517 ( -8.860 9.377 2.280) 13.100 3.043 ( -9.749 -7.007 4.258) 12.739 3.282 ( -4.979 -8.681 8.397) 13.064 3.650 ( -0.657 0.447 -6.102) 6.153 3.760 ( -6.407 -2.579 1.670) 7.106 4.353 ( -7.860 14.699 4.114) 17.169 4.645 ( -0.533 -4.106 -0.720) 4.202 4.769 ( -0.363 -10.025 5.334) 11.361 5.015 ( -11.181 -5.851 9.899) 16.038 5.422 ( -2.058 0.319 5.786) 6.149 5.840 ( 3.823 0.997 3.377) 5.197 6.412 ( -28.444 3.205 1.072) 28.645 6.602 ( -6.153 -5.434 -9.118) 12.269 7.121 ( -3.885 -1.349 2.794) 4.972 7.483 ( -1.373 2.716 0.223) 3.051 8.311 ( -5.222 -2.512 12.831) 14.079 8.973 ( -0.420 -0.349 -6.701) 6.723 9.184 ( -8.701 -0.741 5.176) 10.151 9.423 ( 5.552 -1.026 7.672) 9.525 11.200 ( 6.045 5.656 3.818) 9.116 11.601 ( 3.753 20.284 -2.590) 20.790 11.771 ( -0.968 3.204 -5.732) 6.638 12.067 ( 3.625 -12.031 -1.645) 12.672 12.199 ( -12.891 1.649 5.893) 14.270 12.443 ( -3.853 -6.896 -1.085) 7.974 13.314 ( 13.020 0.098 7.087) 14.825 13.839 ( 14.583 -5.724 -18.554) 24.283 17.092 ( 0.222 -0.847 0.357) 0.946 18.659 ( 6.226 -1.451 -15.725) 16.975 19.223 ( 10.522 2.385 12.915) 16.828 19.661 ( 21.169 0.683 7.343) 22.417 20.361 ( -7.850 1.737 -18.717) 20.371 22.019 ( -18.960 -4.639 3.908) 19.907 23.811 ( 0.732 4.371 6.016) 7.472 24.085 ( 2.095 -3.848 1.539) 4.643 ======================= Grid point 349 (171/361) ======================= q-point: (-0.50 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( -7.568 14.184 7.064) 17.560 2.330 ( -6.969 20.317 7.827) 22.861 3.059 ( -7.755 -11.071 3.641) 13.999 3.346 ( -11.673 -13.873 2.797) 18.345 3.577 ( -0.288 3.649 2.582) 4.479 3.792 ( 3.066 -6.765 -1.094) 7.508 4.288 ( 0.485 12.626 10.389) 16.358 4.627 ( -3.849 -8.521 -3.653) 10.038 4.834 ( -10.974 -6.083 11.842) 17.253 5.124 ( -6.205 -12.170 11.798) 18.050 5.498 ( -2.263 1.206 9.057) 9.413 5.910 ( -0.470 3.060 2.743) 4.136 6.063 ( -18.903 -4.052 4.187) 19.780 6.468 ( -2.994 -4.865 -9.528) 11.109 7.098 ( -2.082 -1.320 -2.699) 3.655 7.432 ( -0.573 4.029 -1.097) 4.215 8.417 ( -4.927 -5.052 10.870) 12.960 8.886 ( -2.620 3.771 -2.274) 5.123 9.145 ( -8.256 -5.898 3.485) 10.728 9.608 ( 4.816 -0.231 9.219) 10.404 11.120 ( 4.007 23.189 -7.554) 24.715 11.500 ( -0.798 9.813 6.150) 11.608 11.662 ( -0.392 1.435 -7.123) 7.277 12.075 ( -12.897 3.897 9.877) 16.706 12.201 ( 7.871 -4.809 -2.561) 9.572 12.499 ( 0.550 -10.040 -0.531) 10.069 13.447 ( 4.186 3.606 -2.062) 5.898 13.891 ( 12.169 -12.121 -17.754) 24.702 17.227 ( 7.035 -4.288 10.037) 12.985 18.545 ( 4.182 -4.196 -19.409) 20.293 19.421 ( 9.051 8.049 3.700) 12.665 19.933 ( 0.308 -2.112 -9.440) 9.678 20.173 ( 15.742 5.060 4.840) 17.229 21.844 ( -20.874 -8.125 4.961) 22.942 23.798 ( -1.287 6.373 1.760) 6.735 24.142 ( -2.345 -5.391 -0.527) 5.902 ======================= Grid point 350 (172/361) ======================= q-point: (-0.40 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( -6.242 15.634 10.693) 19.943 2.177 ( -3.521 22.512 11.676) 25.603 3.066 ( -7.699 -9.776 -0.488) 12.453 3.362 ( -5.912 -10.973 5.160) 13.490 3.644 ( 2.802 -0.771 4.457) 5.321 3.896 ( 5.178 -9.445 -2.772) 11.122 4.279 ( -5.600 12.229 12.250) 18.193 4.695 ( 1.840 -13.081 0.230) 13.212 4.925 ( -11.053 -7.281 18.709) 22.918 5.243 ( -8.526 -8.108 8.756) 14.667 5.510 ( -9.258 0.434 10.835) 14.258 5.896 ( -1.459 -2.583 5.962) 6.659 6.080 ( 0.585 -2.849 4.322) 5.210 6.396 ( -0.278 -6.137 -6.085) 8.647 7.016 ( -3.291 -0.170 -5.504) 6.415 7.367 ( -1.412 3.953 -2.194) 4.736 8.527 ( -3.892 -8.229 7.908) 12.058 8.790 ( -4.801 7.593 4.093) 9.872 9.143 ( -5.918 -8.567 1.987) 10.600 9.752 ( 2.083 2.387 7.148) 7.818 10.813 ( 1.931 27.410 -9.887) 29.203 11.487 ( -4.514 7.475 7.721) 11.656 11.574 ( 3.411 0.009 -8.835) 9.470 11.967 ( -9.145 6.297 3.952) 11.785 12.327 ( 6.920 -2.305 -0.184) 7.296 12.614 ( 4.406 -5.766 3.205) 7.933 13.355 ( -2.463 5.701 -6.073) 8.686 13.932 ( 6.828 -14.509 -18.020) 24.122 17.574 ( 11.362 -8.497 14.277) 20.128 18.396 ( 0.571 -7.587 -18.808) 20.289 19.411 ( 6.373 8.589 -9.018) 13.990 19.773 ( -7.884 -4.828 -4.173) 10.143 20.530 ( 24.006 11.718 9.587) 28.381 21.726 ( -17.674 -10.977 6.637) 21.838 23.730 ( -1.485 4.766 -0.944) 5.080 24.072 ( -7.421 -1.743 -5.449) 9.370 ======================= Grid point 351 (173/361) ======================= q-point: (-0.30 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( 0.311 12.521 12.033) 17.368 2.152 ( 2.058 14.526 15.875) 21.616 3.034 ( -3.202 -7.896 -4.172) 9.487 3.455 ( -3.158 -10.304 2.090) 10.978 3.735 ( 0.698 -1.377 4.542) 4.797 4.027 ( 5.254 -12.734 -5.992) 15.022 4.262 ( -4.897 10.482 14.949) 18.903 4.829 ( 1.893 -8.483 -1.198) 8.774 5.094 ( -4.412 -5.168 17.894) 19.141 5.297 ( -8.852 -4.736 15.477) 18.448 5.546 ( -5.881 1.391 12.455) 13.844 6.021 ( 0.294 -7.585 6.328) 9.882 6.173 ( 0.000 -3.846 6.050) 7.169 6.431 ( 1.439 -7.330 0.335) 7.477 6.881 ( -4.509 -0.364 -8.571) 9.692 7.266 ( -4.073 4.165 -1.680) 6.063 8.640 ( -2.484 -9.406 5.024) 10.949 8.728 ( -6.682 7.003 9.688) 13.695 9.188 ( -1.836 -8.743 1.618) 9.079 9.783 ( 0.003 7.665 3.515) 8.433 10.498 ( 1.371 22.886 -7.883) 24.245 11.382 ( -8.678 9.050 2.676) 12.821 11.566 ( 7.396 -1.729 -7.656) 10.784 11.791 ( -4.989 10.029 -3.762) 11.816 12.421 ( 3.406 -1.524 1.626) 4.070 12.788 ( 6.334 0.194 6.500) 9.078 13.188 ( -4.450 4.394 -3.731) 7.282 13.902 ( 2.223 -14.151 -18.334) 23.267 17.943 ( 10.858 -6.286 6.007) 13.910 18.276 ( -3.826 -10.665 -8.821) 14.360 19.307 ( 1.726 -1.971 -11.260) 11.561 19.698 ( -1.416 -0.580 -2.274) 2.741 20.780 ( 11.586 15.913 10.043) 22.098 21.730 ( -5.266 -11.490 4.742) 13.500 23.658 ( -1.714 2.126 -2.448) 3.667 23.855 ( -8.372 4.052 -8.492) 12.594 ======================= Grid point 352 (174/361) ======================= q-point: (-0.20 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 0.223 6.484 15.769) 17.052 2.380 ( 14.387 4.862 15.132) 21.439 3.034 ( 2.447 -6.684 -5.397) 8.932 3.475 ( -4.087 -10.528 -5.539) 12.579 3.788 ( -4.852 -3.312 5.199) 7.845 4.072 ( 1.640 -8.402 -10.406) 13.475 4.321 ( 2.078 7.558 10.657) 13.229 4.828 ( -1.082 1.953 -4.528) 5.049 5.270 ( 0.173 -3.175 9.042) 9.585 5.487 ( -7.836 2.674 21.283) 22.836 5.641 ( -0.532 0.649 22.611) 22.627 6.153 ( -2.957 -12.117 3.599) 12.982 6.309 ( -0.541 -7.083 8.138) 10.802 6.560 ( 0.253 -6.362 8.228) 10.404 6.693 ( -5.933 -1.486 -10.848) 12.453 7.169 ( -4.562 0.620 0.587) 4.641 8.695 ( -6.671 9.671 12.427) 17.101 8.750 ( -3.178 -12.900 2.970) 13.614 9.256 ( -1.435 -6.281 0.111) 6.444 9.741 ( 1.971 9.961 2.711) 10.510 10.276 ( 2.555 15.587 -4.472) 16.416 11.157 ( -12.173 7.533 -3.186) 14.666 11.566 ( 6.242 8.135 -8.662) 13.423 11.653 ( 5.882 2.388 -4.082) 7.547 12.494 ( 1.236 0.227 3.995) 4.188 12.838 ( -5.850 1.871 1.414) 6.303 13.150 ( 6.377 3.687 1.344) 7.488 13.824 ( -0.735 -12.498 -15.015) 19.550 18.065 ( 4.749 -4.669 -7.941) 10.364 18.304 ( -1.856 -6.399 3.908) 7.724 19.192 ( -6.261 -4.018 -9.203) 11.834 19.681 ( 1.468 0.793 -2.036) 2.632 20.845 ( -1.393 6.888 9.639) 11.928 21.872 ( 9.466 -3.778 0.336) 10.198 23.524 ( -7.055 5.413 -5.381) 10.394 23.682 ( 1.718 1.536 -4.892) 5.408 ======================= Grid point 353 (175/361) ======================= q-point: (-0.10 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( -1.063 -3.861 15.515) 16.023 2.759 ( 18.916 3.055 12.720) 22.999 3.090 ( 5.709 -5.334 -3.880) 8.723 3.420 ( -3.273 -9.663 -8.896) 13.537 3.770 ( -8.919 -3.167 2.157) 9.707 4.004 ( 1.879 -5.538 -13.713) 14.908 4.402 ( 4.476 6.959 5.185) 9.764 4.691 ( -2.138 7.749 -5.484) 9.731 5.357 ( -5.667 4.394 10.363) 12.602 5.486 ( -11.306 3.250 12.565) 17.213 5.954 ( 3.434 2.926 13.385) 14.125 6.244 ( -6.419 -5.472 4.338) 9.485 6.425 ( -3.399 -11.376 7.379) 13.979 6.565 ( 1.413 -4.141 -2.988) 5.298 6.723 ( -5.403 -1.530 16.263) 17.205 7.186 ( -1.918 -11.701 3.020) 12.236 8.639 ( -10.894 11.090 12.773) 20.120 8.865 ( -1.211 -11.396 3.281) 11.921 9.231 ( -3.195 -0.873 -2.743) 4.301 9.760 ( 4.737 5.367 3.452) 7.948 10.202 ( 5.592 9.494 0.416) 11.027 10.878 ( -10.269 0.676 -7.454) 12.707 11.506 ( 10.520 11.662 -2.944) 15.979 11.719 ( 10.506 -1.377 -6.185) 12.269 12.532 ( -0.731 5.192 4.615) 6.984 12.727 ( -9.836 -3.377 0.570) 10.415 13.206 ( 6.147 4.942 -3.779) 8.746 13.776 ( 0.458 -8.345 -6.933) 10.859 18.070 ( 0.490 -4.970 -3.871) 6.319 18.335 ( 0.898 -1.701 -4.953) 5.314 18.986 ( -8.317 3.607 -6.074) 10.912 19.614 ( -9.829 3.555 2.436) 10.732 20.926 ( 0.177 -10.344 3.561) 10.941 22.022 ( 14.474 7.757 -1.080) 16.457 23.345 ( -1.904 6.007 -3.464) 7.191 23.688 ( 4.282 -2.134 -2.963) 5.628 ======================= Grid point 358 (176/361) ======================= q-point: ( 0.40 -0.60 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( -4.820 0.000 4.955) 6.913 2.553 ( -1.368 0.000 7.510) 7.634 2.937 ( -9.134 0.000 5.260) 10.540 3.170 ( -15.008 0.000 2.591) 15.230 3.645 ( 5.704 -0.000 -3.874) 6.895 3.685 ( -0.872 0.000 1.794) 1.995 4.442 ( -3.873 0.000 13.143) 13.701 4.537 ( -5.957 0.000 -5.157) 7.879 4.821 ( -1.764 0.000 8.856) 9.030 4.956 ( -12.418 0.000 16.917) 20.986 5.511 ( -1.997 0.000 9.136) 9.352 5.952 ( 5.199 -0.000 3.233) 6.122 6.012 ( -26.492 0.000 2.603) 26.620 6.421 ( -1.649 0.000 -10.588) 10.716 7.083 ( -1.736 0.000 -2.294) 2.876 7.476 ( -0.016 0.000 -1.694) 1.694 8.366 ( -7.375 0.000 12.219) 14.272 8.903 ( 0.462 -0.000 -4.347) 4.371 9.112 ( -9.969 0.000 5.609) 11.438 9.604 ( 5.031 -0.000 9.934) 11.135 11.323 ( 5.167 -0.000 -2.415) 5.704 11.626 ( 2.189 -0.000 -9.625) 9.871 11.706 ( -9.463 0.000 0.791) 9.496 12.096 ( 11.900 -0.000 -2.800) 12.225 12.120 ( -12.919 0.000 9.334) 15.939 12.402 ( 1.184 -0.000 3.671) 3.857 13.484 ( 3.002 -0.000 1.856) 3.530 13.772 ( 14.007 -0.000 -21.121) 25.343 17.190 ( 6.812 -0.000 8.522) 10.910 18.506 ( 4.338 -0.000 -20.558) 21.011 19.497 ( 8.501 -0.000 7.381) 11.258 19.911 ( -2.427 0.000 -12.937) 13.163 20.219 ( 19.789 -0.000 4.520) 20.299 21.773 ( -20.362 0.000 5.183) 21.011 23.870 ( -5.025 0.000 4.718) 6.893 24.078 ( 0.929 -0.000 -2.668) 2.826 ======================= Grid point 360 (177/361) ======================= q-point: (-0.50 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.295 ( -5.241 9.330 6.633) 12.591 2.577 ( -0.219 20.573 9.482) 22.653 2.906 ( -7.315 -6.670 2.491) 10.208 3.073 ( -8.626 -18.070 1.875) 20.111 3.666 ( 5.232 2.130 -1.605) 5.873 3.757 ( 3.017 -5.250 -1.841) 6.329 4.421 ( -13.978 -1.387 10.388) 17.471 4.579 ( 2.975 3.440 12.299) 13.113 4.871 ( -5.195 1.170 12.467) 13.556 5.080 ( -6.298 -8.812 12.922) 16.861 5.518 ( -12.237 0.260 12.063) 17.185 5.861 ( -4.086 -1.080 5.446) 6.894 6.055 ( 3.730 -0.464 2.668) 4.609 6.308 ( 0.552 -2.944 -8.239) 8.767 7.006 ( -2.851 -0.580 -5.968) 6.639 7.443 ( 1.259 3.146 -3.093) 4.588 8.400 ( -9.480 -4.384 10.284) 14.658 8.877 ( 0.146 1.793 0.133) 1.804 9.056 ( -8.085 -1.491 5.656) 9.979 9.777 ( 2.347 0.609 9.881) 10.174 11.216 ( 3.137 14.773 -14.609) 21.012 11.546 ( 2.051 0.387 -5.772) 6.138 11.589 ( -7.932 1.113 2.054) 8.269 12.061 ( -10.668 3.283 10.014) 14.996 12.233 ( 7.575 -5.962 -3.643) 10.305 12.555 ( 8.443 -1.093 8.894) 12.312 13.437 ( -5.451 3.231 -3.266) 7.129 13.726 ( 10.139 -7.346 -20.508) 24.028 17.473 ( 11.688 -2.850 13.881) 18.369 18.304 ( 1.552 -2.668 -20.966) 21.192 19.551 ( -3.368 6.896 -10.600) 13.087 19.678 ( -2.467 -5.597 -3.581) 7.088 20.683 ( 29.623 4.811 9.335) 31.429 21.593 ( -17.969 -3.862 6.803) 19.598 23.801 ( -6.648 2.691 1.006) 7.242 24.032 ( -2.493 -1.919 -5.860) 6.651 ======================= Grid point 361 (178/361) ======================= q-point: (-0.40 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( 1.306 10.395 7.176) 12.698 2.459 ( -3.682 19.712 9.042) 21.997 2.902 ( -2.308 -6.326 -1.260) 6.851 3.220 ( -1.797 -15.999 2.600) 16.308 3.705 ( 0.503 -1.672 0.474) 1.809 3.817 ( 4.348 -9.137 -5.515) 11.524 4.425 ( -9.469 4.477 18.180) 20.981 4.720 ( 6.439 -1.136 2.278) 6.924 5.006 ( -5.103 -4.215 18.645) 19.785 5.211 ( -4.598 -4.496 14.580) 15.935 5.563 ( -6.193 0.271 16.428) 17.559 5.921 ( -1.608 -3.374 5.198) 6.402 6.131 ( 1.239 -1.184 3.469) 3.870 6.307 ( 3.596 -5.773 -3.168) 7.502 6.869 ( -4.974 -0.837 -8.838) 10.176 7.373 ( 0.138 6.520 -3.198) 7.263 8.439 ( -10.106 -9.815 8.545) 16.476 8.865 ( -2.585 5.972 6.043) 8.880 9.067 ( -2.570 -4.925 3.866) 6.768 9.882 ( -0.121 3.563 7.907) 8.674 10.888 ( 1.020 19.013 -16.409) 25.136 11.474 ( -10.297 2.592 0.757) 10.645 11.535 ( 6.154 -1.816 -6.858) 9.392 11.981 ( -5.362 9.717 4.359) 11.924 12.328 ( 2.841 -7.597 -1.667) 8.281 12.823 ( 11.242 2.701 11.147) 16.060 13.249 ( -9.404 2.585 -3.669) 10.420 13.673 ( 4.682 -10.608 -19.164) 22.398 17.849 ( 12.289 -3.986 12.623) 18.062 18.128 ( -0.479 -5.774 -13.799) 14.966 19.273 ( -7.911 -1.492 -12.792) 15.115 19.689 ( 2.434 -0.361 -2.692) 3.647 21.062 ( 15.446 14.925 8.950) 23.269 21.547 ( -2.944 -9.716 5.060) 11.344 23.689 ( -6.030 1.336 -1.402) 6.334 23.895 ( -4.786 0.874 -8.699) 9.967 ======================= Grid point 362 (179/361) ======================= q-point: (-0.30 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.288 ( 0.393 12.448 7.811) 14.701 2.461 ( 7.651 4.044 11.996) 14.792 2.935 ( 3.282 -4.148 -1.983) 5.649 3.302 ( -1.482 -8.718 -2.940) 9.318 3.698 ( -9.720 -5.726 3.730) 11.882 3.899 ( 7.901 -9.719 -11.191) 16.797 4.477 ( 0.279 8.082 9.897) 12.781 4.840 ( 6.241 -1.413 -1.443) 6.560 5.187 ( -5.186 -4.923 15.613) 17.172 5.464 ( -3.128 -4.508 28.654) 29.175 5.686 ( -0.893 3.827 15.910) 16.388 5.976 ( -4.268 -6.464 2.964) 8.294 6.214 ( -1.546 -4.081 7.545) 8.716 6.423 ( 5.393 -7.620 1.645) 9.479 6.673 ( -6.908 -0.899 -10.879) 12.918 7.262 ( -1.973 8.054 -1.841) 8.494 8.499 ( -10.329 -13.393 7.913) 18.673 8.850 ( -3.552 6.962 8.511) 11.555 9.144 ( 0.099 -5.793 2.340) 6.249 9.904 ( -0.492 7.463 5.315) 9.175 10.564 ( 1.390 15.277 -13.519) 20.447 11.255 ( -14.243 5.239 -2.846) 15.440 11.581 ( 9.868 -2.043 -7.281) 12.432 11.858 ( 1.280 14.226 -0.889) 14.311 12.417 ( 0.472 -7.590 1.214) 7.701 12.914 ( -8.092 5.523 1.650) 9.936 13.206 ( 7.199 2.257 6.150) 9.734 13.596 ( 1.000 -12.280 -15.683) 19.944 17.994 ( 2.730 -3.176 -7.002) 8.159 18.209 ( 4.480 -4.436 8.734) 10.772 19.077 ( -6.372 -7.105 -9.734) 13.632 19.691 ( 3.341 0.329 -3.460) 4.821 21.023 ( -9.267 11.461 4.314) 15.358 21.821 ( 20.124 -2.359 4.422) 20.739 23.573 ( -6.176 0.813 -3.201) 7.003 23.717 ( -1.921 1.984 -8.157) 8.611 ======================= Grid point 363 (180/361) ======================= q-point: (-0.20 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( -7.451 1.665 10.104) 12.664 2.798 ( 19.772 1.213 10.846) 22.585 3.013 ( 5.285 -3.161 -0.758) 6.205 3.291 ( 0.313 -4.017 -6.003) 7.229 3.645 ( -13.686 -9.782 4.124) 17.321 3.914 ( 8.528 -4.649 -15.839) 18.580 4.522 ( 4.005 6.110 2.759) 7.809 4.832 ( 2.419 7.187 -4.882) 9.019 5.342 ( -5.254 -4.855 14.010) 15.731 5.608 ( -11.914 8.576 16.223) 21.879 5.979 ( -7.484 -10.582 -1.301) 13.026 6.030 ( 6.844 -3.858 25.822) 26.991 6.315 ( -4.264 -3.619 6.469) 8.552 6.496 ( -2.730 -3.251 -2.158) 4.763 6.618 ( 3.357 -9.007 7.235) 12.031 7.149 ( -1.813 5.737 -1.205) 6.136 8.576 ( -11.071 -14.002 9.212) 20.087 8.849 ( -2.781 6.490 8.236) 10.848 9.190 ( -1.758 -3.265 -0.457) 3.736 9.889 ( 1.458 8.012 3.388) 8.820 10.362 ( 4.105 7.307 -8.632) 12.031 10.937 ( -15.418 7.119 -5.100) 17.732 11.660 ( 11.873 0.655 -6.070) 13.350 11.780 ( 7.597 12.005 -1.904) 14.334 12.497 ( -1.817 -7.170 2.290) 7.743 12.739 ( -10.874 2.875 0.995) 11.292 13.288 ( 2.471 3.314 -4.602) 6.186 13.622 ( 6.203 -7.934 -1.396) 10.168 18.002 ( 1.390 -2.695 -0.772) 3.129 18.309 ( 0.076 -1.201 -2.263) 2.563 18.974 ( -3.658 -4.181 -4.915) 7.418 19.673 ( -2.774 2.465 -0.035) 3.711 20.838 ( -8.366 0.284 -2.285) 8.678 22.152 ( 21.196 6.741 4.527) 22.698 23.430 ( -3.222 3.297 -4.760) 6.626 23.646 ( 1.309 -2.417 -4.075) 4.915 ======================= Grid point 364 (181/361) ======================= q-point: (-0.10 -0.60 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.295 ( -10.954 -8.648 9.542) 16.906 3.091 ( -1.537 -5.677 1.442) 6.056 3.153 ( 12.595 0.853 4.314) 13.340 3.279 ( 9.013 -0.697 -4.096) 9.925 3.607 ( -8.396 -4.894 4.091) 10.545 3.854 ( 7.744 -3.146 -16.928) 18.879 4.548 ( 2.839 3.053 1.049) 4.299 4.706 ( 1.906 11.319 -5.815) 12.868 5.418 ( -9.831 -2.821 8.691) 13.422 5.468 ( -15.528 13.232 9.516) 22.511 5.900 ( -9.295 -5.471 -3.034) 11.205 6.122 ( -7.471 -1.729 -2.882) 8.192 6.515 ( 0.995 -8.128 10.086) 12.991 6.647 ( 7.257 0.749 11.655) 13.750 6.848 ( -3.865 -7.318 22.608) 24.075 7.129 ( 3.722 -3.610 -0.939) 5.270 8.629 ( -13.504 -5.103 10.680) 17.957 8.849 ( -3.583 0.971 5.822) 6.905 9.167 ( -0.424 -1.262 -1.481) 1.991 9.869 ( -0.005 6.780 -0.164) 6.782 10.356 ( 7.447 -3.327 -3.243) 8.778 10.642 ( -9.063 4.480 -2.822) 10.496 11.758 ( 12.599 2.096 -4.366) 13.498 11.813 ( 11.663 8.153 0.195) 14.231 12.532 ( -8.352 -8.218 3.018) 12.100 12.616 ( -3.288 5.155 1.593) 6.319 13.167 ( -4.143 0.308 -8.332) 9.311 13.793 ( 10.424 0.273 1.957) 10.609 18.000 ( -3.954 0.173 -4.978) 6.359 18.244 ( 1.214 -2.704 -5.334) 6.103 18.920 ( 0.349 4.170 -0.754) 4.252 19.536 ( -14.139 7.062 4.614) 16.464 20.781 ( 1.258 -13.394 -9.143) 16.266 22.381 ( 15.307 14.145 6.305) 21.775 23.345 ( 2.414 2.451 -3.659) 5.022 23.681 ( 2.917 -4.906 -0.915) 5.781 ======================= Grid point 370 (182/361) ======================= q-point: (-0.50 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( -1.652 -0.000 5.479) 5.722 2.737 ( -9.308 -0.000 0.840) 9.346 2.861 ( -2.006 -0.000 -0.118) 2.010 2.955 ( 6.794 -0.000 9.559) 11.728 3.690 ( 9.926 -0.000 -9.962) 14.063 3.731 ( -7.219 0.000 3.802) 8.159 4.440 ( -7.339 -0.000 18.856) 20.234 4.745 ( 3.836 -0.000 0.342) 3.852 4.965 ( -5.995 -0.000 18.860) 19.790 5.162 ( -1.161 -0.000 15.139) 15.183 5.563 ( -7.265 -0.000 19.200) 20.528 5.895 ( -1.710 -0.000 4.982) 5.267 6.121 ( 1.601 -0.000 2.324) 2.822 6.252 ( 4.555 -0.000 -4.360) 6.305 6.860 ( -5.099 -0.000 -8.643) 10.035 7.442 ( 2.935 -0.000 -4.968) 5.770 8.342 ( -13.632 -0.000 11.143) 17.607 8.926 ( 2.415 -0.000 2.763) 3.670 9.016 ( -6.985 -0.000 6.270) 9.386 9.913 ( -0.136 -0.000 9.484) 9.485 11.080 ( 0.348 -0.000 -22.267) 22.269 11.499 ( 6.133 -0.000 -9.065) 10.945 11.509 ( -10.000 0.000 3.871) 10.723 12.090 ( -8.827 -0.000 13.906) 16.471 12.227 ( 5.043 -0.000 -6.751) 8.426 12.852 ( 13.855 0.000 12.412) 18.602 13.275 ( -13.786 -0.000 -2.882) 14.084 13.569 ( 7.559 -0.000 -20.667) 22.006 17.812 ( 12.959 -0.000 14.908) 19.753 18.076 ( 0.509 -0.000 -15.877) 15.885 19.259 ( -11.622 -0.000 -13.061) 17.483 19.686 ( 4.007 -0.000 -3.166) 5.107 21.247 ( 30.994 -0.000 9.080) 32.297 21.413 ( -16.125 0.000 4.706) 16.798 23.702 ( -8.226 -0.000 -0.917) 8.277 23.900 ( -2.899 -0.000 -8.864) 9.325 ======================= Grid point 372 (183/361) ======================= q-point: (-0.40 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.464 ( 9.154 3.952 7.248) 12.326 2.544 ( -11.135 5.990 3.108) 13.021 2.888 ( 5.296 -1.289 -0.991) 5.540 3.175 ( 6.210 -4.788 3.296) 8.506 3.619 ( -14.760 -2.490 2.644) 15.200 3.761 ( 12.400 -4.768 -9.596) 16.388 4.590 ( 0.553 4.475 11.879) 12.706 4.772 ( 6.275 -4.670 -4.688) 9.120 5.138 ( -5.733 -0.729 19.303) 20.149 5.387 ( -1.529 -2.837 23.641) 23.860 5.743 ( -1.319 1.909 19.151) 19.292 5.915 ( -4.121 -1.161 5.487) 6.959 6.163 ( -1.616 -1.491 4.453) 4.966 6.323 ( 7.551 -3.117 -0.896) 8.218 6.661 ( -7.092 -0.368 -10.331) 12.536 7.393 ( 2.121 5.038 -5.277) 7.598 8.309 ( -15.738 -6.540 12.987) 21.427 8.957 ( -2.089 5.418 5.784) 8.196 9.049 ( -0.571 -5.090 3.924) 6.452 9.993 ( -1.458 2.527 7.431) 7.983 10.762 ( -1.824 5.910 -21.894) 22.751 11.364 ( -9.756 6.200 -0.541) 11.572 11.527 ( 8.733 -3.769 -7.123) 11.883 12.082 ( -1.540 10.634 4.052) 11.483 12.262 ( 0.761 -9.100 -0.514) 9.146 13.006 ( -14.228 4.032 -1.016) 14.823 13.214 ( 11.762 -1.363 12.169) 16.979 13.432 ( 2.598 -4.879 -17.664) 18.509 17.956 ( 1.654 -1.060 -6.604) 6.890 18.151 ( 8.956 -1.827 11.753) 14.889 18.984 ( -8.077 -2.847 -10.617) 13.640 19.694 ( 4.105 0.039 -4.384) 6.006 21.190 ( -14.391 5.784 -0.639) 15.523 21.785 ( 27.981 -1.434 8.538) 29.290 23.576 ( -6.951 -0.084 -2.025) 7.240 23.741 ( -2.736 0.666 -9.727) 10.127 ======================= Grid point 373 (184/361) ======================= q-point: (-0.30 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( -15.189 3.509 5.146) 16.416 2.804 ( 18.289 -0.219 11.106) 21.398 2.977 ( 7.788 -0.974 -1.894) 8.074 3.283 ( 4.836 2.442 -1.256) 5.562 3.470 ( -14.150 -8.826 2.356) 16.843 3.839 ( 11.274 -3.542 -12.886) 17.484 4.625 ( 3.674 5.948 -0.319) 6.998 4.880 ( 7.124 -3.530 -4.480) 9.126 5.257 ( -7.963 -2.308 15.549) 17.622 5.679 ( -7.517 -6.329 22.333) 24.399 5.803 ( -10.314 2.468 7.268) 12.856 6.065 ( 6.615 2.353 16.399) 17.839 6.236 ( -3.630 -5.009 9.491) 11.329 6.460 ( -5.003 -0.972 -4.740) 6.960 6.476 ( 8.550 -5.902 0.404) 10.397 7.293 ( 0.238 8.460 -3.521) 9.166 8.334 ( -16.029 -11.757 14.270) 24.470 8.950 ( -2.149 4.916 6.039) 8.078 9.125 ( -0.460 -3.825 1.961) 4.323 10.011 ( -0.729 5.126 4.338) 6.755 10.444 ( -2.559 2.350 -18.659) 18.980 11.122 ( -10.906 11.897 -1.540) 16.212 11.627 ( 11.819 -3.450 -6.182) 13.777 12.007 ( 4.886 11.790 -1.932) 12.908 12.350 ( -2.835 -8.508 2.969) 9.447 12.777 ( -12.848 1.383 0.803) 12.947 13.281 ( -2.429 -3.877 -12.266) 13.091 13.545 ( 13.012 -0.558 9.615) 16.188 17.970 ( 2.602 -1.076 1.548) 3.213 18.294 ( -1.522 -0.535 -0.909) 1.852 18.883 ( 0.700 -4.818 -2.123) 5.312 19.697 ( 2.219 0.425 -2.688) 3.511 20.894 ( -13.221 4.307 -7.855) 15.970 22.251 ( 25.447 4.139 8.735) 27.221 23.463 ( -4.759 0.622 -2.967) 5.642 23.611 ( -0.770 -1.405 -7.245) 7.420 ======================= Grid point 374 (185/361) ======================= q-point: (-0.20 -0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( -17.823 -4.102 9.117) 20.435 2.984 ( -8.013 -5.547 -0.346) 9.752 3.169 ( 5.891 0.604 5.118) 7.827 3.296 ( 15.985 1.054 -0.957) 16.049 3.523 ( 4.767 -2.372 5.342) 7.543 3.808 ( 6.341 -2.340 -16.783) 18.093 4.605 ( 1.668 4.091 -1.547) 4.681 4.877 ( 5.469 6.137 -7.411) 11.068 5.329 ( -10.312 -6.459 8.885) 15.067 5.648 ( -15.651 -0.132 0.297) 15.654 5.796 ( -8.703 2.025 15.583) 17.963 6.100 ( -7.535 0.006 -2.787) 8.034 6.396 ( -1.153 -6.283 10.804) 12.551 6.643 ( 10.667 -2.796 5.268) 12.221 6.689 ( 6.280 -6.285 20.410) 22.260 7.193 ( 0.928 7.770 -0.533) 7.843 8.406 ( -15.646 -14.551 14.392) 25.761 8.947 ( -3.006 5.763 6.040) 8.873 9.141 ( -1.070 -1.631 -0.649) 2.056 9.992 ( 0.127 6.383 0.364) 6.395 10.227 ( -2.100 -6.945 -13.740) 15.538 10.854 ( -7.847 14.504 0.637) 16.503 11.742 ( 11.603 -2.079 -7.213) 13.820 11.998 ( 9.289 10.095 1.317) 13.782 12.384 ( -7.788 -7.783 3.312) 11.498 12.671 ( -3.880 1.335 2.387) 4.747 13.127 ( -6.030 -4.346 -9.254) 11.870 13.821 ( 13.268 2.496 7.013) 15.213 18.019 ( -2.726 1.857 -2.304) 4.024 18.187 ( -1.255 -3.586 -4.368) 5.789 18.966 ( 4.840 1.265 2.891) 5.777 19.645 ( -7.786 4.480 2.017) 9.207 20.622 ( -3.893 -4.575 -14.492) 15.688 22.609 ( 19.322 11.232 9.233) 24.182 23.375 ( 0.437 0.972 -4.546) 4.669 23.586 ( 0.501 -5.480 -1.523) 5.710 ======================= Grid point 375 (186/361) ======================= q-point: (-0.10 -0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.117 ( -18.337 -9.909 10.999) 23.567 2.848 ( -19.494 -12.952 -0.649) 23.414 3.240 ( 5.767 2.499 1.155) 6.390 3.498 ( 9.077 4.338 -0.393) 10.068 3.654 ( 2.497 2.370 -6.752) 7.579 3.763 ( 11.333 -3.689 -0.994) 11.960 4.562 ( -3.522 1.590 0.098) 3.865 4.794 ( 7.900 9.937 -7.805) 14.902 5.250 ( -14.954 -2.100 0.286) 15.104 5.434 ( -12.682 2.662 3.020) 13.306 5.814 ( -7.669 5.992 10.968) 14.664 5.966 ( -8.009 -1.520 -2.045) 8.405 6.527 ( -2.070 -5.503 4.849) 7.621 6.795 ( 2.451 -4.370 3.788) 6.281 7.039 ( 5.650 -0.644 8.781) 10.461 7.264 ( 4.898 1.350 14.480) 15.345 8.479 ( -14.848 -12.817 11.158) 22.566 8.883 ( -6.525 7.520 5.642) 11.444 9.157 ( 2.414 -2.454 -0.459) 3.472 9.862 ( -5.685 5.891 -5.160) 9.678 10.218 ( 3.413 -14.067 -6.244) 15.764 10.720 ( 0.082 9.307 4.944) 10.539 11.800 ( 9.163 -1.856 -9.551) 13.365 12.117 ( 7.309 6.435 9.306) 13.470 12.388 ( -4.243 -6.421 2.420) 8.068 12.659 ( 0.944 3.636 1.025) 3.894 12.978 ( -7.650 -3.126 -4.520) 9.420 14.028 ( 14.084 6.088 1.676) 15.435 17.755 ( -9.405 0.704 -17.201) 19.617 18.308 ( 5.850 -1.559 8.384) 10.341 19.016 ( 3.889 7.723 0.923) 8.696 19.453 ( -14.720 7.084 4.208) 16.869 20.544 ( 5.184 -14.336 -16.311) 22.326 22.782 ( 7.079 16.965 9.174) 20.544 23.365 ( 7.266 -0.709 -5.600) 9.201 23.686 ( 2.955 -6.294 5.276) 8.728 ======================= Grid point 382 (187/361) ======================= q-point: (-0.40 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( -19.574 0.000 3.645) 19.911 2.800 ( 17.029 -0.000 11.552) 20.578 2.971 ( 11.272 -0.000 -3.605) 11.835 3.335 ( 12.370 -0.000 1.667) 12.482 3.364 ( -19.711 0.000 0.214) 19.712 3.804 ( 11.653 -0.000 -10.621) 15.767 4.738 ( 6.511 -0.000 -6.930) 9.509 4.763 ( 3.190 -0.000 4.213) 5.285 5.254 ( -6.045 0.000 12.288) 13.694 5.595 ( -6.758 0.000 16.818) 18.125 5.857 ( -10.747 0.000 17.612) 20.632 6.093 ( 7.361 -0.000 16.080) 17.685 6.176 ( -4.623 0.000 7.058) 8.437 6.423 ( 9.622 -0.000 -0.835) 9.658 6.452 ( -5.135 0.000 -5.365) 7.426 7.382 ( 3.015 -0.000 -6.473) 7.141 8.216 ( -20.019 0.000 18.331) 27.143 9.011 ( -2.129 0.000 3.608) 4.190 9.073 ( 0.275 -0.000 4.240) 4.249 10.058 ( -1.332 0.000 4.927) 5.103 10.463 ( -5.328 0.000 -21.732) 22.376 11.260 ( -9.023 0.000 -1.814) 9.203 11.575 ( 11.942 -0.000 -5.456) 13.130 12.160 ( 8.055 -0.000 -11.164) 13.767 12.227 ( -6.748 0.000 12.649) 14.337 12.790 ( -14.636 0.000 0.933) 14.666 13.230 ( -1.539 0.000 -13.979) 14.064 13.550 ( 13.289 -0.000 12.228) 18.059 17.961 ( 3.107 -0.000 2.439) 3.950 18.289 ( -2.272 0.000 -0.545) 2.336 18.836 ( 2.531 -0.000 -1.096) 2.758 19.699 ( 3.471 -0.000 -3.617) 5.013 20.939 ( -14.238 0.000 -10.169) 17.497 22.290 ( 27.039 -0.000 10.491) 29.003 23.465 ( -5.823 0.000 -1.334) 5.974 23.598 ( -1.258 0.000 -9.356) 9.440 ======================= Grid point 383 (188/361) ======================= q-point: (-0.30 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( -22.621 -0.883 9.436) 24.526 2.905 ( -16.662 -2.838 -2.821) 17.135 3.163 ( 4.188 -0.596 8.676) 9.652 3.313 ( 23.087 0.804 0.511) 23.107 3.530 ( 14.799 1.425 -0.097) 14.867 3.775 ( 3.239 -1.049 -13.140) 13.573 4.706 ( 3.400 7.465 -2.687) 8.632 4.864 ( 4.861 -7.248 -4.458) 9.800 5.255 ( -9.665 -0.902 6.387) 11.620 5.549 ( -14.195 -4.357 1.646) 14.940 5.930 ( -8.743 5.932 14.864) 18.237 6.133 ( -6.869 4.418 2.051) 8.421 6.264 ( -4.638 -8.210 11.060) 14.534 6.558 ( 10.207 -3.081 -2.227) 10.892 6.664 ( 13.288 -0.053 23.490) 26.988 7.326 ( 2.784 5.296 -4.995) 7.794 8.195 ( -21.752 -7.402 20.747) 30.957 9.020 ( -0.514 2.291 3.198) 3.968 9.114 ( -1.721 -1.081 2.571) 3.277 10.080 ( -0.200 3.413 -0.811) 3.514 10.140 ( -5.422 -3.125 -16.188) 17.356 11.072 ( -9.079 7.976 -1.118) 12.136 11.694 ( 11.626 -2.495 -6.104) 13.366 12.143 ( 8.864 5.502 -4.123) 11.218 12.274 ( -7.967 -4.163 7.307) 11.584 12.679 ( -5.264 0.042 4.226) 6.750 13.050 ( -5.518 -3.075 -10.134) 11.941 13.860 ( 13.253 1.346 9.553) 16.393 18.062 ( -1.048 2.874 0.248) 3.069 18.123 ( -3.682 -3.505 -5.204) 7.275 18.976 ( 7.805 0.159 6.790) 10.346 19.690 ( -2.151 0.919 -0.245) 2.352 20.592 ( -8.475 -0.086 -18.897) 20.711 22.759 ( 23.610 4.849 11.198) 26.577 23.384 ( -3.701 0.152 -1.056) 3.852 23.505 ( -0.048 -2.884 -5.561) 6.265 ======================= Grid point 384 (189/361) ======================= q-point: (-0.20 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -22.984 -3.967 15.093) 27.782 2.619 ( -25.601 -11.281 -1.328) 28.008 3.306 ( 7.690 3.839 2.987) 9.099 3.592 ( 1.499 2.796 -3.971) 5.082 3.617 ( 10.956 -0.440 -10.987) 15.522 3.764 ( 15.154 0.875 5.229) 16.055 4.627 ( -3.010 5.792 -1.429) 6.682 4.900 ( 7.475 0.088 -8.790) 11.538 5.176 ( -13.220 -3.814 3.601) 14.222 5.410 ( -12.231 -3.204 3.072) 13.011 5.885 ( -6.265 -0.335 2.413) 6.723 6.041 ( -7.610 10.872 10.108) 16.682 6.409 ( -3.962 -8.017 8.717) 12.488 6.698 ( 8.788 -4.781 -2.619) 10.342 7.097 ( 9.836 4.404 14.579) 18.130 7.300 ( 4.993 2.739 4.676) 7.369 8.228 ( -21.092 -12.713 18.736) 30.944 9.021 ( -2.958 5.735 5.054) 8.196 9.116 ( 0.040 -1.436 -0.127) 1.442 9.848 ( -6.621 -5.176 -14.403) 16.676 10.135 ( 4.112 1.955 -0.110) 4.555 10.884 ( -6.568 8.070 1.715) 10.546 11.761 ( 8.695 -2.345 -9.775) 13.291 12.215 ( -1.920 4.376 11.224) 12.198 12.297 ( 4.079 -3.477 -0.190) 5.363 12.703 ( 1.361 1.670 2.947) 3.650 12.897 ( -7.799 -5.143 -4.799) 10.503 14.119 ( 14.456 3.770 5.036) 15.766 17.765 ( -9.788 0.347 -17.895) 20.400 18.286 ( 5.664 -0.867 10.718) 12.153 19.134 ( 6.357 5.144 5.312) 9.752 19.563 ( -14.651 4.764 1.993) 15.535 20.341 ( 4.608 -8.096 -21.739) 23.651 23.061 ( 10.942 13.865 9.006) 19.827 23.348 ( 5.517 -1.037 -6.696) 8.738 23.561 ( 1.625 -7.563 7.735) 10.940 ======================= Grid point 385 (190/361) ======================= q-point: (-0.10 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.914 ( -22.829 -6.800 15.766) 28.565 2.408 ( -23.964 -16.930 2.494) 29.447 3.245 ( -12.931 -3.995 -7.290) 15.372 3.529 ( 5.176 2.074 2.966) 6.316 3.695 ( 8.317 7.947 -2.484) 11.768 3.946 ( 3.630 3.140 2.375) 5.355 4.513 ( -6.008 3.116 1.422) 6.916 4.899 ( 10.897 4.417 -8.095) 14.275 5.058 ( -8.781 -0.893 1.230) 8.911 5.362 ( -5.344 0.175 6.025) 8.055 5.826 ( -6.836 -1.767 0.376) 7.070 5.944 ( -7.299 13.863 7.976) 17.581 6.483 ( -3.098 -4.962 1.734) 6.102 6.816 ( 0.663 -4.308 4.850) 6.521 7.186 ( 7.594 4.333 -1.400) 8.855 7.500 ( 2.397 1.606 9.315) 9.752 8.267 ( -16.645 -14.509 10.768) 24.566 8.952 ( -5.894 9.588 7.829) 13.710 9.166 ( 3.362 -3.733 -0.164) 5.027 9.708 ( -2.885 -6.790 -6.437) 9.791 10.165 ( 3.496 0.279 -2.031) 4.053 10.822 ( -1.429 1.626 4.643) 5.123 11.764 ( 6.818 -2.767 -10.817) 13.083 12.218 ( -14.527 1.609 14.844) 20.832 12.435 ( 11.666 -0.140 -6.727) 13.467 12.732 ( 2.001 0.837 4.589) 5.076 12.853 ( -1.910 -3.404 2.166) 4.464 14.302 ( 15.625 7.893 -1.565) 17.575 17.417 ( -9.046 -0.125 -16.044) 18.419 18.517 ( 7.146 -0.665 11.494) 13.550 19.112 ( -5.202 10.060 -2.418) 11.580 19.377 ( -4.625 2.301 2.750) 5.852 20.308 ( 7.369 -12.525 -16.476) 21.969 23.046 ( -4.699 16.268 6.944) 18.301 23.388 ( 10.242 -2.980 -8.708) 13.770 23.837 ( 7.532 -3.090 15.438) 17.453 ======================= Grid point 393 (191/361) ======================= q-point: (-0.30 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( -24.604 0.000 17.559) 30.227 2.507 ( -28.378 0.000 -2.690) 28.505 3.347 ( 10.296 -0.000 4.705) 11.320 3.557 ( -4.796 0.000 -17.504) 18.149 3.698 ( 22.438 -0.000 2.516) 22.578 3.750 ( 10.141 -0.000 2.975) 10.569 4.733 ( -7.066 0.000 -3.176) 7.747 4.826 ( 8.170 -0.000 -3.721) 8.978 5.155 ( -9.949 0.000 2.100) 10.168 5.376 ( -10.756 0.000 4.481) 11.653 5.877 ( -7.222 0.000 -0.975) 7.288 6.235 ( -5.664 0.000 12.052) 13.317 6.249 ( -5.605 0.000 10.239) 11.673 6.654 ( 11.280 -0.000 -4.078) 11.994 7.139 ( 13.301 -0.000 20.617) 24.535 7.336 ( 4.781 -0.000 -5.958) 7.639 8.101 ( -25.930 0.000 24.384) 35.594 9.057 ( 1.241 -0.000 1.108) 1.663 9.119 ( -3.299 0.000 4.236) 5.369 9.793 ( -6.881 0.000 -17.387) 18.699 10.162 ( 4.502 -0.000 1.089) 4.632 10.964 ( -10.010 0.000 0.312) 10.015 11.735 ( 8.833 -0.000 -9.479) 12.956 12.258 ( -10.273 0.000 14.600) 17.852 12.266 ( 12.415 -0.000 -3.519) 12.904 12.720 ( 1.765 -0.000 4.950) 5.256 12.840 ( -7.927 0.000 -6.484) 10.241 14.154 ( 14.342 -0.000 6.247) 15.643 17.768 ( -9.915 0.000 -18.244) 20.764 18.279 ( 5.604 -0.000 11.670) 12.946 19.183 ( 7.154 -0.000 8.228) 10.903 19.607 ( -13.520 0.000 1.110) 13.566 20.268 ( 3.568 -0.000 -25.302) 25.553 23.219 ( 22.396 -0.000 2.658) 22.553 23.334 ( -4.995 0.000 2.681) 5.669 23.464 ( 1.045 -0.000 5.439) 5.539 ======================= Grid point 394 (192/361) ======================= q-point: (-0.20 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.869 ( -24.889 1.208 21.860) 33.148 2.134 ( -28.575 -11.351 2.214) 30.827 3.198 ( -19.560 -1.315 -12.840) 23.435 3.544 ( 9.253 0.197 4.123) 10.132 3.852 ( 7.898 8.215 1.234) 11.462 3.965 ( 7.751 -1.925 0.399) 7.996 4.570 ( -7.303 2.650 0.847) 7.815 4.899 ( 5.322 -2.557 -4.124) 7.202 5.065 ( -3.438 1.188 0.897) 3.747 5.361 ( -2.852 -0.090 6.687) 7.270 5.796 ( -5.876 -1.115 1.777) 6.239 6.172 ( -6.031 11.472 6.778) 14.626 6.358 ( -4.539 -8.722 5.475) 11.254 6.775 ( 10.894 -0.811 -2.244) 11.152 7.300 ( 5.634 7.154 -3.406) 9.723 7.478 ( 5.149 -3.939 7.170) 9.666 8.057 ( -23.564 -6.934 19.805) 31.553 9.091 ( -1.980 3.263 5.319) 6.547 9.113 ( -0.193 -0.300 1.264) 1.313 9.571 ( -2.735 -5.271 -10.551) 12.108 10.230 ( 5.733 3.233 -0.172) 6.584 10.844 ( -8.224 0.693 3.106) 8.818 11.724 ( 7.035 -1.411 -10.949) 13.090 12.293 ( -8.952 5.963 14.875) 18.357 12.412 ( 10.059 -3.046 -2.484) 10.800 12.691 ( -7.723 -3.597 0.763) 8.553 12.820 ( 4.183 -0.203 3.026) 5.166 14.399 ( 15.936 2.830 0.959) 16.214 17.415 ( -9.287 -0.084 -16.479) 18.916 18.509 ( 6.698 -0.208 11.995) 13.740 19.280 ( -10.729 7.925 -2.788) 13.627 19.382 ( -3.659 -2.121 3.131) 5.262 20.140 ( 10.849 -5.482 -18.605) 22.224 23.270 ( -5.261 7.630 5.413) 10.733 23.348 ( 10.762 -1.253 -10.937) 15.396 23.782 ( 10.344 -2.398 20.525) 23.109 ======================= Grid point 395 (193/361) ======================= q-point: (-0.10 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.714 ( -26.372 -4.289 13.772) 30.059 1.992 ( -25.563 -13.629 8.726) 30.255 2.806 ( -28.890 -10.096 2.817) 30.733 3.673 ( 3.858 2.620 1.435) 4.879 3.870 ( 2.375 7.145 4.236) 8.639 3.952 ( -4.161 4.027 -1.920) 6.100 4.549 ( -0.429 6.507 7.048) 9.602 4.912 ( 1.726 -3.472 -3.314) 5.100 5.091 ( 9.383 2.970 -1.678) 9.984 5.417 ( -0.362 1.674 6.671) 6.888 5.740 ( -5.911 0.230 -0.444) 5.932 6.032 ( -6.386 12.939 3.446) 14.834 6.402 ( -2.592 -5.466 -0.317) 6.058 6.886 ( -0.803 3.360 8.186) 8.885 7.299 ( 8.142 3.551 -3.621) 9.592 7.538 ( -3.541 -0.127 -1.514) 3.853 8.022 ( -14.450 -13.604 4.262) 20.299 9.051 ( -4.723 6.949 6.455) 10.595 9.196 ( 3.262 -3.639 4.223) 6.459 9.563 ( 2.359 -10.750 -3.450) 11.534 10.237 ( 2.646 8.636 -0.522) 9.047 10.818 ( -4.692 -4.774 4.305) 7.959 11.703 ( 6.122 -1.615 -10.201) 12.006 12.223 ( -12.398 8.667 9.111) 17.659 12.414 ( -1.807 1.447 -5.144) 5.641 12.815 ( 4.901 -13.015 6.003) 15.148 12.897 ( 4.554 1.889 0.160) 4.933 14.549 ( 15.977 7.475 -5.943) 18.613 17.190 ( -4.082 0.032 -1.809) 4.465 18.748 ( 7.484 -0.608 10.236) 12.694 18.939 ( -12.172 1.637 -9.933) 15.796 19.459 ( 3.994 2.484 3.342) 5.770 20.148 ( 6.820 -7.125 -12.067) 15.585 23.148 ( -9.223 14.082 6.019) 17.878 23.395 ( 9.719 -3.152 -8.087) 13.031 24.152 ( 9.179 0.999 15.406) 17.961 ======================= Grid point 404 (194/361) ======================= q-point: (-0.20 -0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( -28.980 0.000 5.670) 29.530 1.837 ( -25.651 0.000 21.548) 33.501 2.718 ( -32.299 0.000 0.984) 32.314 3.698 ( 5.726 -0.000 1.567) 5.936 3.919 ( -5.895 0.000 1.468) 6.075 4.008 ( 1.330 -0.000 0.359) 1.377 4.623 ( 6.344 -0.000 8.830) 10.873 4.858 ( -4.066 0.000 -2.215) 4.630 5.122 ( 10.382 -0.000 -2.675) 10.721 5.432 ( 0.386 -0.000 6.507) 6.519 5.742 ( -5.345 0.000 0.047) 5.345 6.195 ( -5.686 0.000 1.736) 5.945 6.299 ( -3.226 0.000 2.529) 4.099 6.943 ( 12.617 -0.000 2.484) 12.859 7.365 ( 8.204 -0.000 -6.889) 10.713 7.480 ( -9.323 0.000 4.943) 10.552 7.899 ( -18.106 0.000 4.371) 18.626 9.122 ( -6.056 0.000 6.362) 8.783 9.155 ( 3.713 -0.000 2.502) 4.478 9.460 ( 1.881 -0.000 -3.333) 3.827 10.332 ( 6.752 -0.000 -0.663) 6.785 10.766 ( -9.548 0.000 4.632) 10.613 11.687 ( 6.916 -0.000 -9.781) 11.979 12.383 ( 0.636 -0.000 -8.794) 8.817 12.425 ( -7.215 0.000 12.430) 14.372 12.617 ( -3.598 0.000 5.448) 6.529 12.915 ( 5.124 -0.000 0.675) 5.168 14.617 ( 16.248 -0.000 -4.928) 16.978 17.190 ( -3.770 0.000 -0.789) 3.852 18.742 ( 7.627 -0.000 9.292) 12.022 18.955 ( -15.877 0.000 -10.920) 19.270 19.485 ( 2.319 -0.000 4.931) 5.448 20.080 ( 9.634 -0.000 -12.629) 15.884 23.284 ( -7.176 0.000 6.571) 9.730 23.364 ( 9.974 -0.000 -8.834) 13.324 24.161 ( 10.660 -0.000 16.006) 19.231 ======================= Grid point 405 (195/361) ======================= q-point: (-0.10 -0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( -24.354 -5.462 14.385) 28.808 1.551 ( -34.977 -5.231 -1.207) 35.387 2.548 ( -27.997 -7.026 36.955) 46.892 3.691 ( -3.657 2.723 -2.387) 5.146 3.822 ( -7.237 -0.446 -0.884) 7.305 4.043 ( 2.700 3.919 4.384) 6.470 4.706 ( -2.038 9.055 -0.840) 9.320 4.939 ( 10.597 -4.655 8.047) 14.097 5.229 ( 10.182 2.165 -3.650) 11.031 5.509 ( 1.682 1.049 2.165) 2.935 5.584 ( -8.449 -1.121 -6.574) 10.763 6.135 ( -2.157 11.633 6.585) 13.540 6.324 ( -0.631 -7.187 1.141) 7.304 7.045 ( -4.075 17.313 7.451) 19.284 7.395 ( 3.423 1.721 0.237) 3.839 7.428 ( -2.938 -2.177 -2.909) 4.672 7.680 ( -12.113 -18.213 -8.681) 23.533 9.092 ( -5.031 4.320 5.067) 8.346 9.291 ( 4.747 -4.790 7.523) 10.103 9.494 ( 3.176 -5.856 -3.145) 7.367 10.354 ( 1.411 11.322 -0.504) 11.420 10.701 ( -10.106 -8.853 2.082) 13.596 11.678 ( 6.707 0.520 -7.839) 10.330 12.191 ( -9.315 10.362 -3.996) 14.495 12.351 ( -7.531 1.552 -0.472) 7.704 12.733 ( 0.462 -15.225 -0.723) 15.249 12.970 ( 4.241 0.692 -0.837) 4.378 14.711 ( 14.041 4.395 -11.751) 18.830 17.390 ( 14.391 3.513 24.022) 28.222 18.628 ( -5.432 -4.345 -15.348) 16.851 18.978 ( 4.352 1.320 11.833) 12.676 19.540 ( 0.890 -0.500 1.505) 1.818 20.071 ( 6.318 -1.932 -9.801) 11.820 23.210 ( -9.487 11.395 7.101) 16.440 23.418 ( 9.577 -1.833 -6.529) 11.735 24.374 ( 3.180 0.843 0.566) 3.338 ======================= Grid point 415 (196/361) ======================= q-point: (-0.10 -0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( -25.563 0.000 12.693) 28.540 1.370 ( -16.411 0.000 22.792) 28.086 2.690 ( -25.119 0.000 47.744) 53.948 3.585 ( -7.154 0.000 -3.595) 8.007 3.755 ( 0.181 -0.000 0.742) 0.764 4.136 ( 1.930 -0.000 1.874) 2.690 4.665 ( -1.142 0.000 -3.471) 3.654 5.118 ( -0.526 0.000 -4.607) 4.637 5.297 ( 5.900 -0.000 -6.137) 8.513 5.338 ( -2.539 0.000 -1.993) 3.228 5.686 ( 8.443 -0.000 11.049) 13.905 6.250 ( 2.323 -0.000 -1.874) 2.985 6.349 ( -0.420 0.000 12.950) 12.957 7.089 ( -25.228 0.000 -17.586) 30.752 7.217 ( 3.026 -0.000 -6.667) 7.322 7.305 ( -15.624 0.000 12.731) 20.154 7.568 ( 9.326 -0.000 7.222) 11.796 9.127 ( -3.417 0.000 6.751) 7.566 9.437 ( 6.812 -0.000 6.684) 9.543 9.443 ( 1.883 -0.000 -6.502) 6.769 10.386 ( -23.208 0.000 -1.561) 23.261 10.466 ( 3.519 -0.000 -1.483) 3.819 11.691 ( 5.872 -0.000 -6.345) 8.645 12.076 ( -5.177 0.000 -8.813) 10.221 12.153 ( -12.482 0.000 0.855) 12.511 12.701 ( 1.596 -0.000 3.265) 3.634 13.006 ( 2.837 -0.000 -1.628) 3.271 14.721 ( 9.979 -0.000 -17.730) 20.346 18.149 ( 37.957 -0.000 28.325) 47.361 18.372 ( -0.671 0.000 -14.446) 14.462 19.169 ( -0.154 0.000 11.456) 11.457 19.500 ( -3.283 0.000 -3.557) 4.841 20.058 ( 9.139 -0.000 -7.897) 12.078 23.237 ( -8.396 0.000 7.534) 11.280 23.470 ( 9.032 -0.000 -5.278) 10.461 24.152 ( -19.916 0.000 -19.498) 27.872 ======================= Grid point 416 (197/361) ======================= q-point: ( 0.00 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( 9.627 -0.000 15.666) 18.387 2.419 ( 1.460 -0.000 28.273) 28.311 3.162 ( -1.652 0.000 -7.862) 8.034 3.773 ( -4.838 0.000 16.334) 17.036 3.801 ( 0.152 -0.000 -14.192) 14.193 4.008 ( 9.170 -0.000 -4.103) 10.046 4.528 ( -4.860 0.000 -5.876) 7.625 4.563 ( -1.405 0.000 -17.731) 17.786 5.386 ( 3.054 -0.000 10.559) 10.991 5.508 ( -9.418 0.000 13.322) 16.314 5.929 ( -11.747 0.000 13.398) 17.819 6.404 ( 2.172 -0.000 0.621) 2.259 6.484 ( 10.405 -0.000 -2.718) 10.754 6.711 ( -0.620 0.000 -10.395) 10.413 6.952 ( -12.056 0.000 18.408) 22.004 7.992 ( -11.818 0.000 32.674) 34.745 8.212 ( -0.980 0.000 8.900) 8.954 9.108 ( 2.226 -0.000 -3.465) 4.119 9.155 ( -1.599 0.000 -4.108) 4.408 9.727 ( -10.583 0.000 10.850) 15.157 10.243 ( -1.916 0.000 -10.517) 10.690 10.335 ( 10.957 -0.000 9.461) 14.476 11.303 ( 0.775 -0.000 -14.164) 14.185 11.690 ( 0.265 -0.000 -7.454) 7.459 12.369 ( -3.537 0.000 9.082) 9.747 12.858 ( 10.053 -0.000 -4.821) 11.150 12.963 ( -2.471 0.000 1.120) 2.713 14.018 ( 2.563 -0.000 -15.763) 15.970 18.005 ( 9.351 -0.000 -8.242) 12.465 18.732 ( -9.381 0.000 -15.845) 18.414 19.186 ( -18.440 0.000 6.450) 19.536 19.520 ( 15.330 -0.000 -0.350) 15.334 20.643 ( 25.529 -0.000 10.639) 27.657 22.431 ( -32.143 0.000 -14.476) 35.252 23.253 ( -7.076 0.000 2.892) 7.644 23.508 ( 9.246 -0.000 -4.939) 10.483 ======================= Grid point 417 (198/361) ======================= q-point: ( 0.10 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( 12.398 0.018 11.676) 17.030 2.748 ( 2.914 1.895 19.354) 19.664 3.097 ( 3.940 2.308 -1.685) 4.868 3.607 ( -1.600 4.894 -11.622) 12.712 3.784 ( -5.189 -2.002 -6.269) 8.380 4.039 ( 1.776 -1.229 -6.121) 6.491 4.330 ( -1.965 5.227 -4.042) 6.893 4.466 ( -1.227 -7.790 -6.224) 10.046 5.501 ( -6.776 2.900 13.654) 15.516 5.584 ( -5.781 -5.297 12.502) 14.757 5.985 ( -2.762 -0.844 7.215) 7.772 6.353 ( -6.177 -0.227 -3.903) 7.310 6.532 ( 3.530 0.468 -2.823) 4.544 6.635 ( 4.110 2.331 -4.145) 6.285 7.057 ( -9.412 2.145 26.457) 28.163 7.969 ( -9.207 27.676 13.463) 32.125 8.433 ( -10.300 -23.630 15.942) 30.308 9.087 ( 0.521 2.450 -2.264) 3.376 9.152 ( 3.417 -3.167 -1.212) 4.815 9.772 ( -2.800 2.497 13.284) 13.804 10.053 ( -2.400 0.993 -7.604) 8.035 10.693 ( 12.836 -8.471 8.503) 17.573 11.158 ( 3.552 -0.954 -14.102) 14.574 11.616 ( 6.510 2.967 -9.642) 12.006 12.422 ( -4.358 -4.722 5.336) 8.352 12.918 ( 2.114 1.800 -0.907) 2.921 12.955 ( 2.306 -2.488 -1.800) 3.841 13.865 ( 0.912 2.709 -11.321) 11.677 18.054 ( 9.260 1.157 -4.728) 10.461 18.388 ( -9.704 1.736 -15.576) 18.433 19.031 ( -16.411 -2.461 5.820) 17.585 19.636 ( 2.564 0.064 -0.629) 2.641 21.132 ( 21.096 2.506 14.918) 25.959 21.860 ( -19.248 1.449 -15.486) 24.746 23.220 ( -3.709 -3.488 0.882) 5.167 23.584 ( 9.101 -0.139 -3.919) 9.909 ======================= Grid point 418 (199/361) ======================= q-point: ( 0.20 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( 6.063 4.893 8.858) 11.796 2.890 ( 8.810 -1.184 -1.754) 9.060 3.211 ( 4.894 5.731 9.700) 12.283 3.420 ( -1.237 7.999 -4.122) 9.083 3.616 ( -3.113 -2.937 -10.235) 11.094 3.923 ( -4.134 0.776 -9.441) 10.336 4.265 ( 0.246 -5.296 -4.867) 7.196 4.535 ( 3.035 -4.850 3.492) 6.703 5.501 ( -16.386 -3.485 11.463) 20.299 5.641 ( -9.256 -1.950 7.562) 12.110 5.975 ( -2.734 -0.647 -3.175) 4.239 6.197 ( -8.379 -0.894 -4.077) 9.361 6.566 ( 3.925 -0.014 -0.057) 3.925 6.659 ( 5.962 0.753 -1.402) 6.171 7.274 ( -5.859 4.960 31.114) 32.047 7.685 ( -9.163 25.711 3.333) 27.498 8.622 ( -14.634 -18.401 12.509) 26.631 9.064 ( 0.922 3.320 0.695) 3.515 9.201 ( 0.983 0.435 2.136) 2.391 9.777 ( -2.170 2.242 -4.003) 5.075 10.136 ( 4.360 -9.152 11.731) 15.504 10.840 ( 3.817 11.166 -4.275) 12.551 11.265 ( 17.290 -11.724 1.405) 20.937 11.594 ( 12.102 3.382 -11.087) 16.758 12.463 ( -4.082 -8.378 1.811) 9.494 12.874 ( -7.874 4.072 5.997) 10.703 12.999 ( 4.400 -5.024 -6.529) 9.340 13.737 ( 2.724 3.183 -8.960) 9.891 18.037 ( -6.823 1.483 -11.194) 13.193 18.173 ( 5.680 -1.360 -3.160) 6.641 18.911 ( -11.562 -1.572 4.082) 12.362 19.602 ( -8.446 -1.986 1.681) 8.837 21.205 ( -6.348 16.815 -7.749) 19.572 21.827 ( 15.605 -13.346 6.445) 21.522 23.229 ( 0.569 -2.642 -0.411) 2.734 23.665 ( 8.224 0.928 -2.093) 8.537 ======================= Grid point 419 (200/361) ======================= q-point: (-0.70 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.628 ( -7.107 7.657 5.646) 11.875 3.013 ( 5.274 -2.589 -6.824) 9.005 3.264 ( 7.202 2.149 0.392) 7.526 3.353 ( -0.583 6.767 -0.230) 6.796 3.579 ( 0.428 0.254 3.290) 3.328 3.762 ( 0.516 1.588 -6.544) 6.753 4.324 ( 6.640 -9.861 -4.956) 12.880 4.652 ( 0.436 -0.719 5.693) 5.755 5.361 ( -21.580 -7.968 1.957) 23.087 5.558 ( -13.269 -1.080 4.276) 13.982 5.883 ( -5.988 -0.588 -1.581) 6.221 6.057 ( -8.237 -1.846 -2.133) 8.707 6.602 ( 3.724 1.479 -2.280) 4.610 6.758 ( 7.193 -2.713 0.436) 7.700 7.394 ( -4.206 20.579 0.894) 21.023 7.512 ( -5.115 6.308 26.172) 27.403 8.665 ( -14.933 -12.955 7.304) 21.075 9.059 ( -1.872 3.667 4.056) 5.780 9.228 ( -0.953 3.233 5.221) 6.214 9.670 ( -5.766 -7.862 -7.337) 12.202 10.451 ( 8.374 -3.282 12.272) 15.215 10.697 ( 5.556 18.085 -4.469) 19.440 11.590 ( 14.239 0.704 -11.060) 18.044 11.710 ( 20.001 -7.769 4.854) 22.000 12.507 ( -1.869 -8.621 0.448) 8.833 12.777 ( -11.897 5.846 8.296) 15.637 12.987 ( -2.098 -4.910 -5.802) 7.885 13.699 ( 8.233 -2.465 -8.629) 12.178 17.746 ( -10.302 -1.064 -14.559) 17.867 18.308 ( 7.326 0.182 6.960) 10.106 18.848 ( -4.709 -2.909 1.217) 5.667 19.507 ( -13.719 -5.276 3.652) 15.145 20.840 ( -1.240 15.978 -16.325) 22.877 22.288 ( 12.453 -13.777 12.826) 22.570 23.267 ( 5.091 0.359 -1.843) 5.426 23.751 ( 6.871 1.799 1.400) 7.239 ======================= Grid point 420 (201/361) ======================= q-point: (-0.60 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.503 ( -15.198 6.742 10.449) 19.637 2.905 ( -8.278 0.882 -7.673) 11.321 3.253 ( 4.222 1.856 -2.507) 5.250 3.422 ( 4.537 -2.728 1.700) 5.560 3.590 ( -0.305 5.214 2.523) 5.800 3.814 ( 8.794 -2.446 -0.395) 9.137 4.478 ( 9.598 -8.894 -3.793) 13.624 4.656 ( -6.669 4.639 5.288) 9.693 5.155 ( -16.046 -7.203 -1.462) 17.649 5.442 ( -10.960 -4.369 2.571) 12.076 5.803 ( -8.317 -5.257 0.919) 9.882 5.942 ( -8.494 -1.722 -0.374) 8.675 6.587 ( 1.040 2.355 -2.848) 3.839 6.890 ( 6.736 -3.738 -0.203) 7.706 7.225 ( 1.986 16.301 1.378) 16.479 7.627 ( -7.325 4.383 13.715) 16.154 8.641 ( -13.457 -8.467 5.825) 16.933 9.024 ( -6.873 4.380 6.443) 10.389 9.256 ( -1.151 1.767 6.410) 6.748 9.605 ( -4.614 -11.336 -4.908) 13.186 10.484 ( 6.828 24.509 -3.515) 25.684 10.777 ( 6.321 -1.342 10.394) 12.239 11.605 ( 12.817 2.537 -13.903) 19.079 12.097 ( 16.756 -6.023 1.209) 17.846 12.587 ( -0.237 -3.014 2.780) 4.107 12.658 ( -10.935 2.791 10.084) 15.135 12.914 ( -4.152 -3.394 -2.832) 6.065 13.795 ( 11.728 -10.463 -9.183) 18.203 17.444 ( -10.130 -0.077 -11.565) 15.374 18.521 ( 7.287 0.256 11.088) 13.271 18.852 ( 0.010 -6.181 -2.985) 6.864 19.413 ( -12.173 -5.444 3.181) 13.709 20.518 ( 3.182 15.163 -16.084) 22.332 22.667 ( 1.646 -16.049 10.274) 19.127 23.313 ( 9.806 5.271 -3.849) 11.779 23.881 ( 6.632 0.477 7.563) 10.070 ======================= Grid point 421 (202/361) ======================= q-point: (-0.50 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.338 ( -20.268 6.994 13.240) 25.200 2.609 ( -18.658 6.521 -3.078) 20.003 3.364 ( 7.033 2.154 0.159) 7.357 3.459 ( 1.219 -3.759 -1.247) 4.144 3.604 ( 0.824 1.065 7.019) 7.147 3.918 ( 0.108 -5.146 -0.689) 5.193 4.540 ( -10.252 -2.042 5.844) 11.976 4.663 ( 10.481 -4.130 -4.894) 12.282 5.042 ( -5.480 -3.052 1.156) 6.378 5.415 ( -3.361 -4.428 2.384) 6.048 5.756 ( -8.823 -9.107 -1.631) 12.785 5.859 ( -7.109 -3.252 2.908) 8.341 6.528 ( -2.250 2.772 -1.222) 3.774 6.989 ( 3.948 -3.573 -1.832) 5.631 7.187 ( 6.438 11.463 2.565) 13.395 7.557 ( -11.198 0.920 1.304) 11.311 8.554 ( -13.808 1.712 5.250) 14.872 8.988 ( -6.701 -2.051 6.318) 9.435 9.326 ( -0.791 0.728 9.418) 9.479 9.627 ( -0.196 -8.999 -1.743) 9.169 10.304 ( 3.886 22.324 -2.919) 22.847 10.958 ( 3.663 2.615 8.104) 9.270 11.567 ( 10.678 3.560 -14.834) 18.621 12.262 ( 5.733 -4.125 -5.899) 9.202 12.482 ( -14.960 3.809 8.815) 17.776 12.754 ( 2.465 -3.973 -0.380) 4.691 12.944 ( 5.422 -0.083 5.283) 7.570 13.969 ( 12.987 -14.705 -9.795) 21.928 17.234 ( -6.241 -0.382 -2.477) 6.725 18.747 ( 5.646 -0.992 9.768) 11.326 18.837 ( 0.173 -4.009 -9.596) 10.401 19.367 ( -2.353 -2.571 1.810) 3.928 20.285 ( 3.013 11.472 -10.151) 15.612 22.857 ( -8.641 -18.177 5.444) 20.849 23.347 ( 11.650 8.751 -5.228) 15.480 24.109 ( 7.041 -2.134 11.766) 13.877 ======================= Grid point 422 (203/361) ======================= q-point: (-0.40 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( -20.474 9.385 12.909) 25.960 2.205 ( -26.769 10.069 0.751) 28.610 3.313 ( -5.690 12.850 13.445) 19.449 3.581 ( 1.477 -8.800 -1.735) 9.090 3.744 ( 4.198 -6.088 2.987) 7.976 3.910 ( -4.729 -3.801 1.334) 6.212 4.508 ( -10.507 -10.590 3.146) 15.246 4.784 ( 9.531 -4.276 -3.512) 11.021 5.092 ( 6.423 0.918 3.131) 7.205 5.456 ( 0.008 -3.002 0.591) 3.059 5.658 ( -6.532 -2.352 -2.992) 7.560 5.889 ( -4.123 -9.877 3.995) 11.424 6.468 ( -3.779 1.823 2.998) 5.157 6.998 ( -4.079 -4.057 -3.293) 6.629 7.247 ( 8.197 3.571 0.122) 8.942 7.385 ( -11.231 -1.742 -1.404) 11.451 8.374 ( -11.771 12.768 6.858) 18.671 9.007 ( -6.627 -6.588 4.782) 10.497 9.443 ( 0.689 0.759 10.321) 10.372 9.675 ( 3.687 0.887 -2.906) 4.778 10.160 ( -1.054 8.394 -0.034) 8.460 11.014 ( 0.109 7.867 4.161) 8.901 11.503 ( 9.451 2.348 -13.514) 16.657 12.218 ( -4.787 0.214 -4.299) 6.437 12.393 ( -10.394 -1.701 7.797) 13.104 12.776 ( 2.061 -4.400 -6.446) 8.072 13.058 ( 6.011 7.366 2.169) 9.752 14.161 ( 13.356 -14.299 -11.557) 22.724 17.276 ( 2.854 -4.815 11.394) 12.694 18.672 ( -0.359 1.718 -16.428) 16.521 18.927 ( 4.291 -0.925 6.277) 7.660 19.449 ( 8.005 -1.001 1.504) 8.206 20.141 ( -0.340 7.599 -4.019) 8.603 22.924 ( -13.118 -20.882 3.734) 24.942 23.359 ( 10.604 8.471 -5.439) 14.621 24.332 ( 3.281 -2.014 7.148) 8.119 ======================= Grid point 423 (204/361) ======================= q-point: (-0.30 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.751 ( -26.151 13.205 7.262) 30.183 1.958 ( -16.943 11.079 17.612) 26.832 3.374 ( -5.552 6.759 23.234) 24.826 3.584 ( -7.149 -4.485 -0.662) 8.466 3.763 ( -8.805 -4.133 1.255) 9.808 3.969 ( 7.308 -2.736 -3.035) 8.373 4.503 ( -6.826 -14.317 -1.851) 15.969 4.924 ( 5.609 -6.771 -1.496) 8.919 5.236 ( 8.543 3.758 3.445) 9.949 5.400 ( -2.797 1.253 -3.903) 4.962 5.652 ( 5.308 1.156 3.318) 6.366 5.990 ( -0.287 -11.144 1.877) 11.304 6.505 ( -2.107 -2.074 10.889) 11.283 6.847 ( -17.042 -8.586 -6.593) 20.190 7.200 ( -1.856 -2.502 -10.502) 10.955 7.405 ( 1.005 -1.966 8.353) 8.640 8.200 ( -7.875 20.956 13.107) 25.941 9.040 ( -6.234 -8.705 5.054) 11.840 9.523 ( 0.476 4.821 -0.052) 4.844 9.643 ( 5.358 9.509 1.185) 10.979 10.122 ( -7.824 -8.149 1.293) 11.370 10.922 ( -2.195 13.785 -0.461) 13.966 11.487 ( 8.951 -1.220 -9.533) 13.133 12.073 ( -8.176 1.036 -2.811) 8.708 12.363 ( -7.504 -0.040 4.717) 8.863 12.739 ( 1.820 -1.432 -7.030) 7.401 13.050 ( 2.572 8.349 0.347) 8.742 14.280 ( 11.425 -10.458 -16.534) 22.655 17.658 ( 12.565 -12.786 16.591) 24.426 18.476 ( 8.610 8.642 -13.677) 18.327 19.037 ( -1.290 -7.720 2.030) 8.086 19.610 ( 13.127 4.215 2.231) 13.967 20.014 ( -3.497 6.287 -3.220) 7.882 22.975 ( -15.388 -24.837 4.228) 29.522 23.367 ( 10.013 6.482 -5.814) 13.269 24.340 ( -6.152 3.253 -3.809) 7.934 ======================= Grid point 424 (205/361) ======================= q-point: (-0.20 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( -9.431 9.812 19.935) 24.137 1.924 ( -10.684 8.010 23.549) 27.071 3.466 ( -10.039 -3.274 -3.504) 11.126 3.531 ( -13.897 2.151 28.043) 31.371 3.726 ( 4.374 -1.584 -2.260) 5.172 4.020 ( 6.478 -0.358 -7.114) 9.629 4.537 ( -2.595 -13.124 -2.290) 13.572 4.948 ( -1.362 -0.094 -5.200) 5.376 5.216 ( 2.114 2.853 -4.147) 5.459 5.449 ( -1.802 1.412 9.477) 9.749 5.853 ( 17.739 0.950 4.533) 18.333 6.122 ( 2.434 -9.705 1.829) 10.171 6.534 ( -19.814 -4.597 -5.795) 21.149 6.705 ( -3.389 -9.770 13.447) 16.964 7.053 ( -1.559 0.864 -11.664) 11.799 7.533 ( -7.195 -8.464 12.630) 16.821 8.126 ( -3.310 22.226 19.697) 29.882 9.115 ( -2.961 -8.983 4.364) 10.417 9.376 ( -1.324 8.226 -8.418) 11.844 9.716 ( 5.595 7.879 7.310) 12.117 10.065 ( -15.221 -14.763 -0.436) 21.209 10.725 ( -1.073 19.446 -2.797) 19.676 11.518 ( 6.651 -2.657 -8.520) 11.131 11.907 ( -7.642 -0.103 -5.348) 9.328 12.306 ( -5.626 4.717 6.831) 10.029 12.727 ( 3.442 -0.860 -2.372) 4.267 13.016 ( 1.231 4.744 -0.546) 4.932 14.269 ( 8.526 -6.408 -20.213) 22.855 17.991 ( 6.391 -8.570 -6.491) 12.507 18.616 ( 27.455 3.668 7.368) 28.662 19.074 ( -7.617 -15.333 -2.568) 17.312 19.708 ( -1.177 16.598 4.628) 17.272 19.930 ( 11.997 -0.064 -4.320) 12.751 23.025 ( -18.581 -28.308 2.719) 33.970 23.387 ( 10.194 4.009 -6.442) 12.708 23.997 ( -17.921 13.961 -10.853) 25.177 ======================= Grid point 425 (206/361) ======================= q-point: (-0.10 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( 5.114 2.920 21.152) 21.956 2.091 ( -3.497 2.109 27.856) 28.154 3.305 ( -6.781 -2.158 -7.078) 10.037 3.628 ( -11.973 2.431 25.638) 28.400 3.848 ( 9.745 -6.316 -5.646) 12.912 3.981 ( 5.396 5.119 -8.357) 11.187 4.578 ( -1.611 -10.258 -5.042) 11.543 4.805 ( -0.394 5.673 -11.449) 12.784 5.244 ( 2.463 -0.805 4.456) 5.155 5.483 ( -6.968 2.693 11.631) 13.823 6.029 ( -11.190 -0.277 4.457) 12.049 6.273 ( 8.268 -7.611 1.941) 11.405 6.355 ( 4.955 0.272 -1.240) 5.115 6.867 ( -1.710 -0.663 -7.668) 7.885 6.892 ( -7.872 -2.832 10.946) 13.777 7.709 ( -11.913 -14.516 23.823) 30.335 8.157 ( -0.278 18.274 18.023) 25.668 9.171 ( -1.982 -3.038 -3.408) 4.977 9.208 ( -0.778 3.021 -3.866) 4.968 9.769 ( -5.254 6.689 8.966) 12.359 10.055 ( -4.183 -19.709 1.682) 20.218 10.496 ( 0.706 21.441 -4.440) 21.907 11.459 ( 1.008 -0.195 -12.432) 12.474 11.774 ( -3.372 -2.229 -5.368) 6.720 12.312 ( -3.429 3.656 10.283) 11.440 12.779 ( 7.022 -0.367 -2.564) 7.484 12.987 ( -0.261 1.725 -0.639) 1.858 14.164 ( 5.489 -3.028 -19.713) 20.686 17.996 ( 7.513 -1.596 -10.834) 13.280 18.950 ( 0.731 -3.146 -7.792) 8.434 19.160 ( 10.703 -14.663 4.671) 18.745 19.471 ( -9.427 15.935 1.207) 18.554 20.208 ( 23.746 1.198 4.704) 24.237 22.943 ( -28.466 -24.372 -8.339) 38.391 23.401 ( 0.328 7.391 -4.505) 8.662 23.494 ( -6.478 13.393 -3.805) 15.356 ======================= Grid point 427 (207/361) ======================= q-point: ( 0.10 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( 12.896 -0.000 9.119) 15.794 2.878 ( 3.777 -0.000 -4.690) 6.022 3.280 ( 3.879 -0.000 14.250) 14.768 3.500 ( -0.952 0.000 -3.568) 3.693 3.575 ( -4.730 0.000 -12.036) 12.932 3.922 ( -0.556 0.000 -12.535) 12.547 4.223 ( -3.773 0.000 -5.490) 6.662 4.477 ( 3.655 -0.000 5.030) 6.218 5.478 ( -19.367 0.000 12.184) 22.881 5.617 ( -6.763 0.000 7.318) 9.965 5.968 ( -2.023 0.000 -2.929) 3.560 6.188 ( -8.944 0.000 -4.188) 9.876 6.567 ( 4.131 -0.000 0.699) 4.190 6.663 ( 5.469 -0.000 -4.163) 6.873 7.321 ( -7.255 0.000 32.779) 33.572 8.022 ( -12.954 0.000 -4.833) 13.826 8.349 ( -12.237 0.000 21.247) 24.519 9.094 ( 2.582 -0.000 -2.271) 3.439 9.205 ( 2.661 -0.000 3.429) 4.340 9.825 ( -7.754 0.000 -12.437) 14.656 10.025 ( 6.233 -0.000 19.295) 20.276 11.040 ( 17.973 -0.000 13.440) 22.443 11.067 ( 9.080 -0.000 -12.917) 15.789 11.633 ( 11.426 -0.000 -10.999) 15.860 12.375 ( -4.755 0.000 1.988) 5.154 12.916 ( -8.142 0.000 6.493) 10.414 12.947 ( 5.864 -0.000 -8.117) 10.014 13.767 ( 1.456 -0.000 -9.844) 9.951 18.055 ( -9.868 0.000 -16.537) 19.257 18.156 ( 8.872 -0.000 -0.055) 8.872 18.895 ( -12.996 0.000 6.650) 14.598 19.582 ( -10.195 0.000 1.655) 10.328 21.429 ( -9.095 0.000 -20.827) 22.726 21.638 ( 18.194 -0.000 18.173) 25.716 23.203 ( 1.371 -0.000 0.907) 1.644 23.674 ( 8.977 -0.000 -2.337) 9.277 ======================= Grid point 428 (208/361) ======================= q-point: ( 0.20 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.769 ( -0.687 7.432 -4.986) 8.976 2.938 ( 4.846 -5.473 -0.359) 7.319 3.317 ( -1.168 3.034 0.373) 3.273 3.414 ( -1.792 0.216 -6.883) 7.116 3.624 ( 2.942 3.416 13.988) 14.696 3.766 ( 3.418 -0.535 -14.296) 14.709 4.190 ( 3.374 -4.253 -0.965) 5.514 4.600 ( 2.010 -3.414 5.191) 6.530 5.287 ( -22.453 -0.908 5.534) 23.143 5.532 ( -15.049 -1.396 3.193) 15.447 5.883 ( -4.351 0.209 -3.594) 5.647 6.027 ( -9.100 -1.111 -1.930) 9.369 6.640 ( 5.417 2.688 -0.793) 6.099 6.705 ( 6.822 -3.126 -3.194) 8.155 7.582 ( -9.255 2.577 29.235) 30.773 7.725 ( -10.010 12.670 -2.639) 16.361 8.439 ( -13.176 -9.973 12.949) 20.994 9.099 ( 2.541 0.948 -1.585) 3.141 9.279 ( -0.479 1.886 6.724) 7.000 9.567 ( -8.815 -3.270 -11.838) 15.117 10.386 ( 9.933 -2.171 17.778) 20.480 11.032 ( 13.989 14.859 -7.422) 21.716 11.505 ( 18.209 -8.014 10.056) 22.291 11.664 ( 13.830 0.907 -10.780) 17.558 12.367 ( -1.624 -5.466 1.290) 5.846 12.851 ( -11.611 2.417 7.435) 13.998 12.909 ( -0.318 -2.917 -7.135) 7.714 13.678 ( 4.531 -0.345 -11.331) 12.209 17.732 ( -9.919 -0.434 -14.507) 17.579 18.310 ( 8.457 0.083 5.837) 10.276 18.816 ( -7.936 -0.836 3.653) 8.776 19.436 ( -14.870 -2.220 3.380) 15.410 21.067 ( -0.379 7.848 -21.950) 23.314 22.092 ( 10.091 -6.839 17.278) 21.146 23.271 ( 6.306 0.073 1.217) 6.423 23.772 ( 7.799 0.604 -0.307) 7.829 ======================= Grid point 429 (209/361) ======================= q-point: (-0.70 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( -6.941 4.658 -2.239) 8.654 2.909 ( -5.936 0.207 -4.634) 7.533 3.288 ( -1.525 1.554 -4.146) 4.683 3.365 ( -0.814 -3.138 3.139) 4.513 3.694 ( 5.009 3.887 -0.937) 6.409 3.778 ( 5.224 0.192 0.631) 5.265 4.348 ( 8.965 -5.080 2.956) 10.719 4.687 ( -2.932 -3.257 3.449) 5.577 5.056 ( -17.521 -0.502 3.503) 17.874 5.350 ( -16.357 -5.689 1.239) 17.363 5.762 ( -7.904 -0.411 -2.017) 8.167 5.910 ( -7.984 -1.602 0.006) 8.144 6.637 ( 3.340 3.333 -4.388) 6.444 6.819 ( 6.720 -4.274 -1.097) 8.039 7.492 ( -3.255 12.604 -0.364) 13.022 7.693 ( -15.222 2.764 19.162) 24.628 8.476 ( -11.763 -8.385 9.580) 17.333 9.105 ( 0.484 3.337 0.025) 3.372 9.279 ( -4.680 0.500 1.645) 4.985 9.422 ( -4.927 -7.709 -2.062) 9.379 10.719 ( 8.739 0.925 12.955) 15.654 10.985 ( 13.430 23.211 -3.829) 27.088 11.646 ( 12.383 2.412 -12.504) 17.763 11.963 ( 15.008 -9.655 3.375) 18.161 12.488 ( 7.205 -5.513 5.057) 10.386 12.734 ( -15.512 3.577 9.404) 18.489 12.828 ( -4.555 -5.183 -5.202) 8.641 13.648 ( 8.885 -5.669 -13.173) 16.871 17.442 ( -9.908 -0.113 -10.777) 14.639 18.522 ( 8.123 -0.110 8.894) 12.046 18.781 ( -2.301 -2.094 0.792) 3.210 19.326 ( -10.386 -3.909 3.871) 11.752 20.747 ( 2.059 9.835 -20.469) 22.803 22.422 ( -0.179 -10.588 12.310) 16.238 23.396 ( 10.349 3.647 2.184) 11.188 23.881 ( 6.389 -0.321 3.198) 7.152 ======================= Grid point 430 (210/361) ======================= q-point: (-0.60 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( -12.737 4.413 4.236) 14.130 2.709 ( -13.105 5.329 -2.104) 14.303 3.268 ( 6.120 -5.315 -5.046) 9.548 3.430 ( -1.630 -4.858 3.477) 6.192 3.712 ( -0.271 6.005 4.762) 7.668 3.830 ( 1.226 -2.274 -1.192) 2.845 4.505 ( -4.317 -1.565 3.693) 5.893 4.633 ( -2.167 0.606 0.124) 2.254 4.966 ( -4.510 -5.073 4.349) 8.062 5.280 ( -6.594 -9.613 2.356) 11.892 5.639 ( -9.480 -3.204 -0.225) 10.010 5.835 ( -5.646 -0.598 1.968) 6.009 6.578 ( -0.983 2.924 -3.152) 4.410 6.913 ( 4.215 -4.657 -3.399) 7.142 7.388 ( 1.494 10.172 0.702) 10.305 7.575 ( -20.925 1.076 7.554) 22.273 8.504 ( -8.621 -5.055 8.350) 13.023 9.021 ( -5.095 3.395 -0.248) 6.128 9.310 ( 1.260 -3.947 4.268) 5.948 9.446 ( -4.268 -7.072 4.078) 9.212 10.769 ( 6.772 25.044 -3.154) 26.134 11.037 ( 9.071 7.827 9.094) 15.042 11.625 ( 10.553 2.841 -13.870) 17.658 12.163 ( 6.233 -7.385 -5.512) 11.126 12.555 ( -13.912 3.510 6.294) 15.668 12.682 ( -2.225 -3.710 -0.517) 4.357 12.897 ( 9.430 -4.713 9.420) 14.137 13.714 ( 11.685 -12.750 -13.219) 21.768 17.227 ( -7.440 -0.374 -3.693) 8.315 18.659 ( 1.258 -5.332 -4.272) 6.947 18.862 ( 7.305 3.172 8.610) 11.728 19.322 ( -0.362 -2.438 3.400) 4.200 20.464 ( 0.597 8.358 -15.816) 17.899 22.566 ( -9.334 -13.710 5.769) 17.561 23.508 ( 10.270 8.950 0.490) 13.631 24.054 ( 5.612 -3.983 8.344) 10.816 ======================= Grid point 431 (211/361) ======================= q-point: (-0.50 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( -15.216 6.523 7.763) 18.285 2.408 ( -20.196 12.249 4.251) 23.999 3.383 ( 1.560 -11.019 -1.667) 11.253 3.483 ( 5.260 0.761 -0.598) 5.348 3.704 ( -7.155 0.156 7.447) 10.328 3.858 ( 1.278 1.109 4.447) 4.758 4.344 ( -17.442 -6.262 0.768) 18.548 4.713 ( 5.903 -3.119 -1.174) 6.778 5.082 ( 4.662 -3.482 6.456) 8.691 5.342 ( -2.030 -8.963 1.596) 9.328 5.571 ( -7.251 -4.971 3.253) 9.373 5.816 ( -1.623 -0.065 2.774) 3.214 6.495 ( -5.350 1.472 0.781) 5.604 6.905 ( -4.686 -6.106 -7.102) 10.472 7.301 ( -5.679 1.036 -6.877) 8.979 7.392 ( -9.703 3.497 8.929) 13.642 8.512 ( -5.100 2.493 7.151) 9.130 8.947 ( -5.944 -0.139 2.807) 6.575 9.442 ( 3.055 -1.655 7.599) 8.356 9.518 ( -3.832 -11.153 3.267) 12.237 10.546 ( 3.716 28.572 -4.417) 29.149 11.168 ( 5.682 9.137 6.709) 12.680 11.558 ( 8.571 3.449 -14.349) 17.066 12.186 ( 0.457 -3.909 -5.878) 7.074 12.407 ( -14.964 2.669 9.357) 17.849 12.672 ( 0.174 -6.987 -5.429) 8.850 13.149 ( 9.630 3.015 4.120) 10.900 13.875 ( 12.793 -17.007 -11.449) 24.166 17.197 ( -1.079 -3.885 7.027) 8.101 18.609 ( 0.721 -6.242 -13.006) 14.444 19.016 ( 7.253 8.361 5.420) 12.325 19.447 ( 11.098 0.324 3.367) 11.602 20.247 ( -2.737 4.339 -8.212) 9.682 22.578 ( -14.906 -17.109 2.888) 22.875 23.534 ( 8.258 10.893 -2.066) 13.825 24.264 ( 2.276 -5.485 7.927) 9.905 ======================= Grid point 432 (212/361) ======================= q-point: (-0.40 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( -19.104 16.998 7.703) 26.706 2.146 ( -16.667 10.251 15.862) 25.189 3.425 ( -3.940 -6.152 1.219) 7.406 3.547 ( -0.766 2.423 5.283) 5.863 3.685 ( -8.018 -3.925 4.790) 10.131 3.956 ( 4.978 2.899 5.539) 7.991 4.232 ( -8.470 -14.936 -4.267) 17.693 4.806 ( 3.478 -6.118 -0.363) 7.047 5.278 ( 4.847 -2.433 9.864) 11.257 5.358 ( -3.231 -3.535 -3.120) 5.716 5.633 ( 1.008 -3.748 7.862) 8.768 5.855 ( 1.316 -2.443 2.166) 3.521 6.451 ( -8.515 -3.311 7.705) 11.952 6.714 ( -15.427 -7.523 -9.028) 19.394 7.153 ( -3.551 -2.163 -7.022) 8.161 7.392 ( -2.783 0.311 5.737) 6.384 8.500 ( -2.323 11.464 9.943) 15.352 8.917 ( -7.620 -4.106 5.342) 10.172 9.577 ( 0.872 -0.875 2.781) 3.043 9.589 ( -2.219 -10.276 2.220) 10.744 10.291 ( 0.278 24.301 -2.188) 24.401 11.184 ( 4.359 14.967 1.932) 15.708 11.484 ( 7.372 0.840 -12.024) 14.129 12.102 ( -5.822 1.287 -3.442) 6.885 12.351 ( -8.130 -0.642 8.869) 12.048 12.671 ( 2.043 -5.698 -6.682) 9.016 13.201 ( 3.816 7.599 -1.284) 8.600 14.045 ( 10.670 -15.468 -13.497) 23.136 17.445 ( 7.025 -10.728 14.827) 19.603 18.513 ( 5.478 -4.678 -16.013) 17.559 19.037 ( 3.364 8.313 -0.574) 8.986 19.681 ( 18.539 3.604 2.940) 19.113 20.099 ( -6.175 2.844 -2.161) 7.134 22.552 ( -18.246 -21.430 3.421) 28.353 23.513 ( 7.450 9.710 -3.768) 12.805 24.345 ( -4.983 -2.560 0.740) 5.650 ======================= Grid point 433 (213/361) ======================= q-point: (-0.30 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( -10.058 17.548 16.370) 26.021 2.078 ( -13.123 8.577 21.096) 26.283 3.382 ( -8.974 -6.073 -3.852) 11.500 3.577 ( -7.608 1.804 15.410) 17.280 3.691 ( 1.033 -2.034 0.543) 2.345 4.046 ( 5.284 4.540 2.644) 7.451 4.262 ( -0.658 -17.121 -5.368) 17.955 4.893 ( 1.211 -5.494 -0.841) 5.688 5.269 ( -2.690 1.017 -4.178) 5.072 5.468 ( -0.081 0.792 12.916) 12.940 5.834 ( 8.898 -4.954 7.670) 12.749 5.946 ( -0.073 -6.823 3.905) 7.862 6.401 ( -17.759 -8.599 -2.806) 19.929 6.581 ( -2.963 -5.611 9.427) 11.363 7.038 ( -2.897 -1.845 -8.960) 9.596 7.421 ( -5.632 -4.383 5.587) 9.064 8.488 ( -2.839 16.979 15.676) 23.283 8.955 ( -5.345 -8.022 7.136) 11.994 9.514 ( -3.029 2.166 -7.171) 8.080 9.676 ( -2.030 -7.028 2.437) 7.710 10.094 ( -2.192 17.082 2.197) 17.362 11.077 ( 4.334 20.065 -2.924) 20.735 11.469 ( 6.458 -2.483 -8.787) 11.184 11.932 ( -8.331 2.542 -5.293) 10.192 12.367 ( -4.314 1.834 8.404) 9.622 12.689 ( 3.986 -3.456 -3.326) 6.237 13.135 ( 0.200 7.848 -1.536) 7.999 14.104 ( 7.255 -11.887 -17.349) 22.247 17.811 ( 8.182 -10.942 4.987) 14.545 18.548 ( 11.482 -12.113 -6.425) 17.884 18.984 ( 3.174 6.141 -3.458) 7.729 19.918 ( 0.105 -0.966 -4.465) 4.569 19.976 ( 12.620 12.932 6.403) 19.171 22.535 ( -20.907 -25.285 3.954) 33.047 23.488 ( 7.588 7.176 -5.127) 11.634 24.166 ( -13.539 5.023 -6.860) 15.987 ======================= Grid point 434 (214/361) ======================= q-point: (-0.20 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( 2.791 9.258 18.388) 20.776 2.150 ( -8.145 4.089 25.933) 27.488 3.242 ( -7.683 -4.652 -6.254) 10.945 3.665 ( -3.705 -1.596 11.138) 11.846 3.754 ( 3.545 -1.561 1.017) 4.005 4.079 ( 4.712 6.501 -0.491) 8.044 4.342 ( 1.387 -15.365 -8.171) 17.458 4.874 ( -1.565 0.922 -6.339) 6.594 5.235 ( 0.890 0.222 3.463) 3.583 5.554 ( -5.397 4.549 13.024) 14.814 5.969 ( -18.487 -8.245 9.534) 22.375 6.141 ( 15.078 -5.400 3.837) 16.469 6.307 ( 3.562 -4.277 -0.744) 5.615 6.769 ( -5.198 -9.066 15.836) 18.974 6.874 ( -3.927 -0.172 -11.483) 12.137 7.469 ( -9.779 -10.873 11.160) 18.396 8.502 ( -3.625 17.854 19.396) 26.611 9.049 ( -3.919 -8.274 4.765) 10.321 9.340 ( -0.492 8.295 -7.052) 10.898 9.731 ( -6.895 -13.647 1.763) 15.391 9.970 ( 0.045 14.260 3.734) 14.741 10.897 ( 3.833 22.701 -4.369) 23.434 11.447 ( 3.698 -1.296 -11.727) 12.364 11.735 ( -6.977 -1.042 -6.003) 9.263 12.400 ( -2.351 4.967 9.798) 11.234 12.762 ( 6.778 -1.588 -1.402) 7.101 13.050 ( -1.279 5.277 -1.255) 5.573 14.059 ( 4.463 -8.662 -18.088) 20.546 17.945 ( 7.800 -3.892 -7.705) 11.634 18.733 ( -8.271 -18.484 -2.988) 20.470 19.060 ( 20.641 1.236 -0.292) 20.680 19.700 ( -10.080 8.349 -3.810) 13.632 20.274 ( 23.074 7.231 7.457) 25.305 22.483 ( -24.133 -25.106 0.239) 34.825 23.478 ( 7.713 4.484 -5.852) 10.670 23.769 ( -16.278 12.679 -7.413) 21.925 ======================= Grid point 435 (215/361) ======================= q-point: (-0.10 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( 8.428 2.779 14.865) 17.312 2.408 ( -0.229 -0.945 27.537) 27.554 3.126 ( -1.954 -3.720 -7.487) 8.585 3.699 ( -0.206 -7.783 -9.295) 12.125 3.835 ( -2.390 4.053 10.766) 11.749 4.065 ( 5.890 4.726 -4.940) 9.024 4.354 ( -0.406 -10.942 -9.623) 14.577 4.694 ( -3.616 6.312 -10.900) 13.105 5.353 ( 1.146 -1.810 10.665) 10.878 5.577 ( -7.179 5.819 13.266) 16.168 5.927 ( -11.126 -0.429 14.992) 18.674 6.367 ( 5.164 -3.723 1.427) 6.524 6.458 ( 9.300 -3.821 -0.502) 10.067 6.683 ( -3.545 -2.087 -10.495) 11.272 6.921 ( -9.626 -3.669 17.122) 19.983 7.659 ( -9.048 -21.998 17.945) 29.796 8.515 ( -5.224 18.786 18.833) 27.109 9.080 ( -1.903 -5.018 -1.078) 5.474 9.215 ( 0.688 8.031 -3.172) 8.662 9.728 ( -9.936 -3.739 6.202) 12.295 10.006 ( 5.493 -4.771 1.420) 7.413 10.701 ( 4.531 23.261 -1.744) 23.763 11.311 ( 0.888 0.923 -14.200) 14.258 11.638 ( -0.232 -4.803 -7.380) 8.809 12.434 ( -2.684 6.115 8.976) 11.188 12.855 ( 7.944 -0.468 -2.400) 8.312 12.984 ( -1.358 2.584 -0.587) 2.978 13.966 ( 2.204 -5.764 -15.220) 16.424 17.988 ( 9.093 -1.849 -7.743) 12.086 18.632 ( -10.485 -9.189 -9.351) 16.787 19.224 ( -7.779 1.731 1.050) 8.038 19.548 ( 8.505 3.112 -2.215) 9.323 20.663 ( 22.968 2.779 11.568) 25.866 22.266 ( -26.190 -15.128 -8.604) 31.446 23.373 ( -8.620 10.241 -2.228) 13.570 23.529 ( 6.816 2.456 -4.820) 8.702 ======================= Grid point 438 (216/361) ======================= q-point: ( 0.20 -0.80 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.653 ( -2.067 0.000 -12.455) 12.625 2.911 ( -6.793 0.000 1.744) 7.014 3.310 ( -3.765 0.000 3.928) 5.441 3.328 ( -4.042 0.000 -4.111) 5.766 3.699 ( 11.341 -0.000 -13.340) 17.509 3.815 ( -0.214 0.000 10.234) 10.236 4.306 ( 9.074 -0.000 7.356) 11.681 4.622 ( -2.404 0.000 1.469) 2.817 5.092 ( -13.734 0.000 6.965) 15.399 5.277 ( -21.580 0.000 -0.572) 21.588 5.762 ( -7.385 0.000 -3.311) 8.094 5.894 ( -7.783 0.000 0.691) 7.813 6.685 ( 5.264 -0.000 -7.813) 9.421 6.762 ( 5.450 -0.000 1.444) 5.638 7.619 ( -6.230 0.000 -2.562) 6.736 7.717 ( -17.669 0.000 20.815) 27.303 8.392 ( -10.811 0.000 13.194) 17.058 9.131 ( 4.360 -0.000 -1.674) 4.670 9.277 ( -7.975 0.000 -11.599) 14.076 9.359 ( -3.736 0.000 9.023) 9.766 10.723 ( 9.752 -0.000 15.337) 18.175 11.247 ( 18.910 -0.000 -8.153) 20.593 11.701 ( 12.848 -0.000 -12.996) 18.275 11.804 ( 9.221 -0.000 7.886) 12.133 12.434 ( 10.064 -0.000 7.425) 12.507 12.768 ( -15.624 0.000 8.680) 17.873 12.773 ( -4.821 0.000 -6.843) 8.371 13.598 ( 7.367 -0.000 -14.675) 16.420 17.441 ( -9.817 0.000 -10.450) 14.337 18.520 ( 8.381 -0.000 7.220) 11.062 18.765 ( -3.309 0.000 3.379) 4.730 19.289 ( -9.547 0.000 3.845) 10.292 20.839 ( 1.710 -0.000 -23.081) 23.144 22.322 ( -0.713 0.000 13.797) 13.815 23.430 ( 10.349 -0.000 5.303) 11.629 23.877 ( 6.383 -0.000 0.880) 6.444 ======================= Grid point 440 (217/361) ======================= q-point: (-0.70 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( -3.553 0.861 -6.578) 7.526 2.797 ( -10.364 3.538 2.050) 11.142 3.213 ( -1.983 -1.098 -5.337) 5.798 3.336 ( -3.334 -4.100 4.954) 7.243 3.691 ( 2.868 -2.702 -8.189) 9.087 3.893 ( -2.705 3.631 9.966) 10.946 4.516 ( 5.221 3.046 5.767) 8.355 4.615 ( -1.496 -3.885 1.405) 4.394 4.927 ( -17.127 1.679 1.348) 17.262 5.122 ( -5.901 -6.965 6.691) 11.318 5.613 ( -9.454 -0.430 -1.205) 9.540 5.830 ( -4.444 -0.105 2.512) 5.106 6.628 ( 1.045 2.165 -6.940) 7.345 6.838 ( 2.150 -3.086 -1.421) 4.020 7.522 ( -1.961 4.405 -1.161) 4.960 7.589 ( -24.811 0.307 9.338) 26.512 8.434 ( -8.279 -2.141 13.653) 16.110 9.042 ( -2.687 -1.005 -10.602) 10.983 9.236 ( 4.104 -1.700 3.610) 5.724 9.398 ( -6.930 -0.584 9.528) 11.796 10.988 ( 7.126 3.052 9.514) 12.273 11.328 ( 15.737 17.050 -5.055) 23.747 11.680 ( 10.382 4.399 -12.853) 17.098 11.978 ( 3.740 -12.583 -2.141) 13.300 12.596 ( -8.371 1.793 0.013) 8.561 12.636 ( -11.265 -1.873 0.861) 11.452 12.815 ( 13.624 -3.075 15.045) 20.529 13.553 ( 10.475 -4.787 -16.309) 19.966 17.222 ( -8.189 -0.158 -4.322) 9.260 18.594 ( 1.681 -1.880 -7.132) 7.565 18.907 ( 7.308 1.490 14.323) 16.149 19.288 ( 1.762 -1.146 4.275) 4.764 20.569 ( -0.611 3.166 -20.352) 20.605 22.394 ( -9.412 -5.135 6.791) 12.691 23.640 ( 9.418 4.915 7.411) 12.953 23.983 ( 4.841 -3.067 2.812) 6.383 ======================= Grid point 441 (218/361) ======================= q-point: (-0.60 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( -6.648 4.654 2.489) 8.488 2.614 ( -13.601 10.025 5.603) 17.801 3.199 ( 0.240 -8.564 -2.772) 9.005 3.409 ( 1.568 -6.275 1.474) 6.634 3.643 ( -2.662 -4.751 -4.217) 6.888 3.934 ( -6.309 2.099 11.704) 13.460 4.366 ( -12.985 9.645 -1.209) 16.220 4.678 ( 1.406 -1.136 1.537) 2.373 4.925 ( -1.108 -12.781 5.590) 13.993 5.230 ( -0.843 -3.284 9.492) 10.080 5.512 ( -7.015 -1.966 3.296) 7.996 5.829 ( -0.066 0.937 2.940) 3.087 6.522 ( -4.236 1.423 -3.770) 5.847 6.798 ( -8.931 -5.259 -5.625) 11.792 7.304 ( -17.819 0.012 -0.553) 17.828 7.467 ( -2.488 3.643 0.629) 4.456 8.510 ( -5.899 -1.078 12.586) 13.942 8.939 ( -0.814 -2.243 -5.398) 5.902 9.359 ( -2.516 -2.041 7.839) 8.482 9.437 ( -1.194 -2.285 8.318) 8.708 11.014 ( 5.161 19.825 -3.551) 20.792 11.351 ( 9.501 12.936 4.194) 16.590 11.617 ( 8.208 3.567 -13.402) 16.116 12.077 ( 3.151 -9.242 -5.798) 11.356 12.453 ( -14.886 1.879 7.161) 16.625 12.546 ( -4.471 -6.193 -2.434) 8.017 13.179 ( 12.799 0.869 7.977) 15.106 13.601 ( 12.412 -12.502 -14.143) 22.591 17.143 ( -3.285 -2.106 4.100) 5.660 18.511 ( 1.653 -4.078 -13.789) 14.475 19.155 ( 8.225 6.204 11.217) 15.230 19.453 ( 13.514 0.280 4.413) 14.219 20.298 ( -4.033 1.573 -14.697) 15.322 22.340 ( -15.032 -9.258 3.091) 17.923 23.732 ( 5.576 10.974 2.776) 12.619 24.143 ( 2.188 -7.873 5.689) 9.956 ======================= Grid point 442 (219/361) ======================= q-point: (-0.50 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.272 ( -9.602 9.808 9.858) 16.899 2.387 ( -15.002 16.919 10.837) 25.075 3.257 ( -3.973 -10.995 0.239) 11.694 3.509 ( 4.153 -6.337 -2.538) 7.990 3.619 ( -3.540 -4.319 0.954) 5.665 3.935 ( -13.203 -9.711 5.090) 17.162 4.187 ( 2.988 13.548 3.752) 14.372 4.712 ( -1.354 -4.605 1.017) 4.906 5.094 ( -3.331 -12.708 6.748) 14.769 5.362 ( -0.616 -0.128 11.299) 11.316 5.555 ( -0.486 -3.672 7.922) 8.745 5.867 ( 2.975 2.208 1.554) 4.018 6.403 ( -13.560 -1.850 3.806) 14.205 6.569 ( -14.618 -8.281 -9.097) 19.105 7.127 ( -4.970 -0.987 -5.153) 7.227 7.412 ( -2.383 1.753 0.156) 2.962 8.589 ( -3.796 0.232 11.214) 11.841 8.899 ( -3.312 -0.049 0.932) 3.441 9.384 ( -10.293 -7.124 6.998) 14.341 9.596 ( 5.625 0.124 7.297) 9.215 10.778 ( 3.204 27.371 -7.547) 28.573 11.417 ( 5.960 9.708 4.206) 12.143 11.523 ( 7.033 4.717 -13.544) 15.973 12.093 ( 0.785 -2.978 -5.984) 6.730 12.351 ( -12.012 0.622 10.572) 16.013 12.551 ( 0.692 -7.282 -3.202) 7.985 13.308 ( 5.981 4.633 -2.137) 7.862 13.758 ( 10.396 -15.826 -10.411) 21.609 17.287 ( 3.892 -6.875 12.461) 14.754 18.396 ( 3.031 -6.564 -17.977) 19.376 19.245 ( 5.800 12.804 1.613) 14.149 19.732 ( 19.670 2.046 2.575) 19.943 20.110 ( -4.656 -1.435 -4.907) 6.916 22.242 ( -18.236 -13.166 3.393) 22.747 23.702 ( 3.806 11.290 -0.988) 11.955 24.258 ( -3.863 -6.974 2.335) 8.307 ======================= Grid point 443 (220/361) ======================= q-point: (-0.40 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( -10.516 19.116 13.288) 25.546 2.236 ( -11.853 10.820 17.065) 23.426 3.254 ( -8.380 -8.346 -1.871) 11.974 3.544 ( -3.317 -5.819 0.664) 6.731 3.659 ( 0.036 -2.187 4.759) 5.237 3.949 ( -1.697 -16.042 -3.270) 16.460 4.219 ( 6.959 13.589 6.068) 16.429 4.769 ( -0.872 -8.097 1.439) 8.269 5.198 ( -4.218 -8.024 3.566) 9.741 5.495 ( -2.385 1.592 16.068) 16.322 5.703 ( -3.206 -6.850 10.112) 12.627 5.907 ( 3.860 0.639 1.154) 4.079 6.259 ( -14.715 -7.366 2.109) 16.591 6.468 ( -3.757 -7.335 1.545) 8.385 7.011 ( -2.731 -0.975 -7.697) 8.226 7.373 ( -3.538 -1.107 0.238) 3.715 8.668 ( -2.414 1.891 10.391) 10.834 8.879 ( -6.381 0.517 8.560) 10.689 9.374 ( -10.963 -9.420 3.527) 14.879 9.714 ( 4.048 4.620 3.264) 6.956 10.487 ( 1.626 24.964 -6.049) 25.738 11.407 ( 7.198 12.325 -9.201) 16.981 11.445 ( 4.643 3.603 -2.388) 6.344 11.980 ( -5.458 2.531 -7.439) 9.567 12.373 ( -4.208 -1.086 9.969) 10.875 12.614 ( 3.933 -4.628 -0.236) 6.078 13.264 ( 0.831 6.172 -3.649) 7.218 13.865 ( 5.688 -14.290 -13.117) 20.214 17.623 ( 8.436 -9.801 12.414) 17.926 18.315 ( 4.325 -11.995 -15.338) 19.946 19.170 ( 5.308 12.793 -5.149) 14.776 19.875 ( -2.301 -3.823 -3.701) 5.797 20.173 ( 18.799 8.830 5.592) 21.509 22.159 ( -19.835 -16.676 4.840) 26.362 23.634 ( 3.655 9.043 -3.422) 10.337 24.188 ( -10.672 -2.059 -4.028) 11.591 ======================= Grid point 444 (221/361) ======================= q-point: (-0.30 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( -2.837 13.289 14.051) 19.547 2.243 ( -9.084 7.252 22.241) 25.095 3.146 ( -8.588 -6.068 -4.952) 11.623 3.569 ( -1.402 -7.232 -2.221) 7.694 3.761 ( 1.947 -0.699 7.483) 7.764 4.053 ( 2.451 -15.542 -5.953) 16.823 4.244 ( 4.683 11.599 2.893) 12.839 4.826 ( -0.465 -6.188 -3.209) 6.986 5.239 ( -0.893 -0.508 5.585) 5.678 5.628 ( -5.636 3.142 17.347) 18.508 5.787 ( -13.594 -9.832 13.868) 21.767 6.052 ( 9.261 -5.019 2.943) 10.937 6.238 ( 1.153 -3.757 1.713) 4.287 6.581 ( -4.148 -11.438 11.049) 16.436 6.868 ( -3.781 -0.355 -9.859) 10.565 7.337 ( -6.883 -4.135 2.397) 8.379 8.731 ( -2.788 5.791 11.943) 13.563 8.927 ( -7.809 -3.337 12.329) 14.971 9.339 ( -6.610 -7.475 -0.441) 9.988 9.700 ( 0.899 8.561 0.185) 8.610 10.262 ( 0.526 18.259 -2.192) 18.398 11.272 ( 6.349 17.111 -7.580) 19.762 11.429 ( 4.965 1.261 -8.159) 9.634 11.749 ( -8.686 2.498 -8.869) 12.663 12.456 ( -1.305 0.705 9.162) 9.281 12.734 ( 7.072 -0.998 2.568) 7.589 13.157 ( -2.385 6.172 -2.461) 7.060 13.867 ( 2.659 -12.449 -15.085) 19.738 17.869 ( 8.292 -4.336 -2.530) 9.694 18.398 ( -0.526 -18.290 -1.113) 18.331 19.118 ( 10.834 4.701 -6.476) 13.469 19.759 ( -8.459 -0.769 -4.460) 9.594 20.462 ( 23.250 12.722 7.519) 27.549 22.093 ( -20.028 -18.365 3.531) 27.402 23.572 ( 4.385 5.973 -4.834) 8.847 23.921 ( -14.338 4.645 -7.731) 16.939 ======================= Grid point 445 (222/361) ======================= q-point: (-0.20 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( 4.254 5.094 13.165) 14.743 2.409 ( -1.586 1.892 24.300) 24.425 3.044 ( -2.801 -5.161 -6.056) 8.435 3.551 ( -2.284 -8.467 -8.239) 12.033 3.865 ( -0.267 -2.279 2.531) 3.416 4.093 ( 0.134 -5.993 -6.808) 9.071 4.250 ( 5.367 4.522 0.295) 7.024 4.762 ( -1.660 1.145 -8.477) 8.714 5.345 ( 0.916 0.722 11.535) 11.593 5.686 ( -6.590 6.238 13.831) 16.542 5.901 ( -8.085 -2.889 20.062) 21.822 6.257 ( 6.272 -9.469 1.796) 11.498 6.367 ( 5.605 -4.524 3.191) 7.878 6.659 ( -5.573 -1.198 -9.368) 10.966 6.806 ( -4.367 -9.650 13.866) 17.449 7.341 ( -9.344 -12.058 6.893) 16.740 8.776 ( -4.599 9.451 14.940) 18.267 8.973 ( -8.054 -5.394 7.397) 12.193 9.319 ( -1.147 -0.819 -1.849) 2.324 9.659 ( -0.175 3.569 3.218) 4.809 10.115 ( 0.517 12.119 -0.150) 12.131 11.094 ( 2.762 19.800 -5.081) 20.627 11.342 ( 3.499 3.212 -13.740) 14.538 11.559 ( -1.678 -3.209 -8.155) 8.923 12.530 ( -1.325 3.183 8.460) 9.136 12.855 ( 4.862 1.469 2.166) 5.522 13.053 ( -0.438 4.774 -2.099) 5.233 13.819 ( 1.224 -10.522 -13.683) 17.304 17.945 ( 8.347 -2.801 -6.584) 10.994 18.460 ( -7.600 -9.569 -1.110) 12.270 19.201 ( 3.599 -4.068 -4.296) 6.925 19.605 ( -0.027 2.334 -5.040) 5.554 20.764 ( 17.379 8.924 11.904) 22.878 21.991 ( -16.549 -14.439 -2.956) 22.161 23.520 ( -1.050 5.430 -4.993) 7.451 23.604 ( -5.051 5.801 -6.097) 9.815 ======================= Grid point 446 (223/361) ======================= q-point: (-0.10 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( 8.310 0.075 12.175) 14.741 2.701 ( 3.954 -2.509 17.629) 18.240 3.035 ( 3.931 -3.986 -2.042) 5.959 3.475 ( -2.907 -8.881 -10.085) 13.748 3.802 ( -2.873 -1.210 -10.408) 10.865 4.049 ( -3.224 -1.493 -3.470) 4.966 4.298 ( 4.089 2.241 0.081) 4.664 4.597 ( -1.078 6.474 -7.205) 9.746 5.487 ( -2.664 1.232 13.442) 13.759 5.683 ( -9.045 5.802 12.844) 16.746 6.012 ( -2.456 1.994 7.191) 7.857 6.354 ( -5.336 -0.650 -2.225) 5.817 6.508 ( 4.720 -3.479 0.373) 5.875 6.553 ( 3.351 -5.513 -1.575) 6.641 6.994 ( -7.262 -4.827 21.749) 23.432 7.487 ( -8.309 -25.090 9.033) 27.932 8.772 ( -9.179 14.072 16.144) 23.300 9.009 ( -2.858 -5.993 3.131) 7.341 9.238 ( -1.957 4.632 -3.262) 5.994 9.714 ( 1.406 -1.214 5.479) 5.785 10.087 ( 3.173 5.210 2.711) 6.675 10.892 ( -2.834 10.680 -3.659) 11.640 11.217 ( 8.854 7.035 -9.769) 14.944 11.542 ( 8.210 -4.259 -10.026) 13.640 12.544 ( -3.020 7.131 5.679) 9.603 12.876 ( -4.657 -2.351 2.841) 5.940 13.028 ( 6.849 5.664 -3.929) 9.717 13.773 ( 1.359 -7.572 -10.281) 12.841 18.018 ( 7.328 -2.626 -3.430) 8.507 18.347 ( -7.111 -2.192 -9.012) 11.687 19.080 ( -12.801 1.624 -0.714) 12.923 19.631 ( 4.845 -0.616 -1.880) 5.234 21.063 ( 5.812 -4.117 12.850) 14.691 21.833 ( -3.143 -0.825 -9.053) 9.619 23.318 ( -5.530 6.516 -2.281) 8.845 23.588 ( 7.296 0.268 -3.962) 8.307 ======================= Grid point 450 (224/361) ======================= q-point: ( 0.30 -0.70 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.421 ( -1.106 0.000 0.140) 1.115 2.715 ( -10.570 0.000 5.616) 11.969 3.116 ( -1.891 0.000 -3.488) 3.968 3.337 ( -1.184 0.000 3.352) 3.555 3.595 ( -1.689 0.000 -4.980) 5.259 3.939 ( -11.963 0.000 9.837) 15.488 4.566 ( 0.930 -0.000 -3.193) 3.326 4.621 ( -12.426 0.000 -0.150) 12.427 4.762 ( 2.136 -0.000 9.595) 9.830 5.201 ( -2.608 0.000 14.056) 14.296 5.495 ( -6.357 0.000 2.132) 6.705 5.839 ( 0.504 -0.000 3.140) 3.180 6.537 ( -2.420 0.000 -7.505) 7.886 6.746 ( -11.982 0.000 -2.905) 12.329 7.305 ( -20.831 0.000 1.499) 20.885 7.501 ( -0.811 0.000 -2.933) 3.043 8.500 ( -7.183 0.000 15.385) 16.979 8.904 ( 0.944 -0.000 -8.105) 8.160 9.381 ( 7.440 -0.000 6.821) 10.093 9.390 ( -11.164 0.000 10.616) 15.406 11.173 ( 5.327 -0.000 2.924) 6.077 11.521 ( 10.733 -0.000 -8.397) 13.628 11.730 ( 15.364 -0.000 -13.660) 20.558 11.889 ( -3.236 0.000 0.917) 3.364 12.465 ( -5.278 0.000 -2.885) 6.015 12.492 ( -15.752 0.000 7.774) 17.566 13.188 ( 14.575 -0.000 11.425) 18.519 13.481 ( 11.885 -0.000 -17.562) 21.205 17.124 ( -3.969 0.000 3.082) 5.025 18.474 ( 1.838 -0.000 -14.298) 14.416 19.213 ( 8.481 -0.000 14.481) 16.782 19.455 ( 14.519 -0.000 4.743) 15.274 20.311 ( -4.460 0.000 -18.105) 18.646 22.257 ( -14.884 0.000 3.395) 15.266 23.871 ( 3.754 -0.000 9.139) 9.880 24.032 ( 2.954 -0.000 0.211) 2.961 ======================= Grid point 452 (225/361) ======================= q-point: (-0.60 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.419 ( -4.179 5.903 7.997) 10.782 2.640 ( -8.296 8.766 9.984) 15.663 3.091 ( -3.703 -5.602 0.538) 6.737 3.373 ( -2.482 -6.777 0.332) 7.224 3.548 ( 1.684 -2.626 -4.612) 5.568 3.812 ( -15.217 -3.279 3.330) 15.919 4.445 ( 2.146 12.623 2.165) 12.986 4.626 ( -4.549 -5.951 3.868) 8.431 4.924 ( -0.163 -5.163 8.720) 10.135 5.320 ( -10.991 -2.935 20.045) 23.048 5.527 ( 4.202 -0.077 4.651) 6.268 5.902 ( 4.059 1.251 2.151) 4.761 6.391 ( -13.623 0.752 -1.908) 13.776 6.445 ( -18.171 -5.097 -5.938) 19.785 7.113 ( -6.328 -0.480 -3.632) 7.312 7.440 ( -0.045 1.003 -4.965) 5.066 8.581 ( -7.549 -0.324 14.426) 16.285 8.867 ( 1.599 -2.305 -3.646) 4.600 9.342 ( -13.347 0.471 11.052) 17.335 9.590 ( 7.490 -0.489 8.689) 11.481 11.157 ( 4.125 12.233 -8.469) 15.440 11.495 ( 4.691 1.275 -9.920) 11.048 11.700 ( 7.367 14.163 -2.257) 16.123 11.962 ( 4.696 -12.401 -5.771) 14.462 12.373 ( -12.791 1.890 9.130) 15.829 12.441 ( -1.491 -4.465 1.660) 4.991 13.387 ( 8.376 5.066 -4.566) 10.801 13.519 ( 9.850 -10.464 -6.842) 15.917 17.205 ( 2.590 -2.350 10.637) 11.197 18.312 ( 2.449 -2.500 -19.036) 19.354 19.432 ( 6.109 6.671 7.645) 11.844 19.752 ( 17.720 0.243 0.993) 17.750 20.070 ( -1.101 -2.027 -9.911) 10.176 22.088 ( -17.620 -4.294 3.724) 18.514 23.902 ( -0.313 10.624 2.542) 10.928 24.109 ( -1.498 -9.163 0.953) 9.334 ======================= Grid point 453 (226/361) ======================= q-point: (-0.50 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( -8.939 10.105 11.596) 17.790 2.540 ( -7.640 19.371 12.240) 24.154 3.095 ( -7.083 -8.704 0.548) 11.235 3.370 ( -9.073 -13.730 0.072) 16.458 3.579 ( 4.891 -5.947 -4.481) 8.909 3.770 ( -0.964 -3.403 2.960) 4.612 4.456 ( 9.408 8.741 -0.103) 12.842 4.646 ( -7.948 -2.518 7.911) 11.493 5.062 ( -2.268 -5.849 10.013) 11.816 5.454 ( -12.575 -6.089 21.847) 25.932 5.653 ( 2.097 0.907 7.117) 7.475 5.946 ( 0.873 3.330 1.128) 3.622 6.138 ( -13.948 -6.291 2.469) 15.499 6.339 ( -4.468 -6.278 -1.349) 7.823 6.998 ( -2.782 -0.578 -7.019) 7.572 7.374 ( 0.421 0.774 -5.092) 5.168 8.642 ( -7.953 -1.972 12.567) 15.002 8.885 ( -0.199 -1.582 1.997) 2.556 9.285 ( -13.816 -0.965 10.612) 17.448 9.775 ( 5.614 2.239 7.120) 9.340 10.908 ( 2.241 20.201 -13.503) 24.402 11.419 ( 4.895 -0.457 -12.404) 13.343 11.665 ( 1.059 10.367 3.316) 10.936 12.003 ( 5.068 -0.979 -11.647) 12.739 12.338 ( -8.459 -1.828 11.346) 14.270 12.540 ( 4.730 -3.407 4.729) 7.507 13.350 ( 4.039 3.638 -7.752) 9.468 13.631 ( 2.876 -10.995 -6.777) 13.233 17.481 ( 8.303 -5.796 14.942) 18.050 18.151 ( 3.081 -6.286 -19.333) 20.562 19.404 ( 1.338 12.959 -5.314) 14.070 19.778 ( -5.302 -7.186 -4.621) 10.054 20.287 ( 27.181 4.082 4.485) 27.849 21.945 ( -18.435 -7.698 5.358) 20.684 23.800 ( -1.082 9.470 -1.709) 9.683 24.110 ( -7.530 -6.335 -2.760) 10.220 ======================= Grid point 454 (227/361) ======================= q-point: (-0.40 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( -9.215 11.014 10.959) 18.064 2.446 ( -4.823 15.830 15.178) 22.455 3.032 ( -9.029 -6.603 -2.577) 11.479 3.406 ( -4.306 -12.086 -0.450) 12.838 3.667 ( 5.630 -9.688 -5.362) 12.422 3.867 ( 1.089 -3.756 6.445) 7.538 4.471 ( 5.560 12.586 -1.369) 13.828 4.676 ( -1.278 -9.343 0.342) 9.437 5.210 ( -1.109 -2.382 12.033) 12.317 5.578 ( -14.478 -7.864 21.914) 27.417 5.734 ( -3.343 3.035 12.745) 13.521 5.983 ( 3.143 -2.423 3.066) 5.015 6.164 ( 0.988 -4.272 4.030) 5.956 6.383 ( -3.555 -10.288 5.427) 12.162 6.863 ( -3.636 -0.340 -9.161) 9.862 7.311 ( -1.039 0.604 -3.906) 4.087 8.705 ( -7.611 -4.504 11.264) 14.321 8.936 ( -3.009 0.577 9.072) 9.576 9.236 ( -10.825 -2.718 7.583) 13.493 9.857 ( 3.051 7.359 3.356) 8.644 10.597 ( 0.757 18.379 -11.510) 21.699 11.357 ( 7.253 -0.839 -12.767) 14.708 11.596 ( -3.313 9.273 1.756) 10.002 11.837 ( 0.342 8.220 -14.519) 16.688 12.420 ( -3.054 -4.312 8.870) 10.325 12.734 ( 9.651 0.591 7.612) 12.306 13.254 ( -1.951 4.591 -4.260) 6.560 13.642 ( -0.276 -12.150 -10.666) 16.169 17.801 ( 9.191 -3.105 4.664) 10.764 18.111 ( 3.546 -13.384 -4.924) 14.695 19.216 ( 0.203 5.996 -9.957) 11.625 19.709 ( -5.572 -4.122 -3.566) 7.794 20.679 ( 28.012 10.655 5.632) 30.494 21.836 ( -17.540 -10.639 4.573) 21.018 23.683 ( -0.378 6.380 -3.824) 7.448 23.949 ( -11.246 -1.008 -6.835) 13.199 ======================= Grid point 455 (228/361) ======================= q-point: (-0.30 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 0.172 7.060 11.029) 13.096 2.492 ( -2.345 7.391 17.924) 19.529 2.953 ( -3.039 -4.907 -3.394) 6.696 3.399 ( -4.706 -8.797 -5.722) 11.501 3.751 ( 4.024 -9.141 -7.192) 12.308 3.975 ( -3.934 -5.441 5.714) 8.817 4.394 ( 4.225 8.812 -3.761) 10.471 4.736 ( 4.156 -3.700 -6.032) 8.207 5.360 ( -0.637 0.398 13.899) 13.919 5.793 ( -7.185 2.651 21.691) 23.003 5.814 ( -2.113 -4.094 18.753) 19.311 6.087 ( 0.744 -7.392 0.832) 7.476 6.300 ( 3.297 -3.696 6.588) 8.242 6.536 ( -2.685 -13.086 7.428) 15.285 6.690 ( -5.279 -1.286 -7.505) 9.265 7.242 ( -3.809 -0.424 -1.576) 4.144 8.781 ( -6.911 -5.884 10.663) 14.003 8.978 ( -9.185 3.600 13.753) 16.925 9.234 ( -3.172 -5.207 2.612) 6.633 9.829 ( 2.166 11.475 1.770) 11.811 10.349 ( -0.292 13.092 -6.918) 14.810 11.295 ( 1.383 3.006 -10.699) 11.199 11.465 ( -1.742 5.548 -3.341) 6.707 11.591 ( 5.208 11.356 -14.849) 19.406 12.519 ( -2.197 -3.912 7.485) 8.727 12.922 ( 5.099 5.456 6.705) 10.036 13.139 ( -0.898 4.629 -1.604) 4.980 13.608 ( -0.463 -12.713 -11.403) 17.084 17.897 ( 7.328 -2.434 -5.534) 9.500 18.298 ( -0.341 -8.686 6.288) 10.728 19.110 ( 0.711 -5.159 -8.396) 9.880 19.620 ( -0.575 -0.358 -5.669) 5.709 20.968 ( 14.208 13.239 9.295) 21.530 21.770 ( -7.466 -10.625 -0.717) 13.006 23.593 ( -0.242 3.339 -4.023) 5.234 23.691 ( -9.100 3.354 -7.879) 12.496 ======================= Grid point 456 (229/361) ======================= q-point: (-0.20 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( 2.591 2.060 12.101) 12.545 2.677 ( 5.737 -0.214 13.147) 14.346 2.975 ( 4.274 -2.467 0.684) 4.982 3.319 ( -4.211 -8.205 -8.615) 12.620 3.745 ( 2.246 -4.358 -10.955) 12.002 3.970 ( -10.709 -6.989 1.925) 12.932 4.379 ( 7.759 5.485 -2.919) 9.940 4.693 ( 2.434 4.317 -7.325) 8.844 5.513 ( -1.531 0.506 13.694) 13.789 5.801 ( -9.839 7.896 13.572) 18.530 6.047 ( -2.243 1.617 5.411) 6.076 6.255 ( 1.568 -12.595 10.696) 16.598 6.412 ( -0.990 -2.741 1.270) 3.179 6.504 ( 0.997 -2.005 -1.785) 2.864 6.832 ( -1.868 -15.103 15.451) 21.687 7.188 ( -6.331 -5.830 1.057) 8.671 8.876 ( -5.879 -6.769 10.466) 13.781 8.957 ( -9.894 5.837 12.945) 17.307 9.251 ( -3.402 -2.617 -0.683) 4.346 9.797 ( 2.883 9.235 2.932) 10.109 10.208 ( 2.338 7.329 -1.965) 7.940 11.032 ( -12.808 6.449 -8.655) 16.750 11.410 ( 11.624 10.653 -6.839) 17.186 11.496 ( 11.858 1.741 -11.404) 16.543 12.601 ( -2.341 -1.741 6.690) 7.298 12.874 ( -9.488 2.802 2.471) 10.197 13.148 ( 7.234 7.389 -1.530) 10.453 13.608 ( 2.880 -10.442 -7.730) 13.307 17.972 ( 5.820 -2.306 -0.812) 6.312 18.321 ( -4.155 -0.805 -3.535) 5.514 19.053 ( -6.995 -4.926 -3.916) 9.409 19.613 ( 6.815 -1.361 -4.419) 8.235 21.027 ( -10.855 0.628 7.930) 13.457 21.841 ( 14.776 1.518 -2.637) 15.086 23.425 ( -6.858 5.100 -4.540) 9.678 23.591 ( 4.111 0.019 -4.047) 5.769 ======================= Grid point 457 (230/361) ======================= q-point: (-0.10 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( -2.938 -4.748 10.611) 11.990 2.915 ( 14.434 1.597 1.621) 14.613 3.129 ( 6.535 -2.908 6.093) 9.396 3.258 ( -1.769 -9.198 -4.825) 10.536 3.649 ( 0.843 0.830 -9.962) 10.032 3.867 ( -9.969 -5.850 -3.455) 12.064 4.390 ( 6.334 7.217 -4.872) 10.768 4.613 ( 1.425 4.340 -0.450) 4.590 5.597 ( -7.512 4.071 11.132) 14.034 5.683 ( -16.190 5.015 6.633) 18.200 5.985 ( -4.383 0.177 -3.019) 5.325 6.208 ( -7.521 0.014 -3.434) 8.268 6.562 ( 3.327 -1.582 -0.266) 3.693 6.632 ( 7.391 -1.623 6.581) 10.028 7.160 ( -1.726 -10.057 24.858) 26.871 7.244 ( -5.137 -19.455 2.908) 20.331 8.879 ( -13.881 8.683 10.108) 19.242 8.984 ( -3.579 -4.159 8.984) 10.527 9.190 ( -2.279 -0.691 -0.424) 2.419 9.798 ( 1.792 4.709 -0.426) 5.057 10.259 ( 7.051 2.214 5.398) 9.152 10.719 ( -9.616 0.188 -7.583) 12.248 11.470 ( 17.167 10.368 -0.895) 20.075 11.546 ( 14.227 -0.708 -10.805) 17.879 12.608 ( -3.379 6.216 2.710) 7.576 12.784 ( -10.208 -5.213 5.628) 12.769 13.107 ( 1.784 6.068 -5.205) 8.191 13.670 ( 7.019 -3.620 -5.634) 9.701 18.020 ( -4.019 -0.237 -4.942) 6.374 18.192 ( 2.133 0.609 -4.690) 5.188 18.937 ( -7.405 1.027 0.395) 7.486 19.639 ( -2.698 1.645 0.573) 3.211 20.924 ( -12.056 -13.602 -4.989) 18.848 22.053 ( 20.527 11.995 5.359) 24.372 23.284 ( -1.248 3.252 -2.928) 4.550 23.641 ( 6.096 -1.867 -1.363) 6.520 ======================= Grid point 462 (231/361) ======================= q-point: ( 0.40 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( -7.092 0.000 9.477) 11.837 2.762 ( -0.436 0.000 12.283) 12.291 3.016 ( -8.170 0.000 3.644) 8.946 3.169 ( -16.062 0.000 -2.484) 16.253 3.521 ( 6.049 -0.000 -7.398) 9.556 3.752 ( 0.463 -0.000 5.075) 5.096 4.479 ( 0.755 -0.000 -2.118) 2.248 4.690 ( -0.469 0.000 7.725) 7.739 5.009 ( -1.636 0.000 12.050) 12.161 5.378 ( -15.597 0.000 23.909) 28.546 5.670 ( 2.708 -0.000 8.241) 8.675 6.001 ( 5.635 -0.000 1.436) 5.815 6.056 ( -19.855 0.000 2.170) 19.973 6.278 ( -4.838 0.000 -2.556) 5.472 6.992 ( -3.027 0.000 -6.526) 7.193 7.384 ( 2.550 -0.000 -7.551) 7.970 8.625 ( -10.661 0.000 14.401) 17.918 8.860 ( 2.117 -0.000 0.005) 2.117 9.286 ( -14.402 0.000 11.690) 18.549 9.795 ( 6.062 -0.000 8.719) 10.619 11.109 ( 2.975 -0.000 -17.394) 17.647 11.414 ( 4.197 -0.000 -12.366) 13.059 11.778 ( -9.878 0.000 5.058) 11.097 11.958 ( 18.281 -0.000 -11.854) 21.788 12.330 ( -11.813 0.000 11.162) 16.252 12.504 ( 6.037 -0.000 6.538) 8.899 13.391 ( 10.019 -0.000 -15.752) 18.668 13.518 ( -2.683 0.000 2.172) 3.452 17.428 ( 8.250 -0.000 15.176) 17.273 18.095 ( 2.829 -0.000 -20.286) 20.482 19.598 ( 2.955 -0.000 2.730) 4.023 19.637 ( -9.900 0.000 -13.004) 16.343 20.322 ( 30.704 -0.000 3.882) 30.949 21.878 ( -17.945 0.000 5.630) 18.807 23.940 ( -7.898 0.000 2.104) 8.174 23.998 ( -1.420 0.000 -5.551) 5.730 ======================= Grid point 464 (232/361) ======================= q-point: (-0.50 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.439 ( -9.036 6.230 7.687) 13.400 2.765 ( -5.084 18.737 8.445) 21.172 2.929 ( -8.405 -3.699 0.075) 9.183 3.125 ( -4.015 -18.587 3.239) 19.289 3.536 ( 6.066 -3.779 -6.818) 9.877 3.844 ( -0.890 -0.233 8.180) 8.231 4.528 ( 5.230 -4.293 -0.376) 6.776 4.662 ( -1.281 5.754 -4.220) 7.249 5.175 ( -1.692 -1.034 17.152) 17.267 5.457 ( -13.585 -4.468 20.971) 25.383 5.789 ( -4.452 2.131 16.860) 17.567 5.962 ( -2.246 -0.304 4.924) 5.421 6.104 ( 3.988 -2.012 2.768) 5.255 6.243 ( -2.575 -4.627 2.309) 5.777 6.856 ( -3.945 -0.279 -8.607) 9.472 7.331 ( 3.730 0.974 -8.091) 8.963 8.644 ( -12.626 -1.919 15.021) 19.716 8.921 ( 2.125 -1.074 4.054) 4.701 9.226 ( -13.412 0.378 10.900) 17.287 9.944 ( 3.444 2.442 6.475) 7.730 10.855 ( 1.039 8.768 -20.446) 22.271 11.341 ( 6.435 -0.656 -12.050) 13.677 11.676 ( -10.501 1.450 2.866) 10.981 11.988 ( 11.439 5.872 -15.561) 20.186 12.341 ( -8.019 -3.232 11.899) 14.708 12.740 ( 12.805 0.008 9.285) 15.817 13.321 ( 3.083 2.907 -9.405) 10.316 13.468 ( -6.871 -6.415 -3.171) 9.921 17.765 ( 10.756 -0.978 14.155) 17.805 17.943 ( 4.130 -5.049 -13.241) 14.761 19.309 ( -9.922 3.578 -11.903) 15.904 19.638 ( -0.180 -2.917 -2.839) 4.074 20.814 ( 33.941 4.121 4.090) 34.434 21.711 ( -18.066 -3.508 5.119) 19.102 23.790 ( -6.266 5.162 -2.580) 8.519 23.902 ( -6.548 -3.570 -6.781) 10.080 ======================= Grid point 465 (233/361) ======================= q-point: (-0.40 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.393 ( -0.126 7.044 7.801) 10.511 2.652 ( -7.508 9.719 9.596) 15.586 2.879 ( -1.155 -3.043 -0.464) 3.288 3.235 ( -3.132 -9.554 -1.156) 10.121 3.602 ( 7.367 -6.501 -5.834) 11.427 3.894 ( -10.014 -3.806 8.331) 13.571 4.525 ( 2.170 5.577 -7.878) 9.893 4.656 ( 9.576 -4.423 -4.070) 11.307 5.353 ( -2.932 -0.889 15.696) 15.993 5.652 ( -2.516 -7.919 22.325) 23.821 5.910 ( -4.961 5.569 18.209) 19.677 6.016 ( -1.842 -1.390 5.430) 5.900 6.231 ( 2.154 -3.750 7.511) 8.667 6.331 ( -0.249 -8.668 4.868) 9.945 6.680 ( -6.078 -0.371 -9.267) 11.088 7.270 ( 2.718 2.315 -7.248) 8.079 8.681 ( -13.303 -4.513 16.574) 21.726 9.013 ( -1.269 0.355 7.981) 8.089 9.178 ( -8.645 -1.193 7.111) 11.257 9.997 ( 1.633 6.689 3.329) 7.648 10.550 ( -0.339 8.712 -16.652) 18.796 11.312 ( 7.424 -0.009 -10.925) 13.208 11.517 ( -10.478 2.366 -1.378) 10.830 11.843 ( 9.705 12.590 -16.434) 22.864 12.426 ( -5.118 -5.578 9.829) 12.406 13.017 ( 9.243 4.543 7.861) 12.956 13.209 ( -2.334 3.153 -0.500) 3.954 13.394 ( -3.582 -10.451 -8.645) 14.028 17.864 ( 6.198 -1.144 -5.458) 8.337 18.162 ( 7.081 -6.085 12.009) 15.212 19.040 ( -7.327 -2.543 -10.818) 13.311 19.605 ( 1.612 -0.947 -5.963) 6.249 21.205 ( 16.087 12.687 5.806) 21.294 21.601 ( -3.245 -8.901 0.408) 9.483 23.644 ( -4.722 2.328 -3.253) 6.188 23.723 ( -6.992 0.488 -8.227) 10.808 ======================= Grid point 466 (234/361) ======================= q-point: (-0.30 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.463 ( -0.574 6.219 9.426) 11.307 2.679 ( 4.744 -0.032 9.341) 10.477 2.942 ( 4.082 -1.935 2.971) 5.407 3.205 ( -1.097 -3.934 -6.419) 7.608 3.672 ( 6.000 -3.385 -6.865) 9.725 3.824 ( -17.120 -8.585 4.003) 19.566 4.467 ( 8.004 4.353 -6.711) 11.316 4.738 ( 7.732 0.331 -6.587) 10.162 5.489 ( -4.496 -2.843 12.988) 14.035 5.955 ( -5.307 -1.420 6.432) 8.458 5.966 ( -6.107 -2.219 13.493) 14.976 6.107 ( 3.833 0.368 17.569) 17.986 6.375 ( -2.129 -2.607 4.996) 6.025 6.450 ( 0.858 -5.189 -0.627) 5.297 6.573 ( -2.021 -10.047 6.761) 12.277 7.192 ( 0.570 3.195 -5.204) 6.133 8.750 ( -13.577 -6.416 17.844) 23.322 9.039 ( -6.919 3.413 9.878) 12.534 9.192 ( -2.144 -3.366 2.286) 4.599 9.968 ( 1.106 8.779 1.219) 8.932 10.314 ( -0.853 4.170 -11.033) 11.826 11.163 ( -9.883 8.428 -5.782) 14.218 11.435 ( 9.042 -1.322 -8.419) 12.425 11.700 ( 12.965 13.115 -12.872) 22.490 12.520 ( -4.592 -5.861 8.457) 11.268 12.943 ( -12.153 4.013 1.807) 12.926 13.252 ( 1.557 1.891 -3.913) 4.617 13.439 ( 9.854 -6.252 0.573) 11.685 17.940 ( 5.640 -1.246 1.915) 6.085 18.315 ( -2.011 0.039 0.320) 2.037 18.929 ( -2.571 -7.760 -3.761) 8.999 19.589 ( 6.704 -1.246 -6.854) 9.668 21.076 ( -19.721 4.054 0.764) 20.148 21.877 ( 27.367 2.210 1.709) 27.509 23.495 ( -7.157 2.898 -4.633) 9.005 23.587 ( 0.311 -0.514 -4.482) 4.522 ======================= Grid point 467 (235/361) ======================= q-point: (-0.20 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( -9.572 -1.189 11.877) 15.301 2.944 ( 17.817 1.498 3.735) 18.266 3.076 ( 2.142 -5.055 6.304) 8.360 3.158 ( 4.682 0.346 -6.953) 8.390 3.648 ( 2.652 -1.843 -9.759) 10.279 3.724 ( -12.939 -8.575 2.695) 15.754 4.482 ( 7.941 3.351 -4.652) 9.795 4.707 ( 3.381 5.595 -5.679) 8.660 5.575 ( -7.749 -4.481 8.648) 12.446 5.826 ( -14.132 5.473 1.121) 15.196 5.981 ( -6.441 1.376 6.158) 9.017 6.193 ( -7.229 -1.290 -1.555) 7.506 6.496 ( 3.370 -4.270 7.051) 8.905 6.601 ( 7.478 -3.794 7.447) 11.215 6.850 ( 2.738 -14.948 11.427) 19.014 7.146 ( 0.469 0.310 3.922) 3.962 8.831 ( -13.634 -7.201 15.964) 22.194 9.036 ( -6.606 4.266 10.748) 13.317 9.180 ( -3.536 -0.488 -0.291) 3.582 9.917 ( 1.380 7.496 -0.677) 7.652 10.209 ( 0.702 -5.346 -6.578) 8.505 10.857 ( -10.460 12.811 -2.341) 16.704 11.501 ( 14.285 -1.270 -11.469) 18.364 11.691 ( 16.829 10.792 -4.642) 20.524 12.602 ( -5.762 -5.927 8.186) 11.633 12.768 ( -10.807 3.020 1.803) 11.365 13.162 ( -3.195 -0.938 -6.440) 7.250 13.646 ( 13.184 1.637 1.034) 13.325 18.030 ( -2.147 1.369 -0.517) 2.598 18.192 ( -1.353 -0.685 -4.976) 5.202 18.942 ( -1.058 -0.476 1.188) 1.660 19.643 ( 5.165 -1.367 -2.619) 5.951 20.752 ( -19.533 -5.518 -6.761) 21.394 22.246 ( 26.236 9.528 5.220) 28.397 23.339 ( -3.194 3.003 -4.148) 6.036 23.598 ( 3.014 -2.923 -0.408) 4.218 ======================= Grid point 468 (236/361) ======================= q-point: (-0.10 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( -13.486 -5.829 12.363) 19.201 3.052 ( 1.391 1.969 -6.424) 6.862 3.179 ( 1.973 -6.944 0.879) 7.272 3.291 ( 12.685 0.701 2.652) 12.978 3.587 ( 1.202 -0.298 -5.904) 6.033 3.707 ( 0.282 -3.702 2.233) 4.333 4.492 ( 9.177 7.114 -6.539) 13.326 4.650 ( -2.219 1.445 1.877) 3.246 5.482 ( -18.214 1.329 -1.816) 18.353 5.589 ( -11.492 3.727 3.429) 12.558 5.925 ( -6.816 4.977 4.241) 9.445 6.077 ( -8.101 0.168 -0.838) 8.146 6.577 ( 1.903 -1.716 -1.230) 2.843 6.799 ( 6.461 0.652 4.340) 7.811 7.044 ( 1.679 -15.801 -0.745) 15.908 7.393 ( 2.495 -6.938 19.626) 20.965 8.823 ( -14.771 1.464 8.136) 16.927 9.011 ( -8.677 1.690 10.051) 13.386 9.179 ( -0.677 -2.270 4.181) 4.806 9.820 ( -2.758 8.078 -4.653) 9.721 10.270 ( 3.327 -17.237 -4.702) 18.174 10.679 ( -0.812 10.493 5.869) 12.050 11.562 ( 14.213 -1.783 -13.526) 19.702 11.858 ( 19.731 8.063 2.565) 21.468 12.639 ( -3.758 5.700 0.909) 6.887 12.655 ( -10.996 -7.188 9.270) 16.078 13.041 ( -4.468 0.349 -5.065) 6.763 13.778 ( 12.600 6.270 -3.545) 14.514 17.766 ( -11.015 1.103 -15.034) 18.670 18.305 ( 5.939 -0.151 8.834) 10.646 18.921 ( 0.142 5.267 0.034) 5.269 19.604 ( -9.740 5.061 2.701) 11.303 20.548 ( -4.371 -15.847 -14.102) 21.659 22.541 ( 17.265 13.867 9.576) 24.126 23.262 ( 2.237 0.104 -4.738) 5.241 23.707 ( 5.369 -3.150 3.942) 7.368 ======================= Grid point 474 (237/361) ======================= q-point: (-0.50 0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( -0.605 -0.000 6.302) 6.331 2.762 ( -10.632 -0.000 1.740) 10.774 2.860 ( -2.343 -0.000 0.367) 2.371 3.117 ( 2.494 -0.000 5.824) 6.336 3.542 ( 7.822 -0.000 -4.341) 8.946 3.855 ( -12.600 -0.000 8.295) 15.086 4.590 ( 4.800 0.000 -12.812) 13.681 4.598 ( 7.177 -0.000 0.145) 7.179 5.343 ( -3.717 -0.000 16.019) 16.445 5.575 ( -2.585 -0.000 20.384) 20.547 5.965 ( -4.757 -0.000 19.513) 20.084 6.013 ( -2.732 -0.000 9.889) 10.259 6.190 ( 2.387 -0.000 5.357) 5.865 6.250 ( 1.143 -0.000 3.620) 3.796 6.676 ( -6.233 -0.000 -9.187) 11.102 7.295 ( 5.378 -0.000 -9.631) 11.031 8.638 ( -15.899 -0.000 19.218) 24.942 9.012 ( 2.509 -0.000 5.571) 6.110 9.171 ( -11.659 -0.000 8.861) 14.644 10.057 ( 1.346 -0.000 4.444) 4.643 10.631 ( -0.643 -0.000 -21.845) 21.854 11.310 ( 9.171 -0.000 -10.398) 13.864 11.542 ( -10.948 -0.000 -0.497) 10.960 11.967 ( 10.731 0.000 -18.881) 21.717 12.365 ( -7.655 -0.000 13.318) 15.361 13.064 ( 16.408 0.000 7.644) 18.102 13.252 ( -16.141 -0.000 0.563) 16.151 13.275 ( 3.077 -0.000 -7.786) 8.372 17.855 ( 5.457 -0.000 -5.999) 8.109 18.104 ( 10.208 -0.000 14.454) 17.695 19.019 ( -10.988 -0.000 -11.464) 15.880 19.596 ( 2.825 -0.000 -6.191) 6.805 21.372 ( 35.656 -0.000 3.918) 35.871 21.470 ( -20.297 0.000 1.215) 20.333 23.667 ( -8.392 -0.000 -2.584) 8.781 23.723 ( -4.237 -0.000 -8.602) 9.588 ======================= Grid point 476 (238/361) ======================= q-point: (-0.40 0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -0.652 6.811 6.474) 9.419 2.666 ( 1.500 -1.849 7.281) 7.661 2.892 ( 2.429 -2.899 2.038) 4.296 3.179 ( 5.480 0.066 -3.666) 6.594 3.634 ( 7.719 -0.915 -1.782) 7.974 3.701 ( -21.512 -4.185 4.212) 22.316 4.534 ( 9.137 2.815 -10.125) 13.926 4.707 ( 8.284 -2.659 -3.330) 9.316 5.443 ( -6.216 -1.516 11.325) 13.007 5.779 ( -2.569 -5.714 8.902) 10.885 6.113 ( -5.964 6.480 17.846) 19.901 6.125 ( 2.028 0.913 14.584) 14.753 6.306 ( -1.981 -4.327 9.181) 10.341 6.346 ( 4.345 -3.802 2.617) 6.339 6.497 ( -5.312 -1.104 -2.835) 6.121 7.244 ( 5.187 1.902 -9.563) 11.044 8.667 ( -18.375 -2.574 23.139) 29.659 9.089 ( -3.519 2.470 7.110) 8.309 9.138 ( -4.059 -2.656 4.823) 6.840 10.082 ( -0.131 3.516 1.105) 3.688 10.356 ( -3.072 0.891 -17.803) 18.088 11.307 ( 0.729 6.806 -5.662) 8.883 11.401 ( 1.835 -2.725 -5.687) 6.568 11.873 ( 12.357 5.367 -17.233) 21.874 12.435 ( -6.572 -2.891 11.724) 13.747 13.008 ( -15.439 3.145 1.431) 15.821 13.179 ( -1.283 -5.704 -8.655) 10.445 13.430 ( 14.853 1.628 9.043) 17.465 17.926 ( 5.904 -0.361 3.587) 6.918 18.317 ( -0.378 0.091 2.899) 2.925 18.821 ( -1.518 -3.509 -3.783) 5.379 19.572 ( 6.386 -0.502 -8.095) 10.323 21.138 ( -22.613 2.120 -4.485) 23.151 21.908 ( 33.867 1.014 4.009) 34.119 23.531 ( -6.477 1.220 -2.742) 7.139 23.575 ( -2.956 -0.647 -6.080) 6.792 ======================= Grid point 477 (239/361) ======================= q-point: (-0.30 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.496 ( -15.338 1.585 11.410) 19.182 2.953 ( 14.735 -0.926 1.754) 14.868 3.012 ( 8.536 -1.072 7.689) 11.538 3.208 ( 8.503 3.804 -6.637) 11.438 3.500 ( -14.898 -10.347 -0.856) 18.159 3.688 ( 1.900 1.143 -0.872) 2.382 4.536 ( 8.567 3.149 -6.363) 11.127 4.767 ( 6.223 0.445 -5.973) 8.637 5.480 ( -9.154 -4.982 7.847) 13.046 5.777 ( -10.600 -6.149 -1.087) 12.303 6.091 ( -10.157 6.076 8.939) 14.832 6.201 ( -5.096 3.715 3.354) 7.143 6.432 ( 0.933 -3.957 9.498) 10.331 6.482 ( 5.797 -6.742 0.449) 8.903 6.692 ( 9.161 -4.564 18.951) 21.538 7.185 ( 4.558 2.922 -6.814) 8.703 8.717 ( -19.804 -4.952 23.260) 30.948 9.084 ( -4.888 1.460 7.620) 9.170 9.173 ( -2.494 -0.218 3.274) 4.121 10.031 ( -0.266 4.788 -3.079) 5.699 10.127 ( -4.428 -3.403 -11.904) 13.149 11.097 ( -8.093 12.609 -0.734) 15.001 11.471 ( 14.017 -2.331 -11.020) 17.982 11.848 ( 15.678 6.158 -9.414) 19.296 12.500 ( -7.807 -4.274 10.193) 13.531 12.818 ( -11.585 2.162 2.927) 12.143 13.092 ( -4.065 -5.307 -7.199) 9.824 13.705 ( 14.582 3.614 5.684) 16.062 18.064 ( 0.136 2.210 3.480) 4.125 18.168 ( -5.453 -1.862 -6.667) 8.812 18.927 ( 5.508 -0.879 5.717) 7.988 19.604 ( 9.254 -2.275 -6.601) 11.592 20.710 ( -23.552 -0.263 -10.493) 25.785 22.381 ( 30.872 5.378 3.972) 31.588 23.395 ( -4.317 3.420 -2.889) 6.220 23.537 ( -0.329 -3.872 -0.050) 3.887 ======================= Grid point 478 (240/361) ======================= q-point: (-0.20 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( -17.990 -2.642 15.068) 23.615 2.992 ( -13.198 -7.270 0.171) 15.068 3.177 ( 7.950 4.919 -2.078) 9.577 3.316 ( 17.936 1.720 1.151) 18.055 3.520 ( 5.612 -6.259 -5.352) 9.966 3.687 ( 1.330 1.173 4.291) 4.644 4.556 ( 6.207 2.428 -3.229) 7.406 4.729 ( 2.742 4.843 -6.057) 8.225 5.435 ( -14.320 -4.554 2.582) 15.248 5.613 ( -11.996 -1.843 -2.142) 12.325 6.018 ( -7.897 0.657 5.101) 9.424 6.116 ( -7.278 8.254 5.499) 12.302 6.537 ( -0.013 -2.695 2.123) 3.431 6.661 ( 5.375 -12.243 2.079) 13.531 6.982 ( 8.271 4.600 0.867) 9.504 7.276 ( 8.440 -5.914 9.585) 14.074 8.744 ( -19.475 -6.457 17.384) 26.892 9.108 ( -7.297 5.171 10.596) 13.865 9.149 ( -2.268 -0.338 2.839) 3.650 9.896 ( -6.334 -2.883 -8.010) 10.611 10.058 ( 3.328 -2.848 -4.704) 6.428 10.898 ( -5.186 12.859 3.773) 14.370 11.529 ( 13.796 -1.954 -14.393) 20.033 11.979 ( 18.466 4.973 -1.394) 19.175 12.534 ( -11.195 -5.140 10.504) 16.189 12.722 ( -3.952 3.421 2.841) 5.949 12.998 ( -5.042 -4.528 -4.748) 8.275 13.899 ( 13.947 6.506 0.853) 15.414 17.782 ( -11.776 0.642 -15.854) 19.759 18.303 ( 5.052 -0.052 10.889) 12.004 19.029 ( 4.722 6.503 2.640) 8.459 19.662 ( -0.668 0.936 0.075) 1.153 20.312 ( -12.298 -9.933 -16.191) 22.629 22.749 ( 23.844 8.814 3.837) 25.709 23.288 ( -2.016 3.402 -2.653) 4.762 23.636 ( 3.634 -4.874 6.308) 8.761 ======================= Grid point 479 (241/361) ======================= q-point: (-0.10 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.390 ( -20.042 -5.228 15.884) 26.103 2.824 ( -17.315 -8.939 -2.297) 19.621 3.259 ( 8.280 2.383 0.095) 8.616 3.474 ( 6.649 4.445 -1.759) 8.189 3.522 ( 1.525 -3.274 -0.915) 3.725 3.851 ( 10.256 1.677 3.944) 11.115 4.591 ( 0.027 -0.760 1.915) 2.061 4.638 ( 4.404 7.044 -6.267) 10.406 5.231 ( -15.333 1.559 -0.956) 15.441 5.484 ( -7.787 0.070 1.546) 7.939 5.941 ( -7.446 3.465 1.034) 8.277 5.984 ( -8.383 8.555 3.729) 12.545 6.548 ( -0.895 -2.215 -1.901) 3.053 6.887 ( 4.726 -10.812 5.030) 12.828 7.020 ( 7.982 0.872 -3.870) 8.913 7.542 ( 2.750 -5.270 6.856) 9.075 8.685 ( -18.764 -4.264 9.004) 21.245 9.035 ( -7.521 6.379 7.804) 12.576 9.222 ( -2.157 -1.939 9.266) 9.709 9.745 ( -4.251 0.911 -5.872) 7.307 10.130 ( 4.645 -11.256 -3.190) 12.588 10.846 ( 0.078 5.801 7.486) 9.472 11.556 ( 12.453 -2.894 -14.972) 19.688 12.186 ( 16.257 3.701 -1.157) 16.713 12.530 ( -12.995 -4.304 9.714) 16.786 12.707 ( 0.946 4.068 4.191) 5.916 12.927 ( -3.493 -1.977 -1.585) 4.316 13.990 ( 13.419 10.551 -5.023) 17.794 17.444 ( -10.390 -0.061 -12.381) 16.163 18.515 ( 6.410 -0.308 11.091) 12.814 19.000 ( 2.128 10.332 -3.414) 11.088 19.506 ( -14.146 4.694 1.309) 14.962 20.231 ( 5.074 -16.720 -13.801) 22.266 22.951 ( 7.570 14.242 7.475) 17.777 23.232 ( 5.404 -2.549 -7.080) 9.264 23.859 ( 7.431 -2.102 11.374) 13.748 ======================= Grid point 486 (242/361) ======================= q-point: (-0.40 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.517 ( -18.337 0.000 10.912) 21.338 2.939 ( 11.239 -0.000 0.559) 11.253 3.010 ( 15.037 -0.000 9.301) 17.681 3.259 ( 15.202 -0.000 -8.490) 17.412 3.384 ( -22.716 0.000 1.291) 22.753 3.704 ( 2.533 -0.000 0.066) 2.534 4.576 ( 10.778 -0.000 -8.407) 13.669 4.752 ( 5.143 -0.000 -3.151) 6.032 5.434 ( -9.301 0.000 6.899) 11.580 5.713 ( -10.043 0.000 1.282) 10.125 6.132 ( -10.660 0.000 0.710) 10.684 6.298 ( -1.478 0.000 10.573) 10.675 6.345 ( -3.150 0.000 7.545) 8.176 6.429 ( 4.989 -0.000 2.190) 5.448 6.652 ( 11.525 -0.000 19.433) 22.593 7.215 ( 6.442 -0.000 -10.179) 12.047 8.671 ( -22.543 0.000 26.286) 34.629 9.096 ( -4.995 0.000 5.429) 7.378 9.172 ( -1.375 0.000 5.816) 5.977 10.079 ( -7.292 0.000 -15.762) 17.367 10.091 ( 0.627 -0.000 -1.751) 1.860 11.235 ( -8.713 0.000 -0.527) 8.729 11.433 ( 15.008 -0.000 -10.525) 18.331 11.901 ( 15.037 -0.000 -12.031) 19.257 12.464 ( -7.789 0.000 11.335) 13.753 12.840 ( -12.730 0.000 3.684) 13.253 13.033 ( -3.326 0.000 -7.087) 7.829 13.741 ( 14.283 -0.000 6.858) 15.844 18.093 ( 5.247 -0.000 10.412) 11.660 18.141 ( -11.332 0.000 -12.915) 17.182 18.918 ( 8.396 -0.000 8.296) 11.803 19.581 ( 9.847 -0.000 -8.535) 13.031 20.712 ( -24.274 0.000 -12.292) 27.209 22.430 ( 32.694 -0.000 3.041) 32.835 23.454 ( -4.447 0.000 0.368) 4.462 23.474 ( -2.025 0.000 -2.133) 2.941 ======================= Grid point 487 (243/361) ======================= q-point: (-0.30 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.410 ( -19.697 -0.002 16.141) 25.466 2.880 ( -21.117 -4.104 -0.260) 21.514 3.245 ( 7.040 1.850 1.234) 7.383 3.353 ( 17.843 2.137 -4.867) 18.618 3.428 ( 15.238 -3.211 1.861) 15.683 3.711 ( 0.340 0.960 1.977) 2.224 4.616 ( 8.978 3.604 -5.807) 11.284 4.761 ( 1.899 -1.032 -4.909) 5.364 5.365 ( -12.596 -2.355 5.271) 13.856 5.566 ( -11.489 -2.102 -0.544) 11.692 6.001 ( -9.560 -0.815 2.436) 9.899 6.292 ( -4.701 9.581 7.143) 12.842 6.449 ( -2.624 -8.001 6.208) 10.462 6.520 ( 6.290 -2.454 -1.531) 6.923 7.056 ( 14.250 2.344 10.479) 17.843 7.200 ( 8.199 -2.148 -5.420) 10.061 8.656 ( -23.865 -2.819 22.187) 32.707 9.117 ( -4.130 -0.578 8.425) 9.401 9.201 ( -3.947 2.477 6.649) 8.119 9.803 ( -9.468 -3.649 -12.013) 15.725 10.084 ( 4.386 1.785 -3.437) 5.851 11.089 ( -8.850 6.930 2.588) 11.534 11.493 ( 13.664 -1.782 -14.645) 20.108 12.024 ( 16.712 0.578 -4.306) 17.267 12.489 ( -8.685 -0.384 12.077) 14.880 12.765 ( -4.459 1.442 4.118) 6.238 12.915 ( -5.465 -3.577 -4.558) 7.964 13.984 ( 13.790 2.596 2.928) 14.334 17.789 ( -12.224 0.169 -16.441) 20.489 18.303 ( 4.715 0.000 12.256) 13.131 19.128 ( 7.477 3.700 8.121) 11.643 19.644 ( 8.628 -1.792 -4.813) 10.040 20.206 ( -20.814 -2.485 -18.711) 28.098 22.844 ( 27.254 2.273 -3.528) 27.575 23.382 ( -3.394 6.204 2.917) 7.650 23.537 ( 2.064 -5.898 7.901) 10.073 ======================= Grid point 488 (244/361) ======================= q-point: (-0.20 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.339 ( -21.707 -0.170 17.618) 27.958 2.626 ( -23.041 -11.645 2.010) 25.894 3.294 ( -1.322 1.060 -4.326) 4.646 3.465 ( 7.014 -2.805 1.717) 7.747 3.606 ( 12.508 9.529 -0.623) 15.737 3.860 ( 11.591 -1.227 4.372) 12.449 4.611 ( -1.031 3.130 0.166) 3.299 4.720 ( 6.687 1.365 -8.736) 11.086 5.240 ( -14.111 0.057 3.250) 14.480 5.464 ( -5.757 -1.564 1.368) 6.120 5.931 ( -8.391 -1.530 3.210) 9.113 6.192 ( -5.818 11.429 3.929) 13.413 6.499 ( -3.513 -3.834 0.597) 5.234 6.672 ( 9.340 -9.661 0.931) 13.469 7.113 ( 7.387 6.288 -5.322) 11.065 7.442 ( 10.226 -5.608 2.679) 11.967 8.577 ( -23.781 -5.720 13.461) 27.919 9.162 ( -4.599 4.427 5.395) 8.358 9.200 ( -5.823 1.048 13.637) 14.865 9.629 ( -6.599 -8.683 -6.471) 12.681 10.101 ( 6.723 2.839 -3.542) 8.111 10.961 ( -6.905 6.184 5.566) 10.812 11.506 ( 12.093 -2.533 -15.503) 19.824 12.211 ( 14.252 -0.698 -2.960) 14.573 12.509 ( -9.305 2.180 12.094) 15.414 12.763 ( -0.221 2.083 3.599) 4.164 12.856 ( -3.448 -5.310 -0.940) 6.401 14.143 ( 14.042 6.205 -2.413) 15.540 17.442 ( -10.605 -0.112 -12.891) 16.693 18.511 ( 5.824 -0.136 10.222) 11.766 19.204 ( 3.643 11.896 0.429) 12.449 19.570 ( -17.204 2.296 -1.301) 17.405 19.945 ( 8.238 -14.590 -15.513) 22.834 23.066 ( 18.093 -0.425 -8.354) 19.932 23.310 ( -4.311 9.771 4.862) 11.735 23.807 ( 9.016 -3.516 14.558) 17.481 ======================= Grid point 489 (245/361) ======================= q-point: (-0.10 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( -24.240 -5.966 13.479) 28.370 2.469 ( -22.012 -8.851 2.857) 23.896 3.204 ( -10.348 -9.140 3.975) 14.367 3.611 ( 4.905 1.249 2.346) 5.579 3.653 ( 12.539 12.383 -0.759) 17.639 3.990 ( -0.725 2.596 2.722) 3.831 4.578 ( -3.192 1.929 5.270) 6.456 4.740 ( 11.899 3.575 -7.797) 14.668 5.085 ( -8.542 2.188 1.746) 8.989 5.450 ( -0.760 0.477 1.994) 2.186 5.830 ( -8.294 0.732 -2.337) 8.648 6.032 ( -6.762 12.975 3.193) 14.976 6.476 ( -2.843 -3.288 -0.961) 4.451 6.940 ( 6.781 -9.560 7.038) 13.672 7.108 ( 8.475 3.704 -5.283) 10.651 7.535 ( -0.390 -1.758 -4.590) 4.930 8.439 ( -22.036 -9.152 7.594) 25.040 9.094 ( -5.773 7.828 5.862) 11.356 9.307 ( -3.266 -1.282 13.343) 13.796 9.614 ( 0.300 -9.809 -3.484) 10.414 10.128 ( 4.344 1.871 -1.512) 4.966 10.937 ( -3.137 0.066 6.349) 7.083 11.508 ( 10.950 -2.852 -14.847) 18.668 12.296 ( 3.560 -0.313 -5.438) 6.507 12.467 ( -10.881 2.957 8.843) 14.330 12.814 ( 3.678 2.663 0.213) 4.546 12.892 ( 1.627 -5.901 3.179) 6.898 14.201 ( 14.084 10.742 -7.965) 19.421 17.240 ( -5.033 0.242 -0.957) 5.129 18.709 ( 7.853 -2.753 3.576) 9.057 18.983 ( -8.910 9.523 -7.579) 15.084 19.414 ( -1.631 2.932 1.234) 3.575 20.069 ( 6.643 -12.385 -6.711) 15.574 23.176 ( -6.651 16.569 6.541) 19.014 23.211 ( 12.362 -6.162 -9.093) 16.537 24.128 ( 9.127 -0.043 12.889) 15.794 ======================= Grid point 497 (246/361) ======================= q-point: (-0.30 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( -19.353 0.000 20.772) 28.391 2.488 ( -28.171 0.000 0.458) 28.175 3.302 ( -6.381 0.000 -8.139) 10.342 3.437 ( 10.718 -0.000 4.382) 11.579 3.736 ( 17.556 -0.000 0.819) 17.575 3.814 ( 9.059 -0.000 3.993) 9.900 4.671 ( -6.001 0.000 -2.629) 6.552 4.701 ( 11.308 -0.000 -7.201) 13.407 5.241 ( -13.174 0.000 5.445) 14.255 5.448 ( -4.558 0.000 1.602) 4.831 5.914 ( -8.381 0.000 4.272) 9.407 6.345 ( -4.926 0.000 1.390) 5.118 6.411 ( -4.847 0.000 5.316) 7.194 6.590 ( 10.486 -0.000 -2.224) 10.720 7.185 ( 7.729 -0.000 -8.689) 11.629 7.377 ( 12.763 -0.000 3.294) 13.181 8.522 ( -25.597 0.000 14.612) 29.474 9.170 ( -5.597 0.000 11.779) 13.041 9.247 ( -5.139 0.000 8.592) 10.011 9.543 ( -7.629 0.000 -6.426) 9.974 10.132 ( 7.739 -0.000 -4.148) 8.781 11.025 ( -10.627 0.000 5.135) 11.802 11.480 ( 12.355 -0.000 -15.664) 19.950 12.197 ( 13.240 -0.000 -2.931) 13.560 12.550 ( -6.007 0.000 13.609) 14.876 12.775 ( -6.342 0.000 -1.222) 6.459 12.796 ( 1.122 -0.000 2.605) 2.836 14.199 ( 14.198 -0.000 -1.557) 14.283 17.441 ( -10.691 0.000 -13.046) 16.867 18.510 ( 5.613 -0.000 9.802) 11.295 19.347 ( 5.573 -0.000 8.313) 10.008 19.583 ( -23.426 0.000 -5.527) 24.069 19.786 ( 13.159 -0.000 -19.519) 23.540 23.053 ( 17.480 -0.000 -11.919) 21.157 23.420 ( -4.418 0.000 6.077) 7.513 23.764 ( 10.800 -0.000 16.831) 19.998 ======================= Grid point 498 (247/361) ======================= q-point: (-0.20 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( -26.777 -2.587 6.644) 27.710 2.337 ( -22.851 -4.506 13.124) 26.734 3.095 ( -15.432 -3.063 3.465) 16.110 3.619 ( 7.797 0.121 2.970) 8.345 3.859 ( 10.714 8.988 -1.956) 14.121 3.999 ( 1.525 -1.753 4.671) 5.217 4.597 ( 0.412 0.222 2.122) 2.173 4.778 ( 11.118 0.846 -6.472) 12.892 5.121 ( -10.245 1.402 3.455) 10.902 5.453 ( 1.096 0.048 1.476) 1.839 5.833 ( -7.984 -0.043 -1.407) 8.107 6.238 ( -5.847 9.488 3.301) 11.623 6.400 ( -4.392 -5.443 -0.461) 7.010 6.801 ( 13.599 -4.600 5.028) 15.211 7.181 ( 7.735 3.009 -7.223) 11.003 7.499 ( 5.410 -1.735 -5.776) 8.102 8.303 ( -27.110 -4.639 7.900) 28.617 9.209 ( -6.041 4.350 8.524) 11.317 9.280 ( -6.071 -1.819 12.181) 13.731 9.461 ( -1.794 -4.749 -1.108) 5.196 10.192 ( 8.583 2.638 -3.307) 9.569 10.947 ( -9.316 0.629 6.344) 11.289 11.472 ( 11.591 -1.150 -14.115) 18.301 12.287 ( 4.907 -0.192 -4.800) 6.867 12.563 ( -7.733 6.669 7.414) 12.619 12.754 ( -2.944 -8.232 3.122) 9.283 12.847 ( 3.876 0.937 0.064) 3.988 14.333 ( 14.795 3.849 -7.356) 16.965 17.243 ( -4.268 0.077 0.167) 4.272 18.673 ( 7.345 -1.096 -1.109) 7.508 19.120 ( -18.440 4.583 -6.319) 20.024 19.475 ( 2.146 3.302 4.355) 5.871 19.876 ( 11.228 -7.716 -7.711) 15.655 23.133 ( 13.649 -2.285 -10.709) 17.499 23.402 ( -6.135 7.319 7.829) 12.349 24.116 ( 11.174 -0.758 12.504) 16.786 ======================= Grid point 499 (248/361) ======================= q-point: (-0.10 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( -22.722 -9.085 12.366) 27.418 2.061 ( -31.504 -5.908 0.288) 32.054 3.126 ( -10.245 -7.209 22.233) 25.520 3.680 ( -0.056 2.902 -0.340) 2.922 3.889 ( 7.922 8.286 -3.608) 12.018 3.959 ( -9.183 1.593 4.171) 10.211 4.682 ( -1.817 8.314 5.295) 10.023 4.833 ( 11.402 0.455 -2.709) 11.728 5.081 ( 4.240 0.152 0.465) 4.269 5.475 ( 1.463 -0.097 -2.887) 3.238 5.660 ( -7.272 -0.828 -5.440) 9.119 6.106 ( -4.080 12.302 2.461) 13.193 6.421 ( -2.291 -3.801 5.335) 6.939 7.044 ( 1.235 1.233 3.443) 3.860 7.219 ( 12.335 0.568 -0.502) 12.358 7.418 ( -2.844 1.439 -10.502) 10.975 8.114 ( -22.781 -14.190 9.032) 28.318 9.144 ( -6.683 7.948 5.654) 11.824 9.408 ( -1.679 -4.410 12.414) 13.280 9.505 ( 1.887 -9.473 -3.068) 10.135 10.222 ( 4.213 7.311 -0.801) 8.476 10.905 ( -7.792 -4.134 3.623) 9.536 11.480 ( 10.847 -0.396 -11.926) 16.126 12.218 ( -5.003 1.138 -4.528) 6.843 12.450 ( -9.115 4.182 3.833) 10.736 12.799 ( 0.580 -4.114 -5.907) 7.222 12.922 ( 3.796 -4.726 2.528) 6.568 14.361 ( 14.074 7.803 -12.828) 20.579 17.356 ( 7.692 3.737 15.968) 18.114 18.584 ( -1.255 -5.373 -19.907) 20.658 19.006 ( 0.018 4.872 10.359) 11.448 19.495 ( 3.943 4.238 0.143) 5.790 19.989 ( 3.673 -8.822 -4.270) 10.467 23.218 ( 8.053 0.226 -6.169) 10.147 23.294 ( -5.541 11.529 4.893) 13.696 24.338 ( 4.481 -1.044 3.649) 5.873 ======================= Grid point 508 (249/361) ======================= q-point: (-0.20 -0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( -23.466 0.000 11.349) 26.066 2.007 ( -33.333 0.000 0.608) 33.339 3.063 ( -11.706 0.000 25.349) 27.921 3.704 ( 1.367 -0.000 -0.647) 1.512 3.970 ( -13.041 0.000 5.236) 14.053 3.975 ( 8.627 -0.000 -5.116) 10.030 4.780 ( 15.669 -0.000 7.350) 17.307 4.809 ( -1.641 0.000 -2.157) 2.710 5.088 ( 3.456 -0.000 -0.711) 3.528 5.471 ( 1.519 -0.000 -5.581) 5.784 5.651 ( -7.957 0.000 -6.058) 10.000 6.263 ( -2.671 0.000 -5.169) 5.818 6.345 ( -3.502 0.000 14.341) 14.763 7.054 ( 11.802 -0.000 4.767) 12.728 7.235 ( 10.346 -0.000 -2.673) 10.685 7.430 ( 1.011 -0.000 -12.933) 12.972 7.968 ( -30.880 0.000 10.300) 32.552 9.257 ( -7.143 0.000 6.044) 9.357 9.304 ( -2.496 0.000 10.198) 10.499 9.442 ( -0.460 0.000 1.326) 1.404 10.294 ( 8.874 -0.000 -2.726) 9.283 10.869 ( -12.393 0.000 4.608) 13.222 11.479 ( 11.640 -0.000 -10.950) 15.981 12.240 ( -2.121 0.000 -6.140) 6.496 12.513 ( -11.195 0.000 -1.776) 11.335 12.698 ( -1.914 0.000 2.824) 3.412 12.903 ( 4.298 -0.000 -0.928) 4.397 14.431 ( 14.401 -0.000 -13.514) 19.749 17.392 ( 10.194 -0.000 18.148) 20.815 18.531 ( -2.546 0.000 -21.644) 21.794 19.052 ( -1.136 0.000 12.456) 12.508 19.556 ( -0.394 0.000 1.917) 1.957 19.887 ( 7.897 -0.000 -7.139) 10.646 23.189 ( 13.085 -0.000 -8.886) 15.817 23.442 ( -7.987 0.000 9.050) 12.070 24.321 ( 5.002 -0.000 0.811) 5.067 ======================= Grid point 509 (250/361) ======================= q-point: (-0.10 -0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( -30.127 -4.911 7.161) 31.353 1.791 ( -16.994 -6.006 18.436) 25.783 3.294 ( -8.564 -2.137 31.309) 32.529 3.641 ( -5.681 1.743 -2.736) 6.542 3.811 ( -13.052 1.195 2.407) 13.326 4.017 ( 9.150 1.911 -7.327) 11.876 4.700 ( -6.805 6.620 0.968) 9.543 5.030 ( 6.607 4.427 -2.194) 8.250 5.171 ( 8.320 -3.114 -2.142) 9.138 5.350 ( 0.009 -2.742 -3.190) 4.207 5.626 ( 5.742 -1.081 1.361) 6.000 6.163 ( 1.395 6.341 -3.070) 7.182 6.513 ( -2.556 -0.669 16.935) 17.140 7.036 ( -6.101 11.382 -9.266) 15.894 7.202 ( -2.960 -3.304 -16.372) 16.962 7.467 ( 7.782 4.729 11.716) 14.839 7.832 ( -19.210 -16.691 18.397) 31.402 9.191 ( -5.148 7.048 4.500) 9.820 9.405 ( 1.137 -6.436 -4.514) 7.943 9.492 ( -0.358 -4.823 10.711) 11.753 10.325 ( 2.009 9.552 -2.405) 10.053 10.717 ( -14.374 -8.217 -0.620) 16.568 11.515 ( 10.287 1.292 -8.392) 13.338 12.087 ( -6.997 2.079 -5.844) 9.350 12.336 ( -10.185 -2.581 0.323) 10.512 12.720 ( 0.002 -2.152 -0.456) 2.200 12.956 ( 3.502 -1.996 -0.481) 4.060 14.406 ( 12.120 3.599 -18.518) 22.423 17.869 ( 21.748 9.216 20.718) 31.419 18.297 ( 2.888 -8.604 -16.080) 18.465 19.202 ( 1.642 7.644 10.117) 12.785 19.538 ( 0.732 -3.364 -1.332) 3.691 19.909 ( 3.773 -4.115 -6.609) 8.652 23.278 ( 11.561 -0.896 -6.681) 13.382 23.364 ( -10.142 12.810 6.970) 17.764 24.250 ( -8.673 -5.038 -10.780) 14.724 ======================= Grid point 519 (251/361) ======================= q-point: (-0.10 -0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( -8.962 0.000 21.731) 23.506 1.842 ( -9.256 0.000 24.632) 26.314 3.500 ( -8.246 0.000 -5.314) 9.810 3.508 ( -19.132 0.000 33.686) 38.740 3.741 ( 6.082 -0.000 -1.981) 6.396 4.027 ( 7.205 -0.000 -11.330) 13.427 4.677 ( -4.588 0.000 2.322) 5.142 4.923 ( -2.027 0.000 -11.745) 11.919 5.195 ( 4.165 -0.000 -2.469) 4.842 5.433 ( -2.692 0.000 8.551) 8.964 5.839 ( 18.975 -0.000 4.376) 19.473 6.218 ( 6.773 -0.000 -1.591) 6.957 6.565 ( -18.550 0.000 2.285) 18.690 6.848 ( -6.262 0.000 1.649) 6.475 7.016 ( 0.740 -0.000 -11.247) 11.271 7.708 ( -19.899 0.000 25.061) 32.000 7.807 ( 7.953 -0.000 14.454) 16.497 9.216 ( -1.562 0.000 1.677) 2.292 9.296 ( -1.786 0.000 -7.791) 7.993 9.614 ( 1.485 -0.000 11.885) 11.978 10.365 ( -21.461 0.000 -0.186) 21.462 10.402 ( 4.276 -0.000 -5.267) 6.784 11.545 ( 6.083 -0.000 -8.642) 10.568 11.920 ( -6.236 0.000 -6.875) 9.282 12.246 ( -6.319 0.000 7.564) 9.856 12.731 ( 2.697 -0.000 -0.358) 2.720 12.976 ( 2.173 -0.000 -1.152) 2.460 14.326 ( 9.051 -0.000 -21.256) 23.103 18.078 ( 4.013 -0.000 -14.796) 15.331 18.563 ( 30.793 -0.000 14.790) 34.160 19.382 ( -5.855 0.000 -8.261) 10.126 19.402 ( -5.331 0.000 12.068) 13.193 19.930 ( 14.125 -0.000 -4.835) 14.930 23.350 ( 10.851 -0.000 -7.063) 12.947 23.385 ( -10.098 0.000 7.181) 12.391 23.773 ( -26.501 0.000 -18.069) 32.075 ======================= Grid point 520 (252/361) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( 6.652 -0.000 12.453) 14.118 2.832 ( -0.640 0.000 5.066) 5.106 3.112 ( 1.630 -0.000 11.224) 11.342 3.547 ( 0.761 -0.000 -10.569) 10.597 3.741 ( -0.597 0.000 -14.544) 14.556 3.980 ( 0.471 -0.000 -1.590) 1.659 4.345 ( 2.453 -0.000 -4.213) 4.875 4.420 ( -7.354 0.000 -4.649) 8.701 5.609 ( 2.918 -0.000 11.168) 11.543 5.781 ( -6.865 0.000 13.515) 15.158 6.063 ( -4.033 0.000 0.651) 4.085 6.363 ( 1.553 -0.000 -4.251) 4.526 6.450 ( 6.064 -0.000 -0.784) 6.114 6.559 ( 1.449 -0.000 -5.630) 5.813 7.377 ( -6.038 0.000 23.668) 24.426 8.303 ( -4.862 0.000 -0.735) 4.917 8.574 ( -10.395 0.000 24.646) 26.749 9.058 ( 0.845 -0.000 -4.859) 4.932 9.092 ( 2.590 -0.000 2.746) 3.774 9.984 ( 0.476 -0.000 -15.542) 15.549 10.018 ( -11.817 0.000 17.729) 21.306 10.568 ( 10.025 -0.000 14.458) 17.594 11.012 ( 1.399 -0.000 -15.305) 15.368 11.510 ( -1.700 0.000 -11.129) 11.258 12.503 ( -4.902 0.000 4.598) 6.721 12.737 ( 10.169 -0.000 -6.474) 12.055 13.038 ( -3.049 0.000 6.773) 7.427 13.742 ( 4.903 -0.000 -13.084) 13.973 17.898 ( 9.774 -0.000 -2.141) 10.006 18.411 ( -10.312 0.000 -16.200) 19.204 19.318 ( -17.720 0.000 6.453) 18.858 19.510 ( 13.675 -0.000 -0.718) 13.694 20.904 ( 27.742 -0.000 15.989) 32.020 22.102 ( -29.559 0.000 -18.872) 35.070 23.298 ( -8.170 0.000 1.755) 8.356 23.418 ( 9.672 -0.000 -3.896) 10.427 ======================= Grid point 521 (253/361) ======================= q-point: ( 0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( 10.439 0.109 9.697) 14.249 2.788 ( 1.422 -0.135 -7.412) 7.549 3.318 ( 1.089 6.594 10.353) 12.323 3.464 ( 1.254 4.591 1.054) 4.874 3.554 ( -2.128 -3.070 -8.996) 9.741 3.868 ( -2.953 -1.190 -12.026) 12.441 4.268 ( -6.646 -1.161 -2.875) 7.333 4.443 ( 7.004 -3.647 1.952) 8.134 5.731 ( -3.052 1.237 9.233) 9.802 5.837 ( -13.134 -3.550 12.401) 18.409 5.974 ( -3.327 -0.525 -5.390) 6.355 6.266 ( -6.212 -0.474 -3.766) 7.279 6.505 ( 4.457 0.571 -0.902) 4.583 6.556 ( 5.411 -0.421 -4.505) 7.054 7.606 ( -2.679 5.158 26.743) 27.368 8.032 ( -9.651 19.812 -4.716) 22.537 8.753 ( -12.299 -15.998 13.087) 24.051 9.045 ( 1.861 -1.393 -1.768) 2.921 9.202 ( 2.787 -0.189 7.760) 8.248 9.774 ( -1.243 2.619 -13.083) 13.400 10.168 ( -1.846 -3.925 18.342) 18.848 10.828 ( 3.845 6.083 -6.308) 9.570 10.975 ( 14.236 -8.063 6.749) 17.698 11.378 ( 7.667 3.146 -14.579) 16.770 12.483 ( -5.910 -4.984 1.520) 7.879 12.809 ( 8.180 -3.564 -5.712) 10.595 13.067 ( -6.064 1.707 9.022) 11.004 13.636 ( 3.526 2.043 -12.632) 13.273 18.032 ( 7.045 0.999 1.529) 7.278 18.087 ( -7.920 -1.763 -12.805) 15.159 19.150 ( -16.274 1.031 5.637) 17.253 19.627 ( 4.817 0.708 -0.377) 4.884 21.403 ( -4.625 9.980 -0.367) 11.006 21.570 ( 6.188 -8.718 -0.722) 10.715 23.234 ( -4.188 -1.597 0.557) 4.516 23.519 ( 10.187 -0.209 -2.534) 10.499 ======================= Grid point 522 (254/361) ======================= q-point: ( 0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( 0.958 -0.409 -5.483) 5.581 2.858 ( 10.663 -1.041 3.712) 11.339 3.265 ( -0.461 7.564 1.042) 7.649 3.381 ( -1.002 2.917 -4.460) 5.423 3.650 ( 1.060 4.279 9.508) 10.481 3.698 ( -1.447 -3.565 -10.332) 11.025 4.204 ( -1.268 -3.803 -0.704) 4.071 4.610 ( 6.264 -4.471 3.308) 8.377 5.646 ( -21.022 -1.524 1.581) 21.137 5.749 ( -10.353 -1.149 3.871) 11.113 5.929 ( -4.181 -2.159 0.745) 4.764 6.145 ( -7.604 -1.181 -1.186) 7.786 6.522 ( 4.841 1.413 -5.185) 7.233 6.628 ( 6.778 -3.126 -0.860) 7.513 7.658 ( -7.514 19.971 -3.778) 21.670 7.816 ( -1.444 10.549 20.635) 23.220 8.801 ( -12.962 -11.515 5.460) 18.177 9.086 ( -0.118 -4.774 1.602) 5.037 9.328 ( -0.385 2.493 10.824) 11.114 9.607 ( -3.397 -5.683 -11.652) 13.402 10.442 ( 4.936 -2.316 16.833) 17.694 10.709 ( 5.453 10.967 -7.464) 14.343 11.297 ( 15.026 2.806 -14.012) 20.736 11.421 ( 18.840 -5.371 7.342) 20.921 12.475 ( -4.679 -8.276 0.163) 9.509 12.877 ( 3.385 -6.981 -5.056) 9.260 13.047 ( -9.794 4.032 10.311) 14.782 13.520 ( 4.759 0.604 -12.650) 13.529 17.783 ( -10.767 -1.056 -11.618) 15.875 18.246 ( 9.048 -0.973 8.288) 12.308 18.986 ( -12.602 1.771 2.986) 13.071 19.636 ( -4.837 -1.553 1.855) 5.408 20.905 ( -12.939 8.397 -19.661) 24.990 22.095 ( 19.118 -6.781 18.054) 27.155 23.216 ( 0.556 0.008 -0.898) 1.057 23.645 ( 9.845 -0.418 0.094) 9.854 ======================= Grid point 523 (255/361) ======================= q-point: (-0.70 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.668 ( -0.540 -7.224 -5.230) 8.935 2.933 ( -3.905 4.674 3.893) 7.228 3.240 ( -0.978 2.973 -6.618) 7.321 3.354 ( 6.844 0.724 4.227) 8.077 3.616 ( 1.828 -3.471 -2.363) 4.579 3.737 ( 1.932 6.349 5.470) 8.600 4.284 ( 7.168 -3.185 0.519) 7.861 4.750 ( 1.865 -2.283 4.211) 5.140 5.359 ( -20.251 -2.361 -1.276) 20.428 5.615 ( -15.220 -2.370 1.520) 15.478 5.875 ( -7.567 -3.398 0.312) 8.301 6.044 ( -8.263 -1.797 0.289) 8.461 6.513 ( 5.713 1.045 -6.286) 8.558 6.751 ( 7.000 -3.736 -0.390) 7.944 7.384 ( -2.054 17.591 -1.930) 17.815 7.873 ( -3.159 12.533 10.247) 16.494 8.773 ( -11.576 -9.015 4.244) 15.274 9.149 ( -3.607 -4.821 4.876) 7.748 9.377 ( -5.582 0.637 5.978) 8.203 9.524 ( -2.610 -8.485 -4.026) 9.748 10.561 ( 7.259 19.731 -2.501) 21.172 10.761 ( 6.607 -1.290 12.043) 13.797 11.293 ( 17.292 2.817 -18.215) 25.273 11.823 ( 17.805 -4.944 4.821) 19.097 12.521 ( 0.222 -7.872 1.403) 7.999 12.875 ( -2.270 -4.301 -5.519) 7.356 12.983 ( -12.186 3.830 11.381) 17.108 13.496 ( 8.090 -7.666 -10.616) 15.392 17.518 ( -10.916 0.077 -7.586) 13.294 18.495 ( 7.998 -1.160 10.997) 13.648 18.851 ( -6.779 0.332 -1.239) 6.900 19.573 ( -12.647 -4.906 3.109) 13.917 20.488 ( -1.694 10.553 -18.060) 20.985 22.574 ( 9.107 -9.676 15.192) 20.183 23.218 ( 6.300 5.271 -2.967) 8.734 23.815 ( 9.264 -1.946 5.002) 10.707 ======================= Grid point 524 (256/361) ======================= q-point: (-0.60 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.646 ( -8.563 -7.621 -2.814) 11.804 2.844 ( -11.473 5.625 7.819) 14.980 3.155 ( 5.390 -3.175 -6.339) 8.906 3.475 ( 1.813 0.634 2.367) 3.049 3.693 ( 2.549 4.088 6.360) 7.978 3.785 ( 6.342 -2.331 -1.259) 6.873 4.439 ( 11.631 -1.179 -0.513) 11.702 4.769 ( -8.364 1.878 5.851) 10.379 5.153 ( -12.861 -4.375 1.514) 13.669 5.460 ( -9.623 -3.860 -0.450) 10.378 5.797 ( -8.565 -5.743 -1.410) 10.408 5.954 ( -7.536 -2.087 0.568) 7.840 6.514 ( 4.212 1.156 -3.541) 5.623 6.862 ( 5.232 -3.852 -1.627) 6.697 7.238 ( 3.621 14.046 -1.613) 14.595 7.763 ( -7.000 10.866 2.138) 13.101 8.740 ( -11.810 -7.168 4.189) 14.436 9.155 ( -9.895 -2.581 6.808) 12.285 9.388 ( -1.519 -6.710 2.545) 7.336 9.558 ( -0.846 -2.953 3.200) 4.435 10.428 ( 5.095 22.673 -1.443) 23.283 10.983 ( 4.950 1.045 9.810) 11.038 11.278 ( 16.192 3.228 -19.098) 25.245 12.074 ( 9.968 -5.234 -2.465) 11.525 12.625 ( 2.289 -2.892 0.591) 3.735 12.780 ( -6.425 0.262 -1.739) 6.662 12.961 ( -4.172 0.447 9.837) 10.695 13.611 ( 9.077 -14.700 -8.043) 19.057 17.325 ( -8.424 0.344 -0.103) 8.432 18.705 ( -1.488 -8.574 -1.511) 8.833 18.768 ( 5.685 7.095 2.217) 9.358 19.457 ( -11.966 -3.695 1.360) 12.597 20.253 ( 3.955 8.748 -9.674) 13.630 22.854 ( -4.973 -15.072 8.434) 17.973 23.230 ( 12.912 12.249 -4.233) 18.294 24.060 ( 8.842 -3.681 9.862) 13.748 ======================= Grid point 525 (257/361) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.481 ( -14.505 1.212 -0.373) 14.560 2.676 ( -20.990 8.220 10.837) 25.012 3.308 ( 13.213 -10.219 -4.192) 17.222 3.461 ( -0.188 2.962 -0.082) 2.969 3.761 ( 3.030 7.269 7.160) 10.644 3.893 ( 0.988 -11.303 -1.347) 11.426 4.588 ( 7.347 0.800 -2.560) 7.821 4.682 ( -11.032 -4.160 7.676) 14.068 5.104 ( -3.373 -0.552 5.256) 6.269 5.425 ( -0.508 -3.493 -0.913) 3.646 5.699 ( -6.738 -2.992 -3.275) 8.067 5.904 ( -4.926 -5.338 0.292) 7.269 6.528 ( 0.564 0.690 2.201) 2.375 6.914 ( 1.736 -4.263 -4.191) 6.225 7.169 ( 6.269 7.692 -6.633) 11.935 7.595 ( -8.792 7.741 4.524) 12.557 8.651 ( -12.528 -0.431 4.231) 13.230 9.139 ( -10.411 -4.700 9.369) 14.774 9.492 ( 1.525 -5.167 4.501) 7.020 9.601 ( 1.270 0.288 0.314) 1.340 10.289 ( 0.574 16.976 2.257) 17.135 11.093 ( 1.164 4.641 3.865) 6.151 11.237 ( 14.879 2.869 -17.149) 22.885 12.164 ( 2.985 -4.293 -3.936) 6.545 12.599 ( -6.880 1.470 1.747) 7.249 12.689 ( -3.034 -2.687 -3.327) 5.243 13.063 ( 3.871 3.648 6.078) 8.077 13.785 ( 9.917 -15.072 -8.393) 19.898 17.316 ( -1.901 -2.804 9.897) 10.460 18.547 ( -1.578 -0.470 -18.153) 18.227 18.911 ( 4.945 1.347 5.931) 7.839 19.396 ( -1.018 -1.253 1.285) 2.063 20.174 ( 1.700 5.422 -1.706) 5.933 22.944 ( -11.319 -18.029 3.406) 21.558 23.253 ( 12.971 12.759 -4.009) 18.631 24.313 ( 5.451 -2.811 8.314) 10.332 ======================= Grid point 526 (258/361) ======================= q-point: (-0.40 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( -19.042 9.162 4.600) 21.626 2.423 ( -19.651 11.021 13.685) 26.361 3.437 ( 4.443 1.706 -0.078) 4.760 3.545 ( 5.876 -9.834 -1.755) 11.589 3.797 ( 7.129 6.702 -2.254) 10.041 3.976 ( -9.256 -12.211 6.997) 16.844 4.494 ( -11.745 -8.660 -3.632) 15.037 4.811 ( 4.396 -4.881 5.119) 8.328 5.191 ( 7.914 5.536 5.965) 11.352 5.413 ( -1.616 -0.258 -2.473) 2.965 5.633 ( 0.978 1.814 0.226) 2.073 5.912 ( -0.758 -7.529 -1.912) 7.805 6.594 ( -1.534 -2.550 9.812) 10.253 6.866 ( -5.552 -6.326 -8.299) 11.820 7.093 ( 3.358 1.077 -10.815) 11.375 7.536 ( -5.636 2.975 10.951) 12.670 8.543 ( -8.038 8.549 9.173) 14.894 9.157 ( -10.551 -5.303 9.940) 15.435 9.558 ( 0.352 6.558 -3.983) 7.681 9.614 ( 3.411 -3.295 2.550) 5.385 10.219 ( -4.343 5.052 6.370) 9.218 11.017 ( 0.740 7.568 -7.039) 10.362 11.262 ( 10.878 0.672 -7.558) 13.263 12.131 ( -3.415 -0.160 -4.439) 5.603 12.517 ( -6.747 1.577 3.627) 7.821 12.653 ( -0.617 -3.682 -3.214) 4.926 13.103 ( 1.708 7.413 2.544) 8.022 13.915 ( 9.911 -10.820 -13.099) 19.669 17.555 ( 5.979 -8.247 14.308) 17.564 18.316 ( 4.758 4.185 -17.042) 18.182 19.003 ( -0.094 -4.632 1.496) 4.869 19.472 ( 9.423 1.388 0.788) 9.557 20.117 ( -2.750 6.007 0.496) 6.625 22.986 ( -11.425 -20.213 2.587) 23.362 23.259 ( 9.404 9.194 -4.667) 13.955 24.407 ( -2.046 1.464 0.691) 2.609 ======================= Grid point 527 (259/361) ======================= q-point: (-0.30 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( -16.416 12.594 13.142) 24.511 2.319 ( -10.941 9.412 18.755) 23.665 3.477 ( 0.220 -3.229 -3.701) 4.917 3.586 ( -0.999 -0.851 -1.171) 1.759 3.828 ( 12.823 2.854 -9.765) 16.368 4.000 ( -16.801 -6.241 14.049) 22.773 4.410 ( -4.798 -14.725 -7.520) 17.216 4.937 ( -0.334 -3.211 2.309) 3.969 5.206 ( 1.720 7.044 -3.248) 7.945 5.514 ( 8.468 0.988 12.008) 14.726 5.679 ( 8.706 3.852 0.304) 9.525 5.983 ( 5.610 -6.701 -1.934) 8.951 6.664 ( -13.534 -7.293 -10.046) 18.366 6.778 ( -2.158 -7.208 14.962) 16.747 6.988 ( 0.029 0.691 -9.202) 9.228 7.631 ( -4.087 -6.209 12.448) 14.499 8.508 ( -3.525 15.532 15.859) 22.476 9.175 ( -7.469 -3.381 7.550) 11.145 9.402 ( -0.915 8.425 -8.301) 11.862 9.724 ( 1.572 -4.482 4.473) 6.524 10.190 ( -9.896 -1.046 6.428) 11.846 10.845 ( -0.595 10.905 -7.725) 13.377 11.322 ( 8.470 -1.925 -6.648) 10.938 11.982 ( -7.366 1.822 -5.439) 9.336 12.470 ( -4.388 3.982 5.844) 8.322 12.658 ( 0.559 -3.046 -1.488) 3.435 13.064 ( 0.039 7.553 1.130) 7.638 13.936 ( 9.102 -6.552 -17.566) 20.841 17.796 ( 5.447 -6.182 -5.083) 9.681 18.359 ( 18.727 0.135 5.093) 19.408 19.026 ( -5.747 -11.269 -2.962) 12.992 19.646 ( 17.626 4.222 1.275) 18.170 19.984 ( -7.457 8.862 -0.119) 11.583 23.046 ( -14.498 -24.661 3.019) 28.765 23.243 ( 9.386 7.459 -7.021) 13.894 24.229 ( -11.413 8.627 -6.811) 15.845 ======================= Grid point 528 (260/361) ======================= q-point: (-0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( -4.015 6.729 17.962) 19.596 2.391 ( -5.423 6.074 23.484) 24.856 3.345 ( -9.229 -2.408 -7.385) 12.062 3.632 ( 7.295 -3.245 -4.650) 9.239 3.822 ( 7.864 4.002 -8.659) 12.363 3.992 ( -11.137 -0.843 11.278) 15.873 4.412 ( -1.142 -15.451 -9.623) 18.238 4.848 ( -4.598 6.997 -5.587) 10.065 5.239 ( 3.955 0.108 6.595) 7.690 5.670 ( -3.150 3.228 11.627) 12.472 5.903 ( 20.689 0.819 1.755) 20.780 6.131 ( 10.056 -4.600 -1.047) 11.108 6.413 ( -14.437 -5.176 -4.873) 16.092 6.828 ( -2.593 1.203 -8.773) 9.227 7.032 ( -3.346 -7.823 15.896) 18.030 7.820 ( -5.587 -15.688 14.671) 22.194 8.533 ( -2.453 19.220 19.919) 27.788 9.164 ( -2.510 1.218 -2.128) 3.509 9.234 ( -1.808 5.248 -3.442) 6.531 9.863 ( 1.028 -9.736 5.862) 11.411 10.108 ( -15.086 -2.115 7.373) 16.924 10.631 ( -0.341 16.178 -6.121) 17.300 11.326 ( 3.198 -2.003 -11.132) 11.754 11.804 ( -7.484 -0.111 -4.274) 8.619 12.471 ( -2.855 5.029 8.937) 10.645 12.672 ( 3.483 -0.705 -3.763) 5.176 13.018 ( -0.395 4.603 1.193) 4.772 13.886 ( 8.359 -4.001 -18.043) 20.284 17.796 ( 7.200 -1.860 -10.470) 12.842 18.773 ( 21.288 1.034 5.537) 22.021 18.981 ( -7.822 -17.504 -5.409) 19.921 19.759 ( -11.411 8.640 -0.881) 14.340 19.935 ( 23.454 5.541 6.510) 24.963 23.021 ( -21.846 -23.425 -4.293) 32.318 23.254 ( 11.059 3.094 -5.988) 12.952 23.823 ( -16.585 15.266 -6.770) 23.536 ======================= Grid point 529 (261/361) ======================= q-point: (-0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 2.764 1.629 15.923) 16.243 2.615 ( -0.242 1.170 24.410) 24.440 3.155 ( -6.514 -1.499 -7.139) 9.779 3.649 ( 2.854 -4.275 -11.829) 12.897 3.826 ( 11.988 4.716 -8.158) 15.248 3.964 ( -7.754 -0.161 6.779) 10.300 4.395 ( -1.666 -11.340 -10.146) 15.307 4.625 ( -5.588 9.053 -6.466) 12.450 5.413 ( 4.297 -0.839 11.073) 11.907 5.725 ( -5.077 2.715 12.092) 13.393 6.085 ( 1.310 0.669 0.747) 1.650 6.291 ( 9.839 -2.581 -1.244) 10.248 6.347 ( 5.189 -1.370 0.891) 5.441 6.668 ( -3.948 -0.025 -8.104) 9.014 7.211 ( -6.685 -3.860 17.392) 19.028 8.107 ( -4.588 -23.574 14.298) 27.951 8.553 ( -4.867 21.960 21.398) 31.045 9.077 ( -0.438 0.593 -3.354) 3.434 9.146 ( -0.389 4.552 -4.387) 6.335 10.015 ( -13.454 -8.009 5.243) 16.512 10.047 ( -0.625 -7.709 5.771) 9.650 10.439 ( 2.486 17.927 1.493) 18.160 11.188 ( 0.019 -0.023 -14.879) 14.879 11.665 ( -6.276 -2.201 -6.249) 9.126 12.498 ( -3.128 3.641 8.173) 9.478 12.688 ( 8.170 1.143 -6.105) 10.263 13.008 ( -1.275 1.029 3.376) 3.753 13.818 ( 6.934 -2.193 -15.433) 17.061 17.816 ( 9.091 -0.674 -6.717) 11.323 18.721 ( -8.011 -2.487 -14.132) 16.434 19.242 ( 16.321 -7.400 2.941) 18.160 19.519 ( -14.454 6.110 3.240) 16.024 20.363 ( 27.371 2.481 11.252) 29.698 22.696 ( -28.749 -10.107 -16.029) 34.432 23.325 ( 7.510 -1.472 -3.570) 8.444 23.461 ( -10.639 9.981 -0.049) 14.588 ======================= Grid point 531 (262/361) ======================= q-point: ( 0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( 1.833 -0.000 -10.798) 10.952 2.846 ( 10.658 -0.000 7.068) 12.788 3.372 ( -1.649 0.000 1.788) 2.432 3.379 ( -1.874 0.000 -5.913) 6.203 3.639 ( -3.085 0.000 -16.117) 16.410 3.716 ( 3.531 -0.000 15.843) 16.232 4.168 ( -2.010 0.000 0.591) 2.095 4.554 ( 6.020 -0.000 2.324) 6.453 5.642 ( -22.168 0.000 2.844) 22.349 5.732 ( -10.207 0.000 4.275) 11.066 5.909 ( -2.866 0.000 -0.301) 2.882 6.134 ( -7.857 0.000 -1.211) 7.950 6.549 ( 5.398 -0.000 -7.316) 9.092 6.586 ( 5.967 -0.000 0.957) 6.043 7.877 ( -9.699 0.000 -9.338) 13.463 7.904 ( -4.343 0.000 24.713) 25.092 8.669 ( -11.971 0.000 11.641) 16.698 9.040 ( 2.883 -0.000 -3.151) 4.271 9.352 ( 0.684 -0.000 11.696) 11.716 9.551 ( -5.363 0.000 -15.337) 16.247 10.415 ( 5.135 -0.000 19.397) 20.066 10.831 ( 11.716 -0.000 -11.076) 16.123 11.333 ( 16.784 -0.000 15.372) 22.760 11.359 ( 14.315 -0.000 -17.053) 22.264 12.391 ( -4.733 0.000 0.588) 4.770 12.809 ( 4.216 -0.000 -5.906) 7.256 13.083 ( -9.699 0.000 10.222) 14.091 13.528 ( 3.107 -0.000 -14.004) 14.344 17.773 ( -10.512 0.000 -11.406) 15.511 18.237 ( 9.354 -0.000 8.010) 12.315 19.005 ( -13.949 0.000 4.242) 14.580 19.619 ( -7.412 0.000 1.987) 7.674 20.987 ( -10.605 0.000 -23.535) 25.814 22.028 ( 17.086 -0.000 21.178) 27.211 23.218 ( 1.835 -0.000 0.679) 1.957 23.640 ( 10.310 -0.000 -1.120) 10.371 ======================= Grid point 532 (263/361) ======================= q-point: (-0.80 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.582 ( -0.082 -2.343 -11.404) 11.643 2.985 ( -0.980 1.059 3.968) 4.222 3.307 ( -3.340 3.942 -7.912) 9.449 3.371 ( 2.611 1.464 4.417) 5.336 3.504 ( 4.443 -6.726 -7.732) 11.170 3.870 ( 0.714 5.492 10.298) 11.692 4.257 ( 6.301 -0.086 6.850) 9.308 4.658 ( 2.346 -5.411 1.277) 6.035 5.359 ( -19.620 1.337 1.434) 19.718 5.568 ( -17.859 -2.076 0.712) 17.994 5.845 ( -6.836 -0.612 0.175) 6.865 6.021 ( -8.378 -0.712 0.698) 8.437 6.535 ( 6.432 1.019 -7.393) 9.852 6.697 ( 6.466 -2.001 0.794) 6.815 7.630 ( -5.309 8.479 -5.839) 11.584 8.031 ( -9.596 4.451 14.437) 17.898 8.658 ( -10.904 -3.355 9.853) 15.075 9.065 ( 2.877 -3.302 -2.081) 4.849 9.307 ( -6.625 -4.529 -12.281) 14.671 9.484 ( -2.509 0.843 12.312) 12.593 10.724 ( 7.300 0.492 15.901) 17.504 10.879 ( 16.207 9.514 -7.464) 20.221 11.348 ( 17.070 3.060 -18.721) 25.519 11.734 ( 14.499 -4.394 8.380) 17.313 12.406 ( 2.230 -3.979 3.631) 5.830 12.781 ( -0.819 -3.939 -5.874) 7.119 13.041 ( -13.408 1.873 11.258) 17.608 13.412 ( 4.688 -2.103 -14.405) 15.294 17.518 ( -10.512 0.000 -6.638) 12.433 18.477 ( 7.760 -0.622 9.996) 12.670 18.872 ( -8.865 1.150 2.326) 9.237 19.502 ( -13.937 -2.457 3.251) 14.521 20.622 ( 0.119 4.048 -22.475) 22.837 22.441 ( 4.599 -4.268 17.356) 18.455 23.304 ( 9.651 3.189 2.570) 10.484 23.779 ( 9.323 -1.511 0.821) 9.480 ======================= Grid point 533 (264/361) ======================= q-point: (-0.70 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( -0.956 -7.006 -7.862) 10.574 2.941 ( -10.552 4.214 7.896) 13.837 3.129 ( 2.013 0.305 -12.113) 12.282 3.444 ( -1.843 -4.003 2.874) 5.261 3.609 ( 7.867 -4.993 -2.302) 9.598 3.932 ( 0.254 10.137 11.193) 15.103 4.441 ( 9.538 1.528 5.315) 11.025 4.727 ( -4.645 -6.931 1.439) 8.467 5.134 ( -13.724 3.015 3.555) 14.494 5.356 ( -14.915 -6.895 -0.398) 16.436 5.745 ( -8.659 -0.881 0.682) 8.731 5.931 ( -6.872 -0.795 0.798) 6.963 6.532 ( 4.610 0.892 -4.665) 6.619 6.802 ( 4.685 -2.725 -0.487) 5.441 7.456 ( -0.306 9.686 -3.976) 10.475 7.909 ( -15.654 5.090 3.546) 16.838 8.658 ( -8.245 -1.387 8.626) 12.013 9.055 ( -5.399 -7.555 -5.672) 10.881 9.246 ( 2.272 -6.778 0.174) 7.151 9.566 ( -5.106 1.949 12.476) 13.621 10.832 ( 10.138 19.742 -3.353) 22.445 11.021 ( 9.794 3.070 8.863) 13.561 11.330 ( 16.910 2.668 -19.565) 25.998 11.967 ( 7.413 -6.682 -1.895) 10.158 12.578 ( 6.229 -1.349 2.830) 6.974 12.731 ( -1.792 -5.610 -4.092) 7.171 12.983 ( -11.298 1.843 14.431) 18.420 13.385 ( 7.009 -9.592 -11.619) 16.617 17.331 ( -9.542 0.249 -0.293) 9.550 18.593 ( -3.074 -4.085 -3.322) 6.097 18.883 ( 5.616 5.307 10.071) 12.693 19.391 ( -9.759 -3.314 2.693) 10.652 20.371 ( 3.022 4.473 -16.807) 17.653 22.633 ( -7.187 -9.069 8.932) 14.618 23.449 ( 13.246 11.493 3.076) 17.805 23.969 ( 8.207 -6.175 5.516) 11.658 ======================= Grid point 534 (265/361) ======================= q-point: (-0.60 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( -4.732 -3.086 -1.587) 5.868 2.814 ( -16.398 7.192 10.532) 20.774 3.135 ( 10.607 -8.372 -7.293) 15.355 3.457 ( -2.438 -3.634 -0.994) 4.488 3.700 ( 1.230 -7.541 -2.152) 7.938 3.971 ( 1.451 12.874 10.451) 16.645 4.594 ( -12.691 -4.507 5.125) 14.409 4.627 ( 1.527 3.047 -0.327) 3.424 5.077 ( -2.228 -4.316 6.141) 7.830 5.314 ( -2.756 -6.393 1.616) 7.147 5.657 ( -6.644 -1.005 2.196) 7.069 5.866 ( -3.656 -0.357 0.024) 3.673 6.532 ( 0.168 -0.209 -0.270) 0.381 6.846 ( -0.038 -3.254 -2.759) 4.266 7.312 ( 0.151 8.335 -8.498) 11.904 7.671 ( -16.920 0.600 2.620) 17.132 8.653 ( -4.828 2.006 6.529) 8.365 9.010 ( -6.495 -9.852 0.196) 11.802 9.391 ( 4.979 -5.003 4.458) 8.348 9.612 ( -6.313 1.278 10.890) 12.652 10.688 ( 5.725 25.077 -4.360) 26.089 11.189 ( 7.125 5.433 4.486) 10.020 11.291 ( 14.911 2.892 -19.499) 24.716 12.065 ( 3.722 -6.574 -3.452) 8.306 12.577 ( -2.560 -3.518 -3.940) 5.870 12.683 ( -8.304 1.270 2.264) 8.700 13.105 ( 4.964 1.459 8.970) 10.355 13.501 ( 8.626 -15.795 -6.469) 19.124 17.272 ( -5.395 -1.982 7.871) 9.746 18.470 ( -4.017 -5.449 -13.377) 14.992 19.042 ( 7.899 9.970 7.578) 14.806 19.376 ( 1.242 -1.120 2.095) 2.681 20.224 ( 0.555 0.564 -8.224) 8.262 22.660 ( -12.872 -13.010 4.211) 18.780 23.510 ( 10.720 15.440 -0.395) 18.801 24.219 ( 5.127 -7.709 7.771) 12.088 ======================= Grid point 535 (266/361) ======================= q-point: (-0.50 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( -7.679 6.669 5.720) 11.668 2.612 ( -19.910 10.716 12.611) 25.890 3.340 ( 9.749 -12.805 -2.273) 16.253 3.439 ( 1.358 -1.982 -3.183) 3.988 3.751 ( -3.399 -11.353 -0.217) 11.853 3.991 ( 5.147 13.787 4.668) 15.439 4.347 ( -22.018 -7.704 -0.383) 23.330 4.749 ( 3.048 -1.642 5.170) 6.222 5.244 ( 5.551 -5.031 8.582) 11.392 5.351 ( -0.074 -0.745 0.340) 0.822 5.652 ( -0.062 0.187 4.199) 4.204 5.843 ( -0.012 -0.579 0.178) 0.606 6.549 ( -2.998 -2.902 5.097) 6.587 6.764 ( -9.776 -4.791 -6.488) 12.674 7.122 ( -1.777 2.466 -10.349) 10.786 7.535 ( -11.077 -3.058 4.755) 12.436 8.666 ( -0.788 6.096 8.609) 10.578 9.036 ( -7.780 -8.897 5.862) 13.192 9.548 ( 3.970 -2.927 4.458) 6.648 9.625 ( -4.961 1.429 5.705) 7.694 10.476 ( 0.558 22.058 -1.919) 22.148 11.169 ( 11.241 8.134 -16.116) 21.266 11.294 ( 7.542 3.236 -3.319) 8.853 12.099 ( -0.797 -3.585 -2.904) 4.682 12.534 ( -3.771 -1.106 0.541) 3.967 12.596 ( -5.878 -1.225 2.245) 6.410 13.202 ( 3.406 3.430 1.283) 5.001 13.692 ( 8.813 -13.500 -6.611) 17.425 17.420 ( 1.327 -6.722 14.226) 15.790 18.294 ( 0.258 -5.277 -17.408) 18.192 19.073 ( 3.848 11.119 0.568) 11.780 19.500 ( 12.458 1.434 1.865) 12.678 20.158 ( -3.087 -1.418 -1.930) 3.907 22.639 ( -15.436 -17.022 3.689) 23.273 23.484 ( 8.477 14.649 -3.181) 17.221 24.375 ( -1.650 -4.899 3.098) 6.027 ======================= Grid point 536 (267/361) ======================= q-point: (-0.40 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( -12.768 16.932 12.110) 24.421 2.469 ( -12.137 7.430 16.479) 21.773 3.402 ( -4.901 -5.958 -2.417) 8.084 3.539 ( 5.449 -4.273 -1.514) 7.088 3.797 ( -3.622 -10.025 0.303) 10.664 3.992 ( 8.090 9.390 -1.168) 12.449 4.171 ( -12.449 -11.662 -2.395) 17.225 4.863 ( -0.139 -4.020 5.795) 7.054 5.294 ( -3.682 0.027 -2.456) 4.426 5.519 ( 10.351 1.022 12.442) 16.217 5.729 ( 6.367 1.672 1.955) 6.867 5.898 ( 3.510 -2.154 3.183) 5.205 6.534 ( -16.206 -7.217 -7.712) 19.344 6.645 ( -3.311 -7.408 11.040) 13.701 6.987 ( -1.507 -0.464 -8.590) 8.733 7.515 ( -7.860 -7.115 5.728) 12.050 8.724 ( 0.293 8.772 11.956) 14.832 9.089 ( -8.662 -6.844 10.656) 15.343 9.543 ( -4.581 5.066 -2.750) 7.363 9.660 ( 2.561 -0.731 2.428) 3.603 10.297 ( -4.407 13.680 3.451) 14.781 11.042 ( 11.321 10.109 -17.116) 22.876 11.317 ( 5.651 2.136 -4.236) 7.379 12.014 ( -6.610 1.122 -4.258) 7.942 12.517 ( -4.375 1.307 6.770) 8.166 12.604 ( 0.679 -2.895 0.743) 3.065 13.189 ( 0.274 5.498 -0.374) 5.517 13.792 ( 6.698 -9.195 -11.490) 16.169 17.680 ( 4.864 -6.714 5.014) 9.689 18.252 ( 8.238 -11.263 -5.734) 15.086 18.997 ( 0.435 7.653 -3.346) 8.364 19.713 ( 18.177 3.245 0.600) 18.474 20.087 ( -5.034 2.309 -0.200) 5.542 22.627 ( -17.693 -20.974 4.334) 27.780 23.424 ( 7.818 12.111 -5.391) 15.390 24.310 ( -9.673 0.670 -4.038) 10.503 ======================= Grid point 537 (268/361) ======================= q-point: (-0.30 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( -6.905 13.526 14.956) 21.315 2.501 ( -8.587 5.602 21.387) 23.717 3.287 ( -10.222 -4.033 -5.573) 12.321 3.579 ( 2.094 -2.880 -3.734) 5.160 3.843 ( -0.901 -4.164 2.764) 5.078 4.016 ( 8.293 5.512 -6.510) 11.897 4.143 ( -2.291 -13.484 -4.068) 14.269 4.897 ( -4.933 -1.366 -1.054) 5.226 5.265 ( 1.682 2.256 5.215) 5.925 5.736 ( -1.045 3.908 13.204) 13.810 5.899 ( 17.360 -1.816 0.523) 17.463 6.044 ( 5.703 -4.283 4.787) 8.590 6.313 ( -12.316 -5.354 -3.315) 13.833 6.835 ( -1.599 -5.049 4.368) 6.865 6.858 ( -5.155 -6.470 0.862) 8.318 7.572 ( -8.684 -12.622 8.354) 17.450 8.796 ( -0.699 9.726 14.008) 17.068 9.170 ( -7.942 -2.426 13.459) 15.815 9.358 ( -1.912 8.022 -7.805) 11.354 9.709 ( -0.663 -3.737 0.964) 3.916 10.182 ( -7.994 8.855 7.511) 14.097 10.899 ( 10.313 13.418 -14.311) 22.163 11.296 ( 3.434 -0.328 -9.397) 10.010 11.823 ( -10.062 2.022 -4.373) 11.156 12.547 ( -2.712 2.859 9.094) 9.911 12.661 ( 4.604 -0.313 -0.276) 4.623 13.121 ( -1.783 6.237 0.217) 6.490 13.786 ( 5.571 -6.906 -14.484) 16.985 17.754 ( 6.815 -2.621 -8.052) 10.869 18.567 ( 7.018 -20.957 6.381) 23.003 18.898 ( 4.211 6.184 -4.913) 8.950 19.833 ( -4.064 0.699 -4.346) 5.991 20.094 ( 18.574 10.247 5.862) 22.008 22.597 ( -21.584 -22.497 2.077) 31.246 23.370 ( 8.573 8.676 -6.665) 13.900 24.020 ( -15.221 7.028 -7.749) 18.469 ======================= Grid point 538 (269/361) ======================= q-point: (-0.20 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( 0.823 5.781 14.236) 15.387 2.644 ( -4.655 1.737 23.262) 23.787 3.110 ( -7.796 -3.307 -6.388) 10.608 3.561 ( 0.261 -4.915 -8.090) 9.470 3.923 ( -1.821 -5.403 0.740) 5.749 3.934 ( 9.254 6.015 -12.741) 16.857 4.209 ( 1.404 -7.431 -1.443) 7.698 4.749 ( -6.532 4.016 -6.160) 9.836 5.404 ( 3.362 0.350 11.671) 12.151 5.803 ( -3.840 5.397 12.086) 13.782 6.098 ( 1.432 0.281 1.090) 1.822 6.218 ( 6.835 -5.712 5.310) 10.370 6.296 ( 8.449 -3.373 -0.338) 9.104 6.671 ( -5.884 0.286 -8.247) 10.135 7.077 ( -3.971 -10.993 14.952) 18.979 7.706 ( -9.510 -20.677 10.895) 25.232 8.863 ( -2.308 11.152 15.726) 19.416 9.128 ( -5.984 5.538 1.610) 8.311 9.265 ( -0.123 6.415 0.763) 6.462 9.756 ( -1.859 -10.132 -0.130) 10.302 10.100 ( -9.020 6.099 11.087) 15.540 10.757 ( 9.115 16.688 -8.465) 20.814 11.187 ( 1.711 0.131 -14.160) 14.264 11.619 ( -9.626 -1.910 -6.195) 11.605 12.590 ( -2.528 5.140 8.927) 10.606 12.725 ( 8.479 2.954 -2.388) 9.291 13.050 ( -3.183 3.783 1.856) 5.280 13.743 ( 5.196 -6.070 -14.160) 16.258 17.795 ( 9.000 -1.692 -5.970) 10.932 18.633 ( -9.863 -7.532 -7.982) 14.755 19.094 ( 16.946 -7.369 3.518) 18.811 19.624 ( -11.280 4.206 -3.514) 12.541 20.451 ( 26.594 7.364 10.710) 29.601 22.427 ( -26.349 -17.682 -6.243) 32.340 23.359 ( 8.871 4.509 -5.598) 11.418 23.646 ( -14.103 9.366 -5.182) 17.705 ======================= Grid point 539 (270/361) ======================= q-point: (-0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( 6.040 1.490 12.013) 13.528 2.824 ( -1.948 -0.877 6.537) 6.877 3.065 ( 0.343 -4.605 8.956) 10.076 3.492 ( -0.836 -5.174 -8.944) 10.367 3.753 ( -1.415 -0.323 -15.315) 15.383 3.984 ( 3.036 0.488 -4.718) 5.632 4.278 ( 2.678 -2.413 1.625) 3.954 4.529 ( -5.872 6.789 -6.444) 11.050 5.593 ( 1.857 -0.720 12.248) 12.409 5.838 ( -5.654 5.250 12.758) 14.910 6.074 ( -3.793 1.141 0.314) 3.973 6.362 ( 3.027 0.018 -2.594) 3.986 6.444 ( 6.593 -1.110 -0.373) 6.697 6.532 ( -0.170 -2.658 -4.725) 5.424 7.304 ( -4.520 -7.931 20.715) 22.637 7.915 ( -8.491 -27.338 6.768) 29.415 8.887 ( -6.983 17.284 17.471) 25.549 9.065 ( -1.032 1.784 0.489) 2.118 9.162 ( -0.051 7.593 -2.063) 7.868 9.813 ( -1.526 -10.211 -2.493) 10.621 10.101 ( -5.999 3.625 11.627) 13.576 10.706 ( 9.191 12.894 3.593) 16.237 11.026 ( 2.025 1.715 -14.360) 14.603 11.457 ( -2.419 -4.994 -11.143) 12.448 12.575 ( -4.467 7.005 5.267) 9.837 12.780 ( 9.984 4.730 -4.433) 11.904 13.030 ( -3.991 -0.660 5.649) 6.948 13.699 ( 4.493 -4.668 -12.667) 14.228 17.891 ( 9.577 -0.727 -1.487) 9.719 18.398 ( -9.852 -1.224 -13.568) 16.813 19.289 ( -11.242 -3.672 4.746) 12.743 19.506 ( 9.117 -0.349 -2.184) 9.381 20.932 ( 25.709 3.177 15.793) 30.339 22.027 ( -27.013 -7.682 -15.399) 32.029 23.345 ( -5.700 4.640 -0.682) 7.381 23.439 ( 5.822 2.350 -3.992) 7.440 ======================= Grid point 542 (271/361) ======================= q-point: ( 0.20 0.20 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.434 ( 0.558 -0.000 -9.617) 9.633 2.974 ( -7.487 0.000 5.433) 9.251 3.150 ( -0.574 0.000 -14.210) 14.221 3.384 ( -3.021 0.000 2.323) 3.811 3.570 ( 7.582 -0.000 0.167) 7.584 4.037 ( -0.835 0.000 13.880) 13.905 4.478 ( 9.462 -0.000 8.490) 12.713 4.620 ( -3.132 0.000 -0.667) 3.203 5.212 ( -7.098 0.000 4.084) 8.189 5.250 ( -23.656 0.000 -1.925) 23.734 5.740 ( -9.069 0.000 1.789) 9.244 5.924 ( -6.480 0.000 0.930) 6.546 6.541 ( 4.691 -0.000 -5.467) 7.203 6.775 ( 4.396 -0.000 0.291) 4.405 7.548 ( -1.969 0.000 -4.975) 5.350 7.950 ( -19.199 0.000 3.182) 19.461 8.660 ( -8.946 0.000 14.179) 16.766 8.970 ( -1.673 0.000 -13.338) 13.443 9.183 ( 4.139 -0.000 1.182) 4.305 9.587 ( -6.432 0.000 13.836) 15.259 10.994 ( 5.734 -0.000 11.446) 12.802 11.090 ( 19.729 -0.000 -7.689) 21.174 11.366 ( 17.783 -0.000 -21.379) 27.808 11.882 ( 3.717 -0.000 1.131) 3.885 12.585 ( 12.093 -0.000 6.803) 13.876 12.648 ( -4.640 0.000 -6.218) 7.758 13.003 ( -13.488 0.000 15.285) 20.385 13.297 ( 6.055 -0.000 -14.356) 15.581 17.333 ( -9.971 0.000 -0.330) 9.977 18.557 ( -3.593 0.000 -3.553) 5.053 18.935 ( 5.257 -0.000 12.960) 13.985 19.358 ( -8.730 0.000 3.095) 9.262 20.411 ( 2.717 -0.000 -19.951) 20.135 22.550 ( -7.652 0.000 9.378) 12.103 23.576 ( 13.552 -0.000 9.543) 16.575 23.891 ( 7.492 -0.000 0.125) 7.493 ======================= Grid point 543 (272/361) ======================= q-point: (-0.70 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.405 ( 3.258 -2.020 -1.610) 4.157 2.917 ( -12.806 3.626 9.346) 16.263 3.026 ( 6.720 -3.388 -11.867) 14.052 3.375 ( -1.878 -3.694 -0.976) 4.257 3.623 ( -1.203 -1.696 0.106) 2.082 4.155 ( -4.552 6.005 15.512) 17.246 4.555 ( -6.881 0.363 -0.146) 6.892 4.675 ( 4.268 1.615 2.893) 5.403 4.949 ( -14.204 -6.870 2.343) 15.951 5.259 ( 2.966 -0.696 5.444) 6.238 5.652 ( -9.312 0.053 5.843) 10.994 5.865 ( -2.295 -0.011 -0.484) 2.345 6.526 ( -0.820 -0.261 -1.779) 1.976 6.804 ( -0.833 -1.273 -1.512) 2.145 7.444 ( -1.240 5.411 -7.360) 9.219 7.641 ( -22.412 -2.593 -2.914) 22.749 8.710 ( -5.966 3.105 13.005) 14.641 8.849 ( -0.481 -6.286 -7.214) 9.580 9.327 ( 7.646 -2.033 5.472) 9.620 9.635 ( -9.873 0.874 13.821) 17.008 11.069 ( 5.285 14.034 -2.508) 15.204 11.261 ( 14.568 2.169 -1.915) 14.853 11.333 ( 16.556 1.714 -22.301) 27.828 11.947 ( 1.617 -5.447 0.337) 5.692 12.519 ( -4.596 -2.154 -4.303) 6.654 12.696 ( -5.491 0.194 2.686) 6.116 13.134 ( 4.533 2.175 13.186) 14.112 13.272 ( 7.427 -8.743 -8.329) 14.177 17.248 ( -7.413 -0.707 6.754) 10.053 18.400 ( -4.556 -2.093 -12.285) 13.269 19.187 ( 8.065 5.019 13.066) 16.154 19.358 ( 3.260 -0.689 2.832) 4.373 20.216 ( -0.272 -0.759 -15.207) 15.228 22.501 ( -13.193 -4.597 4.755) 14.758 23.778 ( 8.546 13.803 5.456) 17.127 24.047 ( 5.452 -10.932 3.941) 12.836 ======================= Grid point 544 (273/361) ======================= q-point: (-0.60 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( 0.409 3.769 7.030) 7.987 2.794 ( -13.355 8.450 10.157) 18.786 3.116 ( 8.013 -10.648 -3.421) 13.759 3.378 ( 1.731 -4.265 -3.538) 5.806 3.601 ( -4.386 -5.346 -0.692) 6.950 4.160 ( -15.205 -1.484 8.768) 17.615 4.322 ( -7.236 11.014 -2.731) 13.458 4.736 ( 0.196 -1.390 5.090) 5.280 5.054 ( 0.029 -10.943 7.012) 12.997 5.401 ( 8.046 2.802 5.757) 10.283 5.645 ( -5.776 -0.622 10.570) 12.061 5.851 ( 2.124 0.628 -1.044) 2.448 6.493 ( -5.265 -2.850 2.053) 6.329 6.703 ( -12.889 -2.158 -3.613) 13.558 7.185 ( -8.778 4.363 -9.714) 13.801 7.449 ( -7.603 -5.767 -3.568) 10.188 8.764 ( -2.338 4.385 11.745) 12.753 8.868 ( -1.419 -8.291 0.074) 8.412 9.524 ( 6.243 -0.225 7.670) 9.892 9.638 ( -10.525 0.372 12.008) 15.972 10.888 ( 2.999 21.191 -8.610) 23.069 11.259 ( 14.359 2.308 -22.657) 26.923 11.382 ( 11.358 5.476 -2.622) 12.879 12.015 ( -0.499 -5.383 0.421) 5.423 12.475 ( -1.258 -3.802 -0.638) 4.055 12.611 ( -10.295 1.302 5.482) 11.736 13.218 ( 6.011 -1.513 -5.583) 8.342 13.484 ( 7.277 -8.315 4.591) 11.965 17.324 ( -1.812 -3.836 13.702) 14.344 18.198 ( -1.955 -4.328 -17.527) 18.159 19.311 ( 5.125 13.354 4.252) 14.922 19.519 ( 14.568 0.709 2.248) 14.758 20.081 ( -3.150 -6.366 -7.580) 10.388 22.407 ( -15.897 -8.794 4.234) 18.654 23.756 ( 4.964 15.577 -0.556) 16.358 24.240 ( -0.669 -10.153 3.718) 10.833 ======================= Grid point 545 (274/361) ======================= q-point: (-0.50 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.497 ( -5.233 9.924 12.327) 16.668 2.635 ( -13.618 13.611 12.724) 23.078 3.248 ( -2.658 -10.962 -0.788) 11.307 3.448 ( 6.994 -5.637 -2.716) 9.385 3.605 ( -2.059 -10.085 -2.631) 10.624 3.982 ( -17.291 -8.240 2.117) 19.271 4.222 ( 7.245 13.218 -2.324) 15.251 4.809 ( -3.163 -2.263 6.885) 7.908 5.199 ( -1.982 -7.681 4.662) 9.201 5.577 ( 11.027 3.637 7.158) 13.640 5.740 ( -0.391 -0.275 9.933) 9.944 5.894 ( 2.703 1.041 3.961) 4.907 6.418 ( -17.235 -5.388 -5.465) 18.866 6.522 ( -8.245 -6.439 8.051) 13.201 6.985 ( -3.115 0.480 -8.065) 8.659 7.385 ( -4.378 -6.975 -3.000) 8.765 8.836 ( -4.562 4.247 13.951) 15.280 8.945 ( -0.856 -8.187 3.307) 8.871 9.580 ( -13.526 1.249 11.845) 18.023 9.700 ( 6.537 3.050 3.196) 7.889 10.619 ( 0.225 19.866 -7.810) 21.347 11.158 ( 14.406 2.985 -23.085) 27.375 11.420 ( 9.272 8.552 -4.625) 13.434 12.007 ( -5.360 -2.064 -1.631) 5.971 12.516 ( -1.576 -1.324 4.908) 5.322 12.567 ( -3.616 -0.990 5.910) 6.999 13.232 ( 3.559 -0.886 -5.187) 6.353 13.643 ( 2.983 -6.432 -1.282) 7.205 17.567 ( 3.674 -5.736 13.492) 15.114 18.049 ( 2.378 -9.760 -14.350) 17.517 19.219 ( 1.619 15.462 -3.629) 15.965 19.752 ( 14.795 0.817 0.075) 14.818 20.063 ( 2.250 -4.611 -1.571) 5.366 22.327 ( -17.642 -12.606 5.339) 22.331 23.656 ( 3.698 13.670 -3.739) 14.646 24.263 ( -8.079 -5.702 -1.891) 10.068 ======================= Grid point 546 (275/361) ======================= q-point: (-0.40 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( -10.308 16.232 11.393) 22.350 2.591 ( -8.979 5.455 18.096) 20.925 3.203 ( -10.273 -5.517 -3.087) 12.062 3.513 ( -1.109 -5.150 -2.446) 5.808 3.667 ( 2.853 -13.713 -5.504) 15.049 3.970 ( -3.735 -5.934 6.896) 9.835 4.179 ( 11.965 11.010 -9.331) 18.747 4.827 ( -6.613 -5.584 0.949) 8.707 5.287 ( 1.241 -0.098 7.477) 7.580 5.798 ( 5.271 1.511 11.264) 12.527 5.855 ( 6.244 -1.249 3.168) 7.112 5.991 ( -2.285 -1.281 10.945) 11.254 6.232 ( -6.490 -4.119 -1.684) 7.869 6.631 ( -5.640 -11.849 11.093) 17.183 6.848 ( -3.673 -0.050 -7.722) 8.551 7.372 ( -5.390 -9.637 -0.382) 11.049 8.900 ( -5.153 2.975 13.605) 14.849 9.068 ( -1.773 -7.410 8.479) 11.399 9.474 ( -12.094 4.494 4.545) 13.679 9.755 ( 2.565 6.795 2.964) 7.845 10.391 ( -1.826 13.741 -2.768) 14.135 11.065 ( 15.824 4.394 -21.594) 27.129 11.368 ( 5.716 9.263 -8.570) 13.854 11.859 ( -11.056 1.550 -3.445) 11.683 12.565 ( -3.432 -0.578 8.814) 9.476 12.664 ( 5.922 0.380 4.464) 7.426 13.205 ( 0.150 2.338 -2.662) 3.547 13.664 ( 0.225 -5.977 -7.103) 9.286 17.712 ( 6.259 -1.782 -5.257) 8.366 18.205 ( 5.088 -18.830 6.892) 20.687 19.053 ( 1.991 10.711 -6.386) 12.628 19.807 ( -5.008 -3.532 -3.782) 7.201 20.250 ( 24.118 6.887 2.575) 25.213 22.256 ( -20.127 -15.398 4.864) 25.804 23.543 ( 4.117 10.491 -5.659) 12.611 24.080 ( -13.364 0.011 -6.807) 14.998 ======================= Grid point 547 (276/361) ======================= q-point: (-0.30 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.303 ( -3.738 9.261 11.395) 15.152 2.676 ( -7.354 2.288 20.651) 22.040 3.046 ( -8.874 -3.806 -4.961) 10.856 3.475 ( -3.258 -5.252 -6.140) 8.712 3.744 ( 1.543 -12.254 -8.491) 14.988 4.042 ( 3.355 3.944 0.698) 5.224 4.165 ( 9.271 2.705 -4.809) 10.789 4.753 ( -6.130 -3.463 -4.650) 8.437 5.428 ( 3.107 1.902 11.690) 12.244 5.904 ( -2.708 5.793 12.514) 14.054 6.065 ( 10.453 -8.432 1.508) 13.514 6.095 ( -5.259 -2.747 11.399) 12.850 6.271 ( 7.686 0.145 1.848) 7.906 6.671 ( -6.929 -0.801 -7.373) 10.149 6.843 ( -2.885 -14.154 11.929) 18.734 7.395 ( -8.428 -13.995 2.820) 16.579 8.969 ( -4.665 2.614 13.413) 14.440 9.200 ( -7.475 -2.780 11.778) 14.224 9.312 ( -3.158 3.866 -2.471) 5.570 9.747 ( -0.899 7.163 5.095) 8.836 10.244 ( -4.193 9.258 1.420) 10.262 10.999 ( 16.459 8.608 -17.602) 25.590 11.226 ( 3.371 6.631 -12.027) 14.141 11.616 ( -13.403 1.411 -5.541) 14.572 12.637 ( -2.433 -0.091 8.837) 9.167 12.800 ( 9.524 5.277 3.535) 11.448 13.131 ( -3.910 4.514 -0.060) 5.972 13.617 ( 0.935 -7.534 -10.794) 13.196 17.761 ( 8.838 -1.928 -4.996) 10.334 18.458 ( -3.887 -11.564 3.397) 12.664 19.014 ( 9.795 -1.446 -3.114) 10.380 19.654 ( -9.321 -0.732 -6.123) 11.176 20.608 ( 27.967 9.567 7.648) 30.531 22.126 ( -23.128 -15.227 -0.265) 27.692 23.463 ( 5.694 6.773 -5.814) 10.588 23.771 ( -14.101 4.524 -7.328) 16.522 ======================= Grid point 548 (277/361) ======================= q-point: (-0.20 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.386 ( 3.827 3.454 10.982) 12.132 2.802 ( -4.683 -1.354 9.455) 10.637 2.982 ( -0.263 -4.044 4.585) 6.119 3.386 ( -4.011 -6.498 -7.498) 10.702 3.696 ( -0.910 -5.325 -11.824) 13.000 4.019 ( 4.458 3.407 -7.848) 9.647 4.261 ( 4.529 -0.489 4.186) 6.186 4.613 ( -4.088 2.376 -6.740) 8.233 5.601 ( 1.970 1.287 12.656) 12.873 5.945 ( -5.175 6.674 12.586) 15.157 6.094 ( -2.878 0.779 -0.768) 3.079 6.344 ( 6.516 -5.063 6.010) 10.208 6.399 ( 6.611 -1.322 -0.116) 6.743 6.498 ( -4.464 -0.722 -4.957) 6.710 7.106 ( -0.916 -14.479 14.794) 20.720 7.462 ( -10.375 -21.759 4.254) 24.479 9.043 ( -3.611 2.976 12.268) 13.130 9.140 ( -8.085 5.551 8.184) 12.773 9.292 ( -2.972 2.277 -0.884) 3.847 9.738 ( 0.547 3.967 2.412) 4.674 10.168 ( -3.905 4.331 7.417) 9.435 10.937 ( 9.017 10.657 -10.022) 17.185 11.090 ( 6.575 6.847 -10.495) 14.151 11.376 ( -5.512 -3.089 -10.529) 12.279 12.687 ( -3.387 3.732 7.358) 8.918 12.897 ( 8.486 8.327 1.358) 11.967 13.036 ( -5.306 2.071 1.576) 5.910 13.582 ( 3.162 -8.211 -11.241) 14.275 17.875 ( 9.288 -0.956 0.302) 9.342 18.376 ( -8.292 -1.030 -7.988) 11.560 19.180 ( -1.121 -8.386 2.287) 8.764 19.499 ( 2.028 -0.607 -5.620) 6.006 21.019 ( 21.280 6.553 14.040) 26.323 21.866 ( -20.351 -9.613 -9.666) 24.495 23.434 ( 0.970 4.904 -3.387) 6.038 23.495 ( -4.020 3.642 -4.806) 7.247 ======================= Grid point 549 (278/361) ======================= q-point: (-0.10 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( 8.059 0.335 9.580) 12.523 2.794 ( 2.219 0.544 -4.361) 4.924 3.171 ( 0.918 -8.260 7.754) 11.366 3.344 ( -1.378 -8.150 -1.253) 8.360 3.585 ( -0.674 0.199 -5.849) 5.891 3.902 ( -0.988 2.160 -11.606) 11.847 4.307 ( -4.089 2.502 -0.129) 4.796 4.523 ( 5.693 4.210 -0.243) 7.085 5.732 ( -2.809 1.369 10.479) 10.935 5.914 ( -14.387 4.523 8.660) 17.391 5.994 ( -2.185 1.806 -3.878) 4.803 6.280 ( -6.727 0.930 -3.177) 7.497 6.499 ( 4.331 0.057 -2.356) 4.931 6.557 ( 7.527 -0.598 -0.070) 7.551 7.442 ( 0.789 -12.596 20.930) 24.441 7.585 ( -8.831 -27.047 0.702) 28.461 9.046 ( -12.986 11.099 5.209) 17.859 9.093 ( -2.671 5.621 8.480) 10.519 9.210 ( 0.605 0.800 3.755) 3.887 9.738 ( 1.892 0.392 -4.483) 4.881 10.244 ( 0.580 2.589 13.193) 13.457 10.766 ( -5.373 0.469 -8.697) 10.234 11.134 ( 16.994 9.714 1.949) 19.671 11.296 ( 9.349 -5.027 -14.703) 18.135 12.621 ( -5.686 8.959 2.326) 10.863 12.924 ( 6.600 8.604 -2.163) 11.057 13.013 ( -6.539 -3.718 6.796) 10.137 13.568 ( 4.698 -5.245 -11.073) 13.122 18.020 ( 3.907 -0.176 1.833) 4.320 18.126 ( -4.722 2.416 -10.265) 11.554 19.114 ( -14.038 -2.958 3.128) 14.683 19.597 ( 8.368 -2.953 -1.576) 9.013 21.230 ( -17.312 -8.928 -0.797) 19.495 21.712 ( 18.270 7.241 1.864) 19.741 23.283 ( -5.449 3.566 -1.390) 6.659 23.526 ( 8.933 0.592 -1.976) 9.169 ======================= Grid point 553 (279/361) ======================= q-point: ( 0.30 -0.70 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.509 ( 4.582 -0.000 8.225) 9.415 2.860 ( -6.568 0.000 2.840) 7.155 3.029 ( 4.347 -0.000 1.628) 4.642 3.328 ( 1.227 -0.000 -3.481) 3.691 3.555 ( -6.511 0.000 -0.233) 6.515 4.121 ( -23.246 0.000 6.357) 24.099 4.502 ( -1.976 0.000 -2.589) 3.257 4.671 ( -1.509 0.000 5.482) 5.686 4.954 ( 2.124 -0.000 9.913) 10.138 5.425 ( 9.610 -0.000 4.959) 10.814 5.639 ( -9.670 0.000 14.765) 17.649 5.856 ( 3.591 -0.000 -2.469) 4.358 6.466 ( -6.688 0.000 1.494) 6.853 6.684 ( -13.680 0.000 -2.696) 13.943 7.243 ( -18.060 0.000 -6.712) 19.267 7.377 ( 0.855 -0.000 -9.720) 9.758 8.780 ( 4.276 -0.000 -4.175) 5.976 8.814 ( -7.845 0.000 16.364) 18.148 9.524 ( 9.976 -0.000 7.113) 12.252 9.641 ( -13.702 0.000 14.304) 19.807 11.106 ( 0.634 -0.000 -9.217) 9.239 11.277 ( 14.050 -0.000 -22.961) 26.919 11.437 ( 19.152 -0.000 -9.476) 21.368 11.950 ( -3.078 0.000 5.159) 6.008 12.436 ( -1.367 0.000 0.333) 1.407 12.623 ( -10.605 0.000 5.404) 11.903 13.190 ( 7.981 -0.000 -11.323) 13.853 13.416 ( 5.902 -0.000 11.940) 13.319 17.290 ( -2.925 0.000 13.345) 13.661 18.159 ( -2.546 0.000 -17.566) 17.750 19.455 ( 5.784 -0.000 9.662) 11.260 19.525 ( 15.264 -0.000 2.342) 15.442 20.001 ( -3.602 0.000 -13.539) 14.010 22.329 ( -15.818 0.000 4.498) 16.445 24.006 ( 2.539 -0.000 -3.141) 4.039 24.039 ( 0.675 -0.000 7.470) 7.501 ======================= Grid point 555 (280/361) ======================= q-point: (-0.60 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.628 ( -3.448 5.648 12.087) 13.780 2.846 ( -3.835 4.358 7.968) 9.859 3.106 ( -1.091 -0.183 2.586) 2.812 3.329 ( 0.712 -7.862 -3.149) 8.499 3.469 ( -4.277 -4.097 -3.262) 6.761 3.878 ( -15.102 -3.144 3.090) 15.732 4.416 ( 1.377 7.010 -2.754) 7.657 4.765 ( -2.564 -2.557 5.472) 6.562 5.106 ( 1.187 -2.013 10.189) 10.454 5.598 ( 8.300 -0.745 2.359) 8.661 5.751 ( -5.678 1.452 21.461) 22.246 5.908 ( 6.673 0.195 -0.441) 6.690 6.366 ( -19.380 -0.026 -1.537) 19.441 6.419 ( -12.503 -4.740 5.289) 14.379 7.000 ( -5.766 0.773 -7.007) 9.107 7.289 ( 1.515 -3.174 -9.843) 10.453 8.833 ( 3.159 -3.410 0.670) 4.697 8.886 ( -8.667 1.222 16.136) 18.357 9.602 ( -15.779 0.853 14.359) 21.351 9.739 ( 9.050 1.149 5.759) 10.788 10.906 ( 0.268 9.877 -15.458) 18.346 11.182 ( 12.914 0.420 -23.014) 26.393 11.555 ( 17.035 5.105 -9.776) 20.293 11.953 ( -6.672 -2.893 3.254) 7.967 12.489 ( 2.620 -1.083 5.085) 5.822 12.558 ( -8.998 -0.230 7.540) 11.741 13.188 ( 7.094 -2.406 -8.787) 11.546 13.577 ( 0.016 -1.446 6.387) 6.548 17.490 ( 2.684 -2.427 17.693) 18.059 17.932 ( 0.610 -3.277 -18.603) 18.899 19.497 ( -0.101 14.514 -1.540) 14.595 19.715 ( 2.308 -6.091 -2.505) 6.979 19.965 ( 17.894 -4.251 -2.685) 18.587 22.181 ( -17.028 -3.997 5.861) 18.447 23.892 ( -0.197 12.173 -3.485) 12.663 24.122 ( -6.091 -9.451 0.028) 11.243 ======================= Grid point 556 (281/361) ======================= q-point: (-0.50 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.609 ( -12.010 7.713 11.304) 18.208 2.765 ( -6.820 14.794 9.942) 19.084 3.094 ( -7.238 -6.297 -0.512) 9.607 3.352 ( -6.384 -13.780 -2.902) 15.462 3.471 ( 3.941 -6.044 -3.357) 7.958 3.897 ( 1.650 -2.781 7.635) 8.291 4.360 ( 7.796 8.064 -6.962) 13.201 4.732 ( -8.644 -4.254 -1.107) 9.697 5.277 ( 2.940 -0.330 11.457) 11.833 5.735 ( 1.991 -5.253 4.026) 6.911 5.913 ( 0.126 5.044 14.950) 15.779 6.007 ( -1.706 2.248 10.113) 10.499 6.156 ( -5.815 -4.318 1.313) 7.361 6.441 ( -8.455 -9.072 9.359) 15.537 6.850 ( -4.025 0.266 -7.103) 8.168 7.240 ( 1.163 -5.104 -7.967) 9.533 8.920 ( -5.779 -0.860 12.676) 13.958 8.962 ( -1.785 -3.195 8.612) 9.357 9.527 ( -16.337 1.816 11.980) 20.340 9.872 ( 6.386 5.063 2.704) 8.586 10.623 ( -0.719 10.846 -13.798) 17.566 11.095 ( 13.748 0.286 -21.312) 25.363 11.564 ( 12.447 10.472 -12.119) 20.285 11.867 ( -10.311 -0.690 -1.304) 10.416 12.546 ( -6.096 -1.072 9.477) 11.319 12.660 ( 7.894 -0.911 6.747) 10.425 13.201 ( 4.454 -1.850 -6.193) 7.850 13.596 ( -5.807 -1.727 1.624) 6.272 17.701 ( 5.649 0.834 -3.174) 6.533 17.922 ( 5.325 -12.607 7.373) 15.545 19.259 ( -4.498 11.844 -8.214) 15.099 19.709 ( -5.489 -7.268 -3.696) 9.829 20.335 ( 31.460 2.815 0.646) 31.592 22.057 ( -18.841 -7.121 6.000) 21.017 23.729 ( -0.690 10.101 -5.315) 11.435 24.033 ( -10.955 -4.889 -5.068) 13.023 ======================= Grid point 557 (282/361) ======================= q-point: (-0.40 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.470 ( -9.535 8.712 8.796) 15.626 2.748 ( -5.347 6.295 14.443) 16.638 2.977 ( -9.575 -3.806 -2.868) 10.695 3.355 ( -4.270 -8.669 -4.669) 10.733 3.550 ( 4.356 -8.449 -4.128) 10.364 4.053 ( 0.475 -1.196 10.039) 10.121 4.285 ( 9.686 8.585 -13.834) 18.944 4.649 ( -5.008 -7.280 -3.552) 9.523 5.454 ( 2.950 0.795 11.210) 11.619 5.878 ( 1.146 -9.661 8.080) 12.647 6.012 ( 0.235 5.123 10.097) 11.324 6.086 ( -1.922 1.059 10.409) 10.638 6.268 ( 4.897 -1.017 7.531) 9.040 6.546 ( -6.839 -12.476 7.754) 16.203 6.706 ( -5.437 -1.013 -4.489) 7.123 7.213 ( -0.995 -6.759 -5.662) 8.873 8.993 ( -9.517 0.595 17.696) 20.101 9.097 ( 0.730 -5.724 7.087) 9.140 9.399 ( -13.609 3.973 6.204) 15.475 9.900 ( 2.911 8.352 2.250) 9.126 10.394 ( -1.987 7.049 -7.770) 10.678 11.055 ( 15.159 0.196 -18.688) 24.064 11.434 ( 9.093 13.737 -14.825) 22.162 11.654 ( -13.828 2.429 -4.035) 14.608 12.607 ( -4.349 -2.635 9.445) 10.727 12.883 ( 12.321 3.135 6.968) 14.498 13.181 ( 0.005 0.865 -3.533) 3.637 13.509 ( -7.347 -3.799 -3.533) 8.994 17.731 ( 8.637 -1.359 -4.552) 9.857 18.254 ( 3.625 -10.458 12.140) 16.428 19.033 ( -2.114 3.012 -8.133) 8.927 19.609 ( -6.356 -3.760 -6.676) 9.955 20.765 ( 32.640 7.494 3.605) 33.683 21.906 ( -21.373 -9.349 2.560) 23.469 23.586 ( 0.931 6.770 -5.647) 8.865 23.810 ( -12.362 0.108 -7.142) 14.278 ======================= Grid point 558 (283/361) ======================= q-point: (-0.30 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( 0.778 4.791 9.654) 10.806 2.788 ( -6.689 -0.081 8.367) 10.713 2.929 ( 1.451 -2.081 2.998) 3.928 3.269 ( -5.964 -6.366 -6.880) 11.110 3.606 ( 2.051 -4.103 -4.517) 6.438 4.070 ( -5.510 1.161 -2.910) 6.338 4.256 ( 8.801 0.600 -2.556) 9.184 4.615 ( 1.390 -1.834 -6.272) 6.680 5.615 ( 1.345 -0.262 11.028) 11.113 6.064 ( 0.733 -5.910 -3.275) 6.797 6.073 ( -3.915 6.975 13.365) 15.576 6.217 ( 3.641 -4.510 14.223) 15.359 6.412 ( 3.366 1.075 3.284) 4.824 6.490 ( -5.191 -0.848 -4.141) 6.694 6.804 ( -2.208 -17.420 11.111) 20.780 7.194 ( -3.833 -9.003 -3.259) 10.314 9.074 ( -8.933 1.012 17.817) 19.956 9.202 ( -6.453 -0.722 8.408) 10.624 9.274 ( -4.369 0.502 1.113) 4.536 9.880 ( 0.740 8.843 2.577) 9.241 10.247 ( -3.256 3.905 -1.909) 5.431 11.038 ( 11.187 2.275 -15.474) 19.229 11.285 ( 11.746 12.704 -11.883) 20.990 11.376 ( -10.133 3.486 -7.135) 12.874 12.689 ( -3.817 -2.673 9.384) 10.478 13.047 ( -0.239 6.625 5.915) 8.885 13.109 ( 3.404 6.135 -1.875) 7.262 13.426 ( -0.267 -8.549 -7.919) 11.656 17.860 ( 9.401 -0.724 2.556) 9.769 18.363 ( -5.255 -0.557 -1.847) 5.598 19.015 ( 0.613 -9.269 0.091) 9.290 19.480 ( 0.142 -1.525 -8.388) 8.527 21.155 ( 17.633 8.412 9.814) 21.863 21.705 ( -12.104 -8.328 -5.746) 15.776 23.511 ( 2.913 3.720 -3.808) 6.068 23.555 ( -9.562 2.856 -5.685) 11.486 ======================= Grid point 559 (284/361) ======================= q-point: (-0.20 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.602 ( 4.696 1.667 9.896) 11.080 2.806 ( 3.660 0.764 0.289) 3.750 3.059 ( 2.945 -3.909 3.569) 6.057 3.196 ( -3.112 -8.129 -1.570) 8.845 3.583 ( -0.027 0.246 -2.836) 2.847 3.917 ( -5.632 -1.233 -8.411) 10.197 4.336 ( 2.405 0.743 -0.229) 2.527 4.581 ( 5.164 2.549 -3.449) 6.713 5.743 ( -2.600 -1.139 9.447) 9.864 5.967 ( -9.936 0.107 -5.004) 11.126 6.067 ( -6.042 7.488 8.956) 13.145 6.290 ( -7.545 -0.025 -1.407) 7.675 6.491 ( 4.756 -1.823 0.198) 5.098 6.548 ( 9.270 0.084 3.549) 9.926 7.097 ( -2.932 -23.540 7.534) 24.890 7.239 ( 0.169 -11.899 6.075) 13.361 9.115 ( -8.235 1.877 9.317) 12.576 9.205 ( -6.483 2.385 13.398) 15.074 9.238 ( -5.767 1.877 1.527) 6.254 9.816 ( 1.839 7.522 -2.734) 8.212 10.232 ( -1.162 -3.238 5.318) 6.334 10.860 ( -7.416 9.112 -7.969) 14.196 11.226 ( 10.139 -2.431 -14.927) 18.208 11.317 ( 17.877 10.617 -2.181) 20.906 12.744 ( -4.887 3.030 6.986) 9.048 12.943 ( -10.886 -1.214 4.851) 11.980 13.096 ( 3.727 7.660 -3.746) 9.306 13.474 ( 9.029 -4.079 -6.519) 11.860 18.028 ( 4.049 1.116 4.748) 6.339 18.167 ( -5.098 2.080 -9.441) 10.930 19.047 ( -8.900 -4.573 2.299) 10.267 19.522 ( 11.360 -5.162 -4.344) 13.212 21.103 ( -26.070 -5.154 -1.555) 26.620 21.826 ( 27.466 5.585 2.675) 28.156 23.351 ( -6.706 3.887 -2.844) 8.257 23.538 ( 6.376 0.565 -1.079) 6.491 ======================= Grid point 560 (285/361) ======================= q-point: (-0.10 -0.70 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.724 ( -1.274 1.810 6.018) 6.412 2.877 ( 9.311 1.424 -3.422) 10.022 3.142 ( 3.722 -5.621 1.937) 7.014 3.291 ( 1.494 -6.300 0.690) 6.512 3.582 ( -0.599 -2.579 3.434) 4.337 3.749 ( -3.470 1.107 -7.487) 8.326 4.291 ( 2.164 5.582 -4.038) 7.221 4.656 ( 5.100 0.416 3.656) 6.289 5.695 ( -17.911 2.345 -4.530) 18.623 5.759 ( -9.539 0.223 5.635) 11.082 5.994 ( -6.716 5.757 3.682) 9.582 6.170 ( -7.233 1.474 -0.640) 7.410 6.510 ( 4.168 -0.047 -5.108) 6.593 6.683 ( 8.171 3.026 -0.007) 8.713 7.260 ( -4.802 -23.141 -0.247) 23.635 7.576 ( 4.610 -15.290 14.518) 21.583 8.990 ( -11.701 8.770 2.098) 14.773 9.181 ( -6.146 4.318 7.903) 10.903 9.281 ( -3.033 -1.558 10.928) 11.448 9.728 ( 0.081 7.414 -6.369) 9.774 10.361 ( 1.169 -12.862 2.745) 13.204 10.653 ( -2.067 7.585 3.056) 8.435 11.246 ( 15.993 -2.685 -17.072) 23.546 11.532 ( 20.464 6.945 4.795) 22.136 12.638 ( -5.615 9.099 0.645) 10.712 12.945 ( -9.468 -6.744 8.767) 14.560 13.009 ( -0.269 5.537 -3.750) 6.693 13.531 ( 9.841 2.816 -7.978) 12.978 17.807 ( -11.515 1.500 -12.352) 16.953 18.269 ( 8.163 1.577 9.112) 12.334 18.959 ( -8.557 -0.719 0.884) 8.633 19.651 ( 2.378 -0.663 0.864) 2.615 20.731 ( -19.540 -10.122 -13.478) 25.805 22.233 ( 24.198 7.828 11.888) 28.074 23.227 ( -2.531 1.635 -2.693) 4.041 23.650 ( 8.470 -0.044 2.438) 8.814 ======================= Grid point 565 (286/361) ======================= q-point: ( 0.40 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( -11.753 0.000 10.113) 15.505 2.957 ( 3.337 -0.000 6.278) 7.110 3.090 ( -12.033 0.000 -4.952) 13.012 3.102 ( -10.809 0.000 4.345) 11.649 3.420 ( 3.061 -0.000 -1.580) 3.444 3.871 ( 4.201 -0.000 6.132) 7.433 4.434 ( 3.161 -0.000 -2.343) 3.934 4.693 ( -6.649 0.000 -5.289) 8.496 5.278 ( 3.201 -0.000 12.596) 12.996 5.679 ( -1.435 0.000 5.589) 5.770 5.984 ( -2.549 0.000 22.556) 22.699 6.021 ( 8.089 -0.000 1.836) 8.294 6.110 ( -13.411 0.000 3.674) 13.905 6.347 ( -9.005 0.000 8.595) 12.449 6.853 ( -4.631 0.000 -6.726) 8.166 7.194 ( 4.596 -0.000 -11.032) 11.951 8.898 ( 4.161 -0.000 3.567) 5.481 8.947 ( -12.208 0.000 18.322) 22.016 9.543 ( -16.900 0.000 13.139) 21.406 9.918 ( 7.391 -0.000 3.009) 7.980 10.727 ( -0.759 0.000 -18.957) 18.972 11.096 ( 13.170 -0.000 -21.165) 24.928 11.673 ( 15.712 -0.000 -14.443) 21.342 11.851 ( -10.654 0.000 1.713) 10.791 12.536 ( -7.964 0.000 9.376) 12.302 12.646 ( 8.965 -0.000 7.432) 11.645 13.179 ( 5.955 -0.000 -6.493) 8.810 13.584 ( -7.702 0.000 4.582) 8.962 17.743 ( 4.461 -0.000 -14.538) 15.206 17.774 ( 6.365 -0.000 19.589) 20.597 19.408 ( -12.235 0.000 -10.369) 16.038 19.603 ( -0.676 0.000 -2.290) 2.387 20.358 ( 34.535 -0.000 0.032) 34.535 21.995 ( -18.335 0.000 6.277) 19.380 23.865 ( -2.719 0.000 -7.665) 8.133 23.944 ( -9.903 0.000 -1.877) 10.080 ======================= Grid point 567 (287/361) ======================= q-point: (-0.50 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.587 ( -11.861 3.906 7.117) 14.373 2.885 ( -5.423 7.370 3.713) 9.875 2.920 ( -9.969 -2.092 -0.712) 10.211 3.189 ( 0.223 -8.129 2.986) 8.663 3.455 ( 3.539 -2.592 -1.463) 4.625 4.027 ( 1.709 -1.196 9.049) 9.286 4.424 ( 3.562 6.631 -10.629) 13.024 4.528 ( -2.600 -5.916 -5.426) 8.437 5.459 ( 2.227 -0.032 10.541) 10.774 5.746 ( -1.468 -4.294 8.371) 9.522 6.072 ( -1.804 1.592 7.118) 7.514 6.143 ( 2.084 4.386 10.903) 11.935 6.230 ( 1.033 -3.074 14.900) 15.249 6.370 ( -7.038 -5.937 8.790) 12.730 6.701 ( -6.161 -0.029 -6.087) 8.661 7.141 ( 4.881 -1.808 -10.659) 11.862 9.000 ( -11.055 0.414 19.429) 22.358 9.025 ( 1.461 -2.361 7.507) 8.004 9.444 ( -16.172 1.175 9.432) 18.758 10.008 ( 5.491 3.283 -0.325) 6.405 10.483 ( -1.897 2.667 -14.915) 15.270 11.052 ( 14.537 -0.191 -18.307) 23.378 11.629 ( 10.164 6.661 -16.392) 20.406 11.687 ( -11.828 0.955 -2.719) 12.174 12.564 ( -6.116 -1.601 10.216) 12.014 12.901 ( 14.130 -0.350 6.485) 15.551 13.182 ( 3.775 -0.076 -4.573) 5.930 13.479 ( -13.372 -0.320 2.674) 13.640 17.715 ( 8.444 -0.424 -4.917) 9.781 18.118 ( 7.082 -4.211 16.715) 18.635 19.091 ( -11.549 2.436 -10.182) 15.588 19.545 ( -1.932 -2.570 -6.735) 7.463 20.858 ( 37.366 2.740 0.870) 37.476 21.797 ( -21.525 -3.013 3.716) 22.050 23.693 ( -3.486 4.918 -6.464) 8.839 23.784 ( -9.832 -2.647 -5.547) 11.595 ======================= Grid point 568 (288/361) ======================= q-point: (-0.40 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( -0.375 4.362 7.715) 8.870 2.794 ( -7.473 0.387 3.660) 8.330 2.902 ( 1.967 -1.128 3.163) 3.892 3.178 ( -5.659 -3.430 -4.342) 7.914 3.557 ( 5.360 -1.566 1.948) 5.914 4.052 ( -17.042 -2.284 5.190) 17.961 4.287 ( 11.176 2.136 -11.448) 16.141 4.569 ( 7.308 -2.543 -5.244) 9.347 5.592 ( -0.783 -1.900 8.861) 9.096 5.903 ( 1.530 -8.624 3.361) 9.382 6.160 ( 1.556 1.715 10.641) 10.890 6.243 ( -1.086 5.924 12.050) 13.471 6.410 ( -0.015 -2.306 8.113) 8.435 6.435 ( -5.082 -4.974 2.574) 7.562 6.588 ( -4.227 -5.320 3.817) 7.794 7.099 ( 3.736 -2.652 -9.640) 10.674 9.085 ( -12.924 0.401 22.947) 26.340 9.154 ( 0.686 -2.590 6.773) 7.283 9.310 ( -12.231 1.867 4.656) 13.220 10.012 ( 2.767 5.699 -1.548) 6.521 10.290 ( -3.873 0.949 -8.094) 9.023 11.056 ( 15.248 0.271 -16.256) 22.290 11.445 ( -10.262 5.379 -6.020) 13.057 11.508 ( 9.996 8.915 -12.962) 18.639 12.630 ( -5.253 -3.117 10.122) 11.822 13.089 ( 0.586 -1.284 -1.720) 2.225 13.230 ( 8.871 5.805 2.873) 10.984 13.318 ( -8.145 -2.977 -0.170) 8.674 17.850 ( 9.847 -0.359 4.323) 10.760 18.352 ( -0.675 -0.722 4.266) 4.379 18.881 ( -4.352 -5.275 -2.984) 7.461 19.451 ( 1.224 -1.497 -9.741) 9.931 21.304 ( 16.993 8.048 4.583) 19.352 21.570 ( -6.668 -6.961 -3.187) 10.153 23.563 ( -0.883 2.029 -4.456) 4.975 23.593 ( -8.594 1.375 -4.757) 9.919 ======================= Grid point 569 (289/361) ======================= q-point: (-0.30 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.647 ( 2.592 3.529 9.063) 10.066 2.814 ( 4.732 -0.106 4.175) 6.311 3.023 ( 6.435 -1.331 2.136) 6.909 3.074 ( -3.740 -4.678 -3.804) 7.096 3.609 ( -0.597 2.720 0.948) 2.942 3.851 ( -14.001 -5.713 -3.024) 15.421 4.346 ( 8.157 0.729 -3.150) 8.775 4.614 ( 7.588 0.973 -5.786) 9.592 5.686 ( -4.755 -4.720 7.763) 10.254 5.918 ( -6.083 -5.086 -5.467) 9.631 6.226 ( -6.780 8.970 10.101) 15.115 6.280 ( -6.268 -0.558 2.227) 6.676 6.457 ( 4.607 -1.089 4.531) 6.553 6.515 ( 3.978 -5.496 3.684) 7.720 6.777 ( 1.901 -10.954 8.841) 14.204 7.084 ( 4.157 -5.504 -4.557) 8.267 9.140 ( -13.016 1.093 14.811) 19.748 9.227 ( -5.267 0.628 4.998) 7.288 9.247 ( -5.348 -0.373 12.271) 13.391 9.949 ( 1.166 6.412 -4.358) 7.840 10.166 ( -6.182 -3.563 -2.099) 7.438 11.026 ( 4.274 7.489 -10.035) 13.231 11.225 ( 2.939 3.063 -10.574) 11.394 11.494 ( 16.173 8.610 -5.821) 19.225 12.713 ( -5.485 -4.279 10.543) 12.632 12.980 ( -11.670 3.459 1.428) 12.255 13.135 ( -4.330 -2.978 -6.540) 8.390 13.481 ( 15.749 4.549 1.643) 16.475 18.055 ( 5.695 1.668 8.009) 9.968 18.197 ( -7.707 1.156 -10.013) 12.688 18.960 ( -1.203 -4.752 5.611) 7.451 19.431 ( 10.379 -4.615 -8.592) 14.243 21.045 ( -29.785 -1.724 -3.887) 30.087 21.907 ( 33.559 3.394 1.538) 33.765 23.418 ( -6.513 3.664 -2.427) 7.857 23.541 ( 2.738 -0.316 -0.360) 2.780 ======================= Grid point 570 (290/361) ======================= q-point: (-0.20 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.739 ( -6.390 -0.218 13.335) 14.789 2.934 ( 10.305 5.153 -7.172) 13.572 3.065 ( 7.997 -3.519 1.637) 8.889 3.196 ( 3.770 -3.697 4.136) 6.707 3.543 ( -4.549 -2.794 -2.035) 5.713 3.738 ( -4.249 -1.479 -0.458) 4.522 4.380 ( 6.484 3.901 -5.281) 9.228 4.652 ( 4.419 0.058 0.189) 4.423 5.679 ( -13.213 -3.574 0.006) 13.688 5.754 ( -9.533 -1.532 -2.014) 9.863 6.132 ( -8.071 7.702 5.337) 12.368 6.199 ( -7.324 2.870 1.980) 8.111 6.508 ( 3.271 -0.651 -3.989) 5.199 6.712 ( 8.510 -2.809 2.492) 9.302 6.913 ( -1.041 -11.728 -0.383) 11.781 7.307 ( 9.429 -14.229 7.254) 18.547 9.095 ( -11.964 2.040 8.129) 14.607 9.199 ( -4.170 0.883 2.991) 5.208 9.314 ( -9.413 3.079 17.119) 19.778 9.854 ( 2.210 6.390 -5.862) 8.949 10.127 ( -6.984 -11.837 -0.508) 13.753 10.856 ( -2.390 13.323 1.631) 13.633 11.209 ( 15.670 -1.377 -16.707) 22.948 11.656 ( 19.732 6.523 1.049) 20.809 12.777 ( -6.305 5.290 4.977) 9.618 12.818 ( -11.031 -5.759 6.782) 14.172 13.037 ( -2.382 -2.193 -6.334) 7.113 13.633 ( 13.994 7.834 -2.099) 16.174 17.831 ( -12.567 1.160 -13.552) 18.518 18.298 ( 6.910 1.528 10.296) 12.493 18.974 ( -2.407 2.515 0.615) 3.534 19.595 ( 10.787 -5.763 -1.424) 12.313 20.580 ( -27.548 -6.333 -9.926) 29.958 22.346 ( 29.175 4.496 4.214) 29.818 23.285 ( -4.691 4.882 -0.893) 6.829 23.638 ( 6.338 -1.467 4.365) 7.834 ======================= Grid point 571 (291/361) ======================= q-point: (-0.10 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.784 ( -12.867 0.326 14.568) 19.440 2.881 ( 4.225 4.104 -8.985) 10.743 3.179 ( -0.363 -4.182 -2.304) 4.789 3.345 ( 9.942 -0.321 3.582) 10.572 3.553 ( 0.659 -6.113 1.772) 6.399 3.740 ( 4.333 2.627 0.801) 5.130 4.365 ( 8.962 5.496 -5.737) 11.977 4.730 ( -1.083 -2.974 5.487) 6.334 5.419 ( -16.566 3.046 -3.245) 17.154 5.629 ( -12.236 -1.077 0.710) 12.303 5.986 ( -8.025 8.577 1.021) 11.790 6.082 ( -8.207 2.634 0.778) 8.655 6.500 ( 4.581 -0.515 -5.973) 7.545 6.821 ( 7.756 3.871 -0.977) 8.723 7.053 ( 0.856 -18.402 1.087) 18.454 7.624 ( 4.565 -14.675 4.515) 16.019 8.941 ( -12.932 8.328 4.519) 16.032 9.188 ( -7.926 -0.657 7.941) 11.239 9.362 ( -4.570 1.451 11.577) 12.531 9.702 ( -3.488 9.192 -6.518) 11.796 10.208 ( 0.800 -18.144 -0.428) 18.166 10.833 ( 2.648 6.694 8.785) 11.358 11.246 ( 16.744 -2.473 -18.039) 24.736 11.908 ( 18.432 4.528 2.439) 19.136 12.653 ( -2.804 6.240 0.343) 6.850 12.849 ( -9.467 -5.096 6.480) 12.553 12.961 ( -3.415 -0.377 -0.598) 3.488 13.675 ( 11.288 11.510 -5.958) 17.187 17.515 ( -11.414 -0.221 -8.945) 14.503 18.508 ( 6.962 0.132 10.391) 12.508 18.889 ( -2.097 5.044 -3.940) 6.735 19.654 ( -8.418 3.566 2.433) 9.460 20.268 ( -6.475 -13.610 -12.877) 19.824 22.724 ( 19.592 5.033 7.713) 21.648 23.175 ( -2.135 2.336 -3.170) 4.479 23.834 ( 9.002 0.002 8.503) 12.383 ======================= Grid point 577 (292/361) ======================= q-point: (-0.50 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.591 ( -0.076 0.000 6.464) 6.465 2.796 ( -5.886 -0.000 1.314) 6.031 2.890 ( -0.858 -0.000 2.840) 2.967 3.149 ( -4.758 -0.000 -2.398) 5.328 3.544 ( 7.305 -0.000 4.613) 8.639 4.025 ( -20.154 -0.000 7.219) 21.407 4.309 ( 10.264 -0.000 -13.504) 16.962 4.544 ( 9.043 -0.000 -4.658) 10.172 5.570 ( -1.879 -0.000 7.930) 8.149 5.820 ( 0.938 -0.000 4.916) 5.005 6.175 ( 1.982 -0.000 9.647) 9.849 6.318 ( 2.798 0.000 6.063) 6.678 6.370 ( -2.536 0.000 7.955) 8.350 6.378 ( -5.487 -0.000 14.483) 15.487 6.554 ( -5.870 -0.000 -0.572) 5.898 7.078 ( 6.449 -0.000 -11.896) 13.532 9.089 ( -14.853 -0.000 25.491) 29.502 9.130 ( 2.429 -0.000 6.085) 6.551 9.327 ( -13.792 -0.000 5.491) 14.845 10.066 ( 4.006 -0.000 -3.813) 5.530 10.294 ( -4.638 -0.000 -10.018) 11.040 11.058 ( 16.255 -0.000 -16.457) 23.131 11.497 ( -10.533 -0.000 -3.612) 11.135 11.594 ( 10.021 -0.000 -15.368) 18.347 12.599 ( -5.655 -0.000 10.410) 11.847 13.062 ( 4.549 0.000 -5.124) 6.852 13.292 ( -17.793 0.000 3.088) 18.059 13.292 ( 13.945 -0.000 5.105) 14.850 17.847 ( 10.094 -0.000 4.972) 11.252 18.343 ( 1.927 -0.000 7.198) 7.451 18.835 ( -7.828 -0.000 -4.785) 9.175 19.436 ( 2.087 -0.000 -10.125) 10.338 21.416 ( 38.668 -0.000 0.981) 38.680 21.469 ( -26.345 0.000 -0.999) 26.364 23.581 ( -4.078 -0.000 -5.357) 6.732 23.605 ( -6.473 0.000 -3.524) 7.370 ======================= Grid point 579 (293/361) ======================= q-point: (-0.40 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.722 ( 4.225 4.431 6.468) 8.906 2.792 ( 2.017 -2.563 5.359) 6.273 2.981 ( 4.249 -1.824 6.613) 8.069 3.049 ( 2.209 0.114 -8.034) 8.333 3.668 ( -1.154 3.285 3.817) 5.167 3.750 ( -19.282 -4.635 -0.214) 19.832 4.361 ( 10.458 0.673 -5.405) 11.791 4.615 ( 9.430 -0.436 -5.714) 11.034 5.611 ( -6.232 -2.717 6.707) 9.550 5.830 ( -4.714 -3.346 -2.275) 6.212 6.280 ( -7.511 0.983 3.611) 8.391 6.353 ( -1.869 3.851 7.551) 8.680 6.391 ( 0.034 -5.363 1.611) 5.600 6.464 ( 1.310 1.282 7.775) 7.988 6.667 ( 5.559 -3.325 11.731) 13.401 7.033 ( 6.961 -0.934 -11.417) 13.405 9.155 ( -17.727 0.478 18.139) 25.368 9.227 ( -0.329 -0.311 5.558) 5.576 9.244 ( -7.820 0.075 12.800) 15.000 10.030 ( 1.860 2.513 -6.448) 7.166 10.118 ( -9.094 -1.676 -4.864) 10.448 11.092 ( 17.142 1.080 -16.905) 24.100 11.315 ( -6.837 4.393 -2.698) 8.563 11.599 ( 14.028 2.918 -7.928) 16.375 12.651 ( -5.991 -1.940 10.196) 11.984 13.011 ( -2.704 -0.400 -4.642) 5.387 13.082 ( -14.799 -1.054 0.885) 14.863 13.560 ( 16.106 2.797 3.996) 16.829 18.080 ( 8.091 0.888 10.919) 13.619 18.208 ( -11.332 0.193 -11.827) 16.380 18.896 ( 4.947 -2.056 9.649) 11.036 19.372 ( 8.144 -1.751 -12.058) 14.656 21.029 ( -30.453 -0.266 -5.945) 31.029 21.946 ( 36.433 1.095 0.044) 36.449 23.478 ( -4.299 2.945 -1.054) 5.317 23.523 ( -1.359 -1.685 -0.304) 2.186 ======================= Grid point 580 (294/361) ======================= q-point: (-0.30 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.736 ( -10.564 0.217 11.644) 15.723 2.998 ( 10.672 -1.294 2.363) 11.006 3.045 ( 11.897 3.876 -5.978) 13.867 3.160 ( 6.140 -0.817 4.657) 7.749 3.463 ( -11.524 -5.466 -1.877) 12.892 3.733 ( -2.163 1.005 3.643) 4.354 4.427 ( 8.426 1.635 -4.334) 9.616 4.665 ( 6.377 0.875 -4.119) 7.642 5.601 ( -10.968 -4.353 4.599) 12.665 5.708 ( -8.823 -3.037 -4.824) 10.504 6.177 ( -10.138 0.259 3.862) 10.851 6.324 ( -4.920 7.344 4.043) 9.720 6.471 ( 3.063 -3.903 -1.384) 5.151 6.574 ( 0.399 -5.806 4.853) 7.577 6.889 ( 9.531 2.861 -1.119) 10.014 7.092 ( 11.049 -9.433 -0.557) 14.539 9.079 ( -14.189 -1.783 8.382) 16.576 9.255 ( -3.994 4.006 7.344) 9.270 9.343 ( -9.287 0.018 18.480) 20.682 9.940 ( -3.256 1.575 -4.488) 5.764 9.969 ( -5.840 -4.182 -4.100) 8.271 11.067 ( 5.483 8.466 -7.348) 12.479 11.207 ( 7.064 1.794 -9.453) 11.937 11.745 ( 17.678 3.099 -1.137) 17.984 12.707 ( -7.797 -4.008 10.004) 13.302 12.876 ( -9.927 3.592 2.908) 10.950 12.968 ( -2.828 -4.443 -5.856) 7.875 13.763 ( 14.542 5.768 0.414) 15.649 17.846 ( -13.452 0.501 -14.645) 19.892 18.320 ( 5.837 0.897 11.343) 12.789 19.047 ( 3.978 5.368 4.252) 7.920 19.461 ( 14.443 -8.327 -6.028) 17.728 20.507 ( -31.840 -2.172 -9.204) 33.214 22.394 ( 31.206 1.233 -2.543) 31.334 23.391 ( -3.530 6.614 2.585) 7.931 23.594 ( 3.732 -3.467 5.592) 7.564 ======================= Grid point 581 (295/361) ======================= q-point: (-0.20 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( -14.109 -2.600 14.123) 20.132 2.956 ( -11.309 -1.833 -3.427) 11.958 3.151 ( 9.886 3.310 -0.332) 10.431 3.337 ( 13.204 -1.065 2.024) 13.401 3.475 ( 2.436 -1.572 -0.590) 2.959 3.771 ( 4.746 0.755 3.983) 6.241 4.455 ( 9.411 4.072 -6.936) 12.380 4.690 ( -0.567 -0.925 2.055) 2.324 5.451 ( -13.895 0.885 -0.489) 13.932 5.584 ( -9.564 -3.519 -0.759) 10.219 6.074 ( -8.777 0.965 0.361) 8.838 6.204 ( -6.407 10.273 2.809) 12.429 6.491 ( 3.473 -0.584 -5.318) 6.378 6.730 ( 2.702 -14.163 3.781) 14.906 6.919 ( 7.498 3.929 -4.266) 9.479 7.377 ( 10.938 -12.572 -0.270) 16.666 8.986 ( -16.417 -3.202 6.819) 18.063 9.228 ( -4.684 6.357 6.820) 10.434 9.408 ( -8.506 2.356 15.289) 17.654 9.795 ( -10.409 -0.568 -1.911) 10.599 9.973 ( 4.122 -6.161 -2.005) 7.679 10.985 ( -0.071 9.470 3.309) 10.032 11.209 ( 13.868 -1.547 -15.990) 21.223 11.973 ( 17.284 2.321 0.743) 17.455 12.701 ( -8.052 -1.130 3.508) 8.855 12.808 ( -5.135 1.773 6.013) 8.103 12.921 ( -1.818 -3.921 -2.176) 4.838 13.866 ( 12.508 9.153 -3.718) 15.939 17.511 ( -11.729 -0.245 -10.042) 15.443 18.503 ( 5.328 -0.560 6.789) 8.648 19.031 ( 3.481 10.703 -2.550) 11.540 19.671 ( 4.005 -2.940 1.417) 5.167 20.040 ( -19.643 -10.457 -9.808) 24.318 22.732 ( 23.753 -2.433 -4.931) 24.381 23.309 ( -4.022 10.706 4.386) 12.249 23.812 ( 8.692 -2.489 10.660) 13.978 ======================= Grid point 582 (296/361) ======================= q-point: (-0.10 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.677 ( -20.496 -4.323 8.624) 22.653 2.782 ( -12.066 -1.932 1.267) 12.285 3.247 ( 9.820 5.098 -0.488) 11.076 3.436 ( 1.612 -0.612 -2.164) 2.767 3.581 ( 5.967 -4.267 4.986) 8.870 3.903 ( 9.051 5.987 1.922) 11.021 4.480 ( 12.227 3.318 -6.615) 14.292 4.715 ( -6.855 -3.116 7.455) 10.596 5.238 ( -13.844 4.594 1.878) 14.707 5.479 ( -4.813 -1.104 -2.070) 5.354 5.904 ( -8.911 3.460 -4.586) 10.602 6.046 ( -7.036 9.809 2.051) 12.244 6.491 ( 2.923 -1.405 -2.634) 4.178 6.932 ( 6.208 3.361 -2.543) 7.504 6.981 ( 7.485 -13.899 1.198) 15.832 7.555 ( 1.712 -11.759 -2.864) 12.223 8.833 ( -18.478 0.266 6.028) 19.438 9.188 ( -7.450 4.134 8.492) 12.029 9.455 ( -3.879 2.425 10.570) 11.518 9.642 ( -3.199 2.607 -4.241) 5.918 10.111 ( 2.585 -11.331 2.654) 11.921 10.998 ( 0.317 2.950 7.409) 7.981 11.222 ( 14.806 -2.872 -18.391) 23.784 12.148 ( 10.537 2.791 -2.040) 11.090 12.648 ( -4.917 -0.403 1.951) 5.306 12.775 ( -3.126 1.002 -0.465) 3.315 12.943 ( -0.949 -2.250 4.904) 5.479 13.863 ( 10.719 12.720 -7.079) 18.078 17.320 ( -7.074 -0.264 0.321) 7.086 18.644 ( 6.413 -6.383 -3.921) 9.862 18.900 ( -1.310 13.156 -1.828) 13.347 19.514 ( -14.086 2.600 -0.004) 14.324 20.062 ( 5.633 -12.653 -2.872) 14.145 23.002 ( 17.541 -7.900 -4.856) 19.841 23.174 ( -6.805 14.958 3.972) 16.906 24.094 ( 9.649 0.117 11.504) 15.015 ======================= Grid point 589 (297/361) ======================= q-point: (-0.40 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.741 ( -12.148 0.000 10.520) 16.070 2.980 ( 10.309 -0.000 3.070) 10.756 3.090 ( 15.260 -0.000 -7.150) 16.852 3.154 ( 6.015 -0.000 4.714) 7.642 3.403 ( -14.033 0.000 0.823) 14.057 3.748 ( -2.034 0.000 3.791) 4.302 4.443 ( 9.253 -0.000 -4.669) 10.365 4.672 ( 7.287 -0.000 -4.597) 8.616 5.557 ( -10.053 0.000 5.962) 11.688 5.675 ( -8.506 0.000 -4.653) 9.695 6.179 ( -11.844 0.000 4.882) 12.810 6.380 ( 2.858 -0.000 -1.580) 3.266 6.436 ( -1.638 0.000 3.859) 4.192 6.536 ( -2.668 0.000 4.909) 5.587 6.923 ( 14.820 -0.000 6.800) 16.305 6.999 ( 8.555 -0.000 -11.145) 14.050 9.062 ( -15.189 0.000 7.618) 16.992 9.312 ( -1.462 0.000 8.695) 8.817 9.322 ( -11.254 0.000 19.851) 22.819 9.904 ( -15.219 0.000 0.029) 15.219 9.982 ( 4.512 -0.000 -9.369) 10.399 11.127 ( 18.094 -0.000 -19.431) 26.551 11.249 ( -5.909 0.000 2.112) 6.275 11.768 ( 16.353 -0.000 -1.768) 16.449 12.674 ( -6.594 0.000 9.721) 11.746 12.914 ( -2.232 0.000 -5.417) 5.859 12.915 ( -11.389 0.000 3.584) 11.940 13.817 ( 14.447 -0.000 0.964) 14.480 17.850 ( -13.778 0.000 -15.057) 20.410 18.328 ( 5.440 -0.000 11.755) 12.953 19.117 ( 7.265 -0.000 11.151) 13.309 19.362 ( 14.266 -0.000 -13.073) 19.350 20.490 ( -32.695 0.000 -9.327) 34.000 22.403 ( 31.466 -0.000 -5.063) 31.871 23.486 ( -2.068 0.000 2.973) 3.622 23.530 ( 2.250 -0.000 7.116) 7.463 ======================= Grid point 590 (298/361) ======================= q-point: (-0.30 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.716 ( -12.722 0.382 13.676) 18.683 2.875 ( -21.919 -4.180 -0.382) 22.317 3.213 ( 10.746 1.923 -3.963) 11.613 3.303 ( 13.979 -1.747 1.687) 14.189 3.508 ( 11.213 3.139 2.797) 11.975 3.768 ( 2.143 -0.737 3.948) 4.553 4.502 ( 8.892 1.279 -5.412) 10.488 4.691 ( 1.025 0.373 -1.805) 2.109 5.464 ( -12.387 0.764 3.930) 13.018 5.524 ( -7.218 -2.595 -2.462) 8.056 6.076 ( -9.993 -0.196 2.161) 10.226 6.369 ( -2.395 7.776 2.287) 8.451 6.473 ( 4.790 -2.610 -2.574) 6.032 6.536 ( -3.324 -6.227 2.224) 7.401 6.987 ( 8.848 2.781 -7.773) 12.102 7.203 ( 15.036 -6.085 -2.158) 16.363 8.923 ( -17.334 -2.359 5.046) 18.207 9.347 ( -5.678 5.910 11.099) 13.797 9.418 ( -8.531 -1.634 15.794) 18.025 9.725 ( -17.351 -3.457 5.737) 18.599 9.959 ( 9.120 0.882 -8.658) 12.606 11.120 ( 10.028 4.202 -11.693) 15.967 11.196 ( -0.409 0.190 -2.391) 2.433 11.987 ( 15.441 -0.188 0.019) 15.442 12.693 ( -5.226 0.821 6.416) 8.315 12.841 ( -3.013 -2.067 -2.566) 4.465 12.848 ( -4.755 -0.274 4.491) 6.546 13.979 ( 12.847 3.334 -3.096) 13.629 17.507 ( -11.849 -0.103 -10.566) 15.876 18.494 ( 4.547 -0.274 3.931) 6.017 19.251 ( 7.279 13.057 2.209) 15.111 19.524 ( 14.671 -11.979 -3.337) 19.232 19.937 ( -31.310 -1.906 -7.607) 32.278 22.690 ( 22.916 -1.512 -9.982) 25.041 23.482 ( -2.086 6.907 6.479) 9.697 23.754 ( 8.942 -3.203 12.288) 15.532 ======================= Grid point 591 (299/361) ======================= q-point: (-0.20 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.577 ( -23.167 -5.570 5.481) 24.449 2.733 ( -16.253 -2.869 8.542) 18.583 3.236 ( -0.160 -3.194 -1.518) 3.540 3.524 ( 10.618 -0.809 2.238) 10.881 3.575 ( 10.418 10.457 -2.471) 14.966 3.958 ( 11.079 -0.049 6.146) 12.669 4.543 ( 11.065 3.227 -7.494) 13.748 4.671 ( -5.164 -1.814 4.538) 7.110 5.310 ( -13.780 3.394 3.838) 14.701 5.448 ( -1.901 -1.899 -3.017) 4.040 5.928 ( -9.234 0.281 -4.965) 10.488 6.250 ( -5.969 11.421 2.027) 13.045 6.466 ( 0.456 -1.401 -1.349) 1.998 6.738 ( 10.343 -11.871 4.385) 16.344 6.999 ( 7.330 2.903 -5.300) 9.499 7.371 ( 8.736 -8.160 -8.091) 14.435 8.755 ( -20.694 -6.066 5.671) 22.298 9.318 ( -6.588 8.428 8.651) 13.757 9.486 ( -6.232 0.684 12.554) 14.032 9.612 ( -13.309 -4.066 5.133) 14.833 10.024 ( 9.058 -0.743 -2.134) 9.336 11.074 ( -2.688 4.822 3.836) 6.723 11.182 ( 11.897 -1.792 -15.147) 19.344 12.165 ( 9.825 -0.519 -1.767) 9.996 12.655 ( -5.267 2.254 2.578) 6.282 12.797 ( -0.419 0.237 -2.723) 2.765 12.881 ( -2.558 -3.862 5.189) 6.955 14.040 ( 11.746 6.925 -7.558) 15.590 17.316 ( -6.024 -0.120 0.816) 6.080 18.552 ( 6.104 -3.711 -10.259) 12.501 19.163 ( -2.486 16.046 0.030) 16.238 19.545 ( -15.344 0.626 -0.324) 15.361 19.813 ( 8.787 -14.856 0.632) 17.272 22.870 ( 17.210 -5.471 -10.292) 20.786 23.441 ( -4.136 12.754 7.516) 15.371 24.070 ( 10.685 -2.449 11.160) 15.643 ======================= Grid point 592 (300/361) ======================= q-point: (-0.10 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( -19.745 -6.949 4.975) 21.515 2.538 ( -25.820 -6.423 5.688) 27.208 3.316 ( 2.212 -5.975 4.487) 7.792 3.558 ( 11.058 11.664 -5.233) 16.903 3.687 ( 6.065 -1.713 1.204) 6.417 4.084 ( -1.399 8.775 6.824) 11.204 4.602 ( 11.865 2.184 -5.787) 13.380 4.713 ( -2.032 -0.726 7.730) 8.026 5.136 ( -10.220 3.131 3.570) 11.270 5.432 ( 2.217 -1.598 -3.447) 4.399 5.722 ( -8.055 -0.216 -6.638) 10.440 6.067 ( -4.905 11.217 -1.731) 12.364 6.512 ( -0.211 -0.759 6.220) 6.270 6.986 ( 3.671 2.401 -4.302) 6.144 7.043 ( 13.591 -5.213 -2.358) 14.746 7.430 ( -0.308 -9.732 -1.481) 9.849 8.598 ( -21.341 -6.894 7.918) 23.784 9.236 ( -7.713 7.223 7.052) 12.704 9.535 ( -2.290 -1.709 3.975) 4.896 9.570 ( -3.304 -1.373 4.236) 5.545 10.139 ( 3.188 -1.668 3.951) 5.344 11.047 ( -5.751 -0.299 3.618) 6.801 11.199 ( 15.315 -1.182 -14.940) 21.427 12.206 ( 1.456 0.525 -4.008) 4.296 12.581 ( -7.510 0.350 2.272) 7.854 12.739 ( 0.027 2.177 -5.066) 5.514 12.972 ( 1.243 -6.200 4.252) 7.620 14.009 ( 11.043 9.792 -11.168) 18.508 17.366 ( 2.112 2.708 12.411) 12.877 18.462 ( 2.606 -7.259 -21.697) 23.027 19.026 ( -2.428 11.223 6.635) 13.262 19.427 ( -1.521 2.651 0.085) 3.058 20.028 ( 3.294 -10.868 1.257) 11.425 23.034 ( 13.582 -8.198 -8.636) 18.063 23.304 ( -7.570 18.041 6.268) 20.545 24.319 ( 6.086 -1.953 6.388) 9.036 ======================= Grid point 600 (301/361) ======================= q-point: (-0.30 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( -24.722 0.000 2.847) 24.885 2.705 ( -16.867 0.000 12.556) 21.027 3.204 ( -2.082 0.000 -3.065) 3.705 3.509 ( 11.323 -0.000 2.735) 11.649 3.707 ( 12.603 -0.000 -4.362) 13.336 3.934 ( 12.063 -0.000 8.177) 14.573 4.576 ( 10.588 -0.000 -5.208) 11.799 4.654 ( -5.366 0.000 1.625) 5.607 5.345 ( -14.209 0.000 4.828) 15.007 5.427 ( 0.175 -0.000 -3.480) 3.484 5.929 ( -9.288 0.000 -4.940) 10.520 6.405 ( -4.717 0.000 -5.812) 7.485 6.427 ( -5.585 0.000 9.269) 10.822 6.606 ( 14.751 -0.000 3.643) 15.194 7.027 ( 8.054 -0.000 -6.543) 10.377 7.293 ( 11.762 -0.000 -10.347) 15.665 8.693 ( -21.241 0.000 4.474) 21.707 9.423 ( -6.276 0.000 7.232) 9.576 9.472 ( -8.229 0.000 16.457) 18.400 9.566 ( -16.289 0.000 9.209) 18.712 10.023 ( 11.540 -0.000 -5.332) 12.712 11.140 ( -9.688 0.000 5.990) 11.390 11.150 ( 16.277 -0.000 -16.952) 23.501 12.155 ( 9.655 -0.000 -1.529) 9.775 12.708 ( -1.983 0.000 0.273) 2.002 12.762 ( -2.524 0.000 -0.518) 2.577 12.852 ( -3.251 0.000 4.500) 5.551 14.102 ( 12.111 -0.000 -7.920) 14.471 17.315 ( -5.635 0.000 1.042) 5.731 18.518 ( 5.961 -0.000 -12.580) 13.921 19.406 ( -18.817 0.000 -2.376) 18.967 19.498 ( 3.244 -0.000 6.621) 7.373 19.633 ( 6.843 -0.000 -2.185) 7.184 22.820 ( 17.167 -0.000 -11.327) 20.567 23.568 ( -3.564 0.000 8.617) 9.325 24.038 ( 11.567 -0.000 10.357) 15.527 ======================= Grid point 601 (302/361) ======================= q-point: (-0.20 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( -21.612 -4.831 8.388) 23.680 2.465 ( -29.240 -1.955 1.857) 29.364 3.239 ( 2.655 -2.240 6.529) 7.396 3.655 ( 5.584 -0.164 0.780) 5.641 3.748 ( 11.353 6.031 -9.213) 15.816 4.181 ( -0.590 2.207 13.082) 13.280 4.644 ( 9.985 1.628 -1.712) 10.261 4.684 ( 5.821 -1.420 1.322) 6.136 5.192 ( -12.810 2.181 3.683) 13.506 5.400 ( 2.213 -1.308 -6.677) 7.155 5.713 ( -8.773 -0.411 -7.690) 11.673 6.232 ( -4.005 5.663 -6.640) 9.602 6.510 ( -2.530 0.507 13.483) 13.727 6.914 ( 14.766 -4.417 2.643) 15.638 7.071 ( 9.360 2.808 -1.789) 9.934 7.287 ( 5.427 -5.292 -12.239) 14.396 8.471 ( -24.094 -4.980 8.499) 26.030 9.362 ( -6.605 5.208 2.929) 8.906 9.478 ( -8.455 -2.151 3.181) 9.286 9.565 ( -9.277 -0.574 17.858) 20.132 10.136 ( 9.491 0.146 -1.161) 9.563 11.062 ( -10.273 1.030 4.669) 11.331 11.192 ( 15.768 0.067 -13.186) 20.555 12.204 ( 1.691 -0.180 -3.909) 4.263 12.608 ( -6.626 1.924 -3.015) 7.529 12.748 ( -0.892 -1.208 -1.479) 2.108 12.880 ( -0.189 -2.844 3.014) 4.148 14.126 ( 11.730 3.287 -13.154) 17.928 17.403 ( 5.059 1.191 14.452) 15.358 18.361 ( 2.943 -3.262 -24.084) 24.481 19.196 ( -9.898 5.476 8.973) 14.439 19.522 ( 1.078 8.338 0.288) 8.412 19.809 ( 6.162 -12.255 0.025) 13.717 22.930 ( 15.348 -3.096 -9.832) 18.489 23.569 ( -6.221 9.378 8.754) 14.257 24.265 ( 6.575 -2.919 2.834) 7.732 ======================= Grid point 602 (303/361) ======================= q-point: (-0.10 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( -27.468 -5.983 3.946) 28.387 2.227 ( -17.925 -9.874 14.321) 24.978 3.401 ( 6.332 -1.726 4.278) 7.834 3.666 ( -1.599 2.608 -1.022) 3.225 3.757 ( 12.940 2.233 -10.272) 16.672 4.148 ( -18.035 6.501 14.480) 24.025 4.654 ( 0.455 8.965 -6.226) 10.925 4.884 ( 10.301 2.064 4.541) 11.445 5.113 ( 1.220 -2.164 2.089) 3.245 5.350 ( 0.428 -5.734 -5.081) 7.674 5.600 ( -0.380 -1.579 -0.967) 1.890 6.062 ( -0.397 7.447 -5.703) 9.388 6.650 ( -0.648 3.675 15.372) 15.818 6.965 ( -1.874 3.657 -6.877) 8.011 7.081 ( 5.197 0.194 -14.662) 15.557 7.452 ( 6.992 -5.383 12.754) 15.509 8.358 ( -18.651 -10.866 13.247) 25.327 9.251 ( -6.181 5.170 2.368) 8.399 9.435 ( -2.789 -5.481 -3.491) 7.072 9.654 ( -5.178 1.222 14.112) 15.081 10.222 ( 2.737 1.878 1.172) 3.521 10.933 ( -10.564 -1.834 -1.432) 10.817 11.266 ( 13.429 1.012 -8.289) 15.813 12.124 ( -4.659 -0.331 -5.176) 6.972 12.483 ( -7.007 -2.486 -0.140) 7.436 12.709 ( -0.658 2.423 -1.896) 3.146 12.967 ( 1.216 -6.694 2.287) 7.178 14.061 ( 10.937 5.490 -17.012) 20.956 17.702 ( 11.760 7.836 15.593) 21.044 18.184 ( 5.351 -8.610 -17.603) 20.314 19.175 ( -1.216 11.064 6.113) 12.699 19.471 ( 4.701 2.321 -2.130) 5.659 19.956 ( -1.104 -11.477 0.230) 11.532 23.066 ( 13.886 -5.174 -7.874) 16.781 23.415 ( -10.546 19.142 5.661) 22.576 24.327 ( -2.880 -6.840 -3.734) 8.308 ======================= Grid point 611 (304/361) ======================= q-point: (-0.20 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( -30.820 0.000 3.539) 31.022 2.129 ( -16.961 0.000 14.888) 22.568 3.385 ( 7.377 -0.000 5.546) 9.229 3.678 ( -1.003 0.000 -2.599) 2.786 3.795 ( 11.258 -0.000 -11.835) 16.334 4.204 ( -21.672 0.000 17.377) 27.778 4.758 ( 5.527 -0.000 -3.508) 6.547 4.883 ( 16.117 -0.000 0.379) 16.122 5.108 ( -4.983 0.000 2.871) 5.751 5.280 ( 0.901 -0.000 -7.685) 7.737 5.585 ( -1.095 0.000 -1.336) 1.727 6.132 ( 0.028 -0.000 -7.500) 7.500 6.695 ( -1.181 0.000 19.126) 19.162 6.984 ( 5.048 -0.000 -7.084) 8.699 7.098 ( -1.872 0.000 -17.344) 17.445 7.392 ( 16.876 -0.000 13.490) 21.605 8.244 ( -23.438 0.000 14.437) 27.527 9.307 ( -4.465 0.000 -1.931) 4.865 9.385 ( -5.425 0.000 -1.264) 5.570 9.663 ( -10.224 0.000 21.098) 23.445 10.238 ( 8.197 -0.000 -3.253) 8.819 10.924 ( -15.767 0.000 1.103) 15.805 11.280 ( 14.479 -0.000 -8.300) 16.689 12.125 ( -4.274 0.000 -5.869) 7.261 12.450 ( -8.161 0.000 -2.568) 8.555 12.732 ( -1.522 0.000 0.765) 1.703 12.902 ( 1.922 -0.000 1.049) 2.190 14.110 ( 11.368 -0.000 -18.379) 21.610 17.790 ( 17.001 -0.000 20.353) 26.519 18.086 ( 2.063 -0.000 -22.263) 22.359 19.279 ( 2.050 -0.000 9.753) 9.966 19.547 ( -3.583 0.000 -3.092) 4.732 19.797 ( 2.853 -0.000 -1.745) 3.345 23.016 ( 14.937 -0.000 -8.584) 17.228 23.623 ( -8.517 0.000 8.923) 12.335 24.236 ( -3.980 0.000 -8.210) 9.124 ======================= Grid point 612 (305/361) ======================= q-point: (-0.10 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( -17.547 -4.457 14.128) 22.964 2.175 ( -10.360 -5.135 20.319) 23.378 3.529 ( 6.121 2.480 -2.514) 7.066 3.577 ( -2.995 -1.388 -3.913) 5.119 3.805 ( 10.940 -0.293 -12.001) 16.242 4.077 ( -23.670 2.199 18.004) 29.821 4.666 ( -1.983 12.905 -6.133) 14.425 4.905 ( -2.018 -7.427 -8.082) 11.160 5.134 ( 3.566 -0.352 1.828) 4.023 5.488 ( 13.376 -1.283 11.635) 17.775 5.617 ( 7.411 -2.240 -0.421) 7.754 6.083 ( 6.083 3.379 -4.597) 8.340 6.777 ( -12.761 4.364 -13.061) 18.774 6.885 ( -1.002 4.667 14.408) 15.178 6.955 ( 1.104 -3.017 -5.379) 6.265 7.746 ( 7.988 6.111 14.796) 17.891 8.226 ( -13.735 -12.767 19.669) 27.175 9.222 ( -1.735 1.868 -2.660) 3.684 9.295 ( -3.710 -3.325 -5.339) 7.302 9.781 ( -6.839 1.605 19.003) 20.260 10.259 ( 1.817 4.015 -4.493) 6.293 10.688 ( -16.583 -5.600 -1.636) 17.579 11.361 ( 9.906 1.651 -7.063) 12.278 11.966 ( -7.133 -0.092 -6.095) 9.383 12.392 ( -4.705 -3.557 5.052) 7.765 12.703 ( -0.629 1.622 -1.603) 2.365 12.958 ( 1.590 -3.529 0.964) 3.989 14.015 ( 10.404 2.233 -20.306) 22.925 17.883 ( 4.891 2.988 -14.730) 15.806 18.316 ( 22.911 -2.413 14.110) 27.015 19.300 ( -5.650 16.260 -2.594) 17.408 19.552 ( 10.959 -7.525 4.614) 14.072 19.815 ( -3.283 -7.560 -2.261) 8.547 23.131 ( 13.610 -2.819 -7.858) 15.966 23.484 ( -12.914 19.660 4.235) 23.901 24.018 ( -14.985 -13.087 -11.421) 22.940 ======================= Grid point 622 (306/361) ======================= q-point: (-0.10 -0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -2.774 0.000 19.158) 19.358 2.328 ( -3.726 0.000 24.435) 24.717 3.368 ( -8.724 0.000 -8.078) 11.890 3.675 ( 12.470 -0.000 -3.544) 12.964 3.769 ( 6.665 -0.000 -13.407) 14.973 4.002 ( -16.898 0.000 15.321) 22.810 4.661 ( -1.213 0.000 -14.645) 14.695 4.672 ( -4.014 0.000 -2.694) 4.834 5.244 ( 4.396 -0.000 6.921) 8.199 5.637 ( -3.910 0.000 11.026) 11.699 5.892 ( 21.501 -0.000 2.267) 21.620 6.176 ( 10.978 -0.000 -2.915) 11.359 6.465 ( -14.554 0.000 -6.183) 15.813 6.814 ( -2.220 0.000 -8.803) 9.078 7.104 ( -3.678 0.000 16.855) 17.252 8.086 ( 7.031 -0.000 12.918) 14.708 8.224 ( -13.374 0.000 25.876) 29.128 9.157 ( -3.271 0.000 -5.751) 6.616 9.182 ( 1.047 -0.000 -5.078) 5.185 9.937 ( -7.672 0.000 21.343) 22.680 10.245 ( 4.467 -0.000 -10.950) 11.826 10.390 ( -17.959 0.000 2.891) 18.190 11.346 ( 2.300 -0.000 -11.636) 11.861 11.812 ( -5.858 0.000 -4.087) 7.143 12.415 ( -2.718 0.000 8.867) 9.274 12.679 ( 2.667 -0.000 -4.955) 5.627 12.975 ( 0.814 -0.000 1.515) 1.720 13.922 ( 9.242 -0.000 -19.084) 21.204 17.813 ( 7.340 -0.000 -11.460) 13.609 18.756 ( 19.387 -0.000 4.519) 19.907 19.194 ( -4.045 0.000 -9.674) 10.485 19.625 ( -13.732 0.000 8.809) 16.315 19.895 ( 23.825 -0.000 3.153) 24.032 23.174 ( 6.392 -0.000 -11.806) 13.425 23.463 ( -21.993 0.000 -12.470) 25.283 23.509 ( -11.422 0.000 5.146) 12.527 ======================= Grid point 623 (307/361) ======================= q-point: ( 0.00 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.554 ( 4.759 -0.000 10.333) 11.376 2.737 ( -3.393 0.000 -8.233) 8.905 3.382 ( 0.792 -0.000 1.590) 1.776 3.476 ( -0.923 0.000 -9.962) 10.005 3.515 ( 5.056 -0.000 15.914) 16.698 3.825 ( -4.407 0.000 -12.894) 13.626 4.327 ( 7.896 -0.000 0.686) 7.926 4.353 ( -8.841 0.000 -2.146) 9.097 5.807 ( 1.519 -0.000 8.625) 8.758 5.932 ( 0.763 -0.000 -2.351) 2.472 6.098 ( -9.315 0.000 7.762) 12.125 6.257 ( 4.362 -0.000 -6.687) 7.984 6.441 ( 4.174 -0.000 0.044) 4.175 6.470 ( -0.499 0.000 -3.191) 3.229 7.827 ( 1.795 -0.000 20.826) 20.903 8.165 ( -6.030 0.000 -12.832) 14.178 8.890 ( -5.719 0.000 7.596) 9.508 8.980 ( 3.166 -0.000 -3.381) 4.631 9.283 ( -1.505 0.000 16.667) 16.735 9.645 ( 2.578 -0.000 -18.437) 18.616 10.374 ( -8.162 0.000 17.507) 19.316 10.703 ( 3.680 -0.000 -16.070) 16.486 10.898 ( 6.702 -0.000 18.203) 19.397 11.243 ( -3.748 0.000 -15.950) 16.384 12.568 ( -7.122 0.000 2.657) 7.601 12.630 ( 9.065 -0.000 -4.109) 9.953 13.225 ( -4.283 0.000 11.783) 12.537 13.480 ( 5.479 -0.000 -13.487) 14.557 17.934 ( 10.256 -0.000 5.844) 11.804 18.120 ( -10.569 0.000 -12.658) 16.490 19.425 ( -15.692 0.000 4.258) 16.260 19.486 ( 13.944 -0.000 -1.975) 14.083 21.270 ( 28.202 -0.000 20.731) 35.002 21.696 ( -28.414 0.000 -21.831) 35.832 23.327 ( -8.810 0.000 1.354) 8.913 23.359 ( 9.315 -0.000 -2.140) 9.558 ======================= Grid point 624 (308/361) ======================= q-point: ( 0.10 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( 0.105 -0.833 -10.318) 10.352 2.761 ( 8.808 -0.254 7.956) 11.872 3.362 ( -2.410 3.044 -0.271) 3.892 3.397 ( -0.889 3.777 1.623) 4.206 3.587 ( -3.706 -2.897 -14.939) 15.662 3.762 ( 3.506 3.718 13.944) 14.851 4.238 ( -6.129 -1.776 0.055) 6.381 4.482 ( 8.770 -3.767 1.875) 9.727 5.824 ( -6.924 0.123 -8.560) 11.010 5.873 ( -4.452 -0.772 5.070) 6.791 6.061 ( -12.140 -1.691 9.501) 15.509 6.201 ( -2.526 -0.758 -3.820) 4.642 6.435 ( 1.926 0.762 -5.020) 5.430 6.516 ( 5.861 -1.159 0.434) 5.991 7.847 ( -6.607 11.812 -12.676) 18.544 8.048 ( 2.100 10.082 16.733) 19.648 8.902 ( -7.637 -5.651 3.499) 10.124 9.016 ( 1.760 -7.911 -1.050) 8.172 9.459 ( -0.853 -0.196 1.282) 1.552 9.471 ( 0.356 -2.070 -1.823) 2.781 10.536 ( -0.790 -0.800 17.912) 17.947 10.603 ( 6.923 0.849 -11.920) 13.810 11.034 ( 6.958 3.301 -19.439) 20.909 11.246 ( 13.750 -0.624 14.563) 20.038 12.509 ( -7.701 -4.729 1.780) 9.211 12.714 ( 6.576 -4.711 -4.159) 9.096 13.281 ( -7.508 2.036 12.201) 14.470 13.372 ( 3.574 1.025 -13.385) 13.892 17.846 ( -10.663 -0.625 -8.672) 13.758 18.177 ( 9.982 -0.707 10.485) 14.494 19.238 ( -16.179 2.299 3.088) 16.631 19.615 ( 8.241 1.061 -1.045) 8.375 21.053 ( -24.847 1.112 -21.451) 32.844 21.908 ( 25.387 -0.830 21.542) 33.306 23.245 ( -5.112 -0.292 0.727) 5.172 23.484 ( 10.953 -1.142 -1.099) 11.068 ======================= Grid point 625 (309/361) ======================= q-point: ( 0.20 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.508 ( 2.214 -4.081 -12.135) 12.993 2.974 ( 7.855 -1.034 5.821) 9.831 3.244 ( -3.629 3.454 -11.690) 12.718 3.357 ( -0.436 2.424 6.970) 7.392 3.536 ( -0.955 -5.726 0.857) 5.868 3.862 ( 0.929 8.926 8.736) 12.524 4.232 ( 1.765 1.106 2.756) 3.455 4.667 ( 6.513 -6.607 2.925) 9.727 5.574 ( -13.597 0.420 -6.907) 15.257 5.812 ( -12.693 -2.273 2.201) 13.082 5.996 ( -11.508 -1.542 4.642) 12.504 6.122 ( -4.864 -1.235 -2.697) 5.697 6.393 ( 4.129 1.191 -5.966) 7.352 6.633 ( 6.747 -2.155 1.386) 7.218 7.529 ( -3.047 14.349 -8.560) 16.984 8.083 ( 0.713 16.571 5.771) 17.561 8.871 ( -7.931 -5.423 2.406) 9.905 9.129 ( -0.802 -11.563 2.913) 11.951 9.334 ( -1.561 -10.579 -14.223) 17.795 9.601 ( -2.401 4.132 14.177) 14.961 10.568 ( 6.938 7.164 -4.635) 10.997 10.771 ( 5.051 0.271 13.081) 14.025 10.921 ( 15.509 2.238 -20.236) 25.593 11.610 ( 15.773 -1.318 8.629) 18.027 12.496 ( -4.572 -6.821 2.487) 8.580 12.773 ( 2.290 -6.674 -5.828) 9.152 13.237 ( -2.964 2.666 -2.627) 4.775 13.315 ( -3.333 -1.914 4.131) 5.642 17.625 ( -10.628 0.073 -3.851) 11.305 18.459 ( 8.765 -0.807 12.460) 15.256 19.016 ( -13.707 4.174 -0.176) 14.330 19.675 ( -1.014 -1.351 2.048) 2.655 20.503 ( -14.887 2.324 -19.986) 25.029 22.473 ( 18.007 -1.203 19.322) 26.440 23.197 ( -0.405 2.950 -0.858) 3.099 23.667 ( 11.686 -4.086 2.029) 12.545 ======================= Grid point 626 (310/361) ======================= q-point: ( 0.30 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( 5.139 -10.067 -11.885) 16.402 3.017 ( -0.496 -1.362 -14.815) 14.886 3.132 ( -4.974 0.047 12.852) 13.781 3.464 ( 4.293 1.415 6.032) 7.537 3.592 ( -0.419 -8.256 -0.387) 8.276 3.887 ( 1.870 14.156 9.727) 17.278 4.308 ( 8.887 3.736 1.036) 9.696 4.830 ( 2.026 -5.348 4.312) 7.162 5.318 ( -13.001 -0.713 -3.140) 13.394 5.627 ( -17.302 -2.535 0.120) 17.487 5.889 ( -10.515 -1.659 1.007) 10.692 6.016 ( -5.113 -1.697 -4.959) 7.322 6.414 ( 7.025 1.459 -1.525) 7.335 6.760 ( 5.378 -2.601 1.504) 6.160 7.302 ( 0.982 13.864 -6.976) 15.551 7.946 ( -1.715 15.413 -1.662) 15.597 8.842 ( -8.472 -6.859 1.910) 11.066 9.245 ( -4.651 -10.628 4.197) 12.337 9.276 ( -0.738 -12.556 -7.595) 14.693 9.668 ( -1.483 7.020 10.074) 12.367 10.527 ( 3.826 13.365 0.292) 13.905 10.871 ( 20.029 2.432 -19.881) 28.325 11.019 ( 4.115 -0.206 9.327) 10.197 11.878 ( 11.035 -3.646 1.012) 11.666 12.566 ( 1.483 -4.099 2.653) 5.103 12.753 ( -0.400 -4.671 -6.511) 8.024 13.154 ( -4.470 2.285 1.517) 5.244 13.386 ( -0.634 -8.976 4.232) 9.944 17.468 ( -9.496 0.985 2.572) 9.887 18.680 ( -2.134 -4.951 3.491) 6.423 18.811 ( -0.135 10.196 0.360) 10.203 19.628 ( -14.132 -4.206 2.286) 14.921 20.178 ( 1.392 2.964 -12.376) 12.802 22.857 ( 3.441 -6.411 13.065) 14.954 23.157 ( 7.644 11.399 -3.055) 14.061 23.938 ( 11.857 -6.760 7.151) 15.408 ======================= Grid point 627 (311/361) ======================= q-point: (-0.60 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.509 ( 1.215 -10.035 -8.037) 12.914 2.904 ( 4.565 -1.460 -8.211) 9.507 3.184 ( -10.903 -2.228 11.761) 16.191 3.497 ( -2.069 2.633 0.155) 3.353 3.704 ( 5.638 -11.405 -1.654) 12.830 3.893 ( 1.738 15.347 8.516) 17.638 4.440 ( 13.993 4.719 0.200) 14.768 4.876 ( -8.760 -1.766 4.508) 10.009 5.197 ( -6.490 -4.686 2.047) 8.262 5.447 ( -9.115 -1.934 -0.332) 9.324 5.762 ( -8.395 -1.107 -1.705) 8.638 5.912 ( -3.379 -2.791 -5.289) 6.869 6.509 ( 5.206 0.847 4.326) 6.821 6.847 ( 1.838 -2.291 0.304) 2.953 7.122 ( 3.623 11.346 -9.949) 15.519 7.776 ( -2.622 10.546 -0.531) 10.880 8.783 ( -9.358 -6.424 -0.792) 11.379 9.274 ( -10.059 -13.838 4.718) 17.747 9.379 ( 6.096 -4.641 0.350) 7.670 9.679 ( -0.130 8.336 4.684) 9.562 10.459 ( -0.879 12.342 4.924) 13.317 10.875 ( 17.452 2.616 -19.861) 26.568 11.144 ( 1.422 1.280 5.874) 6.178 12.031 ( 6.229 -5.266 -1.109) 8.231 12.592 ( -0.887 -1.882 -3.389) 3.977 12.730 ( 0.043 -0.676 -2.182) 2.285 13.132 ( -1.433 1.928 5.200) 5.728 13.532 ( 2.400 -11.489 1.324) 11.811 17.432 ( -5.549 -0.515 10.142) 11.572 18.475 ( -7.524 1.080 -15.347) 17.127 18.908 ( 6.588 5.745 6.194) 10.713 19.474 ( -11.218 -2.695 0.525) 11.549 20.145 ( 4.555 0.386 -2.099) 5.030 22.989 ( -11.313 -13.824 4.809) 18.499 23.163 ( 15.918 17.434 -1.968) 23.689 24.243 ( 8.894 -5.491 8.176) 13.270 ======================= Grid point 628 (312/361) ======================= q-point: (-0.50 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( -5.480 -0.064 -0.650) 5.519 2.863 ( -12.213 6.491 6.016) 15.083 3.235 ( 8.478 -7.785 -2.571) 11.794 3.447 ( 0.194 1.157 -0.711) 1.372 3.839 ( 0.370 8.025 0.784) 8.072 3.887 ( 2.932 -10.323 0.737) 10.757 4.560 ( 2.350 1.508 -0.484) 2.834 4.804 ( -5.364 -3.081 3.727) 7.222 5.217 ( -0.494 0.410 4.295) 4.343 5.401 ( -0.418 -0.941 -1.030) 1.456 5.667 ( -2.900 1.298 0.802) 3.277 5.849 ( -0.891 -3.413 -4.631) 5.821 6.643 ( 1.495 -2.439 9.148) 9.585 6.826 ( -2.594 -0.869 -6.218) 6.793 6.992 ( 3.796 4.013 -7.371) 9.211 7.694 ( -2.415 4.309 3.578) 6.100 8.707 ( -5.475 -1.018 1.316) 5.722 9.315 ( -7.501 -6.324 6.390) 11.709 9.498 ( 5.099 -1.552 -1.241) 5.472 9.635 ( -0.935 4.543 1.206) 4.793 10.419 ( -5.537 7.028 10.249) 13.604 10.833 ( 11.151 0.387 -17.506) 20.760 11.193 ( 1.570 2.119 1.983) 3.300 12.107 ( 1.169 -2.307 -1.701) 3.096 12.549 ( -0.656 -0.936 -2.704) 2.935 12.694 ( -3.079 0.426 1.015) 3.270 13.166 ( 0.421 3.397 3.561) 4.939 13.652 ( 4.196 -7.568 -4.345) 9.683 17.562 ( 0.380 -3.595 12.099) 12.628 18.189 ( -1.065 2.924 -15.017) 15.336 18.985 ( 1.649 0.377 1.768) 2.447 19.416 ( -0.198 -0.368 0.564) 0.702 20.173 ( 0.512 1.346 0.539) 1.538 22.990 ( -6.603 -9.535 1.179) 11.658 23.197 ( 7.114 7.785 -1.488) 10.650 24.424 ( 1.989 -1.158 2.871) 3.680 ======================= Grid point 629 (313/361) ======================= q-point: (-0.40 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.355 ( -10.033 9.925 7.398) 15.935 2.685 ( -13.477 8.738 12.652) 20.447 3.382 ( 8.326 -2.083 -5.955) 10.446 3.509 ( 7.705 -5.969 -1.708) 9.895 3.713 ( -1.166 11.292 -3.276) 11.815 4.027 ( -0.429 -17.321 -3.505) 17.677 4.444 ( -15.361 -5.735 -0.731) 16.413 4.905 ( 5.753 -1.796 2.503) 6.526 5.228 ( 2.875 7.911 -1.495) 8.549 5.434 ( 7.592 0.985 2.207) 7.968 5.691 ( 1.584 1.405 5.863) 6.234 5.852 ( 3.825 -2.118 -2.019) 4.816 6.668 ( -5.561 -2.454 -9.936) 11.648 6.823 ( 0.356 -6.079 8.341) 10.328 6.950 ( -1.314 -1.367 -0.229) 1.910 7.716 ( -2.418 -3.649 6.267) 7.644 8.702 ( 1.212 6.242 6.645) 9.197 9.316 ( -1.816 5.051 3.329) 6.316 9.429 ( -1.854 6.549 -5.769) 8.922 9.687 ( -1.573 -9.646 2.994) 10.221 10.416 ( -8.384 3.702 12.545) 15.536 10.767 ( 3.223 -3.048 -12.337) 13.110 11.211 ( 2.873 1.511 -1.267) 3.485 12.050 ( -4.594 2.284 -3.082) 5.985 12.539 ( 0.966 1.334 1.186) 2.030 12.679 ( -3.539 -0.844 3.138) 4.804 13.152 ( -1.139 5.599 1.889) 6.017 13.668 ( 5.461 -2.546 -11.074) 12.607 17.653 ( 3.139 -1.539 -7.998) 8.728 18.196 ( 9.915 -2.482 8.712) 13.430 18.993 ( -3.722 -6.097 -2.423) 7.543 19.480 ( 10.285 2.491 -0.024) 10.583 20.129 ( -4.069 4.346 0.378) 5.966 23.024 ( -1.437 -7.981 0.899) 8.159 23.178 ( -1.187 -0.250 -3.242) 3.462 24.369 ( -6.484 4.564 -4.338) 9.039 ======================= Grid point 630 (314/361) ======================= q-point: (-0.30 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -9.283 11.181 13.052) 19.533 2.686 ( -4.892 6.480 18.178) 19.909 3.361 ( -1.479 -1.015 -8.832) 9.012 3.558 ( -2.313 -0.412 -1.956) 3.057 3.638 ( 12.082 6.396 -7.500) 15.593 4.080 ( -4.217 -15.657 -7.045) 17.679 4.309 ( -10.467 -8.033 -0.192) 13.196 4.921 ( -2.015 4.827 -4.198) 6.707 5.231 ( 5.442 2.412 4.931) 7.729 5.633 ( 19.019 2.913 -0.271) 19.242 5.810 ( 1.690 1.526 11.972) 12.186 5.940 ( 9.186 -1.831 -1.700) 9.520 6.483 ( -8.881 -3.893 -7.448) 12.227 6.822 ( -2.342 1.545 -4.947) 5.687 7.097 ( -2.341 -11.347 13.458) 17.758 7.843 ( -1.869 -11.664 8.372) 14.478 8.770 ( 3.866 9.991 9.791) 14.513 9.228 ( 1.478 14.278 -2.947) 14.654 9.300 ( -3.423 3.734 -0.805) 5.129 9.781 ( -2.141 -13.275 -0.467) 13.454 10.416 ( -11.757 2.918 16.151) 20.189 10.667 ( -3.782 -1.167 -7.095) 8.124 11.199 ( 1.797 -0.877 -7.245) 7.516 11.900 ( -7.709 3.069 -2.316) 8.615 12.576 ( 1.881 2.412 3.523) 4.665 12.656 ( -3.732 1.766 1.632) 4.439 13.103 ( -1.788 6.083 3.026) 7.025 13.611 ( 7.818 -0.989 -14.986) 16.932 17.604 ( 6.948 -1.109 -10.306) 12.479 18.556 ( 16.362 -2.274 11.019) 19.857 18.927 ( -8.494 -11.019 -6.783) 15.478 19.656 ( 17.628 3.291 -0.416) 17.937 20.017 ( -6.529 6.024 4.223) 9.836 23.077 ( -6.374 -3.209 -8.169) 10.847 23.104 ( -0.732 -9.549 1.238) 9.657 24.085 ( -13.050 9.766 -7.592) 17.981 ======================= Grid point 631 (315/361) ======================= q-point: (-0.20 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.246 ( -2.509 4.834 14.478) 15.469 2.829 ( -2.160 4.068 19.959) 20.484 3.192 ( -6.900 -1.115 -7.306) 10.111 3.513 ( 1.427 -1.519 -7.652) 7.931 3.645 ( 10.171 5.067 -7.887) 13.832 4.028 ( -5.639 -9.376 -7.157) 13.074 4.279 ( -3.414 -7.946 -2.455) 8.990 4.741 ( -5.606 8.334 -4.749) 11.111 5.411 ( 7.657 -0.084 9.273) 12.026 5.822 ( 9.428 3.492 2.170) 10.285 5.993 ( 6.727 0.431 8.193) 10.609 6.084 ( 13.132 -1.197 -3.467) 13.635 6.350 ( -5.268 -2.846 -1.299) 6.127 6.691 ( -5.321 1.341 -4.831) 7.311 7.322 ( -1.772 -10.201 12.712) 16.395 8.054 ( -2.221 -18.444 7.799) 20.148 8.848 ( 3.259 9.807 9.047) 13.735 9.115 ( -1.329 9.431 3.234) 10.059 9.194 ( -0.048 10.767 -2.977) 11.171 9.837 ( 0.564 -12.229 -8.064) 14.659 10.432 ( -19.205 -0.147 22.191) 29.348 10.540 ( -1.407 4.513 -1.047) 4.842 11.078 ( -1.340 -0.655 -13.857) 13.937 11.731 ( -10.236 -0.137 -4.025) 10.999 12.577 ( 3.617 2.991 -5.215) 7.016 12.639 ( -1.855 5.548 7.794) 9.745 13.084 ( -2.068 3.386 5.981) 7.177 13.565 ( 9.280 -2.037 -14.733) 17.531 17.637 ( 9.293 -0.971 -4.826) 10.516 18.701 ( -4.463 0.017 -10.873) 11.753 18.978 ( 12.515 -9.443 3.259) 16.013 19.718 ( -4.106 2.532 -2.349) 5.365 20.154 ( 17.770 3.668 14.873) 23.461 22.821 ( -18.390 -7.294 -15.102) 24.889 23.192 ( 3.997 -4.001 -0.740) 5.704 23.723 ( -13.908 10.031 -3.713) 17.546 ======================= Grid point 632 (316/361) ======================= q-point: (-0.10 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( 1.105 1.026 12.709) 12.798 2.887 ( -6.244 0.591 -2.278) 6.672 3.188 ( 1.695 -1.873 15.417) 15.622 3.449 ( 1.773 -1.176 -7.302) 7.605 3.607 ( 4.161 1.170 -12.059) 12.811 3.959 ( -1.788 -3.522 -5.799) 7.016 4.271 ( 0.805 -3.068 -3.270) 4.556 4.530 ( -7.657 6.185 -3.396) 10.413 5.633 ( 5.833 -0.302 10.664) 12.158 5.906 ( 2.172 2.333 3.733) 4.909 6.105 ( -0.416 0.340 3.561) 3.601 6.215 ( 12.366 0.180 -5.975) 13.735 6.374 ( 3.672 -0.974 1.517) 4.090 6.554 ( -5.352 0.246 -3.635) 6.474 7.553 ( -0.339 -6.722 16.638) 17.948 8.236 ( -3.033 -17.634 -1.571) 17.961 8.893 ( -0.067 8.842 7.974) 11.907 9.031 ( 0.107 10.447 -2.959) 10.859 9.142 ( -1.531 2.869 10.867) 11.343 9.798 ( 2.786 -5.359 -15.757) 16.875 10.360 ( -15.313 1.938 13.695) 20.635 10.633 ( -0.316 0.663 17.873) 17.888 10.879 ( 0.048 0.652 -16.208) 16.221 11.503 ( -10.651 -1.804 -10.702) 15.207 12.572 ( 8.519 3.253 -4.771) 10.291 12.628 ( -4.569 4.479 5.004) 8.123 13.136 ( -2.314 -0.061 9.607) 9.882 13.538 ( 8.014 -1.828 -13.490) 15.797 17.753 ( 10.092 -0.111 0.649) 10.114 18.431 ( -9.764 -0.047 -14.548) 17.521 19.269 ( 16.561 -3.573 -0.118) 16.942 19.580 ( -12.687 0.147 2.571) 12.946 20.654 ( 26.755 1.532 18.114) 32.346 22.331 ( -26.447 -2.979 -20.620) 33.667 23.270 ( 6.619 -1.032 -1.949) 6.977 23.469 ( -11.327 4.059 0.609) 12.047 ======================= Grid point 634 (317/361) ======================= q-point: ( 0.10 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( 0.584 -0.000 -12.453) 12.466 2.963 ( 7.765 -0.000 4.141) 8.800 3.278 ( -3.014 0.000 -14.723) 15.028 3.390 ( -0.358 0.000 2.141) 2.171 3.469 ( -3.881 0.000 7.023) 8.024 3.954 ( 2.139 -0.000 9.108) 9.356 4.255 ( 2.656 -0.000 7.152) 7.629 4.580 ( 5.758 -0.000 0.980) 5.840 5.581 ( -13.174 0.000 -7.049) 14.941 5.789 ( -12.707 0.000 1.607) 12.809 5.985 ( -11.232 0.000 6.070) 12.767 6.111 ( -4.804 0.000 -2.724) 5.523 6.406 ( 3.877 -0.000 -5.625) 6.832 6.611 ( 6.183 -0.000 1.992) 6.496 7.670 ( -3.830 0.000 -11.596) 12.212 8.248 ( -4.529 0.000 9.416) 10.448 8.854 ( -7.762 0.000 8.598) 11.583 8.963 ( 3.307 -0.000 -5.939) 6.797 9.236 ( -1.897 0.000 -15.009) 15.128 9.643 ( -2.998 0.000 16.800) 17.065 10.632 ( 14.082 -0.000 -9.015) 16.720 10.774 ( 4.055 -0.000 17.051) 17.526 10.953 ( 16.240 -0.000 -24.122) 29.079 11.599 ( 13.653 -0.000 10.560) 17.260 12.430 ( -4.148 0.000 4.026) 5.780 12.702 ( 2.848 -0.000 -5.451) 6.150 13.252 ( 2.256 -0.000 -12.927) 13.122 13.311 ( -10.918 0.000 12.764) 16.797 17.626 ( -10.331 0.000 -3.251) 10.830 18.451 ( 8.571 -0.000 12.914) 15.500 19.058 ( -14.323 0.000 1.292) 14.381 19.658 ( -3.747 0.000 1.926) 4.213 20.525 ( -11.919 0.000 -22.751) 25.684 22.457 ( 14.024 -0.000 21.798) 25.920 23.238 ( 3.263 -0.000 1.670) 3.666 23.621 ( 11.410 -0.000 -1.112) 11.464 ======================= Grid point 635 (318/361) ======================= q-point: ( 0.20 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( 2.227 -3.693 -12.311) 13.045 2.968 ( 2.075 -2.358 -16.349) 16.648 3.158 ( -4.536 1.508 7.086) 8.547 3.469 ( -3.362 -1.814 3.967) 5.507 3.492 ( 4.137 -1.315 3.497) 5.575 4.094 ( 3.253 7.298 12.929) 15.199 4.389 ( 7.547 4.921 5.266) 10.436 4.684 ( 1.242 -8.456 2.119) 8.806 5.332 ( -11.045 1.225 -3.873) 11.768 5.569 ( -20.482 -2.558 -0.366) 20.644 5.893 ( -10.223 0.813 4.088) 11.040 5.995 ( -4.802 -0.712 -5.376) 7.243 6.436 ( 6.099 0.765 -0.451) 6.163 6.724 ( 5.009 -1.201 2.216) 5.607 7.488 ( -0.641 5.975 -9.076) 10.885 8.147 ( -10.520 6.311 -1.802) 12.399 8.814 ( -3.795 3.926 0.539) 5.487 8.972 ( -4.482 -13.539 -3.592) 14.707 9.155 ( 2.978 -4.261 -0.564) 5.229 9.769 ( -4.649 3.191 15.208) 16.220 10.727 ( 15.663 7.051 -7.919) 18.915 10.905 ( 20.550 1.285 -23.631) 31.343 11.021 ( 4.341 0.023 12.024) 12.783 11.829 ( 7.602 -1.583 2.029) 8.026 12.517 ( 4.806 -1.208 6.706) 8.338 12.659 ( -0.742 -4.236 -6.570) 7.852 13.149 ( 2.149 -1.522 -9.560) 9.916 13.308 ( -11.766 -0.811 14.074) 18.362 17.481 ( -9.796 0.389 2.778) 10.190 18.624 ( -4.743 -1.483 2.189) 5.430 18.952 ( 0.466 4.699 7.532) 8.890 19.564 ( -14.352 -2.315 3.006) 14.845 20.208 ( 2.786 0.658 -18.975) 19.190 22.748 ( -4.808 -3.713 13.320) 14.640 23.385 ( 15.157 10.468 5.695) 19.281 23.798 ( 11.052 -7.325 1.173) 13.310 ======================= Grid point 636 (319/361) ======================= q-point: ( 0.30 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.342 ( 6.984 -7.553 -7.647) 12.818 2.843 ( 6.500 -4.309 -15.911) 17.720 3.174 ( -11.779 0.520 14.376) 18.592 3.453 ( -4.711 -5.427 -0.940) 7.248 3.612 ( 4.879 -0.291 1.636) 5.154 4.176 ( 0.588 15.322 12.082) 19.521 4.527 ( 11.955 4.625 2.708) 13.101 4.775 ( -8.077 -9.046 4.110) 12.805 5.166 ( -7.793 1.126 -0.470) 7.888 5.348 ( -12.313 -7.521 -0.220) 14.430 5.788 ( -7.511 3.132 2.356) 8.472 5.883 ( -2.583 -1.252 -5.199) 5.939 6.526 ( 2.845 0.876 5.225) 6.014 6.809 ( 1.566 -1.788 1.525) 2.824 7.309 ( 1.007 8.923 -11.199) 14.354 7.880 ( -13.468 1.792 -5.599) 14.695 8.734 ( -0.898 -0.605 -3.962) 4.107 9.006 ( -7.058 -10.961 4.949) 13.944 9.301 ( 6.170 -5.108 4.237) 9.062 9.822 ( -4.997 6.111 11.811) 14.206 10.700 ( 13.066 12.524 -13.364) 22.499 10.932 ( 16.572 4.016 -14.889) 22.637 11.163 ( 2.842 0.035 3.958) 4.873 11.945 ( 4.891 -3.846 0.901) 6.287 12.555 ( -2.411 -2.213 -3.984) 5.156 12.704 ( 4.337 -1.814 0.587) 4.738 13.117 ( 2.314 -3.536 -4.505) 6.176 13.378 ( -5.616 -4.619 14.298) 16.041 17.426 ( -7.876 -0.181 9.569) 12.395 18.441 ( -10.859 -2.602 -11.241) 15.844 19.090 ( 8.090 11.037 9.433) 16.621 19.429 ( -9.321 -2.141 1.032) 9.620 20.109 ( 4.387 -3.515 -9.543) 11.075 22.783 ( -12.570 -8.275 6.795) 16.513 23.501 ( 13.618 19.363 1.594) 23.726 24.090 ( 9.381 -11.638 6.623) 16.350 ======================= Grid point 637 (320/361) ======================= q-point: ( 0.40 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.441 ( 5.646 -1.813 0.063) 5.930 2.870 ( 8.337 -5.949 -7.591) 12.748 3.163 ( -9.637 0.389 11.801) 15.240 3.413 ( -4.046 -4.732 -2.592) 6.744 3.679 ( 0.876 -5.448 -0.171) 5.521 4.138 ( -0.466 17.479 5.976) 18.478 4.579 ( -12.229 -0.306 -2.804) 12.550 4.744 ( -0.506 -2.440 7.388) 7.797 5.179 ( 2.903 -6.116 4.083) 7.906 5.340 ( -0.187 -3.338 0.347) 3.361 5.708 ( -1.242 3.071 0.036) 3.313 5.835 ( -0.136 0.715 0.466) 0.865 6.611 ( -2.369 -1.173 8.522) 8.922 6.811 ( -4.877 -0.957 -1.203) 5.114 7.090 ( 0.099 7.061 -12.489) 14.347 7.661 ( -12.317 -6.941 -4.018) 14.698 8.734 ( 4.512 2.131 1.265) 5.148 9.078 ( -8.047 -11.835 7.123) 15.986 9.481 ( 7.128 -2.149 4.123) 8.510 9.802 ( -3.967 9.126 6.191) 11.719 10.594 ( 6.188 11.701 -7.579) 15.253 10.880 ( 8.914 5.066 -15.691) 18.743 11.226 ( 5.334 1.029 -1.704) 5.693 12.052 ( 2.091 -3.277 2.186) 4.459 12.514 ( -1.277 -2.742 -1.228) 3.264 12.713 ( -2.477 1.351 0.525) 2.870 13.153 ( 3.065 -4.804 -3.441) 6.657 13.540 ( 0.463 -4.080 9.468) 10.321 17.507 ( -3.467 -2.533 14.607) 15.225 18.167 ( -6.753 -3.569 -15.912) 17.650 19.136 ( 4.803 14.231 2.008) 15.153 19.407 ( 2.663 -0.611 1.117) 2.951 20.123 ( 0.363 -6.657 -3.014) 7.316 22.751 ( -14.556 -11.953 5.350) 19.580 23.485 ( 10.121 19.065 -2.347) 21.712 24.341 ( 2.642 -8.097 4.378) 9.576 ======================= Grid point 638 (321/361) ======================= q-point: (-0.50 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( 1.583 7.324 7.467) 10.579 2.825 ( -12.706 6.898 7.818) 16.436 3.306 ( 13.489 -7.899 -1.234) 15.680 3.383 ( -2.849 -5.825 -1.933) 6.767 3.732 ( -3.211 -11.245 -1.782) 11.830 4.002 ( 0.393 16.151 -2.376) 16.329 4.340 ( -19.488 -5.914 0.221) 20.367 4.870 ( 3.038 -1.534 4.590) 5.715 5.328 ( -4.184 -3.419 0.549) 5.432 5.387 ( 14.669 1.272 1.578) 14.809 5.719 ( 4.219 1.832 2.478) 5.225 5.880 ( 3.616 3.923 5.533) 7.686 6.634 ( -12.387 -1.379 -6.249) 13.942 6.711 ( -3.158 -5.333 9.675) 11.490 6.948 ( -0.992 0.645 -5.815) 5.934 7.568 ( -8.742 -12.007 -1.116) 14.895 8.834 ( 7.222 7.310 7.317) 12.615 9.157 ( -8.059 -13.103 6.362) 16.647 9.619 ( 5.949 0.641 1.846) 6.262 9.691 ( -2.452 13.703 -0.207) 13.922 10.503 ( -3.147 7.191 3.379) 8.546 10.757 ( 8.220 1.385 -18.614) 20.395 11.248 ( 4.853 2.685 -3.899) 6.780 12.077 ( -3.602 0.445 0.680) 3.693 12.540 ( 1.026 -1.039 2.385) 2.796 12.678 ( -3.716 0.637 3.617) 5.225 13.178 ( 1.852 -2.853 -3.984) 5.238 13.642 ( 1.166 -0.100 1.754) 2.108 17.631 ( 0.556 -0.818 -0.194) 1.008 18.064 ( 1.363 -10.819 1.910) 11.071 19.051 ( 0.793 11.416 -2.613) 11.738 19.520 ( 12.649 1.889 0.291) 12.792 20.127 ( -3.376 -4.627 -1.955) 6.052 22.732 ( -15.541 -15.807 5.816) 22.918 23.404 ( 7.874 16.706 -4.952) 19.121 24.383 ( -5.632 -2.797 -2.296) 6.694 ======================= Grid point 639 (322/361) ======================= q-point: (-0.40 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.470 ( -9.139 15.306 11.308) 21.111 2.776 ( -4.556 3.432 14.075) 15.187 3.333 ( -4.607 -2.555 -5.288) 7.464 3.502 ( 4.625 -4.972 -2.805) 7.347 3.739 ( -0.755 -9.274 -4.104) 10.169 3.870 ( 5.454 6.008 -9.500) 12.494 4.185 ( -12.577 -5.900 3.442) 14.312 4.929 ( -1.971 -2.620 -1.206) 3.494 5.301 ( 1.587 3.500 3.330) 5.085 5.632 ( 17.670 -1.986 -0.565) 17.791 5.842 ( 4.662 2.042 9.292) 10.595 5.974 ( 6.739 5.300 4.568) 9.714 6.411 ( -11.824 -3.859 -4.403) 13.194 6.840 ( -2.050 -0.477 -0.861) 2.274 6.887 ( -4.681 -10.577 7.410) 13.737 7.597 ( -6.572 -15.580 2.707) 17.124 8.947 ( 4.961 10.061 9.422) 14.650 9.243 ( -4.087 -10.416 4.027) 11.892 9.497 ( -4.888 12.372 -1.425) 13.379 9.689 ( 5.486 4.825 -0.018) 7.306 10.458 ( -10.875 2.845 12.253) 16.628 10.653 ( 9.690 -0.404 -18.625) 20.999 11.210 ( 2.231 2.594 -7.255) 8.022 11.964 ( -9.137 3.493 -1.033) 9.836 12.601 ( 2.406 0.981 3.088) 4.035 12.687 ( -2.447 1.059 5.586) 6.190 13.169 ( 0.935 0.292 -2.151) 2.364 13.620 ( 1.089 2.366 -5.423) 6.016 17.584 ( 5.431 -0.935 -9.735) 11.187 18.376 ( 5.930 -15.939 13.764) 21.879 18.909 ( -1.294 7.940 -5.428) 9.704 19.714 ( 16.350 2.939 -0.390) 16.617 20.073 ( -2.394 -0.165 -0.839) 2.542 22.720 ( -18.747 -18.613 4.813) 26.852 23.303 ( 7.795 13.751 -6.697) 17.167 24.193 ( -12.072 2.544 -7.650) 14.517 ======================= Grid point 640 (323/361) ======================= q-point: (-0.30 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -6.307 10.027 12.588) 17.285 2.895 ( -4.017 2.608 17.793) 18.427 3.164 ( -9.234 -1.832 -7.010) 11.737 3.482 ( -0.368 -2.123 -6.886) 7.215 3.764 ( 5.022 4.335 -12.734) 14.358 3.809 ( 3.625 -9.695 -4.718) 11.375 4.176 ( -2.636 -4.322 3.291) 6.038 4.829 ( -6.765 0.943 -4.724) 8.305 5.423 ( 7.114 1.533 8.687) 11.332 5.869 ( 14.200 0.297 -0.452) 14.211 6.005 ( 3.261 1.271 10.567) 11.131 6.092 ( 11.562 3.198 0.504) 12.006 6.291 ( -6.606 -3.483 0.966) 7.530 6.717 ( -6.460 1.314 -4.161) 7.796 7.088 ( -1.644 -14.894 9.800) 17.905 7.708 ( -7.367 -19.959 4.742) 21.797 9.014 ( 3.938 9.868 5.979) 12.192 9.256 ( -2.117 4.930 0.051) 5.365 9.384 ( -4.601 3.526 6.481) 8.695 9.697 ( 3.444 2.645 -2.781) 5.157 10.431 ( -17.324 0.253 17.533) 24.649 10.596 ( 12.108 1.675 -13.979) 18.569 11.084 ( -0.530 2.111 -11.698) 11.899 11.751 ( -13.346 2.336 -3.875) 14.092 12.648 ( 5.498 4.670 -0.135) 7.215 12.724 ( -1.329 3.234 7.861) 8.604 13.152 ( -2.009 2.841 2.702) 4.406 13.535 ( 3.552 -0.288 -11.037) 11.598 17.614 ( 9.264 -1.527 -4.255) 10.308 18.639 ( -7.508 -9.587 -3.553) 12.685 18.855 ( 13.057 -0.409 3.268) 13.466 19.748 ( -6.030 0.265 -4.111) 7.303 20.231 ( 22.248 4.507 8.704) 24.312 22.597 ( -24.452 -15.368 -2.800) 29.016 23.245 ( 8.906 8.056 -5.137) 13.061 23.868 ( -14.235 5.846 -7.527) 17.131 ======================= Grid point 641 (324/361) ======================= q-point: (-0.20 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -0.742 3.857 12.101) 12.722 2.904 ( -7.836 1.136 -3.166) 8.528 3.127 ( -1.655 -4.654 13.034) 13.938 3.408 ( -0.335 -3.477 -7.420) 8.201 3.635 ( 1.132 1.085 -10.929) 11.041 3.867 ( 4.196 -4.544 -7.133) 9.441 4.238 ( 3.477 -0.643 2.522) 4.343 4.639 ( -8.440 4.211 -4.913) 10.635 5.632 ( 5.914 0.294 10.749) 12.272 5.973 ( 3.908 4.352 1.284) 5.988 6.118 ( -0.569 1.149 5.040) 5.201 6.228 ( 12.241 1.787 -3.505) 12.858 6.337 ( 4.153 -3.039 3.366) 6.150 6.563 ( -7.496 0.696 -2.804) 8.034 7.342 ( 0.882 -15.756 11.566) 19.566 7.839 ( -8.378 -24.210 1.647) 25.672 9.031 ( 4.768 8.315 1.477) 9.698 9.213 ( -1.951 5.397 4.783) 7.470 9.320 ( -6.387 13.212 7.195) 16.344 9.686 ( 3.128 -3.239 -7.637) 8.865 10.392 ( -14.406 0.900 14.695) 20.598 10.653 ( 9.388 1.222 0.809) 9.501 10.909 ( 1.304 3.083 -12.960) 13.385 11.469 ( -14.075 -0.973 -9.277) 16.886 12.679 ( 9.107 8.294 -1.900) 12.464 12.744 ( -3.664 6.744 6.610) 10.129 13.140 ( -4.584 0.848 7.335) 8.691 13.480 ( 6.097 -4.304 -13.035) 15.020 17.749 ( 10.428 -0.290 1.859) 10.596 18.430 ( -9.515 0.003 -11.819) 15.174 19.162 ( 15.092 -7.687 2.360) 17.101 19.574 ( -12.514 -1.173 -1.309) 12.637 20.704 ( 28.563 3.773 14.898) 32.435 22.231 ( -28.184 -7.860 -13.409) 32.186 23.279 ( 8.421 2.703 -2.305) 9.140 23.562 ( -12.186 5.346 -3.356) 13.723 ======================= Grid point 642 (325/361) ======================= q-point: (-0.10 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.562 ( 4.222 0.978 10.285) 11.161 2.744 ( -3.211 0.708 -7.954) 8.607 3.311 ( -1.232 -7.278 5.210) 9.035 3.395 ( 1.422 -6.219 -3.284) 7.175 3.562 ( 1.070 2.552 4.610) 5.377 3.800 ( -0.915 -1.705 -12.624) 12.771 4.343 ( 4.577 2.290 3.876) 6.421 4.424 ( -5.492 5.152 -4.504) 8.774 5.808 ( 1.560 0.409 9.373) 9.511 5.955 ( 0.431 2.128 -4.536) 5.029 6.117 ( -8.528 2.306 8.677) 12.383 6.273 ( 4.121 1.869 -6.148) 7.634 6.442 ( 3.686 0.096 0.195) 3.693 6.466 ( 0.038 -0.582 -2.351) 2.422 7.681 ( 3.456 -15.001 16.328) 22.441 7.914 ( -7.817 -22.826 -6.583) 25.010 9.045 ( 3.892 8.575 1.720) 9.572 9.079 ( -5.604 12.357 -1.762) 13.683 9.313 ( -4.771 3.715 16.803) 17.857 9.629 ( 3.933 -0.915 -14.033) 14.603 10.402 ( -7.662 2.288 16.143) 18.015 10.699 ( 2.631 -0.193 -13.013) 13.278 10.917 ( 10.307 2.560 11.289) 15.500 11.199 ( -5.656 -3.984 -14.751) 16.293 12.650 ( -6.985 8.358 2.832) 11.255 12.705 ( 9.036 7.956 -3.086) 12.429 13.200 ( -4.995 -2.701 11.155) 12.517 13.446 ( 5.523 -3.798 -13.111) 14.725 17.941 ( 10.123 0.861 6.547) 12.086 18.134 ( -10.222 1.500 -12.364) 16.113 19.384 ( -11.238 -4.654 4.430) 12.945 19.456 ( 10.115 -3.097 -2.985) 10.992 21.283 ( 26.926 1.398 19.485) 33.266 21.676 ( -27.202 -2.251 -19.651) 33.633 23.346 ( -3.856 2.092 0.790) 4.458 23.377 ( 4.076 1.889 -2.357) 5.073 ======================= Grid point 645 (326/361) ======================= q-point: ( 0.20 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( 8.211 -0.000 -7.162) 10.895 2.797 ( 6.588 -0.000 -17.970) 19.140 3.183 ( -10.437 0.000 12.961) 16.641 3.397 ( -5.026 0.000 -0.202) 5.030 3.615 ( 3.613 -0.000 3.022) 4.710 4.354 ( 1.687 -0.000 16.549) 16.635 4.600 ( 9.220 -0.000 3.467) 9.850 4.624 ( -4.957 0.000 1.430) 5.159 5.217 ( -24.226 0.000 -0.890) 24.242 5.236 ( 0.635 -0.000 -1.337) 1.481 5.832 ( -8.321 0.000 6.801) 10.747 5.862 ( -1.704 0.000 -8.049) 8.227 6.535 ( 1.767 -0.000 5.754) 6.019 6.792 ( 1.589 -0.000 1.861) 2.447 7.397 ( 0.945 -0.000 -11.029) 11.070 7.887 ( -19.618 0.000 -8.254) 21.283 8.709 ( 2.620 -0.000 -12.320) 12.596 8.938 ( -6.075 0.000 13.701) 14.987 9.241 ( 7.714 -0.000 4.200) 8.783 9.877 ( -7.736 0.000 14.641) 16.559 10.815 ( 22.278 -0.000 -28.573) 36.231 10.998 ( 18.438 -0.000 -6.546) 19.566 11.147 ( -1.375 0.000 3.801) 4.042 11.910 ( 3.663 -0.000 2.881) 4.660 12.528 ( -2.985 0.000 -5.567) 6.316 12.686 ( 6.240 -0.000 3.506) 7.157 13.070 ( 3.533 -0.000 -8.547) 9.249 13.347 ( -9.017 0.000 18.885) 20.928 17.425 ( -8.760 0.000 9.366) 12.825 18.416 ( -11.438 0.000 -10.406) 15.463 19.205 ( 7.992 -0.000 13.296) 15.513 19.407 ( -8.433 0.000 1.683) 8.599 20.067 ( 4.121 -0.000 -14.720) 15.286 22.708 ( -12.944 0.000 7.259) 14.841 23.794 ( 13.911 -0.000 12.104) 18.440 23.868 ( 8.368 -0.000 -2.753) 8.809 ======================= Grid point 646 (327/361) ======================= q-point: ( 0.30 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( 14.087 -0.808 1.915) 14.239 2.746 ( 11.054 -5.073 -13.621) 18.261 3.193 ( -11.549 1.539 15.695) 19.547 3.332 ( -3.909 -2.965 -2.409) 5.466 3.643 ( -3.077 -0.242 1.171) 3.302 4.422 ( -5.620 12.297 9.519) 16.535 4.552 ( -18.739 -0.935 -1.420) 18.816 4.704 ( 5.964 -3.876 2.240) 7.457 5.049 ( -3.645 -5.283 7.420) 9.811 5.308 ( 8.370 -0.815 -0.128) 8.410 5.757 ( 1.767 1.907 -6.283) 6.800 5.845 ( -3.887 0.147 9.154) 9.946 6.599 ( -5.405 -0.306 8.822) 10.351 6.796 ( -4.706 -0.550 0.976) 4.837 7.229 ( -0.381 7.357 -13.818) 15.659 7.510 ( -19.066 -7.901 -9.646) 22.781 8.690 ( 6.676 -4.413 -5.186) 9.536 9.021 ( -5.654 2.095 14.417) 15.627 9.436 ( 9.691 -2.075 5.051) 11.124 9.907 ( -9.459 2.786 12.422) 15.860 10.742 ( 21.921 3.686 -30.765) 37.956 11.025 ( -1.053 9.469 -5.505) 11.003 11.206 ( 10.420 -3.460 -3.718) 11.592 12.010 ( 1.592 -1.220 5.322) 5.687 12.465 ( -1.318 -2.090 -0.615) 2.546 12.733 ( -1.932 0.702 1.060) 2.313 13.052 ( 4.505 -4.270 -6.951) 9.319 13.504 ( -1.948 -0.649 16.989) 17.112 17.475 ( -5.924 -0.970 15.887) 16.983 18.114 ( -8.714 -1.743 -16.458) 18.704 19.385 ( 5.355 7.251 2.963) 9.488 19.403 ( 4.942 3.486 5.020) 7.860 19.975 ( -0.394 -7.644 -9.239) 11.998 22.605 ( -15.345 -4.188 6.184) 17.066 23.817 ( 6.844 17.026 -1.684) 18.427 24.147 ( 4.252 -12.883 5.880) 14.786 ======================= Grid point 647 (328/361) ======================= q-point: ( 0.40 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.615 ( 8.736 4.764 6.100) 11.671 2.865 ( 7.519 -4.906 -1.797) 9.156 3.197 ( -7.842 -0.168 8.772) 11.768 3.310 ( 1.869 -3.271 -1.180) 3.948 3.593 ( -6.629 -4.516 -0.483) 8.035 4.210 ( -21.682 -2.382 -3.702) 22.124 4.318 ( -4.202 12.053 3.388) 13.206 4.839 ( 2.156 -3.024 2.863) 4.689 5.199 ( -0.167 -6.065 7.704) 9.807 5.443 ( 12.514 1.893 -0.833) 12.684 5.752 ( 7.041 1.661 -1.295) 7.349 5.943 ( 0.467 2.517 12.393) 12.655 6.608 ( -13.333 -1.607 7.306) 15.288 6.659 ( -10.902 -0.562 -0.476) 10.927 6.984 ( -2.869 4.021 -8.767) 10.063 7.333 ( -7.720 -13.459 -7.141) 17.080 8.820 ( 7.316 -7.836 0.039) 10.720 9.086 ( -6.076 4.384 14.905) 16.682 9.630 ( 9.099 0.480 2.763) 9.521 9.863 ( -9.090 5.624 8.081) 13.400 10.638 ( 15.631 5.548 -22.784) 28.182 10.818 ( -1.656 5.653 -11.757) 13.150 11.299 ( 9.202 2.636 -4.859) 10.735 12.068 ( -3.370 -1.061 3.722) 5.132 12.511 ( 1.372 -1.877 4.315) 4.901 12.695 ( -4.516 0.943 3.006) 5.506 13.087 ( 4.699 -5.715 -6.147) 9.619 13.653 ( -1.567 0.776 10.427) 10.573 17.627 ( -1.684 0.394 10.541) 10.682 17.881 ( -3.039 -8.496 -7.958) 12.031 19.327 ( 1.791 17.905 -2.149) 18.123 19.544 ( 14.339 0.879 0.493) 14.375 19.971 ( -2.608 -12.463 -4.510) 13.509 22.517 ( -16.424 -8.136 6.933) 19.596 23.707 ( 4.403 16.403 -4.449) 17.557 24.279 ( -4.426 -8.476 0.027) 9.562 ======================= Grid point 648 (329/361) ======================= q-point: (-0.50 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( -2.203 10.338 9.727) 14.364 2.839 ( -6.273 6.227 7.346) 11.493 3.231 ( -4.486 -9.571 -1.176) 10.635 3.419 ( 8.060 -3.122 -0.443) 8.654 3.526 ( -7.452 -9.694 -4.772) 13.125 3.990 ( -4.315 -1.928 -4.102) 6.258 4.188 ( -4.840 10.053 2.691) 11.477 4.862 ( -4.009 -4.488 -2.138) 6.387 5.316 ( 1.415 -1.185 6.775) 7.022 5.614 ( 15.472 0.030 -1.594) 15.554 5.879 ( 7.507 1.925 6.495) 10.111 6.081 ( 3.423 5.676 10.948) 12.798 6.360 ( -16.101 -1.361 -0.987) 16.189 6.693 ( -5.576 -8.705 7.951) 13.042 6.858 ( -3.961 0.603 -3.644) 5.416 7.317 ( -5.216 -15.158 -2.814) 16.276 9.004 ( 4.849 -9.502 2.983) 11.077 9.137 ( -5.547 5.986 15.010) 17.085 9.663 ( -2.053 7.654 -3.666) 8.732 9.813 ( 1.127 5.344 5.400) 7.680 10.536 ( -2.789 5.557 -0.902) 6.283 10.650 ( 12.682 0.105 -23.348) 26.571 11.294 ( 5.879 6.416 -7.016) 11.178 12.006 ( -9.456 0.973 0.293) 9.510 12.614 ( 3.313 0.324 5.476) 6.408 12.690 ( -2.655 -0.414 5.432) 6.061 13.124 ( 4.282 -4.066 -5.464) 8.045 13.680 ( -4.383 3.463 4.020) 6.882 17.575 ( 3.774 -0.011 -10.225) 10.900 18.097 ( 1.597 -13.889 17.178) 22.148 19.124 ( -1.569 14.972 -5.564) 16.050 19.746 ( 10.463 0.025 -0.750) 10.489 20.011 ( 7.496 -6.256 -3.687) 10.436 22.451 ( -18.441 -11.406 7.139) 22.828 23.557 ( 3.462 14.320 -6.134) 15.958 24.183 ( -10.830 -3.445 -6.211) 12.951 ======================= Grid point 649 (330/361) ======================= q-point: (-0.40 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.584 ( -10.292 12.300 9.171) 18.475 2.915 ( -3.746 0.061 13.729) 14.231 3.130 ( -11.186 -2.162 -4.578) 12.278 3.421 ( -2.827 -5.843 -7.707) 10.076 3.558 ( 2.571 -10.685 -3.564) 11.553 3.947 ( 10.253 7.571 -11.662) 17.276 4.132 ( -2.732 1.242 7.812) 8.369 4.782 ( -7.561 -5.403 -4.173) 10.187 5.452 ( 6.050 1.292 7.791) 9.948 5.828 ( 14.647 -3.889 -1.290) 15.209 6.043 ( 3.764 2.592 10.090) 11.077 6.186 ( 4.088 5.585 6.314) 9.369 6.242 ( -4.610 -1.054 3.292) 5.763 6.726 ( -7.682 -1.235 -2.666) 8.225 6.837 ( -2.459 -11.692 7.064) 13.880 7.366 ( -7.116 -17.866 0.095) 19.231 9.181 ( 3.799 -0.649 5.756) 6.927 9.187 ( -3.940 -0.318 10.816) 11.516 9.469 ( -6.504 8.332 -2.512) 10.864 9.841 ( 3.230 7.272 1.337) 8.068 10.447 ( -13.284 1.587 10.295) 16.881 10.608 ( 20.551 -0.006 -22.761) 30.667 11.178 ( 1.766 8.538 -9.414) 12.831 11.800 ( -14.441 2.725 -3.560) 15.121 12.718 ( 2.382 1.886 6.606) 7.271 12.758 ( 3.890 1.582 4.831) 6.401 13.147 ( 2.580 -2.917 -3.815) 5.452 13.578 ( -6.098 4.568 -1.813) 7.832 17.586 ( 9.141 -1.480 -3.800) 10.010 18.423 ( -0.074 -12.382 10.465) 16.213 18.937 ( 1.204 7.873 -4.434) 9.116 19.716 ( -8.453 -4.044 -5.430) 10.830 20.299 ( 29.054 2.992 3.202) 29.382 22.343 ( -23.172 -12.241 3.730) 26.471 23.422 ( 4.651 10.853 -6.290) 13.378 23.927 ( -13.240 0.929 -8.452) 15.736 ======================= Grid point 650 (331/361) ======================= q-point: (-0.30 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( -4.226 6.403 10.452) 12.965 2.919 ( -9.454 0.428 -4.044) 10.291 3.038 ( -3.668 -4.936 10.535) 12.199 3.326 ( -2.686 -5.343 -8.804) 10.643 3.608 ( -0.322 -3.711 -2.252) 4.353 3.876 ( 8.907 5.236 -11.449) 15.422 4.229 ( 4.159 -0.422 5.610) 6.996 4.654 ( -8.067 -2.482 -5.010) 9.815 5.640 ( 6.172 0.308 9.578) 11.398 6.006 ( 8.090 -2.125 -3.692) 9.143 6.160 ( -0.774 4.021 9.945) 10.755 6.277 ( 2.331 -3.000 6.562) 7.582 6.294 ( 9.578 5.403 -0.190) 10.998 6.575 ( -9.341 0.454 -2.021) 9.568 7.040 ( 0.930 -17.043 7.343) 18.581 7.425 ( -9.566 -21.419 -0.112) 23.458 9.197 ( 0.899 9.768 3.563) 10.437 9.280 ( -0.735 -0.254 1.675) 1.846 9.374 ( -6.532 -0.562 9.783) 11.776 9.788 ( 2.427 9.796 -4.159) 10.916 10.395 ( -13.739 -0.240 13.913) 19.555 10.661 ( 18.503 -0.485 -14.729) 23.654 11.012 ( 3.341 9.001 -8.483) 12.811 11.487 ( -16.497 2.986 -7.484) 18.359 12.807 ( -0.855 1.457 8.336) 8.505 12.852 ( 9.587 8.960 1.527) 13.211 13.152 ( -2.696 -1.107 1.367) 3.219 13.424 ( -2.473 -0.303 -8.507) 8.864 17.743 ( 11.141 -0.405 3.700) 11.746 18.429 ( -7.949 -0.252 -6.721) 10.413 19.027 ( 10.287 -6.739 3.682) 12.837 19.532 ( -11.621 -3.595 -5.564) 13.377 20.777 ( 32.011 4.129 9.633) 33.683 22.076 ( -28.309 -8.882 -4.964) 30.083 23.362 ( 6.796 6.207 -3.928) 10.007 23.640 ( -11.989 3.208 -5.717) 13.664 ======================= Grid point 651 (332/361) ======================= q-point: (-0.20 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.592 ( 2.699 2.415 9.839) 10.485 2.762 ( -2.592 1.254 -6.889) 7.467 3.167 ( -2.256 -7.879 6.579) 10.509 3.269 ( -0.382 -7.537 -5.053) 9.082 3.598 ( -1.909 1.779 4.656) 5.338 3.799 ( 4.071 1.809 -12.532) 13.300 4.372 ( 3.776 0.267 6.031) 7.120 4.490 ( -4.206 1.761 -5.968) 7.510 5.819 ( 2.332 0.361 9.588) 9.874 5.985 ( -1.089 0.498 -7.102) 7.202 6.185 ( -6.417 5.411 9.574) 12.732 6.326 ( 2.850 4.063 -4.706) 6.839 6.438 ( 7.957 -1.490 1.399) 8.216 6.451 ( -3.706 -0.187 -0.859) 3.809 7.354 ( 5.359 -20.449 9.813) 23.306 7.479 ( -9.163 -24.108 -2.769) 25.939 9.178 ( 1.315 6.442 3.506) 7.451 9.237 ( -3.096 4.296 -2.159) 5.719 9.411 ( -7.973 5.454 14.793) 17.667 9.667 ( 4.374 6.301 -9.451) 12.172 10.416 ( -9.306 -1.211 15.420) 18.051 10.705 ( 8.383 0.628 -13.436) 15.850 11.002 ( 13.920 7.120 2.458) 15.827 11.153 ( -10.998 0.356 -11.103) 15.632 12.813 ( -5.993 8.231 5.131) 11.402 12.886 ( 8.979 11.390 -2.297) 14.684 13.144 ( -7.297 -2.805 8.908) 11.852 13.355 ( 5.419 -5.833 -11.719) 14.167 17.963 ( 10.153 1.545 8.265) 13.182 18.170 ( -9.690 2.500 -11.693) 15.390 19.267 ( -3.561 -8.125 5.750) 10.572 19.385 ( 3.539 -4.709 -5.956) 8.377 21.316 ( 23.554 2.182 15.813) 28.454 21.622 ( -23.194 -3.634 -14.613) 27.653 23.397 ( 3.448 3.462 -0.331) 4.898 23.420 ( -4.274 2.875 -2.634) 5.785 ======================= Grid point 652 (333/361) ======================= q-point: (-0.10 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( 1.542 2.936 -9.397) 9.965 2.770 ( 8.493 0.775 7.941) 11.653 3.258 ( -3.509 -7.776 5.423) 10.109 3.309 ( 1.558 -5.806 -3.451) 6.932 3.654 ( 0.304 4.023 -11.147) 11.855 3.683 ( -0.513 -3.706 10.546) 11.190 4.283 ( -7.050 2.642 -1.925) 7.771 4.559 ( 9.441 3.240 3.178) 10.475 5.823 ( -7.879 -0.037 -8.715) 11.748 5.898 ( -4.408 1.668 6.505) 8.033 6.116 ( -11.366 4.526 7.452) 14.325 6.228 ( -3.593 2.270 -3.255) 5.353 6.419 ( 1.654 -0.755 -5.049) 5.366 6.545 ( 7.765 1.754 -0.470) 7.974 7.523 ( -6.337 -22.097 -6.520) 23.894 7.755 ( 6.490 -20.646 10.232) 23.939 9.050 ( -8.071 9.010 -1.132) 12.149 9.194 ( 0.662 9.294 3.287) 9.880 9.444 ( -5.182 -0.001 12.570) 13.596 9.569 ( 4.496 7.318 -10.275) 13.392 10.511 ( -3.869 -4.945 7.891) 10.084 10.622 ( 2.461 4.216 -0.959) 4.975 10.963 ( 5.707 -3.248 -16.909) 18.139 11.272 ( 17.512 2.686 9.635) 20.167 12.651 ( -8.044 10.243 1.168) 13.077 12.852 ( 5.569 9.291 -4.512) 11.734 13.212 ( -7.626 -5.515 11.048) 14.513 13.345 ( 6.091 -1.392 -10.106) 11.881 17.867 ( -11.113 1.554 -9.531) 14.723 18.201 ( 9.738 1.952 10.430) 14.402 19.168 ( -15.024 -4.985 1.666) 15.917 19.572 ( 11.565 -4.043 -0.818) 12.279 21.019 ( -28.648 -2.424 -15.991) 32.898 21.930 ( 28.588 1.276 15.808) 32.692 23.263 ( -6.672 2.012 -0.420) 6.981 23.517 ( 10.544 2.249 1.046) 10.831 ======================= Grid point 656 (334/361) ======================= q-point: ( 0.30 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.704 ( 12.631 -0.000 10.128) 16.190 2.743 ( 12.033 -0.000 -8.252) 14.590 3.234 ( -1.630 0.000 -5.197) 5.447 3.268 ( -6.931 0.000 15.718) 17.179 3.555 ( -9.418 0.000 -0.084) 9.418 4.165 ( -25.225 0.000 -1.222) 25.255 4.475 ( -5.339 0.000 -0.043) 5.339 4.779 ( 3.022 -0.000 2.966) 4.235 5.151 ( 1.824 -0.000 9.701) 9.871 5.456 ( 12.135 -0.000 -0.388) 12.141 5.768 ( 8.759 -0.000 -3.860) 9.572 5.965 ( -1.742 0.000 15.825) 15.921 6.592 ( -10.114 0.000 9.406) 13.812 6.659 ( -17.172 0.000 0.271) 17.174 7.083 ( -13.561 0.000 -8.367) 15.934 7.144 ( 2.877 -0.000 -12.316) 12.647 8.736 ( 7.549 -0.000 -0.703) 7.581 9.139 ( -6.497 0.000 16.197) 17.451 9.634 ( 11.389 -0.000 3.323) 11.864 9.910 ( -12.107 0.000 11.034) 16.381 10.680 ( 23.961 -0.000 -34.211) 41.768 10.890 ( -7.284 0.000 -9.512) 11.981 11.325 ( 11.903 -0.000 -4.036) 12.569 12.056 ( -3.864 0.000 4.730) 6.108 12.490 ( 1.824 -0.000 5.144) 5.458 12.704 ( -5.142 0.000 2.938) 5.922 13.028 ( 5.868 -0.000 -5.651) 8.147 13.660 ( -2.235 0.000 12.721) 12.916 17.635 ( -2.671 0.000 21.327) 21.494 17.798 ( -4.146 0.000 -18.405) 18.866 19.552 ( 15.585 -0.000 0.432) 15.591 19.584 ( 2.496 -0.000 3.418) 4.232 19.764 ( -3.789 0.000 -10.744) 11.392 22.445 ( -16.450 0.000 7.277) 17.988 23.906 ( 2.446 -0.000 -6.875) 7.297 24.151 ( -3.568 0.000 3.548) 5.032 ======================= Grid point 657 (335/361) ======================= q-point: ( 0.40 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.826 ( 5.922 4.853 4.999) 9.144 2.940 ( 0.595 -2.737 5.732) 6.380 3.117 ( -5.123 2.278 -4.272) 7.049 3.343 ( -7.080 -5.914 3.307) 9.800 3.438 ( -4.949 -0.522 1.579) 5.221 3.917 ( -8.229 -3.296 0.153) 8.866 4.378 ( -2.326 7.670 -0.461) 8.028 4.780 ( -5.499 -3.911 -3.135) 7.440 5.299 ( 3.967 -0.305 8.275) 9.182 5.613 ( 11.221 -0.224 -0.854) 11.256 5.903 ( 10.142 0.698 3.519) 10.758 6.148 ( 0.995 1.624 15.436) 15.553 6.372 ( -19.882 1.850 2.015) 20.069 6.578 ( -8.832 -3.912 7.862) 12.455 6.879 ( -5.306 1.615 -4.018) 6.849 7.096 ( 0.472 -8.204 -7.680) 11.247 8.867 ( 6.346 -4.245 2.785) 8.127 9.225 ( -7.946 2.664 17.271) 19.197 9.776 ( 4.405 4.722 -1.110) 6.552 9.850 ( -7.011 -0.653 6.228) 9.401 10.609 ( 20.015 1.612 -27.266) 33.862 10.666 ( -4.759 1.627 -9.992) 11.186 11.400 ( 9.693 4.029 -6.369) 12.278 12.004 ( -9.220 -0.552 1.236) 9.319 12.610 ( 4.313 -0.436 6.629) 7.920 12.683 ( -4.429 -0.253 5.067) 6.735 13.064 ( 5.913 -1.975 -4.569) 7.729 13.724 ( -6.162 1.299 8.055) 10.224 17.582 ( 2.559 0.521 -12.870) 13.132 17.917 ( 0.527 -5.638 21.869) 22.590 19.405 ( -6.501 15.436 -6.398) 17.930 19.672 ( -3.389 -9.298 -2.887) 10.309 19.910 ( 26.864 -3.092 -2.974) 27.204 22.318 ( -17.902 -3.675 7.994) 19.947 23.781 ( -0.032 9.368 -7.256) 11.849 24.091 ( -9.478 -5.531 -3.622) 11.556 ======================= Grid point 658 (336/361) ======================= q-point: ( 0.50 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.785 ( -14.013 9.121 6.277) 17.859 2.928 ( -2.519 2.515 6.208) 7.156 3.080 ( -7.181 -3.403 -0.716) 7.978 3.263 ( -2.962 -9.810 -4.426) 11.162 3.456 ( 0.099 -2.290 0.036) 2.292 3.968 ( 9.439 -2.336 -3.302) 10.269 4.270 ( -1.343 10.700 0.698) 10.806 4.667 ( -9.647 -6.810 -3.741) 12.387 5.462 ( 5.921 -0.009 7.083) 9.232 5.758 ( 9.379 -3.503 -0.987) 10.060 6.086 ( 7.051 2.029 7.930) 10.803 6.204 ( -8.081 -0.273 5.323) 9.680 6.314 ( 2.720 5.272 11.548) 12.983 6.608 ( -6.559 -8.026 5.166) 11.581 6.763 ( -6.539 -0.158 -0.637) 6.572 7.100 ( -2.281 -11.384 -4.774) 12.554 9.041 ( 4.750 -5.868 5.033) 9.073 9.296 ( -7.777 4.034 18.088) 20.098 9.622 ( -7.428 7.830 -3.759) 11.429 9.902 ( 4.274 0.163 -1.399) 4.500 10.481 ( -10.735 1.968 3.228) 11.381 10.603 ( 23.488 -0.397 -26.272) 35.243 11.353 ( 5.188 9.491 -8.521) 13.769 11.836 ( -13.421 1.091 -2.680) 13.729 12.711 ( -3.160 -1.478 7.293) 8.085 12.780 ( 9.817 0.106 4.935) 10.988 13.096 ( 4.370 -1.829 -5.339) 7.138 13.657 ( -10.468 3.531 3.988) 11.745 17.565 ( 8.950 -0.890 -3.674) 9.716 18.241 ( 1.916 -7.444 17.326) 18.954 19.103 ( -7.303 10.009 -7.071) 14.266 19.608 ( -7.691 -7.528 -6.650) 12.651 20.335 ( 34.586 1.166 0.209) 34.606 22.179 ( -21.893 -6.104 6.389) 23.609 23.606 ( -0.079 9.278 -6.762) 11.481 23.908 ( -11.435 -2.790 -7.650) 14.038 ======================= Grid point 659 (337/361) ======================= q-point: (-0.40 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( -8.311 6.270 8.075) 13.175 2.912 ( -8.650 -1.333 -4.087) 9.659 2.968 ( -4.471 -2.710 6.638) 8.449 3.244 ( -3.701 -3.368 -5.875) 7.717 3.537 ( 4.376 -3.808 3.136) 6.594 3.990 ( 8.957 5.988 -14.143) 17.779 4.237 ( -0.224 2.066 7.626) 7.904 4.567 ( -6.850 -6.599 -4.070) 10.345 5.633 ( 5.319 -1.067 7.590) 9.330 5.913 ( 7.675 -6.909 -2.566) 10.641 6.230 ( -0.728 0.910 11.195) 11.255 6.248 ( 4.130 2.106 5.647) 7.306 6.407 ( 4.801 6.404 3.922) 8.913 6.570 ( -9.488 -1.483 -0.835) 9.640 6.776 ( -2.435 -11.573 6.248) 13.376 7.108 ( -4.879 -13.805 -4.412) 15.292 9.199 ( 2.106 -5.014 4.075) 6.796 9.363 ( -3.501 7.330 9.857) 12.772 9.425 ( -8.704 4.333 5.352) 11.099 9.904 ( 4.102 3.043 -6.129) 7.978 10.392 ( -12.747 -0.016 10.264) 16.366 10.644 ( 21.710 -1.120 -21.011) 30.233 11.212 ( 4.684 12.239 -7.365) 15.033 11.558 ( -15.393 4.282 -5.569) 16.921 12.785 ( -2.740 -2.677 8.638) 9.449 12.992 ( 14.429 4.055 3.907) 15.488 13.089 ( 2.151 -2.843 -6.462) 7.380 13.478 ( -12.754 4.748 -0.003) 13.609 17.736 ( 12.010 -0.410 5.360) 13.158 18.415 ( -3.642 -1.450 0.925) 4.028 18.948 ( -0.113 -1.852 1.453) 2.357 19.452 ( -8.505 -5.073 -8.753) 13.217 20.840 ( 36.012 2.817 4.417) 36.391 21.938 ( -27.700 -6.211 0.675) 28.396 23.479 ( 2.561 6.421 -4.789) 8.410 23.674 ( -10.326 0.656 -6.384) 12.158 ======================= Grid point 660 (338/361) ======================= q-point: (-0.30 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( 0.695 3.033 8.594) 9.140 2.783 ( -1.422 1.001 -5.033) 5.325 3.051 ( -0.657 -5.070 5.525) 7.527 3.148 ( -2.979 -5.557 -5.211) 8.180 3.634 ( -1.565 2.316 7.419) 7.928 3.852 ( 3.186 3.652 -13.316) 14.170 4.349 ( 0.211 -2.490 7.115) 7.541 4.487 ( 0.648 -1.679 -6.733) 6.969 5.801 ( 1.853 -2.584 8.396) 8.978 5.956 ( -0.813 -3.875 -7.160) 8.182 6.300 ( -3.701 6.864 8.968) 11.884 6.395 ( 3.268 -2.514 5.075) 6.539 6.406 ( -1.136 3.993 -2.095) 4.650 6.460 ( 2.018 1.051 -1.980) 3.016 6.995 ( 0.559 -18.645 7.836) 20.232 7.116 ( -2.938 -16.021 -4.785) 16.977 9.258 ( -2.018 1.153 2.054) 3.102 9.277 ( -1.575 2.605 -0.468) 3.080 9.489 ( -6.968 3.930 18.896) 20.520 9.802 ( 3.253 6.775 -11.378) 13.636 10.373 ( -12.800 -2.893 14.000) 19.189 10.700 ( 17.111 -1.199 -17.771) 24.699 11.162 ( 9.555 10.328 -0.729) 14.089 11.230 ( -10.314 7.441 -6.654) 14.353 12.878 ( -3.221 -1.396 9.488) 10.116 13.037 ( 1.915 2.058 -5.862) 6.501 13.161 ( -0.737 6.495 5.572) 8.589 13.280 ( 1.477 -0.775 -6.781) 6.983 17.993 ( 10.850 1.649 10.221) 14.997 18.218 ( -9.712 2.744 -11.187) 15.066 19.113 ( -0.139 -8.601 8.439) 12.051 19.299 ( 0.704 -4.691 -9.701) 10.798 21.356 ( 19.167 2.244 10.414) 21.928 21.553 ( -16.994 -3.888 -9.270) 19.745 23.459 ( 5.928 3.296 -1.125) 6.876 23.473 ( -8.330 2.988 -2.520) 9.201 ======================= Grid point 661 (339/361) ======================= q-point: (-0.20 -0.70 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.709 ( 4.651 4.512 -8.159) 10.419 2.787 ( 7.469 1.048 7.827) 10.870 3.118 ( -2.517 -7.462 3.712) 8.706 3.206 ( 3.803 -5.210 0.953) 6.520 3.645 ( -5.806 -0.561 4.548) 7.396 3.724 ( 1.194 3.503 -5.877) 6.945 4.317 ( -5.235 1.185 -2.809) 6.058 4.573 ( 9.253 -1.397 2.544) 9.697 5.814 ( -8.001 -1.238 -8.288) 11.586 5.901 ( -4.940 -2.088 6.451) 8.389 6.223 ( -9.488 6.997 4.811) 12.733 6.278 ( -6.294 3.433 -0.456) 7.183 6.416 ( 2.733 0.558 -6.705) 7.262 6.571 ( 10.146 1.005 -0.550) 10.211 7.129 ( -5.900 -20.687 -1.883) 21.594 7.377 ( 9.726 -20.739 5.164) 23.481 9.191 ( -5.793 6.801 0.890) 8.978 9.269 ( -0.218 -0.427 3.014) 3.051 9.513 ( -8.569 7.121 8.950) 14.291 9.690 ( 5.755 5.568 -5.455) 9.689 10.397 ( -12.644 -6.940 10.167) 17.646 10.704 ( 10.932 3.089 -10.670) 15.585 10.968 ( -1.402 5.284 -6.956) 8.847 11.351 ( 18.733 6.079 5.247) 20.381 12.839 ( -8.889 10.033 2.390) 13.616 12.968 ( 1.171 1.842 -6.529) 6.884 13.098 ( -7.767 -6.677 6.880) 12.338 13.364 ( 12.185 4.735 -3.295) 13.481 17.897 ( -12.052 1.695 -10.971) 16.385 18.243 ( 9.305 2.648 10.480) 14.262 19.082 ( -11.413 -4.227 -0.301) 12.174 19.470 ( 14.396 -7.319 -0.015) 16.150 20.976 ( -33.016 -2.267 -9.725) 34.493 21.943 ( 31.878 0.075 7.680) 32.791 23.321 ( -7.034 4.442 0.146) 8.321 23.554 ( 9.095 1.721 2.746) 9.655 ======================= Grid point 662 (340/361) ======================= q-point: (-0.10 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.615 ( 6.234 7.732 -11.223) 14.987 2.989 ( 5.945 0.322 9.353) 11.087 3.171 ( -1.229 -4.370 -6.450) 7.888 3.312 ( 1.847 -2.653 7.223) 7.913 3.622 ( 0.512 0.260 0.819) 1.000 3.715 ( -2.212 -3.251 4.685) 6.117 4.231 ( 1.222 0.957 -2.517) 2.957 4.737 ( 6.621 0.540 4.422) 7.980 5.576 ( -12.736 0.581 -6.914) 14.503 5.838 ( -13.289 -0.403 2.625) 13.551 6.060 ( -11.075 5.983 2.306) 12.797 6.154 ( -5.430 2.543 -2.335) 6.435 6.374 ( 4.936 -0.714 -7.446) 8.962 6.677 ( 8.103 2.605 0.277) 8.516 7.222 ( -1.643 -18.816 -3.954) 19.297 7.736 ( 6.509 -21.031 2.530) 22.160 9.022 ( -8.523 10.448 1.766) 13.599 9.286 ( -1.256 4.656 2.124) 5.269 9.465 ( -1.119 -0.418 0.878) 1.483 9.617 ( -2.984 10.310 0.659) 10.753 10.403 ( -6.621 -10.222 4.498) 12.983 10.768 ( 11.544 -0.302 -3.144) 11.968 10.916 ( 9.017 2.632 -6.442) 11.391 11.650 ( 18.008 3.175 6.253) 19.325 12.644 ( -6.174 9.029 0.176) 10.940 12.873 ( 0.305 3.183 -7.084) 7.772 13.151 ( -7.020 -6.466 6.358) 11.468 13.409 ( 7.000 8.508 -1.475) 11.116 17.623 ( -11.390 -0.260 -5.318) 12.573 18.475 ( 8.605 0.823 10.670) 13.732 18.942 ( -10.665 -3.120 -3.108) 11.538 19.682 ( 5.593 -1.235 2.442) 6.227 20.451 ( -22.659 -3.187 -13.514) 26.575 22.466 ( 25.424 -2.686 10.265) 27.549 23.194 ( -6.139 3.582 -0.028) 7.107 23.733 ( 11.507 2.902 5.818) 13.216 ======================= Grid point 667 (341/361) ======================= q-point: ( 0.40 0.40 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.865 ( -15.889 0.000 7.454) 17.551 2.993 ( -5.252 0.000 -4.552) 6.950 3.036 ( 2.251 -0.000 2.212) 3.156 3.145 ( -5.052 0.000 0.982) 5.147 3.440 ( -2.815 0.000 1.448) 3.166 3.940 ( 9.702 -0.000 -0.600) 9.720 4.397 ( 1.262 -0.000 -1.183) 1.730 4.581 ( -12.941 0.000 -3.680) 13.454 5.461 ( 5.971 -0.000 6.443) 8.784 5.723 ( 6.501 -0.000 -0.509) 6.521 6.105 ( 9.300 -0.000 6.370) 11.272 6.205 ( -8.459 0.000 5.820) 10.268 6.367 ( -0.041 0.000 14.641) 14.641 6.529 ( -8.115 0.000 6.771) 10.568 6.764 ( -7.190 0.000 -1.427) 7.330 6.992 ( 1.778 -0.000 -7.635) 7.839 8.988 ( 6.058 -0.000 5.211) 7.991 9.331 ( -9.658 0.000 19.599) 21.849 9.704 ( -12.220 0.000 -0.153) 12.221 9.889 ( 9.156 -0.000 -6.211) 11.064 10.502 ( -10.279 0.000 0.418) 10.288 10.599 ( 24.064 -0.000 -26.998) 36.166 11.450 ( 6.558 -0.000 -8.442) 10.690 11.843 ( -12.385 0.000 -2.179) 12.575 12.694 ( -3.745 0.000 6.699) 7.675 12.775 ( 9.409 -0.000 4.944) 10.629 13.083 ( 5.267 -0.000 -4.407) 6.867 13.690 ( -11.438 0.000 5.685) 12.773 17.557 ( 8.851 -0.000 -3.696) 9.592 18.173 ( 2.298 -0.000 19.660) 19.794 19.224 ( -14.403 0.000 -8.043) 16.497 19.510 ( -3.085 0.000 -7.025) 7.672 20.345 ( 36.537 -0.000 -0.612) 36.542 22.126 ( -21.373 0.000 7.013) 22.494 23.709 ( -2.386 0.000 -7.744) 8.103 23.862 ( -10.262 0.000 -6.328) 12.056 ======================= Grid point 668 (342/361) ======================= q-point: ( 0.50 0.40 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.718 ( -11.510 2.719 6.283) 13.392 2.892 ( -8.259 -0.265 -2.113) 8.529 2.932 ( -3.242 -1.572 1.083) 3.762 3.212 ( -3.603 -0.561 -1.802) 4.067 3.485 ( 7.739 -1.730 4.965) 9.356 4.051 ( 11.658 1.122 -10.062) 15.440 4.313 ( -10.327 5.582 4.044) 12.416 4.447 ( -2.869 -6.272 -3.079) 7.553 5.611 ( 4.124 -0.944 6.162) 7.475 5.810 ( 5.424 -3.565 -1.280) 6.615 6.229 ( -0.797 0.162 7.909) 7.951 6.295 ( 6.876 1.474 6.643) 9.674 6.493 ( -1.892 1.790 5.613) 6.187 6.517 ( -4.908 -2.091 6.107) 8.109 6.664 ( -7.558 -1.900 3.177) 8.415 6.942 ( 1.387 -4.822 -8.350) 9.742 9.136 ( 4.182 -1.848 5.349) 7.037 9.437 ( -9.333 1.631 21.386) 23.391 9.503 ( -9.472 3.125 -4.062) 10.769 9.922 ( 8.296 -0.093 -8.999) 12.240 10.393 ( -12.655 0.097 7.863) 14.899 10.629 ( 22.629 -0.460 -22.884) 32.187 11.387 ( 4.144 5.926 -7.751) 10.601 11.617 ( -12.997 1.904 -4.288) 13.818 12.741 ( -3.287 -1.658 7.912) 8.726 12.955 ( 8.761 -2.936 -2.163) 9.490 13.127 ( 10.023 2.544 -0.877) 10.378 13.545 ( -15.603 2.145 3.381) 16.109 17.730 ( 12.585 -0.182 6.284) 14.068 18.388 ( 0.200 -1.069 7.165) 7.247 18.947 ( -10.876 0.789 -1.663) 11.031 19.374 ( -3.656 -2.896 -10.433) 11.428 20.873 ( 38.685 0.927 1.306) 38.718 21.863 ( -27.357 -2.112 3.130) 27.617 23.573 ( -1.830 3.646 -5.170) 6.586 23.667 ( -7.690 -1.057 -6.182) 9.923 ======================= Grid point 669 (343/361) ======================= q-point: (-0.40 0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.691 ( -0.529 2.198 6.689) 7.060 2.793 ( -0.418 0.112 -3.115) 3.144 2.987 ( 2.415 -2.238 4.738) 5.770 3.082 ( -6.401 -2.021 -4.988) 8.362 3.676 ( 2.956 2.092 9.613) 10.272 3.912 ( -3.686 2.621 -13.458) 14.198 4.301 ( -2.999 -2.381 7.542) 8.459 4.449 ( 6.354 -2.060 -6.946) 9.636 5.739 ( -0.110 -3.668 6.833) 7.756 5.865 ( 0.736 -5.242 -5.405) 7.566 6.350 ( 2.725 -1.072 7.517) 8.067 6.401 ( -1.754 1.612 3.603) 4.320 6.455 ( -1.472 2.914 1.397) 3.551 6.489 ( -2.474 1.382 -0.044) 2.835 6.747 ( -0.411 -8.415 8.484) 11.957 6.912 ( 2.289 -7.253 -8.884) 11.695 9.252 ( 2.089 -0.622 4.463) 4.967 9.325 ( -6.335 2.017 -2.503) 7.104 9.548 ( -9.126 2.471 21.100) 23.121 9.883 ( 5.507 2.580 -12.435) 13.842 10.329 ( -15.265 -1.822 12.416) 19.760 10.677 ( 20.370 -1.052 -20.446) 28.881 11.337 ( 3.390 8.296 -1.955) 9.173 11.367 ( -4.663 6.563 -4.285) 9.120 12.819 ( -3.584 -3.662 9.119) 10.460 12.985 ( 1.863 -4.573 -7.485) 8.967 13.294 ( 0.698 6.169 2.817) 6.818 13.325 ( -0.702 3.629 -0.212) 3.703 18.017 ( 11.967 1.038 11.742) 16.798 18.261 ( -10.358 1.913 -11.200) 15.375 18.983 ( -0.018 -5.528 11.173) 12.466 19.228 ( 0.698 -3.007 -12.500) 12.875 21.394 ( 15.922 2.138 4.721) 16.744 21.489 ( -11.858 -3.282 -4.737) 13.185 23.505 ( 0.269 1.750 -1.051) 2.059 23.521 ( -3.979 2.136 -2.484) 5.154 ======================= Grid point 670 (344/361) ======================= q-point: (-0.30 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 8.308 3.794 -6.703) 11.329 2.806 ( 6.616 1.124 6.744) 9.514 3.005 ( -2.227 -5.137 1.134) 5.713 3.139 ( 5.318 -2.200 4.778) 7.480 3.641 ( -10.867 -0.478 -3.365) 11.386 3.782 ( -1.369 3.216 3.547) 4.980 4.332 ( -0.948 0.614 -1.141) 1.606 4.529 ( 9.982 -2.880 -1.601) 10.512 5.775 ( -6.994 -3.070 -6.024) 9.728 5.827 ( -5.443 -5.536 4.561) 9.005 6.302 ( -7.654 2.155 0.172) 7.953 6.368 ( -5.760 4.607 1.513) 7.530 6.440 ( 0.977 2.512 -3.408) 4.345 6.568 ( 10.144 -1.683 0.581) 10.299 6.847 ( -3.177 -9.572 -0.779) 10.116 7.053 ( 10.468 -15.139 1.137) 18.441 9.239 ( -4.282 -1.861 0.215) 4.674 9.296 ( -1.425 4.929 4.649) 6.924 9.623 ( -9.633 4.055 14.408) 17.799 9.764 ( 5.728 3.220 -10.799) 12.641 10.288 ( -17.987 -4.919 13.462) 22.999 10.716 ( 18.091 -0.660 -18.836) 26.125 11.135 ( -5.649 11.339 0.434) 12.676 11.468 ( 16.594 6.346 2.492) 17.940 12.914 ( -4.342 -5.033 6.853) 9.547 12.949 ( -0.490 -2.195 -3.224) 3.931 13.042 ( -14.117 3.754 -1.991) 14.743 13.489 ( 15.598 7.590 -0.562) 17.356 17.922 ( -13.265 1.110 -12.481) 18.247 18.290 ( 8.658 2.358 10.730) 13.987 19.035 ( -4.956 -0.708 -1.959) 5.376 19.323 ( 13.797 -8.839 1.177) 16.428 20.943 ( -35.563 -1.430 -5.746) 36.052 21.934 ( 33.289 -0.889 0.980) 33.315 23.412 ( -4.818 5.351 1.746) 7.409 23.573 ( 6.518 0.204 3.554) 7.427 ======================= Grid point 671 (345/361) ======================= q-point: (-0.20 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.760 ( 9.338 7.867 -9.047) 15.196 2.979 ( 2.077 -1.305 9.460) 9.773 3.104 ( 5.154 -2.955 -1.810) 6.211 3.264 ( 3.470 -2.711 5.478) 7.029 3.525 ( -4.710 -6.177 0.144) 7.769 3.772 ( -2.512 4.517 5.222) 7.347 4.270 ( 3.023 3.522 -6.170) 7.721 4.698 ( 6.470 -4.063 3.846) 8.553 5.585 ( -10.281 0.141 -6.105) 11.958 5.792 ( -12.782 -4.301 2.493) 13.714 6.162 ( -8.212 3.542 -1.954) 9.154 6.235 ( -6.890 6.879 0.517) 9.750 6.375 ( 4.514 1.101 -8.558) 9.738 6.713 ( 9.697 0.562 -0.832) 9.749 6.912 ( -1.082 -14.351 -0.742) 14.410 7.373 ( 10.018 -19.165 0.285) 21.627 9.190 ( -8.485 2.982 2.592) 9.359 9.270 ( -0.943 1.577 2.774) 3.327 9.529 ( -1.476 6.565 -2.184) 7.075 9.769 ( -1.075 4.549 3.252) 5.694 10.241 ( -17.189 -7.427 12.716) 22.635 10.754 ( 17.388 -1.047 -16.354) 23.893 11.031 ( 0.596 9.839 3.673) 10.519 11.716 ( 17.930 3.918 4.415) 18.877 12.790 ( -9.234 6.612 -1.262) 11.427 12.879 ( -0.842 -1.800 -6.332) 6.637 13.029 ( -5.312 -6.459 7.839) 11.462 13.585 ( 11.568 10.043 -2.082) 15.460 17.616 ( -12.217 -0.424 -6.911) 14.043 18.477 ( 6.116 -0.732 5.537) 8.282 18.935 ( -3.171 2.803 -3.557) 5.529 19.616 ( 11.399 -6.254 3.731) 13.527 20.401 ( -30.973 -2.271 -7.398) 31.925 22.387 ( 27.451 -5.331 -0.284) 27.965 23.315 ( -5.312 9.044 3.913) 11.195 23.762 ( 10.453 0.215 7.838) 13.067 ======================= Grid point 672 (346/361) ======================= q-point: (-0.10 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.679 ( 7.084 12.069 -10.097) 17.257 2.985 ( -6.818 -3.871 -3.900) 8.757 3.170 ( -0.124 2.868 8.458) 8.932 3.429 ( 3.496 -2.412 4.336) 6.070 3.634 ( 2.695 -12.938 6.000) 14.514 3.755 ( 1.667 8.707 1.694) 9.026 4.266 ( 9.451 -0.544 -4.506) 10.484 4.846 ( 1.205 -2.735 5.795) 6.521 5.366 ( -10.264 3.832 -2.550) 11.249 5.626 ( -15.281 -2.214 -0.490) 15.448 5.963 ( -9.976 4.782 -3.173) 11.509 6.071 ( -5.931 5.696 -3.191) 8.820 6.390 ( 7.985 -1.096 -3.176) 8.663 6.807 ( 6.353 2.455 0.170) 6.813 7.035 ( 2.827 -15.271 -4.127) 16.069 7.637 ( 4.387 -18.480 -1.492) 19.052 9.015 ( -11.220 10.356 2.161) 15.421 9.295 ( -0.044 -3.060 0.511) 3.102 9.481 ( 0.744 5.582 0.175) 5.634 9.650 ( -7.394 8.430 2.711) 11.536 10.306 ( -6.913 -10.939 11.183) 17.103 10.824 ( 19.183 -2.633 -18.198) 26.573 11.051 ( 1.091 3.968 7.289) 8.371 11.947 ( 13.159 3.729 1.289) 13.737 12.646 ( -1.790 4.412 -1.240) 4.920 12.798 ( -1.086 0.481 -5.699) 5.821 13.084 ( -6.051 -4.693 6.761) 10.215 13.587 ( 6.686 12.009 -1.954) 13.883 17.448 ( -8.880 -1.135 2.363) 9.259 18.614 ( 3.133 -10.849 -5.177) 12.423 18.812 ( -1.917 9.562 1.333) 9.843 19.696 ( -12.049 3.082 1.600) 12.540 20.094 ( -2.824 -6.675 -4.249) 8.402 22.792 ( 21.491 -11.553 -1.205) 24.429 23.183 ( -7.676 12.096 4.302) 14.958 24.019 ( 11.791 2.319 9.658) 15.417 ======================= Grid point 678 (347/361) ======================= q-point: (-0.50 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.712 ( -0.531 0.000 5.526) 5.551 2.792 ( -0.344 0.000 -2.165) 2.192 2.968 ( 3.498 -0.000 4.736) 5.888 3.066 ( -7.649 0.000 -5.062) 9.173 3.696 ( 5.991 -0.000 10.314) 11.928 3.936 ( -8.579 0.000 -13.105) 15.664 4.278 ( -3.054 0.000 7.554) 8.148 4.429 ( 8.262 -0.000 -6.967) 10.807 5.701 ( -1.154 0.000 6.101) 6.209 5.812 ( 1.346 -0.000 -4.362) 4.565 6.343 ( 3.836 -0.000 6.610) 7.642 6.395 ( -2.888 0.000 1.272) 3.156 6.495 ( -9.947 0.000 2.685) 10.304 6.500 ( 3.687 -0.000 3.581) 5.140 6.680 ( 0.526 -0.000 7.762) 7.780 6.849 ( 4.249 -0.000 -10.528) 11.353 9.246 ( 3.383 -0.000 5.662) 6.595 9.343 ( -8.001 0.000 -3.382) 8.686 9.571 ( -10.175 0.000 21.456) 23.746 9.904 ( 6.872 -0.000 -12.522) 14.284 10.313 ( -16.140 0.000 11.807) 19.997 10.668 ( 21.182 -0.000 -21.295) 30.036 11.420 ( 7.737 -0.000 -3.150) 8.354 11.426 ( -9.039 0.000 -2.820) 9.469 12.782 ( -3.762 0.000 8.459) 9.258 12.938 ( 2.617 -0.000 -7.269) 7.726 13.351 ( -18.087 0.000 2.274) 18.229 13.362 ( 17.152 -0.000 1.469) 17.214 18.027 ( 12.548 -0.000 12.323) 17.587 18.279 ( -10.806 0.000 -11.346) 15.668 18.932 ( -0.371 0.000 12.331) 12.336 19.200 ( 1.068 -0.000 -13.478) 13.520 21.428 ( 37.940 -0.000 0.530) 37.944 21.445 ( -33.107 0.000 -1.208) 33.129 23.521 ( -1.495 0.000 -0.816) 1.704 23.541 ( -2.700 0.000 -2.550) 3.714 ======================= Grid point 679 (348/361) ======================= q-point: (-0.40 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.828 ( 8.437 1.121 2.426) 8.850 2.832 ( 10.351 1.173 -1.836) 10.578 2.939 ( -4.339 -2.136 -1.004) 4.939 3.120 ( 6.425 -0.278 6.672) 9.267 3.624 ( -15.675 -0.906 -7.599) 17.443 3.832 ( -3.199 1.868 9.476) 10.174 4.340 ( 2.038 0.262 1.826) 2.749 4.490 ( 11.938 -1.257 -6.603) 13.700 5.725 ( -6.067 -1.748 -0.062) 6.314 5.740 ( -4.970 -3.253 -0.540) 5.964 6.334 ( -4.344 1.711 -1.208) 4.822 6.382 ( -6.593 -1.533 -1.916) 7.035 6.467 ( 1.462 -0.787 4.852) 5.129 6.567 ( 2.269 2.505 1.758) 3.810 6.782 ( 4.599 0.504 -4.039) 6.142 6.850 ( 8.525 -7.585 -1.250) 11.479 9.215 ( -6.289 -0.735 -2.087) 6.667 9.362 ( 2.210 2.112 7.801) 8.378 9.654 ( -11.604 0.263 17.904) 21.337 9.810 ( 5.696 1.592 -15.230) 16.338 10.229 ( -20.376 -1.732 15.359) 25.575 10.704 ( 19.644 -0.422 -20.235) 28.205 11.301 ( -4.510 5.723 1.515) 7.442 11.550 ( 13.648 2.415 1.562) 13.947 12.836 ( -5.136 -2.610 8.092) 9.934 12.887 ( 1.032 -2.548 -6.642) 7.189 13.117 ( -15.774 2.589 1.132) 16.025 13.590 ( 16.322 3.114 -0.713) 16.631 17.935 ( -14.143 0.345 -13.427) 19.505 18.320 ( 7.978 0.948 10.941) 13.574 19.063 ( 3.408 3.760 -4.323) 6.666 19.173 ( 9.076 -7.427 3.507) 12.241 20.926 ( -36.405 -0.478 -4.140) 36.643 21.920 ( 33.469 -0.519 -2.409) 33.560 23.498 ( -1.258 3.930 2.549) 4.850 23.559 ( 3.264 -1.703 4.101) 5.511 ======================= Grid point 680 (349/361) ======================= q-point: (-0.30 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.868 ( 3.738 3.627 -1.129) 5.329 2.965 ( 7.863 0.557 1.112) 7.961 3.063 ( 8.740 -2.005 1.905) 9.167 3.212 ( -1.114 -3.079 1.053) 3.439 3.448 ( -2.015 -2.266 0.402) 3.058 3.833 ( -6.026 2.236 7.006) 9.508 4.346 ( 4.373 4.347 -4.543) 7.659 4.623 ( 8.666 -3.677 0.224) 9.416 5.578 ( -8.023 -0.705 -5.247) 9.612 5.709 ( -10.701 -4.268 3.547) 12.054 6.202 ( -8.891 1.527 -2.626) 9.395 6.315 ( 2.106 1.091 -4.499) 5.086 6.441 ( -3.058 6.066 -2.246) 7.155 6.633 ( 2.126 -7.319 1.267) 7.726 6.803 ( 6.919 0.216 -3.982) 7.986 7.082 ( 11.194 -12.901 -1.484) 17.145 9.121 ( -7.093 -4.314 -2.213) 8.592 9.415 ( -2.668 8.568 8.215) 12.166 9.636 ( -2.956 4.667 -0.990) 5.613 9.777 ( 2.586 -2.635 1.669) 4.052 10.147 ( -23.034 -3.236 18.123) 29.487 10.738 ( 18.517 -0.628 -18.780) 26.381 11.221 ( -3.067 9.846 4.982) 11.453 11.772 ( 16.019 2.010 3.098) 16.439 12.816 ( -6.166 -2.067 -0.979) 6.577 12.857 ( -3.721 -2.234 -4.696) 6.395 12.970 ( -5.664 0.787 7.035) 9.066 13.732 ( 13.175 6.017 -3.142) 14.821 17.609 ( -12.717 -0.322 -8.008) 15.031 18.456 ( 3.170 -1.305 -1.150) 3.616 19.038 ( 6.479 8.105 -1.770) 10.526 19.468 ( 11.388 -9.776 6.123) 16.210 20.373 ( -35.376 -0.940 -4.169) 35.633 22.304 ( 26.642 -3.580 -5.942) 27.530 23.479 ( -1.427 8.462 5.805) 10.360 23.742 ( 8.786 -2.344 8.671) 12.564 ======================= Grid point 681 (350/361) ======================= q-point: (-0.20 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.863 ( 1.582 7.609 -4.171) 8.820 2.911 ( -10.283 -3.807 0.456) 10.974 3.182 ( 5.716 -2.693 3.504) 7.225 3.394 ( 6.003 -1.703 2.968) 6.910 3.465 ( 3.169 -3.445 0.261) 4.688 3.867 ( 3.582 2.761 6.161) 7.643 4.307 ( 8.431 5.237 -7.584) 12.491 4.773 ( 1.894 -4.586 5.435) 7.359 5.419 ( -6.125 1.534 -3.191) 7.075 5.583 ( -14.807 -1.847 0.816) 14.944 6.010 ( -9.361 1.087 -6.020) 11.183 6.229 ( -5.254 10.615 -2.142) 12.037 6.377 ( 8.479 -0.461 -4.211) 9.478 6.773 ( 4.857 -11.258 -0.262) 12.264 6.856 ( 5.757 0.669 -2.058) 6.150 7.320 ( 7.938 -16.463 -3.223) 18.558 9.041 ( -9.762 -7.237 -0.320) 12.156 9.336 ( -2.118 9.536 -0.779) 9.800 9.578 ( 0.793 5.671 2.572) 6.277 9.797 ( -7.101 5.523 3.873) 9.794 10.142 ( -14.236 -7.576 19.101) 24.998 10.788 ( 18.353 -1.251 -16.992) 25.043 11.162 ( -3.401 7.856 6.070) 10.495 11.996 ( 13.219 1.553 1.199) 13.363 12.702 ( -4.553 1.513 -2.569) 5.442 12.788 ( -0.604 -0.932 -4.755) 4.883 13.009 ( -4.784 -3.445 6.699) 8.924 13.774 ( 9.381 8.475 -5.127) 13.642 17.430 ( -8.116 -0.833 2.261) 8.466 18.442 ( 2.771 -8.011 -13.662) 16.078 19.022 ( 2.822 13.811 3.570) 14.541 19.717 ( -1.774 -1.899 2.374) 3.519 19.953 ( -15.974 -7.905 0.570) 17.832 22.600 ( 20.594 -8.859 -7.647) 23.687 23.426 ( -3.533 13.692 6.789) 15.685 24.022 ( 11.332 -1.855 9.901) 15.162 ======================= Grid point 682 (351/361) ======================= q-point: (-0.10 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.648 ( -10.286 4.255 -5.402) 12.373 2.887 ( -4.392 -2.732 2.076) 5.573 3.267 ( -0.370 6.593 2.469) 7.050 3.389 ( 1.372 -7.852 -2.208) 8.271 3.674 ( 5.655 -8.481 4.027) 10.960 3.946 ( 6.590 13.525 2.652) 15.277 4.376 ( 14.915 -1.976 -3.663) 15.485 4.859 ( -4.934 -2.768 5.494) 7.885 5.299 ( -9.485 5.714 3.620) 11.650 5.417 ( -5.280 -3.692 -3.258) 7.220 5.793 ( -9.287 0.955 -5.467) 10.818 6.016 ( -4.577 8.744 -5.638) 11.367 6.505 ( 7.422 0.619 4.744) 8.830 6.883 ( 2.994 0.998 -3.166) 4.471 6.930 ( 7.863 -9.224 -5.448) 13.288 7.529 ( 3.846 -16.043 1.289) 16.548 8.905 ( -14.873 2.832 0.537) 15.149 9.272 ( 3.187 -3.482 -2.934) 5.558 9.594 ( 0.462 6.613 5.551) 8.646 9.627 ( -9.643 8.367 2.452) 13.000 10.286 ( -6.988 -7.719 15.151) 18.384 10.845 ( 17.051 -0.547 -17.422) 24.384 11.144 ( -3.028 1.767 6.247) 7.164 12.109 ( 6.456 2.904 -1.991) 7.354 12.617 ( -1.069 0.804 -4.335) 4.536 12.732 ( -1.661 0.021 -2.215) 2.768 13.068 ( -2.388 -4.767 6.504) 8.410 13.730 ( 6.185 9.765 -6.135) 13.086 17.445 ( -2.569 0.904 11.136) 11.464 18.351 ( 0.423 -10.806 -19.594) 22.380 18.974 ( 0.717 11.569 5.114) 12.669 19.517 ( -13.066 2.102 0.325) 13.238 20.076 ( 4.471 -7.545 2.733) 9.186 22.864 ( 15.921 -13.717 -7.400) 22.280 23.291 ( -6.990 17.518 6.332) 19.895 24.286 ( 8.661 -0.615 7.538) 11.498 ======================= Grid point 689 (352/361) ======================= q-point: (-0.40 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.894 ( -2.662 0.000 4.998) 5.663 2.986 ( 16.128 -0.000 -4.144) 16.652 3.036 ( 8.229 -0.000 1.984) 8.465 3.178 ( -6.200 0.000 -1.622) 6.408 3.433 ( 2.425 -0.000 1.824) 3.034 3.852 ( -7.791 0.000 6.394) 10.079 4.392 ( 3.635 -0.000 -0.834) 3.730 4.586 ( 11.032 -0.000 -3.376) 11.537 5.570 ( -6.999 0.000 -5.380) 8.828 5.667 ( -9.529 0.000 4.772) 10.657 6.217 ( -10.074 0.000 -2.980) 10.505 6.316 ( 4.761 -0.000 -4.768) 6.738 6.523 ( -1.870 0.000 5.425) 5.738 6.550 ( -2.888 0.000 -4.106) 5.020 6.814 ( 9.195 -0.000 -6.487) 11.253 6.953 ( 11.397 -0.000 -1.604) 11.510 9.081 ( -7.990 0.000 -3.292) 8.642 9.507 ( -0.806 0.000 9.219) 9.255 9.678 ( -11.774 0.000 14.656) 18.799 9.735 ( 10.622 -0.000 -14.073) 17.632 10.120 ( -24.377 0.000 19.928) 31.486 10.733 ( 18.640 -0.000 -18.821) 26.490 11.320 ( -4.070 0.000 5.046) 6.483 11.787 ( 14.610 -0.000 2.721) 14.862 12.808 ( -7.365 0.000 2.547) 7.793 12.810 ( 0.356 -0.000 -5.379) 5.391 12.989 ( -8.104 0.000 4.589) 9.314 13.787 ( 13.553 -0.000 -3.652) 14.036 17.606 ( -12.855 0.000 -8.379) 15.344 18.443 ( 2.252 -0.000 -3.918) 4.519 19.156 ( 15.633 -0.000 -4.060) 16.152 19.335 ( 5.126 -0.000 10.408) 11.602 20.365 ( -36.415 0.000 -3.316) 36.565 22.271 ( 26.157 -0.000 -7.509) 27.213 23.573 ( 0.540 -0.000 5.829) 5.854 23.704 ( 7.829 -0.000 9.289) 12.148 ======================= Grid point 690 (353/361) ======================= q-point: (-0.30 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.855 ( -18.759 -1.675 -0.195) 18.834 2.945 ( -4.130 1.395 8.104) 9.202 3.120 ( 9.093 -2.164 -5.913) 11.061 3.342 ( 15.175 -2.202 1.749) 15.433 3.512 ( 6.043 4.002 -2.625) 7.708 3.865 ( 3.502 -1.522 4.975) 6.271 4.410 ( 5.971 4.466 -3.553) 8.260 4.703 ( 3.734 -2.718 3.051) 5.536 5.424 ( -4.696 -0.304 -4.886) 6.783 5.568 ( -12.823 -0.128 3.545) 13.305 6.018 ( -9.996 0.091 -6.553) 11.953 6.368 ( 4.071 0.328 -7.026) 8.126 6.411 ( 3.191 7.828 -0.963) 8.508 6.602 ( 0.350 -7.070 4.319) 8.292 6.874 ( 7.666 0.620 -3.095) 8.291 7.090 ( 9.973 -7.873 -6.482) 14.264 8.928 ( -10.292 -3.784 -2.659) 11.284 9.483 ( -1.615 4.999 -3.784) 6.475 9.669 ( -6.036 3.983 8.448) 11.120 9.835 ( 6.288 -0.541 2.198) 6.683 10.043 ( -23.994 -3.051 24.197) 34.213 10.778 ( 17.750 -0.068 -15.496) 23.562 11.284 ( -7.015 4.462 5.629) 10.040 12.003 ( 12.171 -0.330 0.987) 12.216 12.715 ( -3.914 0.620 -2.937) 4.933 12.769 ( 0.427 -1.252 -4.069) 4.278 12.971 ( -5.640 -0.891 5.718) 8.081 13.876 ( 10.344 2.918 -6.953) 12.801 17.420 ( -7.582 -0.294 2.224) 7.907 18.343 ( 2.812 -2.923 -18.244) 18.690 19.284 ( 8.645 14.592 4.644) 17.585 19.583 ( 7.911 -11.889 5.743) 15.392 19.873 ( -30.450 -1.343 0.048) 30.479 22.493 ( 19.925 -3.062 -9.647) 22.348 23.627 ( -0.740 7.425 7.966) 10.915 23.969 ( 10.957 -3.047 8.831) 14.399 ======================= Grid point 691 (354/361) ======================= q-point: (-0.20 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.646 ( -17.005 -3.307 2.194) 17.462 2.843 ( -17.330 -1.524 1.728) 17.482 3.223 ( 6.153 -6.149 0.567) 8.717 3.449 ( 8.067 9.093 -8.576) 14.876 3.576 ( 8.728 -3.247 1.224) 9.393 4.097 ( 14.684 2.008 7.104) 16.435 4.409 ( 10.198 6.277 -5.788) 13.300 4.795 ( -3.644 -4.198 6.339) 8.432 5.343 ( 0.989 -2.207 -5.855) 6.335 5.393 ( -15.345 2.789 2.950) 15.873 5.795 ( -10.210 -0.372 -6.098) 11.898 6.170 ( -3.893 6.925 -9.345) 12.265 6.548 ( 8.346 4.638 7.452) 12.112 6.769 ( 11.203 -7.201 -3.128) 13.680 6.923 ( 4.982 2.179 -2.263) 5.890 7.245 ( 6.447 -14.984 -1.025) 16.344 8.816 ( -12.433 -8.246 0.977) 14.951 9.336 ( -0.080 7.069 -8.229) 10.849 9.628 ( -7.203 1.093 3.000) 7.879 9.835 ( -7.678 10.522 11.535) 17.399 10.155 ( -7.785 -7.685 18.115) 21.161 10.855 ( 16.788 1.298 -11.784) 20.552 11.203 ( -7.737 3.960 5.053) 10.054 12.129 ( 6.099 -0.208 -2.264) 6.509 12.621 ( -2.094 -0.112 -5.456) 5.845 12.739 ( 0.000 0.615 -2.070) 2.159 12.982 ( -4.093 -4.282 4.851) 7.656 13.861 ( 7.694 4.921 -10.231) 13.714 17.462 ( 0.078 0.883 12.632) 12.663 18.175 ( 3.089 -7.709 -23.132) 24.578 19.245 ( -1.304 17.599 5.603) 18.515 19.546 ( -13.770 1.144 0.137) 13.818 19.880 ( 4.675 -14.177 4.705) 15.652 22.677 ( 16.848 -7.180 -9.110) 20.455 23.589 ( -4.093 14.825 7.112) 16.944 24.231 ( 8.295 -4.962 5.145) 10.950 ======================= Grid point 692 (355/361) ======================= q-point: (-0.10 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( -15.302 -1.394 0.206) 15.367 2.692 ( -19.765 -11.386 9.057) 24.542 3.353 ( 4.776 -0.251 -1.233) 4.939 3.419 ( 14.266 3.553 -7.549) 16.527 3.686 ( 1.333 -4.506 -0.677) 4.748 4.190 ( 2.920 17.491 1.624) 17.807 4.538 ( 10.910 -0.941 -0.023) 10.950 4.820 ( -1.199 -1.489 1.134) 2.223 5.211 ( -9.861 0.173 2.384) 10.146 5.352 ( 2.299 -5.115 -2.953) 6.337 5.650 ( -4.905 -0.852 0.863) 5.053 5.956 ( -1.679 7.196 -8.096) 10.961 6.698 ( 2.991 3.557 9.447) 10.528 6.850 ( 6.997 1.762 -11.468) 13.549 6.943 ( 2.341 -1.191 -0.277) 2.641 7.528 ( 7.219 -12.747 8.228) 16.802 8.713 ( -13.691 -3.664 3.371) 14.568 9.238 ( 4.219 -3.201 -6.748) 8.578 9.532 ( -7.774 -0.789 -0.790) 7.853 9.768 ( -4.969 13.771 9.565) 17.488 10.316 ( -6.449 -5.923 14.218) 16.698 10.880 ( 8.955 5.757 -11.194) 15.448 11.162 ( -2.498 -1.273 3.934) 4.831 12.125 ( -0.329 -0.118 -4.332) 4.346 12.542 ( -1.348 -1.570 -3.692) 4.233 12.707 ( -1.851 1.762 0.735) 2.659 13.061 ( -1.269 -7.376 4.864) 8.926 13.771 ( 6.303 5.295 -12.621) 15.069 17.635 ( 4.433 4.640 9.736) 11.661 18.062 ( 4.696 -9.641 -13.538) 17.270 19.126 ( -2.308 13.972 2.945) 14.464 19.422 ( -2.588 0.619 -0.499) 2.707 20.072 ( 0.771 -9.783 2.519) 10.131 22.876 ( 14.602 -10.208 -7.310) 19.257 23.415 ( -8.933 19.574 4.723) 22.028 24.383 ( 1.412 -5.634 0.343) 5.818 ======================= Grid point 700 (356/361) ======================= q-point: (-0.30 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.603 ( -19.133 0.000 5.693) 19.962 2.831 ( -21.765 0.000 -0.567) 21.773 3.166 ( 7.846 -0.000 0.417) 7.858 3.541 ( 12.884 -0.000 -3.645) 13.390 3.554 ( 7.026 -0.000 -6.995) 9.915 4.091 ( 19.100 -0.000 6.314) 20.116 4.500 ( 8.595 -0.000 -2.519) 8.957 4.740 ( -4.377 0.000 5.685) 7.175 5.319 ( -0.300 0.000 -7.221) 7.227 5.423 ( -13.965 0.000 2.914) 14.266 5.790 ( -10.576 0.000 -6.108) 12.213 6.231 ( -2.928 0.000 -11.232) 11.608 6.645 ( 0.521 -0.000 8.501) 8.517 6.666 ( 19.249 -0.000 1.054) 19.278 6.968 ( 8.162 -0.000 1.745) 8.347 7.066 ( 5.655 -0.000 -8.431) 10.152 8.732 ( -12.565 0.000 0.306) 12.568 9.411 ( 0.195 -0.000 -9.377) 9.379 9.636 ( -10.735 0.000 3.270) 11.222 9.997 ( 9.247 -0.000 1.301) 9.338 10.016 ( -23.838 0.000 31.218) 39.279 10.870 ( 16.576 -0.000 -8.794) 18.765 11.245 ( -9.669 0.000 4.543) 10.683 12.123 ( 6.178 -0.000 -2.163) 6.545 12.620 ( -2.211 0.000 -7.030) 7.369 12.745 ( 1.042 -0.000 -1.352) 1.707 12.940 ( -5.506 0.000 4.005) 6.809 13.905 ( 8.126 -0.000 -11.660) 14.212 17.471 ( 1.209 -0.000 13.590) 13.644 18.103 ( 3.523 -0.000 -24.980) 25.227 19.503 ( -19.615 0.000 7.225) 20.903 19.592 ( 0.551 -0.000 2.476) 2.537 19.618 ( 8.259 -0.000 1.699) 8.432 22.613 ( 16.967 -0.000 -9.625) 19.507 23.746 ( -2.802 0.000 9.012) 9.438 24.164 ( 8.226 -0.000 2.582) 8.621 ======================= Grid point 701 (357/361) ======================= q-point: (-0.20 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.436 ( -21.122 1.069 2.425) 21.287 2.511 ( -21.015 -7.690 7.921) 23.738 3.301 ( 7.451 -2.138 1.123) 7.833 3.504 ( 11.455 2.666 -14.849) 18.943 3.659 ( 4.188 0.349 -0.410) 4.223 4.428 ( 8.530 5.822 9.822) 14.252 4.557 ( 12.323 5.540 -4.719) 14.312 4.752 ( -0.721 -5.843 0.760) 5.936 5.212 ( -3.680 -0.462 -7.495) 8.362 5.278 ( -8.453 -1.998 1.314) 8.784 5.638 ( -5.909 -0.429 1.724) 6.170 6.055 ( -0.763 3.150 -10.400) 10.893 6.753 ( 4.922 2.087 3.109) 6.185 6.855 ( 10.086 -0.968 -6.169) 11.863 6.997 ( 0.038 6.504 1.991) 6.802 7.298 ( 14.798 -11.229 10.478) 21.328 8.600 ( -13.771 -5.284 4.764) 15.500 9.275 ( 0.543 3.724 -10.196) 10.869 9.502 ( -9.922 -1.787 -1.196) 10.153 9.997 ( -7.247 11.743 14.097) 19.727 10.183 ( -5.552 -9.083 13.492) 17.187 10.997 ( 11.767 5.362 -4.139) 13.578 11.141 ( -9.455 -1.198 2.953) 9.977 12.118 ( -0.580 -0.244 -5.062) 5.101 12.507 ( -2.961 -1.702 -4.734) 5.837 12.742 ( -0.184 1.559 0.023) 1.570 12.947 ( -2.561 -4.182 4.029) 6.347 13.833 ( 7.266 1.704 -16.141) 17.783 17.725 ( 8.310 4.986 12.508) 15.824 17.901 ( 5.497 -7.339 -16.821) 19.158 19.347 ( -7.024 5.219 5.159) 10.158 19.496 ( -1.509 10.908 -2.809) 11.365 19.849 ( 2.162 -13.765 3.856) 14.457 22.749 ( 15.972 -3.687 -8.351) 18.397 23.728 ( -6.336 12.901 6.825) 15.910 24.249 ( 0.371 -7.450 -3.696) 8.325 ======================= Grid point 702 (358/361) ======================= q-point: (-0.10 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( -17.730 -6.639 6.697) 20.081 2.526 ( -11.673 -8.036 15.883) 21.287 3.403 ( 6.143 0.365 -3.226) 6.949 3.512 ( 13.102 -4.068 -11.997) 18.225 3.644 ( -2.392 2.187 -1.335) 3.505 4.335 ( -5.414 15.472 -0.369) 16.396 4.545 ( -8.404 5.975 -1.922) 10.489 4.882 ( 9.605 -6.032 -4.975) 12.385 5.136 ( -0.481 -0.539 1.577) 1.735 5.340 ( 10.807 -7.720 1.015) 13.320 5.669 ( -0.933 -0.984 8.601) 8.707 5.931 ( 3.794 4.894 -6.637) 9.077 6.714 ( -0.854 2.520 -11.774) 12.071 6.869 ( 2.467 -0.333 -4.643) 5.268 7.033 ( -2.516 6.803 15.041) 16.699 7.706 ( 10.571 -3.180 11.642) 16.043 8.582 ( -7.926 -8.066 9.575) 14.817 9.171 ( 3.490 -2.702 -8.627) 9.691 9.379 ( -7.342 -3.660 -3.177) 8.797 9.924 ( -4.342 14.266 6.078) 16.103 10.327 ( -8.086 -6.900 14.180) 17.721 10.864 ( -9.144 6.659 -3.203) 11.757 11.191 ( 5.611 -0.834 -0.545) 5.698 12.014 ( -5.076 -1.363 -5.407) 7.541 12.491 ( -0.327 -3.683 1.809) 4.116 12.706 ( -2.996 1.929 0.483) 3.596 13.024 ( -1.466 -7.178 3.756) 8.233 13.712 ( 8.040 1.947 -17.929) 19.745 17.679 ( 5.299 1.206 -14.380) 15.373 18.179 ( 14.953 -2.405 13.739) 20.449 19.216 ( -5.614 15.918 -2.519) 17.066 19.439 ( 7.744 -1.827 -0.628) 7.981 19.988 ( -4.059 -10.632 3.292) 11.847 22.918 ( 14.500 -6.941 -7.129) 17.586 23.496 ( -12.172 21.771 2.274) 25.046 24.222 ( -7.907 -11.721 -6.421) 15.528 ======================= Grid point 711 (359/361) ======================= q-point: (-0.20 -0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -20.063 0.000 6.324) 21.036 2.447 ( -11.176 0.000 17.187) 20.501 3.403 ( 8.117 -0.000 -0.847) 8.161 3.475 ( 9.408 -0.000 -15.529) 18.157 3.669 ( -0.450 0.000 -2.542) 2.582 4.485 ( -17.245 0.000 7.529) 18.817 4.679 ( 6.846 -0.000 -3.929) 7.894 4.732 ( 5.097 -0.000 -12.387) 13.395 5.181 ( -5.293 0.000 3.778) 6.504 5.226 ( 18.743 -0.000 -1.179) 18.780 5.659 ( -1.900 0.000 9.545) 9.732 5.980 ( 4.137 -0.000 -7.815) 8.842 6.741 ( 1.416 -0.000 -13.628) 13.702 6.859 ( 1.820 -0.000 -5.049) 5.367 7.109 ( -3.948 0.000 17.286) 17.731 7.666 ( 18.819 -0.000 13.380) 23.090 8.488 ( -11.278 0.000 10.799) 15.615 9.180 ( 1.479 -0.000 -10.166) 10.273 9.328 ( -8.152 0.000 -4.137) 9.142 10.123 ( 7.146 -0.000 -9.364) 11.780 10.195 ( -19.364 0.000 31.367) 36.862 10.937 ( -18.037 0.000 1.079) 18.069 11.182 ( 10.626 -0.000 -1.829) 10.783 12.004 ( -5.039 0.000 -6.098) 7.911 12.447 ( -1.387 0.000 2.272) 2.662 12.730 ( -2.628 0.000 -1.091) 2.846 12.950 ( -0.950 0.000 3.976) 4.087 13.730 ( 8.830 -0.000 -19.700) 21.589 17.690 ( 6.181 -0.000 -17.247) 18.321 18.154 ( 16.019 -0.000 16.093) 22.706 19.405 ( 6.930 -0.000 2.703) 7.438 19.428 ( -6.534 0.000 -8.928) 11.063 19.845 ( -3.203 0.000 7.169) 7.852 22.854 ( 15.107 -0.000 -7.786) 16.995 23.777 ( -8.710 0.000 6.383) 10.798 24.033 ( -10.612 0.000 -11.722) 15.811 ======================= Grid point 712 (360/361) ======================= q-point: (-0.10 -0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.092 ( -7.853 -3.860 13.804) 16.344 2.582 ( -5.126 -3.870 20.670) 21.644 3.374 ( -0.149 0.446 -11.714) 11.723 3.512 ( 7.801 -2.396 -2.212) 8.455 3.610 ( 2.157 0.255 -7.404) 7.716 4.277 ( -13.654 5.228 -0.158) 14.621 4.493 ( -2.969 12.481 -8.397) 15.333 4.760 ( -0.786 -11.648 -5.831) 13.050 5.228 ( 4.630 0.846 6.056) 7.670 5.566 ( 22.456 -2.935 -0.221) 22.648 5.791 ( 0.603 -0.573 13.376) 13.402 5.989 ( 9.472 2.112 -4.905) 10.873 6.537 ( -6.996 1.826 -9.648) 12.057 6.796 ( -2.268 -0.973 -5.374) 5.913 7.250 ( -2.135 4.920 15.345) 16.255 8.009 ( 9.583 6.540 11.092) 16.051 8.580 ( -4.228 -9.351 16.413) 19.357 9.094 ( 3.064 -0.818 -8.666) 9.228 9.206 ( -4.826 -5.089 -4.225) 8.188 10.023 ( 2.081 10.923 -7.225) 13.261 10.336 ( -13.632 -5.317 23.404) 27.602 10.685 ( -18.247 0.625 2.139) 18.383 11.222 ( 3.003 1.123 -7.965) 8.586 11.869 ( -6.003 -0.518 -3.215) 6.830 12.514 ( -0.000 -3.107 6.815) 7.490 12.644 ( -3.518 0.074 -4.544) 5.747 13.008 ( -0.736 -3.314 4.543) 5.671 13.631 ( 10.592 0.777 -18.198) 21.070 17.619 ( 7.869 0.481 -10.841) 13.404 18.549 ( 17.329 -0.845 8.596) 19.362 19.150 ( -7.719 9.380 -10.542) 16.084 19.610 ( 17.633 -1.491 -0.846) 17.716 19.897 ( -8.101 -5.519 11.510) 15.118 22.966 ( 12.014 -3.580 -9.251) 15.580 23.495 ( -16.461 21.741 -3.632) 27.510 23.847 ( -13.962 -16.786 -5.054) 22.411 ======================= Grid point 722 (361/361) ======================= q-point: (-0.10 -0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 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 2.32e-04 2.32e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( -0.879 0.000 14.968) 14.994 2.786 ( -0.862 0.000 21.011) 21.029 3.201 ( -6.043 0.000 -7.358) 9.521 3.532 ( 2.706 -0.000 -10.204) 10.557 3.595 ( 9.907 -0.000 -5.051) 11.120 4.107 ( -9.053 0.000 -4.245) 9.999 4.407 ( -2.873 0.000 -9.325) 9.757 4.613 ( -4.568 0.000 -2.558) 5.235 5.414 ( 7.672 -0.000 9.245) 12.013 5.786 ( 8.611 -0.000 2.776) 9.047 5.989 ( 7.247 -0.000 7.934) 10.745 6.099 ( 12.999 -0.000 -4.995) 13.925 6.378 ( -4.691 0.000 -2.334) 5.240 6.678 ( -4.756 0.000 -5.015) 6.912 7.417 ( -2.166 0.000 14.337) 14.500 8.277 ( 6.184 -0.000 5.420) 8.222 8.692 ( -5.168 0.000 20.857) 21.487 9.034 ( 3.861 -0.000 -9.195) 9.973 9.092 ( -2.518 0.000 -0.022) 2.518 9.975 ( 4.471 -0.000 -16.007) 16.620 10.430 ( -17.280 0.000 26.692) 31.797 10.482 ( -13.308 0.000 6.954) 15.016 11.087 ( -1.909 0.000 -14.594) 14.718 11.739 ( -8.326 0.000 -4.322) 9.381 12.550 ( 2.650 -0.000 -7.351) 7.814 12.578 ( -1.856 0.000 7.387) 7.616 13.054 ( -0.771 0.000 6.854) 6.897 13.585 ( 10.530 -0.000 -15.220) 18.508 17.646 ( 9.292 -0.000 -5.087) 10.593 18.698 ( -1.193 0.000 -10.127) 10.197 19.076 ( 10.173 -0.000 -1.783) 10.328 19.688 ( -3.877 0.000 -0.627) 3.928 20.118 ( 16.592 -0.000 17.693) 24.256 22.865 ( -7.359 0.000 -18.983) 20.360 23.298 ( -8.523 0.000 -4.957) 9.859 23.586 ( -11.893 0.000 2.718) 12.200 =================== 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 3/46800 10.0 1609.527 1638.346 1396.288 0.000 155.475 -0.000 3/46800 20.0 455.571 501.702 516.264 0.000 51.059 -0.000 3/46800 30.0 159.614 162.666 185.373 0.000 14.792 -0.000 3/46800 40.0 79.513 75.569 91.510 0.000 5.471 -0.000 3/46800 50.0 48.916 44.374 55.816 0.000 2.487 -0.000 3/46800 60.0 34.171 30.078 38.774 0.000 1.274 -0.000 3/46800 70.0 25.874 22.334 29.257 0.000 0.690 -0.000 3/46800 80.0 20.680 17.627 23.335 0.000 0.375 -0.000 3/46800 90.0 17.175 14.521 19.354 0.000 0.189 -0.000 3/46800 100.0 14.675 12.342 16.521 0.000 0.073 -0.000 3/46800 110.0 12.814 10.741 14.416 0.000 -0.002 -0.000 3/46800 120.0 11.381 9.519 12.796 0.000 -0.052 -0.000 3/46800 130.0 10.248 8.558 11.515 0.000 -0.086 -0.000 3/46800 140.0 9.330 7.783 10.478 0.000 -0.108 -0.000 3/46800 150.0 8.573 7.144 9.622 0.000 -0.123 -0.000 3/46800 160.0 7.939 6.609 8.903 0.000 -0.132 -0.000 3/46800 170.0 7.399 6.154 8.290 0.000 -0.137 -0.000 3/46800 180.0 6.934 5.762 7.763 0.000 -0.140 -0.000 3/46800 190.0 6.529 5.420 7.303 0.000 -0.140 -0.000 3/46800 200.0 6.174 5.119 6.898 0.000 -0.140 -0.000 3/46800 210.0 5.859 4.853 6.539 0.000 -0.138 -0.000 3/46800 220.0 5.577 4.614 6.217 0.000 -0.135 -0.000 3/46800 230.0 5.324 4.400 5.928 0.000 -0.132 -0.000 3/46800 240.0 5.095 4.206 5.667 0.000 -0.129 -0.000 3/46800 250.0 4.886 4.029 5.429 0.000 -0.125 -0.000 3/46800 260.0 4.696 3.867 5.211 0.000 -0.121 -0.000 3/46800 270.0 4.521 3.719 5.011 0.000 -0.118 -0.000 3/46800 280.0 4.359 3.582 4.826 0.000 -0.114 -0.000 3/46800 290.0 4.210 3.455 4.656 0.000 -0.111 -0.000 3/46800 300.0 4.071 3.338 4.497 0.000 -0.107 -0.000 3/46800 310.0 3.941 3.228 4.350 0.000 -0.104 -0.000 3/46800 320.0 3.820 3.126 4.212 0.000 -0.101 -0.000 3/46800 330.0 3.707 3.031 4.083 0.000 -0.098 -0.000 3/46800 340.0 3.600 2.941 3.961 0.000 -0.095 -0.000 3/46800 350.0 3.500 2.856 3.847 0.000 -0.092 -0.000 3/46800 360.0 3.405 2.777 3.740 0.000 -0.089 -0.000 3/46800 370.0 3.316 2.702 3.639 0.000 -0.087 -0.000 3/46800 380.0 3.231 2.630 3.543 0.000 -0.084 -0.000 3/46800 390.0 3.151 2.563 3.452 0.000 -0.082 -0.000 3/46800 400.0 3.074 2.499 3.366 0.000 -0.080 -0.000 3/46800 410.0 3.002 2.439 3.284 0.000 -0.078 -0.000 3/46800 420.0 2.933 2.381 3.206 0.000 -0.076 -0.000 3/46800 430.0 2.866 2.326 3.131 0.000 -0.074 -0.000 3/46800 440.0 2.803 2.273 3.060 0.000 -0.072 -0.000 3/46800 450.0 2.743 2.223 2.993 0.000 -0.070 -0.000 3/46800 460.0 2.685 2.175 2.928 0.000 -0.068 -0.000 3/46800 470.0 2.630 2.129 2.866 0.000 -0.067 -0.000 3/46800 480.0 2.577 2.085 2.807 0.000 -0.065 -0.000 3/46800 490.0 2.526 2.043 2.750 0.000 -0.064 -0.000 3/46800 500.0 2.477 2.002 2.695 0.000 -0.062 -0.000 3/46800 510.0 2.430 1.963 2.643 0.000 -0.061 -0.000 3/46800 520.0 2.384 1.926 2.592 0.000 -0.060 -0.000 3/46800 530.0 2.341 1.890 2.543 0.000 -0.058 -0.000 3/46800 540.0 2.299 1.855 2.497 0.000 -0.057 -0.000 3/46800 550.0 2.258 1.822 2.452 0.000 -0.056 -0.000 3/46800 560.0 2.219 1.790 2.408 0.000 -0.055 -0.000 3/46800 570.0 2.181 1.759 2.366 0.000 -0.054 -0.000 3/46800 580.0 2.144 1.728 2.326 0.000 -0.053 -0.000 3/46800 590.0 2.109 1.699 2.287 0.000 -0.052 -0.000 3/46800 600.0 2.075 1.671 2.249 0.000 -0.051 -0.000 3/46800 610.0 2.042 1.644 2.212 0.000 -0.050 -0.000 3/46800 620.0 2.010 1.618 2.177 0.000 -0.049 -0.000 3/46800 630.0 1.979 1.593 2.142 0.000 -0.048 -0.000 3/46800 640.0 1.948 1.568 2.109 0.000 -0.047 -0.000 3/46800 650.0 1.919 1.544 2.077 0.000 -0.046 -0.000 3/46800 660.0 1.891 1.521 2.046 0.000 -0.046 -0.000 3/46800 670.0 1.863 1.498 2.015 0.000 -0.045 -0.000 3/46800 680.0 1.836 1.476 1.986 0.000 -0.044 -0.000 3/46800 690.0 1.810 1.455 1.957 0.000 -0.043 -0.000 3/46800 700.0 1.785 1.435 1.930 0.000 -0.043 -0.000 3/46800 710.0 1.761 1.415 1.903 0.000 -0.042 -0.000 3/46800 720.0 1.737 1.395 1.876 0.000 -0.041 -0.000 3/46800 730.0 1.713 1.376 1.851 0.000 -0.041 -0.000 3/46800 740.0 1.691 1.358 1.826 0.000 -0.040 -0.000 3/46800 750.0 1.669 1.340 1.802 0.000 -0.040 -0.000 3/46800 760.0 1.647 1.322 1.778 0.000 -0.039 -0.000 3/46800 770.0 1.626 1.305 1.755 0.000 -0.039 -0.000 3/46800 780.0 1.606 1.289 1.733 0.000 -0.038 -0.000 3/46800 790.0 1.586 1.272 1.711 0.000 -0.037 -0.000 3/46800 800.0 1.566 1.257 1.690 0.000 -0.037 -0.000 3/46800 810.0 1.547 1.241 1.669 0.000 -0.036 -0.000 3/46800 820.0 1.529 1.226 1.649 0.000 -0.036 -0.000 3/46800 830.0 1.511 1.212 1.629 0.000 -0.036 -0.000 3/46800 840.0 1.493 1.197 1.610 0.000 -0.035 -0.000 3/46800 850.0 1.476 1.183 1.591 0.000 -0.035 -0.000 3/46800 860.0 1.459 1.170 1.573 0.000 -0.034 -0.000 3/46800 870.0 1.442 1.156 1.555 0.000 -0.034 -0.000 3/46800 880.0 1.426 1.143 1.537 0.000 -0.033 -0.000 3/46800 890.0 1.410 1.130 1.520 0.000 -0.033 -0.000 3/46800 900.0 1.395 1.118 1.503 0.000 -0.033 -0.000 3/46800 910.0 1.380 1.106 1.487 0.000 -0.032 -0.000 3/46800 920.0 1.365 1.094 1.470 0.000 -0.032 -0.000 3/46800 930.0 1.351 1.082 1.455 0.000 -0.031 -0.000 3/46800 940.0 1.336 1.071 1.439 0.000 -0.031 -0.000 3/46800 950.0 1.323 1.059 1.424 0.000 -0.031 -0.000 3/46800 960.0 1.309 1.048 1.410 0.000 -0.030 -0.000 3/46800 970.0 1.296 1.038 1.395 0.000 -0.030 -0.000 3/46800 980.0 1.283 1.027 1.381 0.000 -0.030 -0.000 3/46800 990.0 1.270 1.017 1.367 0.000 -0.029 -0.000 3/46800 1000.0 1.257 1.007 1.353 0.000 -0.029 -0.000 3/46800 Thermal conductivity related properties were written into "kappa-m101013.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:59:04]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|