----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 22:28:18]------------------------- Compiled with OpenMP support (max 48 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 3 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.285653781273222 -1.907795530000000 0.000000000000000 b 6.285653781273222 1.907795530000000 0.000000000000000 c -2.052245811218807 0.000000000000000 6.322130938022574 Atomic positions (fractional): *1 O 0.13716630057804 0.13716630057804 0.01763163379365 15.999 2 O 0.86283369942196 0.86283369942196 0.98236836620636 15.999 *3 O 0.05481794034093 0.05481794034093 0.36685968422537 15.999 4 O 0.94518205965907 0.94518205965907 0.63314031577463 15.999 *5 O 0.74113597886910 0.74113597886910 0.35504968584320 15.999 6 O 0.25886402113090 0.25886402113090 0.64495031415680 15.999 *7 O 0.63955065427456 0.63955065427456 0.70269689011643 15.999 8 O 0.36044934572544 0.36044934572544 0.29730310988357 15.999 *9 Ga 0.80270148289051 0.80270148289051 0.68349365154912 69.723 10 Ga 0.19729851710949 0.19729851710949 0.31650634845088 69.723 *11 Nb 0.89613463338741 0.89613463338740 0.26866512754780 92.906 12 Nb 0.10386536661260 0.10386536661260 0.73133487245220 92.906 -------------------------------- unit cell --------------------------------- Lattice vectors: a 12.571307562546444 0.000000000000000 0.000000000000000 b 0.000000000000000 3.815591060000001 0.000000000000000 c -2.052245811218807 0.000000000000000 6.322130938022574 Atomic positions (fractional): *1 O 0.13716630057804 0.00000000000000 0.01763163379365 15.999 > 1 2 O 0.36283369942196 0.50000000000000 0.98236836620636 15.999 > 2 *3 O 0.05481794034093 0.00000000000000 0.36685968422537 15.999 > 3 4 O 0.44518205965907 0.50000000000000 0.63314031577463 15.999 > 4 *5 O 0.24113597886910 0.50000000000000 0.35504968584320 15.999 > 5 6 O 0.25886402113090 0.00000000000000 0.64495031415680 15.999 > 6 *7 O 0.13955065427456 0.50000000000000 0.70269689011643 15.999 > 7 8 O 0.36044934572544 0.00000000000000 0.29730310988357 15.999 > 8 9 O 0.63716630057804 0.50000000000000 0.01763163379365 15.999 > 1 10 O 0.86283369942196 0.00000000000000 0.98236836620636 15.999 > 2 11 O 0.55481794034093 0.50000000000000 0.36685968422537 15.999 > 3 12 O 0.94518205965907 0.00000000000000 0.63314031577463 15.999 > 4 13 O 0.74113597886910 0.00000000000000 0.35504968584320 15.999 > 5 14 O 0.75886402113090 0.50000000000000 0.64495031415680 15.999 > 6 15 O 0.63955065427456 0.00000000000000 0.70269689011643 15.999 > 7 16 O 0.86044934572544 0.50000000000000 0.29730310988357 15.999 > 8 *17 Ga 0.30270148289051 0.50000000000000 0.68349365154912 69.723 > 9 18 Ga 0.19729851710949 0.00000000000000 0.31650634845088 69.723 > 10 19 Ga 0.80270148289051 0.00000000000000 0.68349365154912 69.723 > 9 20 Ga 0.69729851710949 0.50000000000000 0.31650634845088 69.723 > 10 *21 Nb 0.39613463338741 0.50000000000000 0.26866512754780 92.906 > 11 22 Nb 0.10386536661260 0.00000000000000 0.73133487245220 92.906 > 12 23 Nb 0.89613463338740 0.00000000000000 0.26866512754780 92.906 > 11 24 Nb 0.60386536661260 0.50000000000000 0.73133487245220 92.906 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.571307562546444 0.000000000000000 0.000000000000000 b 0.000000000000000 11.446773180000003 0.000000000000000 c -4.104491622437614 0.000000000000000 12.644261876045148 Atomic positions (fractional): *1 O 0.13716630057804 0.00000000000000 0.00881581689682 15.999 > 1 2 O 0.13716630057804 0.33333333333333 0.00881581689682 15.999 > 1 3 O 0.13716630057804 0.66666666666667 0.00881581689682 15.999 > 1 4 O 0.13716630057804 0.00000000000000 0.50881581689682 15.999 > 1 5 O 0.13716630057804 0.33333333333333 0.50881581689682 15.999 > 1 6 O 0.13716630057804 0.66666666666667 0.50881581689682 15.999 > 1 7 O 0.36283369942196 0.16666666666667 0.49118418310318 15.999 > 2 8 O 0.36283369942196 0.50000000000000 0.49118418310318 15.999 > 2 9 O 0.36283369942196 0.83333333333333 0.49118418310318 15.999 > 2 10 O 0.36283369942196 0.16666666666667 0.99118418310318 15.999 > 2 11 O 0.36283369942196 0.50000000000000 0.99118418310318 15.999 > 2 12 O 0.36283369942196 0.83333333333333 0.99118418310318 15.999 > 2 *13 O 0.05481794034093 0.00000000000000 0.18342984211268 15.999 > 3 14 O 0.05481794034093 0.33333333333333 0.18342984211268 15.999 > 3 15 O 0.05481794034093 0.66666666666667 0.18342984211268 15.999 > 3 16 O 0.05481794034093 0.00000000000000 0.68342984211268 15.999 > 3 17 O 0.05481794034093 0.33333333333333 0.68342984211268 15.999 > 3 18 O 0.05481794034093 0.66666666666667 0.68342984211268 15.999 > 3 19 O 0.44518205965907 0.16666666666667 0.31657015788732 15.999 > 4 20 O 0.44518205965907 0.50000000000000 0.31657015788732 15.999 > 4 21 O 0.44518205965907 0.83333333333333 0.31657015788732 15.999 > 4 22 O 0.44518205965907 0.16666666666667 0.81657015788732 15.999 > 4 23 O 0.44518205965907 0.50000000000000 0.81657015788732 15.999 > 4 24 O 0.44518205965907 0.83333333333333 0.81657015788732 15.999 > 4 *25 O 0.24113597886910 0.16666666666667 0.17752484292160 15.999 > 5 26 O 0.24113597886910 0.50000000000000 0.17752484292160 15.999 > 5 27 O 0.24113597886910 0.83333333333333 0.17752484292160 15.999 > 5 28 O 0.24113597886910 0.16666666666667 0.67752484292160 15.999 > 5 29 O 0.24113597886910 0.50000000000000 0.67752484292160 15.999 > 5 30 O 0.24113597886910 0.83333333333333 0.67752484292160 15.999 > 5 31 O 0.25886402113090 0.00000000000000 0.32247515707840 15.999 > 6 32 O 0.25886402113090 0.33333333333333 0.32247515707840 15.999 > 6 33 O 0.25886402113090 0.66666666666667 0.32247515707840 15.999 > 6 34 O 0.25886402113090 0.00000000000000 0.82247515707840 15.999 > 6 35 O 0.25886402113090 0.33333333333333 0.82247515707840 15.999 > 6 36 O 0.25886402113090 0.66666666666667 0.82247515707840 15.999 > 6 *37 O 0.13955065427456 0.16666666666667 0.35134844505822 15.999 > 7 38 O 0.13955065427456 0.50000000000000 0.35134844505822 15.999 > 7 39 O 0.13955065427456 0.83333333333333 0.35134844505822 15.999 > 7 40 O 0.13955065427456 0.16666666666667 0.85134844505822 15.999 > 7 41 O 0.13955065427456 0.50000000000000 0.85134844505822 15.999 > 7 42 O 0.13955065427456 0.83333333333333 0.85134844505822 15.999 > 7 43 O 0.36044934572544 0.00000000000000 0.14865155494178 15.999 > 8 44 O 0.36044934572544 0.33333333333333 0.14865155494178 15.999 > 8 45 O 0.36044934572544 0.66666666666667 0.14865155494178 15.999 > 8 46 O 0.36044934572544 0.00000000000000 0.64865155494178 15.999 > 8 47 O 0.36044934572544 0.33333333333333 0.64865155494178 15.999 > 8 48 O 0.36044934572544 0.66666666666667 0.64865155494178 15.999 > 8 49 O 0.63716630057804 0.16666666666667 0.00881581689682 15.999 > 1 50 O 0.63716630057804 0.50000000000000 0.00881581689682 15.999 > 1 51 O 0.63716630057804 0.83333333333333 0.00881581689682 15.999 > 1 52 O 0.63716630057804 0.16666666666667 0.50881581689682 15.999 > 1 53 O 0.63716630057804 0.50000000000000 0.50881581689682 15.999 > 1 54 O 0.63716630057804 0.83333333333333 0.50881581689682 15.999 > 1 55 O 0.86283369942196 0.00000000000000 0.49118418310318 15.999 > 2 56 O 0.86283369942196 0.33333333333333 0.49118418310318 15.999 > 2 57 O 0.86283369942196 0.66666666666667 0.49118418310318 15.999 > 2 58 O 0.86283369942196 0.00000000000000 0.99118418310318 15.999 > 2 59 O 0.86283369942196 0.33333333333333 0.99118418310318 15.999 > 2 60 O 0.86283369942196 0.66666666666667 0.99118418310318 15.999 > 2 61 O 0.55481794034093 0.16666666666667 0.18342984211268 15.999 > 3 62 O 0.55481794034093 0.50000000000000 0.18342984211268 15.999 > 3 63 O 0.55481794034093 0.83333333333333 0.18342984211268 15.999 > 3 64 O 0.55481794034093 0.16666666666667 0.68342984211268 15.999 > 3 65 O 0.55481794034093 0.50000000000000 0.68342984211268 15.999 > 3 66 O 0.55481794034093 0.83333333333333 0.68342984211268 15.999 > 3 67 O 0.94518205965907 0.00000000000000 0.31657015788732 15.999 > 4 68 O 0.94518205965907 0.33333333333333 0.31657015788732 15.999 > 4 69 O 0.94518205965907 0.66666666666667 0.31657015788732 15.999 > 4 70 O 0.94518205965907 0.00000000000000 0.81657015788732 15.999 > 4 71 O 0.94518205965907 0.33333333333333 0.81657015788732 15.999 > 4 72 O 0.94518205965907 0.66666666666667 0.81657015788732 15.999 > 4 73 O 0.74113597886910 0.00000000000000 0.17752484292160 15.999 > 5 74 O 0.74113597886910 0.33333333333333 0.17752484292160 15.999 > 5 75 O 0.74113597886910 0.66666666666667 0.17752484292160 15.999 > 5 76 O 0.74113597886910 0.00000000000000 0.67752484292160 15.999 > 5 77 O 0.74113597886910 0.33333333333333 0.67752484292160 15.999 > 5 78 O 0.74113597886910 0.66666666666667 0.67752484292160 15.999 > 5 79 O 0.75886402113090 0.16666666666667 0.32247515707840 15.999 > 6 80 O 0.75886402113090 0.50000000000000 0.32247515707840 15.999 > 6 81 O 0.75886402113090 0.83333333333333 0.32247515707840 15.999 > 6 82 O 0.75886402113090 0.16666666666667 0.82247515707840 15.999 > 6 83 O 0.75886402113090 0.50000000000000 0.82247515707840 15.999 > 6 84 O 0.75886402113090 0.83333333333333 0.82247515707840 15.999 > 6 85 O 0.63955065427456 0.00000000000000 0.35134844505822 15.999 > 7 86 O 0.63955065427456 0.33333333333333 0.35134844505822 15.999 > 7 87 O 0.63955065427456 0.66666666666667 0.35134844505822 15.999 > 7 88 O 0.63955065427456 0.00000000000000 0.85134844505822 15.999 > 7 89 O 0.63955065427456 0.33333333333333 0.85134844505822 15.999 > 7 90 O 0.63955065427456 0.66666666666667 0.85134844505822 15.999 > 7 91 O 0.86044934572544 0.16666666666667 0.14865155494178 15.999 > 8 92 O 0.86044934572544 0.50000000000000 0.14865155494178 15.999 > 8 93 O 0.86044934572544 0.83333333333333 0.14865155494178 15.999 > 8 94 O 0.86044934572544 0.16666666666667 0.64865155494178 15.999 > 8 95 O 0.86044934572544 0.50000000000000 0.64865155494178 15.999 > 8 96 O 0.86044934572544 0.83333333333333 0.64865155494178 15.999 > 8 *97 Ga 0.30270148289051 0.16666666666667 0.34174682577456 69.723 > 9 98 Ga 0.30270148289051 0.50000000000000 0.34174682577456 69.723 > 9 99 Ga 0.30270148289051 0.83333333333333 0.34174682577456 69.723 > 9 100 Ga 0.30270148289051 0.16666666666667 0.84174682577456 69.723 > 9 101 Ga 0.30270148289051 0.50000000000000 0.84174682577456 69.723 > 9 102 Ga 0.30270148289051 0.83333333333333 0.84174682577456 69.723 > 9 103 Ga 0.19729851710949 0.00000000000000 0.15825317422544 69.723 > 10 104 Ga 0.19729851710949 0.33333333333333 0.15825317422544 69.723 > 10 105 Ga 0.19729851710949 0.66666666666667 0.15825317422544 69.723 > 10 106 Ga 0.19729851710949 0.00000000000000 0.65825317422544 69.723 > 10 107 Ga 0.19729851710949 0.33333333333333 0.65825317422544 69.723 > 10 108 Ga 0.19729851710949 0.66666666666667 0.65825317422544 69.723 > 10 109 Ga 0.80270148289051 0.00000000000000 0.34174682577456 69.723 > 9 110 Ga 0.80270148289051 0.33333333333333 0.34174682577456 69.723 > 9 111 Ga 0.80270148289051 0.66666666666667 0.34174682577456 69.723 > 9 112 Ga 0.80270148289051 0.00000000000000 0.84174682577456 69.723 > 9 113 Ga 0.80270148289051 0.33333333333333 0.84174682577456 69.723 > 9 114 Ga 0.80270148289051 0.66666666666667 0.84174682577456 69.723 > 9 115 Ga 0.69729851710949 0.16666666666667 0.15825317422544 69.723 > 10 116 Ga 0.69729851710949 0.50000000000000 0.15825317422544 69.723 > 10 117 Ga 0.69729851710949 0.83333333333333 0.15825317422544 69.723 > 10 118 Ga 0.69729851710949 0.16666666666667 0.65825317422544 69.723 > 10 119 Ga 0.69729851710949 0.50000000000000 0.65825317422544 69.723 > 10 120 Ga 0.69729851710949 0.83333333333333 0.65825317422544 69.723 > 10 *121 Nb 0.39613463338741 0.16666666666667 0.13433256377390 92.906 > 11 122 Nb 0.39613463338741 0.50000000000000 0.13433256377390 92.906 > 11 123 Nb 0.39613463338741 0.83333333333333 0.13433256377390 92.906 > 11 124 Nb 0.39613463338741 0.16666666666667 0.63433256377390 92.906 > 11 125 Nb 0.39613463338741 0.50000000000000 0.63433256377390 92.906 > 11 126 Nb 0.39613463338741 0.83333333333333 0.63433256377390 92.906 > 11 127 Nb 0.10386536661260 0.00000000000000 0.36566743622610 92.906 > 12 128 Nb 0.10386536661260 0.33333333333333 0.36566743622610 92.906 > 12 129 Nb 0.10386536661260 0.66666666666667 0.36566743622610 92.906 > 12 130 Nb 0.10386536661260 0.00000000000000 0.86566743622610 92.906 > 12 131 Nb 0.10386536661260 0.33333333333333 0.86566743622610 92.906 > 12 132 Nb 0.10386536661260 0.66666666666667 0.86566743622610 92.906 > 12 133 Nb 0.89613463338740 0.00000000000000 0.13433256377390 92.906 > 11 134 Nb 0.89613463338740 0.33333333333333 0.13433256377390 92.906 > 11 135 Nb 0.89613463338740 0.66666666666667 0.13433256377390 92.906 > 11 136 Nb 0.89613463338740 0.00000000000000 0.63433256377390 92.906 > 11 137 Nb 0.89613463338740 0.33333333333333 0.63433256377390 92.906 > 11 138 Nb 0.89613463338740 0.66666666666667 0.63433256377390 92.906 > 11 139 Nb 0.60386536661260 0.16666666666667 0.36566743622610 92.906 > 12 140 Nb 0.60386536661260 0.50000000000000 0.36566743622610 92.906 > 12 141 Nb 0.60386536661260 0.83333333333333 0.36566743622610 92.906 > 12 142 Nb 0.60386536661260 0.16666666666667 0.86566743622610 92.906 > 12 143 Nb 0.60386536661260 0.50000000000000 0.86566743622610 92.906 > 12 144 Nb 0.60386536661260 0.83333333333333 0.86566743622610 92.906 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.4076172 0.0000000 0.1702217 0.0000000 4.9754500 0.0000000 0.1702214 0.0000000 4.5627466 -------------------------- Born effective charges -------------------------- 1 O -0.9293628 0.0000000 -0.2064497 0.0000000 -1.1274078 0.0000000 0.0508186 0.0000000 -4.2291847 2 O -0.9293628 0.0000000 -0.2064497 0.0000000 -1.1274078 0.0000000 0.0508186 0.0000000 -4.2291847 3 O -3.7032581 0.0000000 -0.8571424 0.0000000 -1.0486062 0.0000000 -0.7246107 0.0000000 -2.2492617 4 O -3.7032581 0.0000000 -0.8571424 0.0000000 -1.0486062 0.0000000 -0.7246107 0.0000000 -2.2492617 5 O -2.5230544 0.0000000 0.4642728 0.0000000 -2.5411346 0.0000000 0.1878181 0.0000000 -1.9595126 6 O -2.5230544 0.0000000 0.4642728 0.0000000 -2.5411346 0.0000000 0.1878181 0.0000000 -1.9595126 7 O -1.6882034 0.0000000 0.0652572 0.0000000 -5.7086543 0.0000000 0.0107431 0.0000000 -0.9484232 8 O -1.6882034 0.0000000 0.0652572 0.0000000 -5.7086543 0.0000000 0.0107431 0.0000000 -0.9484232 9 Ga 4.0487122 0.0000000 -0.4146580 0.0000000 3.2161511 0.0000000 0.0733781 0.0000000 4.0660247 10 Ga 4.0487122 0.0000000 -0.4146580 0.0000000 3.2161511 0.0000000 0.0733781 0.0000000 4.0660247 11 Nb 4.7951666 0.0000000 0.9487200 0.0000000 7.2096519 0.0000000 0.4018527 0.0000000 5.3203575 12 Nb 4.7951666 0.0000000 0.9487200 0.0000000 7.2096519 0.0000000 0.4018527 0.0000000 5.3203575 ---------------------------------------------------------------------------- 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: 2160 Number of blocks in projector: 2160 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: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 288 Use standard eigh solver. Tree of FC basis block matrices: - (2160, 2131), data: False |-- (288, 288), data: True |-- (288, 288), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.011 Solver_block: 100 / 400 - Time: 1.063 Solver_block: 200 / 400 - Time: 1.011 Solver_block: 300 / 400 - Time: 1.003 Solver_block: 400 / 400 - Time: 0.999 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.149 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (zz) 0.00000000 (zz) 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: 2160 Number of blocks in projector: 2160 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: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 565 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 336 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 288 Use standard eigh solver. Tree of FC basis block matrices: - (2160, 2131), data: False |-- (288, 288), data: True |-- (288, 288), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (336, 330), data: True |-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), 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 22:28:48]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:28:48]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 3 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.285653781273222 -1.907795530000000 0.000000000000000 b 6.285653781273222 1.907795530000000 0.000000000000000 c -2.052245811218807 0.000000000000000 6.322130938022574 Atomic positions (fractional): 1 O 0.13716630057804 0.13716630057804 0.01763163379365 15.999 2 O 0.86283369942196 0.86283369942196 0.98236836620636 15.999 3 O 0.05481794034093 0.05481794034093 0.36685968422537 15.999 4 O 0.94518205965907 0.94518205965907 0.63314031577463 15.999 5 O 0.74113597886910 0.74113597886910 0.35504968584320 15.999 6 O 0.25886402113090 0.25886402113090 0.64495031415680 15.999 7 O 0.63955065427456 0.63955065427456 0.70269689011643 15.999 8 O 0.36044934572544 0.36044934572544 0.29730310988357 15.999 9 Ga 0.80270148289051 0.80270148289051 0.68349365154912 69.723 10 Ga 0.19729851710949 0.19729851710949 0.31650634845088 69.723 11 Nb 0.89613463338741 0.89613463338740 0.26866512754780 92.906 12 Nb 0.10386536661260 0.10386536661260 0.73133487245220 92.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.571307562546444 0.000000000000000 0.000000000000000 b 0.000000000000000 11.446773180000003 0.000000000000000 c -4.104491622437614 0.000000000000000 12.644261876045148 Atomic positions (fractional): 1 O 0.13716630057804 0.00000000000000 0.00881581689682 15.999 > 1 2 O 0.13716630057804 0.33333333333333 0.00881581689682 15.999 > 1 3 O 0.13716630057804 0.66666666666667 0.00881581689682 15.999 > 1 4 O 0.13716630057804 0.00000000000000 0.50881581689682 15.999 > 1 5 O 0.13716630057804 0.33333333333333 0.50881581689682 15.999 > 1 6 O 0.13716630057804 0.66666666666667 0.50881581689682 15.999 > 1 7 O 0.36283369942196 0.16666666666667 0.49118418310318 15.999 > 7 8 O 0.36283369942196 0.50000000000000 0.49118418310318 15.999 > 7 9 O 0.36283369942196 0.83333333333333 0.49118418310318 15.999 > 7 10 O 0.36283369942196 0.16666666666667 0.99118418310318 15.999 > 7 11 O 0.36283369942196 0.50000000000000 0.99118418310318 15.999 > 7 12 O 0.36283369942196 0.83333333333333 0.99118418310318 15.999 > 7 13 O 0.05481794034093 0.00000000000000 0.18342984211268 15.999 > 13 14 O 0.05481794034093 0.33333333333333 0.18342984211268 15.999 > 13 15 O 0.05481794034093 0.66666666666667 0.18342984211268 15.999 > 13 16 O 0.05481794034093 0.00000000000000 0.68342984211268 15.999 > 13 17 O 0.05481794034093 0.33333333333333 0.68342984211268 15.999 > 13 18 O 0.05481794034093 0.66666666666667 0.68342984211268 15.999 > 13 19 O 0.44518205965907 0.16666666666667 0.31657015788732 15.999 > 19 20 O 0.44518205965907 0.50000000000000 0.31657015788732 15.999 > 19 21 O 0.44518205965907 0.83333333333333 0.31657015788732 15.999 > 19 22 O 0.44518205965907 0.16666666666667 0.81657015788732 15.999 > 19 23 O 0.44518205965907 0.50000000000000 0.81657015788732 15.999 > 19 24 O 0.44518205965907 0.83333333333333 0.81657015788732 15.999 > 19 25 O 0.24113597886910 0.16666666666667 0.17752484292160 15.999 > 25 26 O 0.24113597886910 0.50000000000000 0.17752484292160 15.999 > 25 27 O 0.24113597886910 0.83333333333333 0.17752484292160 15.999 > 25 28 O 0.24113597886910 0.16666666666667 0.67752484292160 15.999 > 25 29 O 0.24113597886910 0.50000000000000 0.67752484292160 15.999 > 25 30 O 0.24113597886910 0.83333333333333 0.67752484292160 15.999 > 25 31 O 0.25886402113090 0.00000000000000 0.32247515707840 15.999 > 31 32 O 0.25886402113090 0.33333333333333 0.32247515707840 15.999 > 31 33 O 0.25886402113090 0.66666666666667 0.32247515707840 15.999 > 31 34 O 0.25886402113090 0.00000000000000 0.82247515707840 15.999 > 31 35 O 0.25886402113090 0.33333333333333 0.82247515707840 15.999 > 31 36 O 0.25886402113090 0.66666666666667 0.82247515707840 15.999 > 31 37 O 0.13955065427456 0.16666666666667 0.35134844505822 15.999 > 37 38 O 0.13955065427456 0.50000000000000 0.35134844505822 15.999 > 37 39 O 0.13955065427456 0.83333333333333 0.35134844505822 15.999 > 37 40 O 0.13955065427456 0.16666666666667 0.85134844505822 15.999 > 37 41 O 0.13955065427456 0.50000000000000 0.85134844505822 15.999 > 37 42 O 0.13955065427456 0.83333333333333 0.85134844505822 15.999 > 37 43 O 0.36044934572544 0.00000000000000 0.14865155494178 15.999 > 43 44 O 0.36044934572544 0.33333333333333 0.14865155494178 15.999 > 43 45 O 0.36044934572544 0.66666666666667 0.14865155494178 15.999 > 43 46 O 0.36044934572544 0.00000000000000 0.64865155494178 15.999 > 43 47 O 0.36044934572544 0.33333333333333 0.64865155494178 15.999 > 43 48 O 0.36044934572544 0.66666666666667 0.64865155494178 15.999 > 43 49 O 0.63716630057804 0.16666666666667 0.00881581689682 15.999 > 1 50 O 0.63716630057804 0.50000000000000 0.00881581689682 15.999 > 1 51 O 0.63716630057804 0.83333333333333 0.00881581689682 15.999 > 1 52 O 0.63716630057804 0.16666666666667 0.50881581689682 15.999 > 1 53 O 0.63716630057804 0.50000000000000 0.50881581689682 15.999 > 1 54 O 0.63716630057804 0.83333333333333 0.50881581689682 15.999 > 1 55 O 0.86283369942196 0.00000000000000 0.49118418310318 15.999 > 7 56 O 0.86283369942196 0.33333333333333 0.49118418310318 15.999 > 7 57 O 0.86283369942196 0.66666666666667 0.49118418310318 15.999 > 7 58 O 0.86283369942196 0.00000000000000 0.99118418310318 15.999 > 7 59 O 0.86283369942196 0.33333333333333 0.99118418310318 15.999 > 7 60 O 0.86283369942196 0.66666666666667 0.99118418310318 15.999 > 7 61 O 0.55481794034093 0.16666666666667 0.18342984211268 15.999 > 13 62 O 0.55481794034093 0.50000000000000 0.18342984211268 15.999 > 13 63 O 0.55481794034093 0.83333333333333 0.18342984211268 15.999 > 13 64 O 0.55481794034093 0.16666666666667 0.68342984211268 15.999 > 13 65 O 0.55481794034093 0.50000000000000 0.68342984211268 15.999 > 13 66 O 0.55481794034093 0.83333333333333 0.68342984211268 15.999 > 13 67 O 0.94518205965907 0.00000000000000 0.31657015788732 15.999 > 19 68 O 0.94518205965907 0.33333333333333 0.31657015788732 15.999 > 19 69 O 0.94518205965907 0.66666666666667 0.31657015788732 15.999 > 19 70 O 0.94518205965907 0.00000000000000 0.81657015788732 15.999 > 19 71 O 0.94518205965907 0.33333333333333 0.81657015788732 15.999 > 19 72 O 0.94518205965907 0.66666666666667 0.81657015788732 15.999 > 19 73 O 0.74113597886910 0.00000000000000 0.17752484292160 15.999 > 25 74 O 0.74113597886910 0.33333333333333 0.17752484292160 15.999 > 25 75 O 0.74113597886910 0.66666666666667 0.17752484292160 15.999 > 25 76 O 0.74113597886910 0.00000000000000 0.67752484292160 15.999 > 25 77 O 0.74113597886910 0.33333333333333 0.67752484292160 15.999 > 25 78 O 0.74113597886910 0.66666666666667 0.67752484292160 15.999 > 25 79 O 0.75886402113090 0.16666666666667 0.32247515707840 15.999 > 31 80 O 0.75886402113090 0.50000000000000 0.32247515707840 15.999 > 31 81 O 0.75886402113090 0.83333333333333 0.32247515707840 15.999 > 31 82 O 0.75886402113090 0.16666666666667 0.82247515707840 15.999 > 31 83 O 0.75886402113090 0.50000000000000 0.82247515707840 15.999 > 31 84 O 0.75886402113090 0.83333333333333 0.82247515707840 15.999 > 31 85 O 0.63955065427456 0.00000000000000 0.35134844505822 15.999 > 37 86 O 0.63955065427456 0.33333333333333 0.35134844505822 15.999 > 37 87 O 0.63955065427456 0.66666666666667 0.35134844505822 15.999 > 37 88 O 0.63955065427456 0.00000000000000 0.85134844505822 15.999 > 37 89 O 0.63955065427456 0.33333333333333 0.85134844505822 15.999 > 37 90 O 0.63955065427456 0.66666666666667 0.85134844505822 15.999 > 37 91 O 0.86044934572544 0.16666666666667 0.14865155494178 15.999 > 43 92 O 0.86044934572544 0.50000000000000 0.14865155494178 15.999 > 43 93 O 0.86044934572544 0.83333333333333 0.14865155494178 15.999 > 43 94 O 0.86044934572544 0.16666666666667 0.64865155494178 15.999 > 43 95 O 0.86044934572544 0.50000000000000 0.64865155494178 15.999 > 43 96 O 0.86044934572544 0.83333333333333 0.64865155494178 15.999 > 43 97 Ga 0.30270148289051 0.16666666666667 0.34174682577456 69.723 > 97 98 Ga 0.30270148289051 0.50000000000000 0.34174682577456 69.723 > 97 99 Ga 0.30270148289051 0.83333333333333 0.34174682577456 69.723 > 97 100 Ga 0.30270148289051 0.16666666666667 0.84174682577456 69.723 > 97 101 Ga 0.30270148289051 0.50000000000000 0.84174682577456 69.723 > 97 102 Ga 0.30270148289051 0.83333333333333 0.84174682577456 69.723 > 97 103 Ga 0.19729851710949 0.00000000000000 0.15825317422544 69.723 > 103 104 Ga 0.19729851710949 0.33333333333333 0.15825317422544 69.723 > 103 105 Ga 0.19729851710949 0.66666666666667 0.15825317422544 69.723 > 103 106 Ga 0.19729851710949 0.00000000000000 0.65825317422544 69.723 > 103 107 Ga 0.19729851710949 0.33333333333333 0.65825317422544 69.723 > 103 108 Ga 0.19729851710949 0.66666666666667 0.65825317422544 69.723 > 103 109 Ga 0.80270148289051 0.00000000000000 0.34174682577456 69.723 > 97 110 Ga 0.80270148289051 0.33333333333333 0.34174682577456 69.723 > 97 111 Ga 0.80270148289051 0.66666666666667 0.34174682577456 69.723 > 97 112 Ga 0.80270148289051 0.00000000000000 0.84174682577456 69.723 > 97 113 Ga 0.80270148289051 0.33333333333333 0.84174682577456 69.723 > 97 114 Ga 0.80270148289051 0.66666666666667 0.84174682577456 69.723 > 97 115 Ga 0.69729851710949 0.16666666666667 0.15825317422544 69.723 > 103 116 Ga 0.69729851710949 0.50000000000000 0.15825317422544 69.723 > 103 117 Ga 0.69729851710949 0.83333333333333 0.15825317422544 69.723 > 103 118 Ga 0.69729851710949 0.16666666666667 0.65825317422544 69.723 > 103 119 Ga 0.69729851710949 0.50000000000000 0.65825317422544 69.723 > 103 120 Ga 0.69729851710949 0.83333333333333 0.65825317422544 69.723 > 103 121 Nb 0.39613463338741 0.16666666666667 0.13433256377390 92.906 > 121 122 Nb 0.39613463338741 0.50000000000000 0.13433256377390 92.906 > 121 123 Nb 0.39613463338741 0.83333333333333 0.13433256377390 92.906 > 121 124 Nb 0.39613463338741 0.16666666666667 0.63433256377390 92.906 > 121 125 Nb 0.39613463338741 0.50000000000000 0.63433256377390 92.906 > 121 126 Nb 0.39613463338741 0.83333333333333 0.63433256377390 92.906 > 121 127 Nb 0.10386536661260 0.00000000000000 0.36566743622610 92.906 > 127 128 Nb 0.10386536661260 0.33333333333333 0.36566743622610 92.906 > 127 129 Nb 0.10386536661260 0.66666666666667 0.36566743622610 92.906 > 127 130 Nb 0.10386536661260 0.00000000000000 0.86566743622610 92.906 > 127 131 Nb 0.10386536661260 0.33333333333333 0.86566743622610 92.906 > 127 132 Nb 0.10386536661260 0.66666666666667 0.86566743622610 92.906 > 127 133 Nb 0.89613463338740 0.00000000000000 0.13433256377390 92.906 > 121 134 Nb 0.89613463338740 0.33333333333333 0.13433256377390 92.906 > 121 135 Nb 0.89613463338740 0.66666666666667 0.13433256377390 92.906 > 121 136 Nb 0.89613463338740 0.00000000000000 0.63433256377390 92.906 > 121 137 Nb 0.89613463338740 0.33333333333333 0.63433256377390 92.906 > 121 138 Nb 0.89613463338740 0.66666666666667 0.63433256377390 92.906 > 121 139 Nb 0.60386536661260 0.16666666666667 0.36566743622610 92.906 > 127 140 Nb 0.60386536661260 0.50000000000000 0.36566743622610 92.906 > 127 141 Nb 0.60386536661260 0.83333333333333 0.36566743622610 92.906 > 127 142 Nb 0.60386536661260 0.16666666666667 0.86566743622610 92.906 > 127 143 Nb 0.60386536661260 0.50000000000000 0.86566743622610 92.906 > 127 144 Nb 0.60386536661260 0.83333333333333 0.86566743622610 92.906 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.4076172 0.0000000 0.1702217 0.0000000 4.9754500 0.0000000 0.1702214 0.0000000 4.5627466 -------------------------- Born effective charges -------------------------- 1 O -0.9293628 0.0000000 -0.2064497 0.0000000 -1.1274078 0.0000000 0.0508186 0.0000000 -4.2291847 2 O -0.9293628 0.0000000 -0.2064497 0.0000000 -1.1274078 0.0000000 0.0508186 0.0000000 -4.2291847 3 O -3.7032581 0.0000000 -0.8571424 0.0000000 -1.0486062 0.0000000 -0.7246107 0.0000000 -2.2492617 4 O -3.7032581 0.0000000 -0.8571424 0.0000000 -1.0486062 0.0000000 -0.7246107 0.0000000 -2.2492617 5 O -2.5230544 0.0000000 0.4642728 0.0000000 -2.5411346 0.0000000 0.1878181 0.0000000 -1.9595126 6 O -2.5230544 0.0000000 0.4642728 0.0000000 -2.5411346 0.0000000 0.1878181 0.0000000 -1.9595126 7 O -1.6882034 0.0000000 0.0652572 0.0000000 -5.7086543 0.0000000 0.0107431 0.0000000 -0.9484232 8 O -1.6882034 0.0000000 0.0652572 0.0000000 -5.7086543 0.0000000 0.0107431 0.0000000 -0.9484232 9 Ga 4.0487122 0.0000000 -0.4146580 0.0000000 3.2161511 0.0000000 0.0733781 0.0000000 4.0660247 10 Ga 4.0487122 0.0000000 -0.4146580 0.0000000 3.2161511 0.0000000 0.0733781 0.0000000 4.0660247 11 Nb 4.7951666 0.0000000 0.9487200 0.0000000 7.2096519 0.0000000 0.4018527 0.0000000 5.3203575 12 Nb 4.7951666 0.0000000 0.9487200 0.0000000 7.2096519 0.0000000 0.4018527 0.0000000 5.3203575 ---------------------------------------------------------------------------- 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] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] 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] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Computing fc3[ 37, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] 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] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] 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] [-0.0031 0.0000 0.0095] [ 0.0031 0.0000 -0.0095] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000004 (xxx) 0.00000004 (xxx) 0.00000004 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (zx) 0.00000001 (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 22:29:22]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:29:22]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 3 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.285653781273222 -1.907795530000000 0.000000000000000 b 6.285653781273222 1.907795530000000 0.000000000000000 c -2.052245811218807 0.000000000000000 6.322130938022574 Atomic positions (fractional): 1 O 0.13716630057804 0.13716630057804 0.01763163379365 15.999 2 O 0.86283369942196 0.86283369942196 0.98236836620636 15.999 3 O 0.05481794034093 0.05481794034093 0.36685968422537 15.999 4 O 0.94518205965907 0.94518205965907 0.63314031577463 15.999 5 O 0.74113597886910 0.74113597886910 0.35504968584320 15.999 6 O 0.25886402113090 0.25886402113090 0.64495031415680 15.999 7 O 0.63955065427456 0.63955065427456 0.70269689011643 15.999 8 O 0.36044934572544 0.36044934572544 0.29730310988357 15.999 9 Ga 0.80270148289051 0.80270148289051 0.68349365154912 69.723 10 Ga 0.19729851710949 0.19729851710949 0.31650634845088 69.723 11 Nb 0.89613463338741 0.89613463338740 0.26866512754780 92.906 12 Nb 0.10386536661260 0.10386536661260 0.73133487245220 92.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.571307562546444 0.000000000000000 0.000000000000000 b 0.000000000000000 11.446773180000003 0.000000000000000 c -4.104491622437614 0.000000000000000 12.644261876045148 Atomic positions (fractional): 1 O 0.13716630057804 0.00000000000000 0.00881581689682 15.999 > 1 2 O 0.13716630057804 0.33333333333333 0.00881581689682 15.999 > 1 3 O 0.13716630057804 0.66666666666667 0.00881581689682 15.999 > 1 4 O 0.13716630057804 0.00000000000000 0.50881581689682 15.999 > 1 5 O 0.13716630057804 0.33333333333333 0.50881581689682 15.999 > 1 6 O 0.13716630057804 0.66666666666667 0.50881581689682 15.999 > 1 7 O 0.36283369942196 0.16666666666667 0.49118418310318 15.999 > 7 8 O 0.36283369942196 0.50000000000000 0.49118418310318 15.999 > 7 9 O 0.36283369942196 0.83333333333333 0.49118418310318 15.999 > 7 10 O 0.36283369942196 0.16666666666667 0.99118418310318 15.999 > 7 11 O 0.36283369942196 0.50000000000000 0.99118418310318 15.999 > 7 12 O 0.36283369942196 0.83333333333333 0.99118418310318 15.999 > 7 13 O 0.05481794034093 0.00000000000000 0.18342984211268 15.999 > 13 14 O 0.05481794034093 0.33333333333333 0.18342984211268 15.999 > 13 15 O 0.05481794034093 0.66666666666667 0.18342984211268 15.999 > 13 16 O 0.05481794034093 0.00000000000000 0.68342984211268 15.999 > 13 17 O 0.05481794034093 0.33333333333333 0.68342984211268 15.999 > 13 18 O 0.05481794034093 0.66666666666667 0.68342984211268 15.999 > 13 19 O 0.44518205965907 0.16666666666667 0.31657015788732 15.999 > 19 20 O 0.44518205965907 0.50000000000000 0.31657015788732 15.999 > 19 21 O 0.44518205965907 0.83333333333333 0.31657015788732 15.999 > 19 22 O 0.44518205965907 0.16666666666667 0.81657015788732 15.999 > 19 23 O 0.44518205965907 0.50000000000000 0.81657015788732 15.999 > 19 24 O 0.44518205965907 0.83333333333333 0.81657015788732 15.999 > 19 25 O 0.24113597886910 0.16666666666667 0.17752484292160 15.999 > 25 26 O 0.24113597886910 0.50000000000000 0.17752484292160 15.999 > 25 27 O 0.24113597886910 0.83333333333333 0.17752484292160 15.999 > 25 28 O 0.24113597886910 0.16666666666667 0.67752484292160 15.999 > 25 29 O 0.24113597886910 0.50000000000000 0.67752484292160 15.999 > 25 30 O 0.24113597886910 0.83333333333333 0.67752484292160 15.999 > 25 31 O 0.25886402113090 0.00000000000000 0.32247515707840 15.999 > 31 32 O 0.25886402113090 0.33333333333333 0.32247515707840 15.999 > 31 33 O 0.25886402113090 0.66666666666667 0.32247515707840 15.999 > 31 34 O 0.25886402113090 0.00000000000000 0.82247515707840 15.999 > 31 35 O 0.25886402113090 0.33333333333333 0.82247515707840 15.999 > 31 36 O 0.25886402113090 0.66666666666667 0.82247515707840 15.999 > 31 37 O 0.13955065427456 0.16666666666667 0.35134844505822 15.999 > 37 38 O 0.13955065427456 0.50000000000000 0.35134844505822 15.999 > 37 39 O 0.13955065427456 0.83333333333333 0.35134844505822 15.999 > 37 40 O 0.13955065427456 0.16666666666667 0.85134844505822 15.999 > 37 41 O 0.13955065427456 0.50000000000000 0.85134844505822 15.999 > 37 42 O 0.13955065427456 0.83333333333333 0.85134844505822 15.999 > 37 43 O 0.36044934572544 0.00000000000000 0.14865155494178 15.999 > 43 44 O 0.36044934572544 0.33333333333333 0.14865155494178 15.999 > 43 45 O 0.36044934572544 0.66666666666667 0.14865155494178 15.999 > 43 46 O 0.36044934572544 0.00000000000000 0.64865155494178 15.999 > 43 47 O 0.36044934572544 0.33333333333333 0.64865155494178 15.999 > 43 48 O 0.36044934572544 0.66666666666667 0.64865155494178 15.999 > 43 49 O 0.63716630057804 0.16666666666667 0.00881581689682 15.999 > 1 50 O 0.63716630057804 0.50000000000000 0.00881581689682 15.999 > 1 51 O 0.63716630057804 0.83333333333333 0.00881581689682 15.999 > 1 52 O 0.63716630057804 0.16666666666667 0.50881581689682 15.999 > 1 53 O 0.63716630057804 0.50000000000000 0.50881581689682 15.999 > 1 54 O 0.63716630057804 0.83333333333333 0.50881581689682 15.999 > 1 55 O 0.86283369942196 0.00000000000000 0.49118418310318 15.999 > 7 56 O 0.86283369942196 0.33333333333333 0.49118418310318 15.999 > 7 57 O 0.86283369942196 0.66666666666667 0.49118418310318 15.999 > 7 58 O 0.86283369942196 0.00000000000000 0.99118418310318 15.999 > 7 59 O 0.86283369942196 0.33333333333333 0.99118418310318 15.999 > 7 60 O 0.86283369942196 0.66666666666667 0.99118418310318 15.999 > 7 61 O 0.55481794034093 0.16666666666667 0.18342984211268 15.999 > 13 62 O 0.55481794034093 0.50000000000000 0.18342984211268 15.999 > 13 63 O 0.55481794034093 0.83333333333333 0.18342984211268 15.999 > 13 64 O 0.55481794034093 0.16666666666667 0.68342984211268 15.999 > 13 65 O 0.55481794034093 0.50000000000000 0.68342984211268 15.999 > 13 66 O 0.55481794034093 0.83333333333333 0.68342984211268 15.999 > 13 67 O 0.94518205965907 0.00000000000000 0.31657015788732 15.999 > 19 68 O 0.94518205965907 0.33333333333333 0.31657015788732 15.999 > 19 69 O 0.94518205965907 0.66666666666667 0.31657015788732 15.999 > 19 70 O 0.94518205965907 0.00000000000000 0.81657015788732 15.999 > 19 71 O 0.94518205965907 0.33333333333333 0.81657015788732 15.999 > 19 72 O 0.94518205965907 0.66666666666667 0.81657015788732 15.999 > 19 73 O 0.74113597886910 0.00000000000000 0.17752484292160 15.999 > 25 74 O 0.74113597886910 0.33333333333333 0.17752484292160 15.999 > 25 75 O 0.74113597886910 0.66666666666667 0.17752484292160 15.999 > 25 76 O 0.74113597886910 0.00000000000000 0.67752484292160 15.999 > 25 77 O 0.74113597886910 0.33333333333333 0.67752484292160 15.999 > 25 78 O 0.74113597886910 0.66666666666667 0.67752484292160 15.999 > 25 79 O 0.75886402113090 0.16666666666667 0.32247515707840 15.999 > 31 80 O 0.75886402113090 0.50000000000000 0.32247515707840 15.999 > 31 81 O 0.75886402113090 0.83333333333333 0.32247515707840 15.999 > 31 82 O 0.75886402113090 0.16666666666667 0.82247515707840 15.999 > 31 83 O 0.75886402113090 0.50000000000000 0.82247515707840 15.999 > 31 84 O 0.75886402113090 0.83333333333333 0.82247515707840 15.999 > 31 85 O 0.63955065427456 0.00000000000000 0.35134844505822 15.999 > 37 86 O 0.63955065427456 0.33333333333333 0.35134844505822 15.999 > 37 87 O 0.63955065427456 0.66666666666667 0.35134844505822 15.999 > 37 88 O 0.63955065427456 0.00000000000000 0.85134844505822 15.999 > 37 89 O 0.63955065427456 0.33333333333333 0.85134844505822 15.999 > 37 90 O 0.63955065427456 0.66666666666667 0.85134844505822 15.999 > 37 91 O 0.86044934572544 0.16666666666667 0.14865155494178 15.999 > 43 92 O 0.86044934572544 0.50000000000000 0.14865155494178 15.999 > 43 93 O 0.86044934572544 0.83333333333333 0.14865155494178 15.999 > 43 94 O 0.86044934572544 0.16666666666667 0.64865155494178 15.999 > 43 95 O 0.86044934572544 0.50000000000000 0.64865155494178 15.999 > 43 96 O 0.86044934572544 0.83333333333333 0.64865155494178 15.999 > 43 97 Ga 0.30270148289051 0.16666666666667 0.34174682577456 69.723 > 97 98 Ga 0.30270148289051 0.50000000000000 0.34174682577456 69.723 > 97 99 Ga 0.30270148289051 0.83333333333333 0.34174682577456 69.723 > 97 100 Ga 0.30270148289051 0.16666666666667 0.84174682577456 69.723 > 97 101 Ga 0.30270148289051 0.50000000000000 0.84174682577456 69.723 > 97 102 Ga 0.30270148289051 0.83333333333333 0.84174682577456 69.723 > 97 103 Ga 0.19729851710949 0.00000000000000 0.15825317422544 69.723 > 103 104 Ga 0.19729851710949 0.33333333333333 0.15825317422544 69.723 > 103 105 Ga 0.19729851710949 0.66666666666667 0.15825317422544 69.723 > 103 106 Ga 0.19729851710949 0.00000000000000 0.65825317422544 69.723 > 103 107 Ga 0.19729851710949 0.33333333333333 0.65825317422544 69.723 > 103 108 Ga 0.19729851710949 0.66666666666667 0.65825317422544 69.723 > 103 109 Ga 0.80270148289051 0.00000000000000 0.34174682577456 69.723 > 97 110 Ga 0.80270148289051 0.33333333333333 0.34174682577456 69.723 > 97 111 Ga 0.80270148289051 0.66666666666667 0.34174682577456 69.723 > 97 112 Ga 0.80270148289051 0.00000000000000 0.84174682577456 69.723 > 97 113 Ga 0.80270148289051 0.33333333333333 0.84174682577456 69.723 > 97 114 Ga 0.80270148289051 0.66666666666667 0.84174682577456 69.723 > 97 115 Ga 0.69729851710949 0.16666666666667 0.15825317422544 69.723 > 103 116 Ga 0.69729851710949 0.50000000000000 0.15825317422544 69.723 > 103 117 Ga 0.69729851710949 0.83333333333333 0.15825317422544 69.723 > 103 118 Ga 0.69729851710949 0.16666666666667 0.65825317422544 69.723 > 103 119 Ga 0.69729851710949 0.50000000000000 0.65825317422544 69.723 > 103 120 Ga 0.69729851710949 0.83333333333333 0.65825317422544 69.723 > 103 121 Nb 0.39613463338741 0.16666666666667 0.13433256377390 92.906 > 121 122 Nb 0.39613463338741 0.50000000000000 0.13433256377390 92.906 > 121 123 Nb 0.39613463338741 0.83333333333333 0.13433256377390 92.906 > 121 124 Nb 0.39613463338741 0.16666666666667 0.63433256377390 92.906 > 121 125 Nb 0.39613463338741 0.50000000000000 0.63433256377390 92.906 > 121 126 Nb 0.39613463338741 0.83333333333333 0.63433256377390 92.906 > 121 127 Nb 0.10386536661260 0.00000000000000 0.36566743622610 92.906 > 127 128 Nb 0.10386536661260 0.33333333333333 0.36566743622610 92.906 > 127 129 Nb 0.10386536661260 0.66666666666667 0.36566743622610 92.906 > 127 130 Nb 0.10386536661260 0.00000000000000 0.86566743622610 92.906 > 127 131 Nb 0.10386536661260 0.33333333333333 0.86566743622610 92.906 > 127 132 Nb 0.10386536661260 0.66666666666667 0.86566743622610 92.906 > 127 133 Nb 0.89613463338740 0.00000000000000 0.13433256377390 92.906 > 121 134 Nb 0.89613463338740 0.33333333333333 0.13433256377390 92.906 > 121 135 Nb 0.89613463338740 0.66666666666667 0.13433256377390 92.906 > 121 136 Nb 0.89613463338740 0.00000000000000 0.63433256377390 92.906 > 121 137 Nb 0.89613463338740 0.33333333333333 0.63433256377390 92.906 > 121 138 Nb 0.89613463338740 0.66666666666667 0.63433256377390 92.906 > 121 139 Nb 0.60386536661260 0.16666666666667 0.36566743622610 92.906 > 127 140 Nb 0.60386536661260 0.50000000000000 0.36566743622610 92.906 > 127 141 Nb 0.60386536661260 0.83333333333333 0.36566743622610 92.906 > 127 142 Nb 0.60386536661260 0.16666666666667 0.86566743622610 92.906 > 127 143 Nb 0.60386536661260 0.50000000000000 0.86566743622610 92.906 > 127 144 Nb 0.60386536661260 0.83333333333333 0.86566743622610 92.906 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.4076172 0.0000000 0.1702217 0.0000000 4.9754500 0.0000000 0.1702214 0.0000000 4.5627466 -------------------------- Born effective charges -------------------------- 1 O -0.9293628 0.0000000 -0.2064497 0.0000000 -1.1274078 0.0000000 0.0508186 0.0000000 -4.2291847 2 O -0.9293628 0.0000000 -0.2064497 0.0000000 -1.1274078 0.0000000 0.0508186 0.0000000 -4.2291847 3 O -3.7032581 0.0000000 -0.8571424 0.0000000 -1.0486062 0.0000000 -0.7246107 0.0000000 -2.2492617 4 O -3.7032581 0.0000000 -0.8571424 0.0000000 -1.0486062 0.0000000 -0.7246107 0.0000000 -2.2492617 5 O -2.5230544 0.0000000 0.4642728 0.0000000 -2.5411346 0.0000000 0.1878181 0.0000000 -1.9595126 6 O -2.5230544 0.0000000 0.4642728 0.0000000 -2.5411346 0.0000000 0.1878181 0.0000000 -1.9595126 7 O -1.6882034 0.0000000 0.0652572 0.0000000 -5.7086543 0.0000000 0.0107431 0.0000000 -0.9484232 8 O -1.6882034 0.0000000 0.0652572 0.0000000 -5.7086543 0.0000000 0.0107431 0.0000000 -0.9484232 9 Ga 4.0487122 0.0000000 -0.4146580 0.0000000 3.2161511 0.0000000 0.0733781 0.0000000 4.0660247 10 Ga 4.0487122 0.0000000 -0.4146580 0.0000000 3.2161511 0.0000000 0.0733781 0.0000000 4.0660247 11 Nb 4.7951666 0.0000000 0.9487200 0.0000000 7.2096519 0.0000000 0.4018527 0.0000000 5.3203575 12 Nb 4.7951666 0.0000000 0.9487200 0.0000000 7.2096519 0.0000000 0.4018527 0.0000000 5.3203575 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000004 (xxx) 0.00000004 (xxx) 0.00000004 (xxx) 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 ... [ 14 14 8 ] 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: 0.78, Number of G-points: 291, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/429) ======================= 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 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 3.184 ( 0.000 0.000 0.000) 0.000 4.118 ( 0.000 0.000 0.000) 0.000 4.408 ( 0.000 0.000 0.000) 0.000 4.617 ( 0.000 0.000 0.000) 0.000 5.226 ( 0.000 0.000 0.000) 0.000 5.348 ( 0.000 0.000 0.000) 0.000 6.480 ( 0.000 0.000 0.000) 0.000 6.736 ( 0.000 0.000 0.000) 0.000 6.942 ( 0.000 0.000 0.000) 0.000 7.327 ( 0.000 0.000 0.000) 0.000 7.638 ( 0.000 0.000 0.000) 0.000 7.725 ( 0.000 0.000 0.000) 0.000 7.989 ( 0.000 0.000 0.000) 0.000 8.244 ( 0.000 0.000 0.000) 0.000 8.705 ( 0.000 0.000 0.000) 0.000 8.850 ( 0.000 0.000 0.000) 0.000 9.893 ( 0.000 0.000 0.000) 0.000 10.062 ( 0.000 0.000 0.000) 0.000 11.028 ( 0.000 0.000 0.000) 0.000 11.912 ( 0.000 0.000 0.000) 0.000 12.576 ( 0.000 0.000 0.000) 0.000 12.896 ( 0.000 0.000 0.000) 0.000 13.371 ( 0.000 0.000 0.000) 0.000 13.969 ( 0.000 0.000 0.000) 0.000 14.162 ( 0.000 0.000 0.000) 0.000 14.215 ( 0.000 0.000 0.000) 0.000 15.812 ( 0.000 0.000 0.000) 0.000 19.107 ( 0.000 0.000 0.000) 0.000 20.232 ( 0.000 0.000 0.000) 0.000 22.709 ( 0.000 0.000 0.000) 0.000 23.135 ( 0.000 0.000 0.000) 0.000 26.859 ( 0.000 0.000 0.000) 0.000 27.098 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/429) ======================= q-point: ( 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.542 ( 14.406 -30.240 2.668) 33.603 0.623 ( 10.869 -29.282 9.078) 32.527 1.437 ( 14.805 -69.583 3.251) 71.215 3.562 ( -1.311 -35.532 -0.352) 35.558 4.130 ( 7.631 -0.702 -1.661) 7.841 4.332 ( -1.232 3.582 1.203) 3.975 4.782 ( 0.395 -6.466 0.122) 6.479 5.380 ( -0.111 -17.846 -0.275) 17.849 5.435 ( 0.633 -8.320 0.111) 8.344 6.466 ( 1.799 1.867 -2.107) 3.340 6.779 ( 2.740 -2.909 2.238) 4.580 6.982 ( 2.690 -0.531 4.379) 5.167 7.255 ( -0.369 11.160 -1.929) 11.332 7.530 ( 0.107 9.157 -0.040) 9.158 8.083 ( 0.018 -6.814 1.511) 6.980 8.383 ( -1.317 -12.271 -0.040) 12.341 8.705 ( -16.611 -9.567 9.066) 21.205 8.841 ( -0.589 0.232 -0.280) 0.693 9.371 ( 11.589 -4.376 -27.500) 30.161 9.871 ( -5.945 -0.620 -10.772) 12.319 10.067 ( 3.045 2.813 10.141) 10.956 10.937 ( -5.967 10.599 18.529) 22.164 11.921 ( 0.777 -0.600 -0.359) 1.045 12.509 ( 2.478 9.001 -0.732) 9.365 12.814 ( 5.833 12.489 6.891) 15.410 13.353 ( 9.081 5.997 -4.738) 11.870 13.833 ( -1.510 12.869 -0.619) 12.972 13.965 ( 6.489 20.047 3.703) 21.394 16.167 ( -6.550 -35.742 5.690) 36.780 17.535 ( -4.222 -17.837 -16.377) 24.580 20.204 ( -5.414 1.008 0.157) 5.510 22.656 ( -59.636 -24.167 -51.578) 82.467 22.733 ( -57.743 -24.792 -23.815) 67.202 25.161 ( 62.726 28.396 33.095) 76.395 26.865 ( -5.188 -3.674 -15.707) 16.944 27.142 ( -1.751 1.583 49.132) 49.188 ======================= Grid point 2 (3/429) ======================= q-point: ( 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( 9.093 -31.147 9.737) 33.876 1.272 ( 14.196 -33.269 2.394) 36.250 2.739 ( 13.724 -58.894 3.567) 60.577 4.085 ( -6.565 -13.725 -0.567) 15.225 4.289 ( -2.185 -0.536 0.868) 2.411 4.477 ( 16.411 -33.168 -1.005) 37.020 4.823 ( 3.009 1.836 0.470) 3.556 5.582 ( 0.760 -5.833 0.383) 5.894 5.864 ( -3.053 -29.412 -1.922) 29.632 6.467 ( 3.585 -1.914 0.624) 4.112 6.832 ( -0.920 1.023 -0.260) 1.400 6.942 ( -9.136 1.501 0.205) 9.261 7.229 ( 8.152 -11.038 -2.105) 13.882 7.359 ( -2.005 8.068 2.627) 8.718 8.147 ( 1.873 1.930 2.549) 3.705 8.593 ( -3.368 -10.800 0.286) 11.317 8.857 ( -0.611 -3.497 -0.363) 3.568 8.916 ( -5.467 -18.405 2.679) 19.386 9.521 ( 3.287 -10.992 -16.133) 19.796 9.812 ( -9.969 -0.783 -15.555) 18.492 10.044 ( 1.336 2.838 11.693) 12.106 10.714 ( -8.298 10.017 9.006) 15.821 11.934 ( 1.266 0.001 -2.731) 3.010 12.202 ( 0.153 25.445 2.427) 25.561 12.596 ( 6.806 17.633 8.211) 20.608 13.177 ( 1.549 13.015 -5.838) 14.348 13.591 ( 5.244 12.581 1.380) 13.700 13.638 ( 5.649 16.158 3.025) 17.382 16.929 ( -12.690 -45.749 10.230) 48.566 17.868 ( 1.346 -20.534 -18.440) 27.631 20.153 ( -5.820 0.504 0.575) 5.870 22.632 ( -5.525 -0.106 -9.268) 10.791 22.901 ( -47.790 -28.318 -24.199) 60.592 25.010 ( 34.125 21.786 19.647) 45.002 26.879 ( -6.328 -4.876 -19.336) 20.921 27.208 ( 2.945 -0.146 31.197) 31.336 ======================= Grid point 3 (4/429) ======================= q-point: ( 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( 10.537 -27.081 10.673) 30.957 1.975 ( 10.698 -32.128 1.933) 33.917 3.751 ( 12.656 -37.744 4.079) 40.018 4.250 ( -0.171 -6.773 1.234) 6.886 4.341 ( -3.632 -9.590 -0.309) 10.260 4.776 ( 2.217 2.966 0.282) 3.713 5.122 ( 12.022 -16.383 -2.172) 20.436 5.680 ( 3.389 -8.696 1.747) 9.495 6.184 ( -14.002 -8.009 -1.932) 16.246 6.459 ( -5.794 6.371 -2.288) 8.910 6.948 ( 0.317 -9.870 -7.451) 12.371 7.032 ( 8.648 -19.066 0.770) 20.950 7.219 ( -3.223 5.679 8.928) 11.061 7.625 ( -1.353 -26.201 -0.896) 26.252 8.089 ( 5.795 3.590 3.885) 7.846 8.782 ( -1.472 -11.623 -0.542) 11.728 8.943 ( 0.072 -6.005 -1.143) 6.114 9.311 ( -2.770 -23.142 -2.138) 23.405 9.649 ( -9.127 -4.726 -19.832) 22.338 9.839 ( -4.224 -11.759 -0.425) 12.502 10.052 ( 0.854 -3.099 6.998) 7.701 10.534 ( -7.905 5.341 4.047) 10.363 11.589 ( 0.155 36.553 6.771) 37.175 11.921 ( 1.391 5.110 -4.898) 7.213 12.231 ( 7.745 24.136 4.343) 25.717 13.002 ( -1.033 4.820 -0.977) 5.026 13.357 ( 3.552 11.914 2.438) 12.669 13.509 ( 6.996 6.161 0.877) 9.363 17.650 ( -20.168 -36.766 12.622) 43.793 18.217 ( 5.534 -17.815 -19.155) 26.738 20.141 ( -0.847 -1.389 0.711) 1.776 22.577 ( -2.337 2.170 -4.096) 5.191 23.126 ( -29.985 -22.493 -14.673) 40.253 24.826 ( 25.269 18.870 14.510) 34.715 26.907 ( -5.248 -5.169 -15.962) 17.580 27.286 ( 3.626 -0.832 20.670) 21.002 ======================= Grid point 4 (5/429) ======================= q-point: ( 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( 8.985 -22.788 10.166) 26.521 2.582 ( 7.934 -26.422 2.892) 27.738 4.151 ( 8.321 -2.182 6.363) 10.700 4.416 ( -0.237 -7.707 -0.979) 7.772 4.595 ( -0.869 -11.497 -1.523) 11.630 4.801 ( -1.997 -9.750 1.384) 10.048 5.153 ( 11.130 10.188 -2.439) 15.285 5.975 ( -11.693 -7.878 3.272) 14.474 6.111 ( 0.169 0.267 -4.386) 4.397 6.348 ( -7.019 -1.516 -1.635) 7.364 7.006 ( 0.233 -0.793 -6.158) 6.213 7.139 ( -2.968 1.428 5.838) 6.703 7.424 ( 9.788 -6.804 -3.022) 12.298 8.093 ( 0.504 -20.648 6.456) 21.639 8.304 ( 0.967 -25.582 1.702) 25.657 8.983 ( -1.390 -8.980 -4.918) 10.332 9.103 ( 1.496 -12.424 0.821) 12.541 9.450 ( -6.455 -0.482 -11.361) 13.075 9.914 ( -3.327 -23.933 -3.913) 24.478 10.002 ( -4.885 -10.418 6.849) 13.391 10.257 ( -0.597 -10.665 -4.959) 11.777 10.461 ( -4.635 -5.746 -1.341) 7.504 10.969 ( -0.053 28.002 14.000) 31.306 11.591 ( 0.273 25.629 -3.483) 25.866 12.021 ( 10.714 6.859 -0.773) 12.745 12.931 ( -1.363 3.540 2.049) 4.312 13.221 ( 1.499 4.473 1.080) 4.840 13.449 ( 5.355 4.235 1.329) 6.956 18.097 ( -21.509 -22.553 7.274) 32.003 18.500 ( 3.443 -11.769 -11.716) 16.959 20.201 ( 5.602 -3.280 0.162) 6.494 22.514 ( -1.454 2.660 -2.090) 3.682 23.326 ( -20.100 -15.920 -9.173) 27.232 24.660 ( 20.126 14.822 10.884) 27.262 26.954 ( -3.919 -5.250 -11.338) 13.095 27.352 ( 3.605 -0.576 13.143) 13.640 ======================= Grid point 5 (6/429) ======================= q-point: ( 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.820 ( 4.974 -16.099 9.101) 19.150 3.065 ( 4.845 -20.662 3.908) 21.579 4.211 ( 9.540 0.651 6.224) 11.410 4.425 ( -5.200 4.621 2.374) 7.351 4.644 ( 0.329 3.569 -5.576) 6.629 4.902 ( -0.309 -1.473 -1.288) 1.981 5.202 ( 3.337 -9.375 -1.980) 10.146 5.731 ( -14.037 13.752 -0.874) 19.670 6.139 ( -4.338 1.091 -2.937) 5.352 6.497 ( 6.870 -8.728 4.055) 11.825 6.999 ( 1.348 -0.979 -8.712) 8.869 7.153 ( -2.126 -3.354 5.619) 6.881 7.520 ( 6.981 -1.450 -1.353) 7.257 8.343 ( -4.822 -6.112 1.520) 7.933 8.781 ( -2.735 -18.417 1.863) 18.712 9.079 ( -4.132 -5.403 -2.008) 7.093 9.407 ( 2.455 -15.891 2.210) 16.231 9.529 ( 1.402 -14.687 -9.033) 17.300 10.076 ( -0.169 -3.881 3.995) 5.572 10.184 ( 1.394 8.243 -14.703) 16.913 10.323 ( -3.876 -4.535 9.437) 11.165 10.579 ( -8.614 -6.722 3.155) 11.373 10.918 ( 0.206 -17.470 5.138) 18.211 11.194 ( 2.695 10.094 -0.020) 10.448 11.950 ( 11.538 8.020 -3.392) 14.455 12.835 ( -2.518 5.683 2.985) 6.896 13.203 ( 0.918 -1.053 0.126) 1.403 13.418 ( 2.832 1.898 1.622) 3.776 18.325 ( -16.422 -13.663 0.340) 21.365 18.637 ( -0.293 -3.691 -2.916) 4.713 20.306 ( 7.888 -3.157 -0.372) 8.505 22.457 ( -0.905 2.314 -1.018) 2.685 23.450 ( -12.576 -8.728 -5.533) 16.277 24.546 ( 14.498 9.544 7.444) 18.886 27.012 ( -2.724 -4.644 -7.206) 8.996 27.394 ( 3.165 0.247 7.877) 8.493 ======================= Grid point 6 (7/429) ======================= q-point: ( 0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.075 ( 1.192 -7.764 6.101) 9.946 3.429 ( 1.660 -15.462 3.583) 15.959 4.207 ( 1.424 12.439 4.411) 13.274 4.290 ( 2.691 -0.322 2.311) 3.562 4.552 ( 1.228 3.356 -4.830) 6.009 4.965 ( -2.332 -4.626 -2.634) 5.812 5.327 ( -8.580 -5.804 -6.691) 12.332 5.418 ( 1.896 13.849 3.114) 14.320 6.101 ( -3.250 -0.042 -0.191) 3.256 6.637 ( 4.773 -2.331 2.178) 5.741 7.037 ( 1.386 -2.365 -3.705) 4.609 7.260 ( 0.408 -7.229 2.708) 7.730 7.553 ( 2.761 1.196 -1.171) 3.229 8.322 ( -6.333 2.176 -1.352) 6.832 8.958 ( 0.374 -3.959 2.360) 4.624 9.171 ( -5.905 -6.179 0.842) 8.588 9.679 ( 0.521 -12.305 1.263) 12.380 9.807 ( 3.083 -4.231 -11.329) 12.480 10.040 ( 4.391 -4.559 -7.881) 10.108 10.179 ( 8.719 -0.349 -0.365) 8.734 10.249 ( -9.666 4.500 17.342) 20.358 10.578 ( -7.333 4.346 1.282) 8.620 11.157 ( 0.619 -14.262 -8.042) 16.385 11.391 ( 0.131 -13.120 8.584) 15.679 11.844 ( 8.852 7.677 -4.060) 12.400 12.730 ( -2.197 3.904 1.993) 4.903 13.240 ( 0.737 -1.720 0.010) 1.871 13.412 ( 0.848 0.250 1.093) 1.405 18.448 ( -9.921 -8.026 -2.677) 13.039 18.651 ( 0.135 1.200 1.481) 1.911 20.389 ( 5.171 -1.592 -0.357) 5.422 22.417 ( -0.445 1.338 -0.406) 1.467 23.499 ( -5.866 -3.237 -2.606) 7.189 24.491 ( 7.500 4.391 3.784) 9.479 27.064 ( -1.496 -2.957 -3.617) 4.906 27.409 ( 1.978 0.762 3.850) 4.395 ======================= Grid point 7 (8/429) ======================= 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 394 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.154 ( 0.000 -0.000 -0.000) 0.000 3.621 ( 0.000 -0.000 0.000) 0.000 4.037 ( 0.000 -0.000 0.000) 0.000 4.321 ( -0.000 -0.000 0.000) 0.000 4.521 ( 0.000 -0.000 -0.000) 0.000 5.004 ( 0.000 -0.000 0.000) 0.000 5.273 ( -0.000 -0.000 -0.000) 0.000 5.359 ( 0.000 0.000 0.000) 0.000 6.094 ( 0.000 -0.000 0.000) 0.000 6.672 ( 0.000 -0.000 0.000) 0.000 7.061 ( 0.000 -0.000 -0.000) 0.000 7.366 ( 0.000 -0.000 -0.000) 0.000 7.522 ( 0.000 -0.000 0.000) 0.000 8.272 ( 0.000 -0.000 0.000) 0.000 8.997 ( 0.000 -0.000 0.000) 0.000 9.211 ( 0.000 -0.000 0.000) 0.000 9.776 ( 0.000 -0.000 0.000) 0.000 9.834 ( 0.000 -0.000 0.000) 0.000 10.145 ( 0.000 0.000 -0.000) 0.000 10.155 ( -0.000 -0.000 0.000) 0.000 10.247 ( 0.000 -0.000 0.000) 0.000 10.499 ( -0.000 -0.000 -0.000) 0.000 11.316 ( -0.000 -0.000 0.000) 0.000 11.506 ( -0.000 -0.000 -0.000) 0.000 11.795 ( 0.000 -0.000 -0.000) 0.000 12.687 ( 0.000 -0.000 0.000) 0.000 13.261 ( 0.000 -0.000 0.000) 0.000 13.415 ( 0.000 -0.000 0.000) 0.000 18.498 ( -0.000 -0.000 -0.000) 0.000 18.633 ( 0.000 -0.000 0.000) 0.000 20.419 ( 0.000 -0.000 -0.000) 0.000 22.402 ( 0.000 -0.000 0.000) 0.000 23.508 ( 0.000 -0.000 0.000) 0.000 24.475 ( -0.000 -0.000 0.000) 0.000 27.085 ( 0.000 -0.000 0.000) 0.000 27.409 ( -0.000 -0.000 -0.000) 0.000 ======================= Grid point 16 (9/429) ======================= q-point: ( 0.07 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.366 ( 23.293 -0.000 29.735) 37.772 0.374 ( 30.242 -0.000 7.135) 31.072 0.802 ( 66.553 -0.000 12.065) 67.638 3.188 ( 0.936 -0.000 -0.729) 1.187 4.177 ( 9.480 -0.000 -1.766) 9.643 4.417 ( 1.961 -0.000 2.130) 2.896 4.608 ( -1.265 0.000 -0.648) 1.421 5.243 ( 3.090 -0.000 -0.242) 3.100 5.351 ( 0.289 -0.000 0.757) 0.810 6.515 ( 1.102 -0.000 -12.331) 12.380 6.734 ( -0.179 0.000 -0.267) 0.322 7.328 ( -0.011 0.000 0.613) 0.613 7.629 ( -1.967 0.000 1.865) 2.710 7.734 ( 2.126 -0.000 -2.377) 3.190 7.792 ( -20.291 0.000 33.765) 39.392 7.999 ( -4.337 0.000 13.344) 14.031 8.294 ( 2.866 -0.000 4.644) 5.457 8.838 ( -2.234 0.000 0.755) 2.359 9.370 ( 29.187 -0.000 -101.604) 105.713 9.796 ( -9.948 0.000 -15.443) 18.370 10.228 ( 2.843 -0.000 1.962) 3.454 11.210 ( -47.682 0.000 100.397) 111.145 11.956 ( 6.241 -0.000 3.060) 6.950 12.617 ( 6.860 -0.000 -1.144) 6.954 13.366 ( -2.239 0.000 5.142) 5.608 13.687 ( 2.243 -0.000 2.035) 3.029 14.194 ( 4.558 -0.000 3.738) 5.895 14.212 ( -0.496 0.000 0.029) 0.497 15.812 ( -0.067 0.000 0.029) 0.073 16.361 ( 36.442 -0.000 -111.767) 117.558 19.107 ( 0.000 -0.000 -0.002) 0.002 20.232 ( -0.004 0.000 -0.015) 0.016 22.700 ( -1.642 0.000 0.038) 1.643 26.142 ( 27.632 -0.000 -88.591) 92.801 26.837 ( -7.180 0.000 10.861) 13.020 27.360 ( -61.593 0.000 205.666) 214.691 ======================= Grid point 17 (10/429) ======================= q-point: ( 0.14 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.786 ( 21.061 -22.830 16.031) 34.954 0.884 ( 24.920 -22.962 8.453) 34.925 1.773 ( 38.267 -53.280 9.049) 66.219 3.541 ( -1.164 -31.475 -1.175) 31.518 4.255 ( 9.641 -4.991 -1.623) 10.977 4.326 ( 3.939 4.901 0.786) 6.337 4.799 ( 2.956 -8.786 0.243) 9.273 5.386 ( 1.958 -15.026 -0.259) 15.155 5.445 ( 0.993 -9.118 -0.214) 9.174 6.470 ( 0.717 1.019 -5.050) 5.202 6.803 ( -0.672 -6.065 0.478) 6.121 7.059 ( 3.013 18.360 9.586) 20.930 7.243 ( 0.974 7.288 -3.262) 8.043 7.533 ( 0.385 9.380 0.081) 9.389 8.088 ( -1.402 -9.717 3.412) 10.394 8.335 ( -8.484 -13.779 1.366) 16.239 8.545 ( -12.848 -17.896 11.551) 24.875 8.823 ( -2.357 -0.282 0.127) 2.377 9.374 ( 11.149 -3.751 -43.603) 45.162 9.704 ( -12.764 -0.428 -17.415) 21.596 10.150 ( 1.945 5.652 12.891) 14.210 10.896 ( -18.029 13.587 28.899) 36.671 11.955 ( 5.879 1.924 0.637) 6.218 12.541 ( 3.692 12.161 -3.008) 13.060 12.951 ( 8.914 17.319 14.260) 24.140 13.477 ( 13.676 13.966 -9.284) 21.640 13.851 ( 6.425 12.959 0.538) 14.475 14.096 ( 11.949 21.644 7.622) 25.872 16.059 ( -18.607 -35.815 13.587) 42.586 17.356 ( -5.716 -31.901 -40.983) 52.249 20.054 ( -22.093 -8.713 -1.814) 23.818 21.251 ( -67.649 -100.552 -51.356) 131.623 22.681 ( -2.540 0.719 0.798) 2.758 25.763 ( 30.738 30.978 -1.037) 43.653 26.754 ( -7.722 0.213 -1.348) 7.841 27.311 ( -6.541 3.427 61.540) 61.982 ======================= Grid point 18 (11/429) ======================= q-point: ( 0.21 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( 16.951 -28.807 14.527) 36.445 1.498 ( 21.810 -26.832 5.286) 34.980 2.978 ( 24.089 -52.094 7.160) 57.839 4.031 ( -1.747 -17.972 -2.186) 18.189 4.258 ( -4.937 0.232 3.095) 5.831 4.662 ( 15.126 -26.960 -1.724) 30.961 4.883 ( 8.081 0.605 -0.422) 8.115 5.601 ( 2.051 -6.620 1.036) 7.007 5.821 ( -1.502 -24.110 -3.741) 24.445 6.517 ( 3.713 -4.454 1.387) 5.962 6.726 ( -12.226 9.419 -4.570) 16.096 6.926 ( 0.425 -6.022 3.071) 6.774 7.245 ( -1.150 -4.065 -5.323) 6.796 7.389 ( 3.548 3.496 6.272) 8.009 8.190 ( 2.649 0.416 5.367) 5.999 8.543 ( -5.616 -12.618 0.882) 13.840 8.839 ( -2.823 -8.676 -0.046) 9.124 8.864 ( -4.431 -16.194 2.071) 16.917 9.459 ( -0.068 -7.004 -29.390) 30.214 9.629 ( -12.314 -4.313 -10.384) 16.675 10.091 ( -0.595 3.541 10.597) 11.189 10.627 ( -13.234 9.251 10.803) 19.427 11.955 ( 4.937 2.046 -2.773) 6.021 12.198 ( -2.627 23.881 3.378) 24.261 12.753 ( 12.862 19.832 12.083) 26.547 13.162 ( 0.220 16.220 -7.760) 17.982 13.688 ( 10.538 11.643 1.152) 15.746 13.737 ( 8.842 20.083 5.135) 22.536 16.766 ( -23.933 -45.315 14.465) 53.249 17.803 ( 3.487 -24.844 -29.735) 38.905 20.065 ( -9.948 -4.512 1.453) 11.019 22.176 ( -39.444 -47.296 -31.645) 69.240 22.657 ( -5.003 -0.908 2.726) 5.769 25.414 ( 24.878 25.132 12.149) 37.391 26.748 ( -6.275 -4.662 -12.209) 14.498 27.347 ( 1.228 0.873 30.451) 30.488 ======================= Grid point 19 (12/429) ======================= q-point: ( 0.29 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.048 ( 16.082 -24.173 15.067) 32.710 2.137 ( 15.950 -27.992 2.933) 32.351 3.943 ( 16.637 -33.901 6.273) 38.281 4.253 ( -1.763 -4.785 2.509) 5.683 4.298 ( -1.521 -12.299 -2.462) 12.635 4.814 ( 4.037 4.752 1.008) 6.316 5.246 ( 10.595 -14.076 -3.652) 17.992 5.713 ( -2.079 -7.642 4.083) 8.911 6.070 ( -1.262 -5.183 -2.058) 5.717 6.338 ( -11.406 7.816 -6.886) 15.447 6.942 ( 0.030 -9.958 -1.485) 10.069 7.113 ( 4.665 -17.456 -9.137) 20.248 7.192 ( -4.423 -1.844 11.853) 12.784 7.623 ( 1.193 -20.948 1.094) 21.010 8.185 ( 6.879 1.440 7.529) 10.300 8.762 ( -1.306 -12.821 -1.505) 12.974 8.931 ( -1.130 -6.514 -2.425) 7.041 9.256 ( -4.633 -19.830 -6.625) 21.415 9.469 ( -9.083 -8.909 -16.377) 20.738 9.768 ( -7.842 -14.032 -0.955) 16.103 10.079 ( -0.521 -2.882 5.525) 6.253 10.449 ( -9.109 4.471 3.242) 10.652 11.592 ( -3.873 33.637 5.878) 34.366 11.947 ( 5.507 8.798 -1.453) 10.481 12.353 ( 10.343 24.948 3.218) 27.198 12.989 ( -0.598 4.015 -0.664) 4.113 13.425 ( 6.125 14.746 4.405) 16.565 13.598 ( 7.935 7.485 0.268) 10.912 17.423 ( -26.566 -36.338 10.454) 46.211 18.203 ( 4.829 -19.488 -20.225) 28.498 20.137 ( -0.212 -6.013 1.304) 6.157 22.505 ( -6.477 -5.684 -10.724) 13.757 22.788 ( -20.724 -23.287 -5.115) 31.590 25.134 ( 19.983 20.863 11.285) 31.015 26.798 ( -4.732 -6.182 -12.276) 14.537 27.395 ( 2.723 0.186 18.648) 18.846 ======================= Grid point 20 (13/429) ======================= q-point: ( 0.36 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( 13.000 -18.787 12.909) 26.241 2.705 ( 11.267 -23.297 4.608) 26.286 4.228 ( -0.610 -2.571 4.842) 5.515 4.434 ( 4.710 -5.033 -1.569) 7.070 4.608 ( 4.451 -11.126 -0.621) 11.999 4.777 ( -2.778 -4.276 0.455) 5.120 5.274 ( 10.780 9.556 -1.277) 14.463 5.753 ( -22.154 -0.711 2.736) 22.334 6.142 ( -3.050 2.002 -4.105) 5.493 6.324 ( 9.049 -13.009 -1.286) 15.899 6.994 ( -0.131 -0.244 -3.018) 3.030 7.099 ( -5.160 -0.332 -1.802) 5.475 7.497 ( 4.458 -7.373 -1.546) 8.753 8.138 ( 2.765 -21.993 7.721) 23.472 8.338 ( 3.055 -17.962 4.218) 18.702 8.933 ( -3.680 -7.118 -6.638) 10.405 9.124 ( 1.918 -14.847 -0.300) 14.973 9.334 ( -5.817 -4.706 -11.058) 13.352 9.864 ( -3.225 -24.435 -3.765) 24.933 9.958 ( -7.309 -14.333 6.666) 17.415 10.225 ( -1.839 -4.833 -4.215) 6.671 10.410 ( -3.393 -9.782 -1.060) 10.408 10.991 ( -4.612 25.831 11.683) 28.723 11.603 ( 3.577 25.987 -1.648) 26.284 12.150 ( 12.367 7.230 -1.670) 14.422 12.920 ( -2.014 3.853 2.635) 5.084 13.259 ( 3.964 6.692 2.152) 8.070 13.513 ( 4.904 5.552 1.102) 7.489 17.859 ( -23.321 -24.743 3.463) 34.177 18.486 ( 1.156 -11.538 -9.176) 14.787 20.274 ( 6.735 -5.588 0.299) 8.757 22.487 ( -1.671 1.563 -2.632) 3.487 23.095 ( -15.432 -19.606 -6.229) 25.717 24.902 ( 15.985 16.784 8.756) 24.777 26.874 ( -3.402 -6.414 -9.269) 11.774 27.436 ( 3.081 0.324 11.480) 11.891 ======================= Grid point 21 (14/429) ======================= q-point: ( 0.43 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( 8.408 -11.847 11.967) 18.822 3.147 ( 6.655 -17.487 5.397) 19.473 4.269 ( -4.081 -2.153 1.885) 4.984 4.427 ( 4.343 7.379 4.034) 9.465 4.643 ( 3.443 3.974 -5.572) 7.661 4.856 ( -6.168 -3.623 -4.138) 8.264 5.201 ( -3.439 0.105 -2.879) 4.486 5.624 ( -4.007 5.820 4.046) 8.143 6.074 ( -5.103 0.037 -0.911) 5.184 6.592 ( 7.532 -6.673 -0.489) 10.075 6.993 ( 1.387 -1.526 -2.898) 3.557 7.137 ( -1.405 -5.932 -2.116) 6.453 7.582 ( 4.423 -0.900 -0.777) 4.580 8.295 ( -4.665 -1.317 3.910) 6.227 8.761 ( -1.954 -15.848 -0.354) 15.972 9.035 ( -2.275 -7.298 -0.493) 7.661 9.415 ( -1.268 -14.453 -2.112) 14.661 9.531 ( 3.893 -18.542 -5.130) 19.628 10.074 ( -2.590 -6.108 1.673) 6.842 10.166 ( 2.272 2.307 -5.380) 6.279 10.313 ( -1.982 -7.685 3.466) 8.660 10.495 ( -8.311 -0.456 4.667) 9.543 10.907 ( -3.764 -14.879 0.788) 15.368 11.240 ( 4.350 7.641 1.996) 9.017 12.073 ( 12.234 9.239 -3.662) 15.762 12.815 ( -3.234 5.894 3.633) 7.641 13.223 ( 2.116 -0.014 0.645) 2.212 13.454 ( 2.533 3.169 1.387) 4.287 18.131 ( -16.894 -17.125 -1.108) 24.081 18.622 ( -0.761 -4.448 -1.927) 4.907 20.395 ( 7.784 -2.460 -0.315) 8.169 22.443 ( -0.922 1.800 -0.920) 2.222 23.310 ( -9.063 -11.914 -3.972) 15.487 24.719 ( 11.426 12.587 6.034) 18.039 26.959 ( -2.338 -5.734 -5.955) 8.591 27.455 ( 2.812 1.270 6.707) 7.383 ======================= Grid point 22 (15/429) ======================= q-point: ( 0.50 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.143 ( 5.720 -4.042 9.721) 11.982 3.462 ( 1.715 -12.898 3.968) 13.603 4.182 ( -5.523 9.414 1.726) 11.050 4.338 ( 2.130 3.101 1.234) 3.959 4.561 ( 3.543 3.801 -5.225) 7.369 4.898 ( -7.362 -6.486 -5.895) 11.447 5.158 ( -10.558 -0.882 -7.141) 12.777 5.537 ( 10.009 6.037 8.981) 14.740 6.080 ( -0.846 -1.537 1.381) 2.233 6.659 ( -0.823 -0.527 -2.932) 3.090 7.043 ( 0.510 -2.131 0.409) 2.229 7.279 ( 3.323 -7.668 -2.219) 8.646 7.582 ( 2.240 2.985 0.085) 3.733 8.264 ( -3.462 0.512 1.259) 3.719 8.913 ( -6.791 -5.653 -3.758) 9.602 9.171 ( 2.973 -6.083 4.685) 8.233 9.676 ( -0.777 -13.308 -2.541) 13.570 9.796 ( 1.053 -4.454 -6.853) 8.241 10.050 ( 2.231 -0.796 -4.273) 4.886 10.210 ( -6.476 3.468 12.610) 14.594 10.290 ( 9.065 -0.364 0.037) 9.072 10.507 ( -6.364 0.034 4.047) 7.542 11.119 ( -1.604 -14.204 -9.178) 16.987 11.424 ( 0.380 -11.991 7.199) 13.991 11.922 ( 7.285 11.175 -3.531) 13.799 12.713 ( -1.939 3.179 2.085) 4.268 13.251 ( 0.915 -1.171 0.412) 1.542 13.426 ( 0.999 1.191 0.696) 1.704 18.326 ( -9.702 -12.392 -2.338) 15.911 18.659 ( 0.387 -0.189 1.077) 1.160 20.444 ( 4.543 0.906 -0.352) 4.646 22.411 ( -0.355 0.984 -0.238) 1.073 23.435 ( -3.847 -6.401 -1.925) 7.712 24.579 ( 5.766 8.597 3.074) 10.798 27.035 ( -1.378 -4.204 -3.033) 5.364 27.444 ( 1.821 2.254 3.273) 4.371 ======================= Grid point 23 (16/429) ======================= q-point: (-0.43 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.190 ( 4.857 3.628 3.655) 7.079 3.615 ( -0.833 1.289 0.047) 1.535 4.030 ( -1.138 -0.505 -0.846) 1.505 4.275 ( -6.224 2.238 -2.206) 6.972 4.535 ( 2.213 0.351 -1.150) 2.519 5.001 ( -1.015 -5.801 -0.050) 5.889 5.123 ( -10.838 -5.875 -8.720) 15.101 5.531 ( 14.251 4.875 11.812) 19.141 6.108 ( 1.817 -0.993 0.597) 2.155 6.629 ( -5.516 0.866 -4.164) 6.965 7.063 ( -0.717 0.298 3.078) 3.175 7.364 ( 1.522 2.297 -5.446) 6.103 7.535 ( 0.697 0.810 3.064) 3.245 8.291 ( 3.073 -3.669 1.704) 5.080 8.927 ( -7.918 -2.103 -5.834) 10.057 9.292 ( 9.747 -0.892 4.694) 10.855 9.771 ( -2.469 -0.426 4.426) 5.086 9.830 ( 2.137 1.932 -8.322) 8.806 10.056 ( -9.986 -4.118 6.652) 12.686 10.185 ( -5.053 4.275 5.804) 8.803 10.261 ( 7.412 1.264 -9.800) 12.352 10.549 ( 6.793 -1.491 3.142) 7.632 11.285 ( -3.503 -3.716 -4.658) 6.912 11.522 ( 1.529 2.768 3.067) 4.405 11.782 ( -2.103 4.317 -0.333) 4.813 12.691 ( 0.533 -0.900 -0.075) 1.049 13.261 ( -0.060 0.571 0.380) 0.688 13.416 ( 0.307 0.607 -0.400) 0.789 18.481 ( -2.298 -7.963 -0.553) 8.306 18.651 ( 2.479 1.782 0.557) 3.104 20.417 ( -0.353 3.064 -0.053) 3.085 22.403 ( 0.112 -0.282 0.135) 0.332 23.515 ( 1.040 -3.489 0.216) 3.647 24.470 ( -0.757 4.929 -0.215) 4.991 27.084 ( -0.183 -1.692 -0.031) 1.702 27.410 ( 0.143 2.061 0.035) 2.066 ======================= Grid point 24 (17/429) ======================= q-point: (-0.36 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.067 ( 2.149 12.088 -2.540) 12.537 3.401 ( -1.136 17.063 -2.658) 17.306 4.103 ( -10.151 -3.166 -6.182) 12.300 4.296 ( 2.763 -10.361 -1.169) 10.787 4.561 ( -0.346 -2.311 3.696) 4.373 4.980 ( -0.473 5.040 0.706) 5.111 5.286 ( -4.876 -8.840 -4.135) 10.910 5.570 ( 13.886 -2.472 10.000) 17.290 6.148 ( 4.114 -1.409 1.120) 4.490 6.549 ( -7.418 2.966 -5.659) 9.790 7.042 ( -1.590 1.970 8.071) 8.459 7.242 ( 0.950 6.795 -8.139) 10.645 7.528 ( -3.021 1.864 2.155) 4.153 8.412 ( 7.917 -2.941 3.076) 8.988 8.907 ( -4.655 -1.230 -5.609) 7.392 9.277 ( 11.187 9.725 1.268) 14.877 9.658 ( -1.269 12.554 -4.127) 13.276 9.809 ( -4.537 4.739 12.980) 14.544 9.987 ( -7.891 1.835 2.124) 8.376 10.114 ( -4.464 -2.377 4.826) 6.990 10.304 ( 9.746 -1.230 -14.216) 17.280 10.658 ( 6.927 -6.055 -0.239) 9.203 11.160 ( -3.263 13.219 5.085) 14.534 11.366 ( 1.290 15.628 -7.470) 17.370 11.756 ( -8.797 -5.332 3.933) 11.014 12.747 ( 1.903 -4.286 -1.507) 4.926 13.235 ( -0.354 1.885 0.344) 1.949 13.399 ( -0.651 0.859 -1.223) 1.630 18.561 ( 7.533 2.877 3.256) 8.697 18.646 ( 0.748 -1.497 -2.353) 2.887 20.333 ( -4.714 4.075 0.289) 6.238 22.423 ( 0.438 -1.639 0.450) 1.755 23.585 ( 7.150 -1.093 3.006) 7.833 24.385 ( -8.255 0.915 -3.966) 9.204 27.094 ( 1.374 1.278 3.610) 4.068 27.372 ( -1.789 1.132 -3.793) 4.343 ======================= Grid point 25 (18/429) ======================= q-point: (-0.29 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( -2.276 20.209 -5.426) 21.048 3.009 ( -2.789 22.821 -2.433) 23.119 4.074 ( -9.209 -2.344 -5.284) 10.873 4.485 ( 6.336 -1.990 -2.488) 7.092 4.665 ( 0.107 -7.146 5.368) 8.938 4.878 ( -4.149 1.330 -0.565) 4.394 5.174 ( -1.899 14.749 1.007) 14.905 5.902 ( 13.212 -17.789 3.095) 22.374 6.176 ( -0.169 3.120 3.348) 4.580 6.425 ( -2.219 3.941 -6.240) 7.707 7.028 ( -0.878 0.169 13.492) 13.522 7.148 ( 3.388 2.416 -12.100) 12.796 7.436 ( -8.526 3.979 1.644) 9.551 8.380 ( 2.282 11.287 -1.042) 11.562 8.816 ( 4.226 17.380 -1.283) 17.932 9.136 ( 4.257 6.767 2.337) 8.329 9.359 ( -3.713 16.274 -2.789) 16.924 9.548 ( -0.743 9.659 6.795) 11.833 10.063 ( -0.165 1.399 -1.917) 2.379 10.230 ( -1.738 -12.269 18.790) 22.508 10.329 ( 4.799 2.455 -14.203) 15.192 10.661 ( 7.099 12.060 -1.395) 14.064 10.870 ( -3.400 20.701 -7.542) 22.293 11.178 ( -0.959 -12.875 1.431) 12.989 11.845 ( -8.477 -7.260 2.506) 11.439 12.850 ( 1.612 -5.305 -1.929) 5.871 13.202 ( 0.438 1.248 0.374) 1.374 13.380 ( -2.736 -0.342 -1.534) 3.155 18.490 ( 13.018 10.413 -2.466) 16.852 18.648 ( -0.812 3.561 4.141) 5.522 20.225 ( -6.162 3.657 0.311) 7.172 22.469 ( 0.685 -2.739 0.802) 2.935 23.635 ( 15.604 4.260 7.046) 17.643 24.338 ( -16.803 -5.205 -8.373) 19.482 27.072 ( 2.821 3.162 7.667) 8.760 27.328 ( -3.134 1.164 -8.127) 8.788 ======================= Grid point 26 (19/429) ======================= q-point: (-0.21 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.287 ( -4.543 25.734 -5.534) 26.712 2.505 ( -4.135 28.631 -1.473) 28.966 4.042 ( -6.262 2.880 -3.778) 7.860 4.429 ( 1.154 9.603 0.358) 9.679 4.621 ( 2.284 12.577 0.860) 12.812 4.813 ( 0.954 12.337 -1.036) 12.417 5.050 ( -7.851 -12.041 1.652) 14.469 5.947 ( -5.134 17.214 -0.658) 17.975 6.263 ( 14.082 -9.815 2.046) 17.287 6.420 ( 4.296 -1.357 0.177) 4.509 7.046 ( 2.158 2.997 9.487) 10.181 7.130 ( 1.804 -1.150 -10.984) 11.190 7.305 ( -12.250 6.302 2.714) 14.040 8.075 ( 0.550 16.344 -3.895) 16.811 8.298 ( 0.118 33.104 0.085) 33.104 9.004 ( 0.088 10.874 2.713) 11.208 9.087 ( -0.594 10.182 -0.927) 10.242 9.545 ( 3.798 -1.736 6.975) 8.129 9.966 ( 2.847 17.008 4.426) 17.804 10.021 ( 2.845 13.397 -6.137) 15.008 10.275 ( -0.626 17.242 4.826) 17.916 10.518 ( 4.240 2.081 0.667) 4.770 10.903 ( -2.687 -30.687 -10.625) 32.585 11.612 ( 1.209 -27.051 2.967) 27.241 11.922 ( -6.519 -5.477 -0.067) 8.515 12.937 ( 0.698 -3.566 -1.155) 3.813 13.217 ( 0.818 -2.874 -0.063) 2.989 13.386 ( -4.484 -3.062 -1.162) 5.553 18.284 ( 16.562 21.332 -10.252) 28.887 18.490 ( -6.424 12.072 12.646) 18.625 20.150 ( -3.215 1.153 -0.061) 3.416 22.533 ( 0.838 -3.303 1.128) 3.590 23.608 ( 21.968 11.842 10.789) 27.189 24.375 ( -21.740 -12.450 -11.558) 27.590 27.044 ( 4.011 3.665 12.411) 13.548 27.259 ( -3.813 1.938 -13.425) 14.090 ======================= Grid point 27 (20/429) ======================= q-point: (-0.14 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( -3.691 29.020 -3.900) 29.512 1.886 ( -3.807 34.633 -0.686) 34.848 3.640 ( -4.623 39.472 -1.409) 39.767 4.250 ( 0.301 6.610 -0.503) 6.636 4.373 ( 1.682 8.930 0.055) 9.087 4.760 ( -0.582 -1.940 0.071) 2.026 5.020 ( -5.590 19.291 0.539) 20.092 5.649 ( -1.275 6.665 -0.427) 6.799 6.346 ( 11.062 11.619 2.147) 16.185 6.474 ( -2.851 0.053 -1.534) 3.238 6.943 ( -3.616 8.528 -2.368) 9.561 7.000 ( 0.996 11.594 10.241) 15.501 7.191 ( -0.723 -5.401 -8.754) 10.312 7.647 ( 1.126 29.954 0.938) 29.990 8.033 ( -2.240 -5.935 -1.053) 6.431 8.797 ( 0.767 10.563 0.105) 10.592 8.942 ( -0.291 5.875 0.374) 5.894 9.338 ( 1.093 23.298 0.482) 23.329 9.783 ( 3.014 11.754 10.417) 15.993 9.877 ( 2.569 0.435 0.481) 2.650 10.014 ( -1.190 5.655 -5.173) 7.756 10.590 ( 3.390 -5.500 -2.004) 6.765 11.556 ( -1.305 -38.143 -3.018) 38.284 11.932 ( -0.101 -2.009 2.970) 3.587 12.159 ( -2.375 -25.282 -2.394) 25.506 13.015 ( 0.596 -5.611 0.455) 5.661 13.327 ( -0.908 -9.310 -0.620) 9.375 13.445 ( -3.188 -5.870 -0.602) 6.707 17.777 ( 7.915 38.275 -6.398) 39.605 18.220 ( -2.820 15.744 8.652) 18.184 20.147 ( 0.449 -1.390 -0.209) 1.476 22.602 ( 0.684 -3.224 1.074) 3.466 23.498 ( 20.709 14.392 11.281) 27.627 24.502 ( -18.314 -14.978 -10.540) 25.901 27.032 ( 5.129 3.551 18.993) 19.991 27.162 ( -4.497 2.412 -20.742) 21.360 ======================= Grid point 28 (21/429) ======================= q-point: (-0.07 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.160 ( -0.000 31.175 -0.000) 31.175 1.184 ( -0.000 37.713 -0.000) 37.713 2.653 ( -0.000 61.375 -0.000) 61.375 4.145 ( -0.000 4.317 -0.000) 4.317 4.308 ( -0.000 0.473 -0.000) 0.473 4.354 ( -0.000 43.174 -0.000) 43.174 4.805 ( 0.000 -1.947 0.000) 1.947 5.578 ( -0.000 5.428 -0.000) 5.428 5.887 ( -0.000 32.267 -0.000) 32.267 6.444 ( -0.000 0.064 -0.000) 0.064 6.822 ( -0.000 3.548 -0.000) 3.548 7.047 ( 0.000 -9.285 0.000) 9.285 7.140 ( -0.000 13.227 -0.000) 13.227 7.372 ( 0.000 -5.124 0.000) 5.124 8.132 ( 0.000 -2.265 0.000) 2.265 8.612 ( -0.000 10.489 -0.000) 10.489 8.860 ( -0.000 2.674 -0.000) 2.674 8.947 ( -0.000 16.748 -0.000) 16.748 9.526 ( -0.000 12.250 -0.000) 12.250 9.928 ( -0.000 2.363 -0.000) 2.363 9.989 ( 0.000 -4.634 0.000) 4.634 10.745 ( 0.000 -9.941 0.000) 9.941 11.933 ( -0.000 0.213 -0.000) 0.213 12.191 ( 0.000 -25.917 0.000) 25.917 12.545 ( 0.000 -16.453 0.000) 16.453 13.177 ( 0.000 -10.598 0.000) 10.598 13.560 ( 0.000 -15.524 0.000) 15.524 13.597 ( 0.000 -13.031 0.000) 13.031 16.981 ( -0.000 46.051 -0.000) 46.051 17.896 ( -0.000 18.640 -0.000) 18.640 20.186 ( 0.000 -2.057 0.000) 2.057 22.660 ( 0.000 -2.514 0.000) 2.514 23.350 ( -0.000 10.553 -0.000) 10.553 24.685 ( 0.000 -12.235 0.000) 12.235 27.000 ( -0.000 5.785 -0.000) 5.785 27.085 ( 0.000 -0.203 0.000) 0.203 ======================= Grid point 31 (22/429) ======================= q-point: ( 0.14 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.736 ( 28.790 -0.000 6.922) 29.611 0.755 ( 26.564 -0.000 28.240) 38.770 1.599 ( 65.220 -0.000 13.641) 66.632 3.197 ( 1.360 -0.000 -1.445) 1.984 4.243 ( -0.520 0.000 0.962) 1.094 4.532 ( 20.209 -0.000 -1.300) 20.250 4.585 ( -2.151 0.000 -1.081) 2.408 5.292 ( 5.823 -0.000 -0.810) 5.879 5.360 ( 0.442 -0.000 1.307) 1.380 6.465 ( -2.658 0.000 -10.067) 10.412 6.730 ( -0.323 0.000 -0.482) 0.580 7.332 ( -0.007 0.000 1.157) 1.157 7.610 ( -2.588 0.000 2.251) 3.430 7.667 ( -16.257 0.000 12.776) 20.676 7.752 ( 2.866 -0.000 -3.225) 4.314 7.968 ( -8.449 0.000 8.755) 12.166 8.358 ( 2.639 -0.000 11.178) 11.485 8.807 ( -3.752 0.000 1.225) 3.947 9.317 ( 13.222 -0.000 -56.218) 57.752 9.589 ( -14.900 0.000 -17.293) 22.827 10.250 ( -2.629 0.000 7.791) 8.222 10.989 ( -35.390 0.000 40.091) 53.476 12.062 ( 8.439 -0.000 6.760) 10.813 12.703 ( 9.206 -0.000 -3.716) 9.928 13.365 ( -1.520 0.000 6.304) 6.485 13.718 ( 2.887 -0.000 -2.029) 3.529 14.204 ( -0.895 0.000 0.053) 0.897 14.296 ( 10.353 -0.000 5.688) 11.813 15.811 ( -0.121 0.000 0.053) 0.132 16.363 ( 17.571 -0.000 -53.357) 56.176 19.107 ( 0.001 -0.000 -0.003) 0.003 20.232 ( -0.008 0.000 -0.028) 0.029 22.674 ( -2.894 0.000 0.081) 2.896 26.125 ( 11.528 -0.000 -40.597) 42.202 26.785 ( -9.324 0.000 12.924) 15.936 27.434 ( -21.760 0.000 89.282) 91.895 ======================= Grid point 32 (23/429) ======================= q-point: ( 0.21 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.126 ( 26.212 -17.420 20.948) 37.807 1.200 ( 25.194 -22.475 6.699) 34.420 2.318 ( 48.118 -34.766 13.074) 60.785 3.534 ( 1.018 -29.201 -1.885) 29.279 4.234 ( -7.845 -0.354 3.347) 8.537 4.478 ( 14.866 -1.432 -3.825) 15.417 4.873 ( 12.061 -9.456 -1.349) 15.385 5.430 ( 6.288 -13.512 -2.051) 15.044 5.454 ( 0.868 -8.438 0.804) 8.520 6.442 ( -2.111 -2.223 -6.390) 7.087 6.778 ( -3.196 -4.627 -0.036) 5.624 7.062 ( -5.500 25.267 1.862) 25.926 7.271 ( 3.001 4.664 3.005) 6.308 7.540 ( 0.379 9.576 0.958) 9.631 8.063 ( -5.538 -15.992 4.072) 17.407 8.221 ( -10.956 -17.328 2.409) 20.642 8.509 ( -2.862 -12.290 10.797) 16.607 8.791 ( -3.238 -0.846 0.421) 3.373 9.320 ( 7.776 -3.142 -41.059) 41.907 9.477 ( -15.928 -1.169 -14.706) 21.711 10.187 ( -2.988 4.777 9.632) 11.159 10.744 ( -23.321 9.787 19.585) 31.988 12.060 ( 9.959 4.728 4.885) 12.058 12.567 ( 3.327 17.347 -4.091) 18.131 13.092 ( 7.395 13.103 9.919) 18.021 13.549 ( 4.432 18.181 -5.001) 19.370 13.988 ( 16.475 13.789 -1.950) 21.572 14.277 ( 13.479 22.366 10.154) 28.018 15.857 ( -24.764 -31.728 13.520) 42.458 17.165 ( 1.190 -40.248 -44.367) 59.915 19.746 ( -25.313 -28.456 -1.557) 38.118 20.734 ( -13.756 -62.450 -17.964) 66.422 22.650 ( -3.316 0.675 0.487) 3.419 25.967 ( 13.362 16.725 -12.198) 24.639 26.678 ( -7.270 3.586 5.649) 9.880 27.440 ( -5.652 2.423 46.903) 47.305 ======================= Grid point 33 (24/429) ======================= q-point: ( 0.29 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.714 ( 22.877 -25.005 16.091) 37.517 1.785 ( 23.941 -23.121 6.858) 33.982 3.314 ( 27.971 -42.460 10.194) 51.858 4.030 ( 3.378 -19.251 -3.431) 19.844 4.195 ( -8.171 -0.727 3.354) 8.862 4.775 ( 5.115 -18.717 0.009) 19.403 5.010 ( 14.572 -2.317 -2.655) 14.992 5.622 ( 0.116 -7.285 -0.155) 7.287 5.841 ( 9.453 -20.738 -4.237) 23.181 6.524 ( -7.405 14.955 0.851) 16.710 6.595 ( -4.049 -10.731 -2.855) 11.820 6.900 ( -4.892 -6.634 -4.752) 9.514 7.226 ( -1.018 3.095 3.740) 4.960 7.450 ( 3.803 -1.045 3.327) 5.160 8.231 ( -0.570 -3.480 7.451) 8.244 8.484 ( -4.583 -15.570 0.877) 16.254 8.792 ( -5.013 -14.518 0.272) 15.361 8.834 ( -2.031 -9.854 0.229) 10.064 9.309 ( -6.252 -1.427 -28.988) 29.689 9.477 ( -8.167 -9.898 -8.050) 15.148 10.100 ( -4.089 3.618 7.727) 9.462 10.501 ( -14.361 6.731 7.937) 17.735 12.033 ( 10.004 7.935 -1.314) 12.837 12.176 ( -3.374 20.782 4.457) 21.520 12.946 ( 12.602 20.118 10.825) 26.091 13.126 ( -1.501 17.861 -7.331) 19.365 13.826 ( 13.033 12.882 -0.679) 18.338 13.871 ( 10.427 24.960 7.681) 28.120 16.503 ( -29.911 -45.357 11.377) 55.510 17.740 ( 5.097 -28.511 -30.216) 41.855 19.954 ( -10.148 -11.751 2.741) 15.766 21.729 ( -22.569 -52.552 -19.813) 60.528 22.617 ( -3.900 0.557 1.510) 4.220 25.667 ( 14.830 21.893 4.991) 26.909 26.648 ( -5.191 -3.760 -6.560) 9.171 27.459 ( 0.272 1.319 25.478) 25.513 ======================= Grid point 34 (25/429) ======================= q-point: ( 0.36 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( 19.994 -21.056 16.676) 33.484 2.352 ( 19.394 -23.589 3.948) 30.793 4.121 ( 3.409 -16.842 6.427) 18.346 4.213 ( -0.325 -18.299 0.730) 18.317 4.327 ( 7.912 -9.809 -2.800) 12.910 4.873 ( 5.236 5.439 1.448) 7.688 5.324 ( 4.953 -15.661 -1.770) 16.520 5.652 ( -8.462 4.713 4.921) 10.864 6.139 ( -1.062 -0.410 -7.260) 7.349 6.202 ( 6.510 -2.153 -3.255) 7.590 6.884 ( -10.424 -8.373 -2.940) 13.690 7.077 ( 0.871 -6.494 -11.815) 13.510 7.235 ( -0.010 -15.280 13.274) 20.241 7.665 ( 5.301 -19.709 2.242) 20.532 8.284 ( 4.012 -0.868 10.015) 10.824 8.739 ( -1.060 -11.736 -3.856) 12.399 8.901 ( -1.736 -8.161 -3.821) 9.177 9.155 ( -6.285 -12.343 -11.553) 18.037 9.344 ( -6.068 -19.441 -6.424) 21.355 9.660 ( -9.875 -13.929 -1.649) 17.154 10.075 ( -2.974 -3.869 2.932) 5.693 10.361 ( -7.809 2.727 2.564) 8.660 11.556 ( -4.851 32.756 3.670) 33.316 12.032 ( 8.899 11.627 2.145) 14.798 12.470 ( 8.339 25.114 0.903) 26.477 12.985 ( 0.112 4.101 0.214) 4.108 13.524 ( 7.560 17.311 5.824) 19.768 13.686 ( 7.563 9.400 -0.549) 12.077 17.140 ( -27.649 -37.395 5.650) 46.848 18.180 ( 3.169 -20.167 -16.614) 26.320 20.147 ( 1.000 -10.970 1.736) 11.152 22.351 ( -10.588 -24.831 -13.351) 30.115 22.628 ( -8.700 -9.020 2.171) 12.719 25.360 ( 13.804 20.575 7.547) 25.901 26.711 ( -3.768 -6.637 -8.723) 11.590 27.484 ( 1.914 0.749 15.302) 15.439 ======================= Grid point 35 (26/429) ======================= q-point: ( 0.43 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.775 ( 15.812 -14.795 11.921) 24.719 2.873 ( 14.207 -19.512 8.125) 25.467 4.175 ( -9.153 -3.876 -0.086) 9.940 4.494 ( 6.103 -3.380 -1.159) 7.072 4.645 ( -2.302 -14.358 -1.223) 14.593 4.774 ( 5.262 7.401 -1.368) 9.184 5.348 ( -2.691 14.900 2.397) 15.329 5.580 ( -5.205 -7.747 4.879) 10.531 6.043 ( -8.681 0.592 -3.496) 9.378 6.483 ( 15.710 -10.443 -1.906) 18.960 6.964 ( -3.013 -7.282 -5.796) 9.783 7.026 ( -4.090 2.160 -4.300) 6.315 7.519 ( -0.263 -8.292 0.871) 8.342 8.210 ( 4.550 -18.217 8.279) 20.521 8.400 ( 4.530 -14.001 4.976) 15.534 8.858 ( -4.391 -7.526 -7.271) 11.348 9.136 ( 0.226 -14.947 -1.030) 14.985 9.250 ( -2.558 -9.885 -7.904) 12.912 9.798 ( -6.862 -17.890 -3.499) 19.478 9.892 ( -6.667 -24.954 3.827) 26.112 10.192 ( -0.909 -2.806 -3.926) 4.910 10.378 ( -2.585 -12.182 1.681) 12.567 10.958 ( -6.557 25.309 7.246) 27.130 11.654 ( 5.379 27.367 0.298) 27.892 12.282 ( 11.933 6.593 -2.138) 13.799 12.904 ( -2.668 4.580 2.883) 6.033 13.321 ( 5.003 9.033 2.638) 10.657 13.567 ( 4.119 6.750 0.793) 7.947 17.607 ( -21.731 -27.368 0.624) 34.952 18.463 ( -0.053 -11.611 -6.469) 13.292 20.352 ( 6.562 -7.387 0.411) 9.889 22.459 ( -1.474 0.249 -2.537) 2.945 22.929 ( -10.691 -21.833 -3.657) 24.584 25.086 ( 11.529 17.719 6.369) 22.078 26.810 ( -2.658 -7.194 -6.920) 10.330 27.505 ( 2.406 0.881 9.094) 9.448 ======================= Grid point 36 (27/429) ======================= q-point: ( 0.50 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.094 ( 11.249 -8.711 12.418) 18.885 3.255 ( 8.158 -12.928 7.592) 17.068 4.182 ( -9.462 -2.074 -2.381) 9.975 4.492 ( 3.442 6.556 3.687) 8.271 4.667 ( 0.736 5.301 -6.191) 8.184 4.742 ( -6.784 -2.731 -7.242) 10.292 5.119 ( -7.758 4.334 -0.806) 8.923 5.662 ( 5.029 0.629 7.824) 9.322 6.030 ( -2.280 -2.865 0.942) 3.780 6.640 ( 2.189 -1.365 -4.818) 5.466 6.993 ( -2.019 -2.355 -0.216) 3.110 7.137 ( 6.032 -9.639 -5.668) 12.705 7.606 ( 0.009 -1.838 -0.719) 1.973 8.283 ( -0.803 2.369 7.665) 8.063 8.720 ( -3.757 -10.637 -4.708) 12.224 9.030 ( 0.910 -10.860 1.554) 11.009 9.381 ( -2.115 -14.814 -3.251) 15.313 9.566 ( 4.010 -18.212 -2.148) 18.772 10.031 ( -4.702 -12.013 -1.727) 13.016 10.181 ( 0.413 -1.752 2.561) 3.130 10.301 ( -0.849 -12.678 -1.782) 12.830 10.441 ( -4.029 8.195 6.244) 11.062 10.849 ( -5.575 -14.874 -1.924) 16.000 11.298 ( 4.128 7.277 2.141) 8.636 12.194 ( 10.948 10.857 -3.430) 15.796 12.789 ( -3.584 5.693 3.689) 7.673 13.252 ( 2.373 1.397 0.864) 2.886 13.485 ( 2.140 4.129 1.032) 4.764 17.945 ( -14.512 -20.466 -1.682) 25.145 18.607 ( -0.800 -5.330 -1.179) 5.517 20.476 ( 6.399 -1.664 -0.201) 6.615 22.430 ( -0.809 1.307 -0.636) 1.663 23.214 ( -5.783 -14.154 -2.618) 15.512 24.849 ( 8.109 14.652 4.389) 17.312 26.916 ( -1.789 -6.487 -4.382) 8.030 27.506 ( 2.201 1.979 5.066) 5.867 ======================= Grid point 37 (28/429) ======================= q-point: ( 0.57 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.272 ( 9.436 -1.274 11.905) 15.244 3.496 ( 1.621 -9.445 3.792) 10.306 4.105 ( -7.948 4.642 -2.095) 9.439 4.346 ( -0.473 8.914 0.469) 8.939 4.575 ( 1.187 3.032 -4.816) 5.813 4.765 ( -9.244 -8.111 -8.920) 15.193 5.062 ( -4.016 -0.406 -2.183) 4.589 5.691 ( 10.328 2.007 10.607) 14.940 6.082 ( -0.061 -2.424 0.524) 2.481 6.611 ( -4.160 1.490 -4.592) 6.372 7.043 ( -1.238 -2.694 1.112) 3.167 7.326 ( 7.112 -6.189 -4.338) 10.378 7.592 ( -1.072 2.666 0.210) 2.881 8.262 ( 1.403 -0.326 4.932) 5.138 8.805 ( -8.287 -4.561 -6.541) 11.500 9.236 ( 4.660 -9.149 4.129) 11.067 9.650 ( -1.155 -14.269 -3.420) 14.718 9.784 ( -0.255 -3.610 -2.523) 4.412 10.064 ( 1.087 3.589 1.126) 3.915 10.192 ( -2.627 1.671 6.088) 6.838 10.341 ( 0.102 5.699 -5.439) 7.878 10.500 ( 1.961 -10.966 9.654) 14.741 11.057 ( -3.097 -13.449 -8.970) 16.459 11.451 ( 0.288 -11.361 4.883) 12.369 11.980 ( 4.859 14.899 -2.554) 15.878 12.702 ( -1.295 2.196 1.707) 3.068 13.263 ( 0.748 -0.495 0.572) 1.064 13.440 ( 0.988 1.902 0.314) 2.166 18.218 ( -7.592 -16.002 -1.794) 17.803 18.667 ( 0.405 -1.588 0.746) 1.801 20.488 ( 3.269 3.025 -0.278) 4.462 22.407 ( -0.239 0.633 -0.076) 0.681 23.396 ( -2.033 -8.622 -1.227) 8.943 24.643 ( 3.781 11.718 2.126) 12.495 27.011 ( -1.059 -5.027 -2.146) 5.567 27.473 ( 1.386 3.306 2.342) 4.282 ======================= Grid point 38 (29/429) ======================= q-point: (-0.36 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.281 ( 7.459 7.419 5.625) 11.930 3.605 ( -0.937 2.123 0.115) 2.323 3.991 ( -4.687 -0.121 -3.667) 5.952 4.199 ( -4.609 2.626 -1.091) 5.416 4.553 ( 1.404 0.080 -1.076) 1.771 4.942 ( -6.776 -16.957 -5.623) 19.107 5.040 ( -1.048 1.497 -0.635) 1.935 5.728 ( 12.338 3.976 11.629) 17.415 6.125 ( 0.746 -2.597 -1.912) 3.310 6.541 ( -6.141 2.004 -3.907) 7.549 7.066 ( -1.230 -0.005 4.140) 4.318 7.363 ( 2.642 5.152 -7.815) 9.726 7.546 ( -1.120 0.799 3.285) 3.561 8.360 ( 7.127 -6.501 4.409) 10.606 8.803 ( -9.357 -2.714 -7.226) 12.130 9.428 ( 10.366 -4.245 4.077) 11.920 9.749 ( -4.327 0.753 4.782) 6.493 9.826 ( 3.286 1.806 -10.730) 11.367 9.988 ( -6.835 -1.291 9.770) 11.993 10.121 ( -6.884 6.621 -0.250) 9.555 10.309 ( 5.040 -3.455 -4.664) 7.687 10.651 ( 7.868 0.123 4.086) 8.867 11.214 ( -4.936 -5.344 -5.532) 9.139 11.557 ( 2.285 2.282 3.150) 4.511 11.748 ( -3.237 8.833 -0.680) 9.432 12.697 ( 0.644 -1.562 -0.088) 1.691 13.262 ( -0.084 0.976 0.459) 1.082 13.418 ( 0.388 1.126 -0.486) 1.286 18.452 ( -2.099 -11.987 -0.511) 12.180 18.682 ( 2.328 0.829 0.517) 2.524 20.412 ( -0.442 5.557 -0.067) 5.575 22.405 ( 0.138 -0.518 0.167) 0.561 23.530 ( 1.330 -6.526 0.280) 6.666 24.459 ( -0.976 9.120 -0.277) 9.176 27.081 ( -0.225 -3.001 -0.038) 3.010 27.412 ( 0.175 3.666 0.042) 3.670 ======================= Grid point 39 (30/429) ======================= q-point: (-0.29 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.092 ( 2.559 16.194 -0.378) 16.400 3.386 ( -0.214 17.941 -1.321) 17.990 3.975 ( -7.721 -1.741 -4.415) 9.063 4.322 ( 2.148 -14.694 -0.492) 14.858 4.566 ( -0.587 -0.864 2.091) 2.338 4.968 ( -1.326 5.365 -0.497) 5.549 5.238 ( -1.676 -12.165 -1.866) 12.421 5.739 ( 9.198 -0.614 7.479) 11.871 6.190 ( 2.566 -2.913 0.129) 3.884 6.449 ( -5.819 3.191 -4.636) 8.095 7.056 ( -1.435 0.975 7.916) 8.104 7.227 ( 1.915 6.587 -8.494) 10.918 7.499 ( -2.992 4.520 1.575) 5.645 8.517 ( 7.591 0.005 3.868) 8.520 8.826 ( -5.436 -7.760 -5.357) 10.884 9.412 ( 10.810 12.822 1.529) 16.840 9.621 ( -2.445 13.494 -5.007) 14.599 9.802 ( -4.689 9.691 11.958) 16.090 9.906 ( -5.147 -7.366 -2.303) 9.277 10.093 ( -2.249 -3.933 3.132) 5.508 10.355 ( 5.837 1.271 -7.137) 9.307 10.728 ( 5.029 -6.952 0.200) 8.582 11.127 ( -3.903 11.989 1.587) 12.708 11.367 ( 2.199 19.140 -4.054) 19.688 11.681 ( -6.158 -4.833 2.755) 8.299 12.760 ( 1.104 -4.442 -0.795) 4.645 13.234 ( -0.073 1.695 0.357) 1.734 13.390 ( -0.379 1.880 -0.844) 2.095 18.623 ( 0.763 -5.512 2.606) 6.145 18.664 ( 4.045 2.907 -2.130) 5.417 20.290 ( -2.886 6.005 0.162) 6.664 22.429 ( 0.278 -1.844 0.297) 1.888 23.673 ( 5.878 -6.525 2.434) 9.113 24.285 ( -6.411 7.040 -2.969) 9.973 27.119 ( 0.901 -0.570 2.501) 2.719 27.343 ( -1.142 3.124 -2.600) 4.222 ======================= Grid point 40 (31/429) ======================= q-point: (-0.21 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.724 ( -0.609 22.771 -1.763) 22.847 2.983 ( -0.863 24.039 -0.832) 24.069 3.985 ( -3.597 -3.094 -2.030) 5.161 4.539 ( 3.606 1.369 -1.545) 4.155 4.680 ( -0.501 -16.395 3.288) 16.729 4.828 ( -2.803 6.995 -1.051) 7.609 5.166 ( -0.257 16.135 0.334) 16.140 6.024 ( 5.529 -19.654 2.022) 20.517 6.171 ( -1.172 8.189 1.042) 8.337 6.396 ( -0.219 -1.933 -3.026) 3.597 7.058 ( -1.308 -0.712 7.277) 7.427 7.162 ( 5.086 0.273 -7.217) 8.833 7.350 ( -6.257 8.472 1.055) 10.585 8.391 ( 0.482 14.532 -0.510) 14.549 8.854 ( 2.195 15.679 -0.303) 15.835 9.185 ( 2.523 10.228 1.435) 10.632 9.312 ( -2.438 14.623 -1.606) 14.911 9.559 ( -0.309 6.297 2.383) 6.740 10.058 ( -0.046 0.022 -0.479) 0.482 10.273 ( -1.936 -18.074 14.063) 22.982 10.326 ( 3.287 3.477 -12.039) 12.955 10.731 ( 5.297 17.955 1.612) 18.789 10.799 ( -4.364 21.365 -5.568) 22.506 11.176 ( -0.260 -14.444 0.721) 14.464 11.783 ( -3.156 -6.950 0.945) 7.691 12.857 ( 0.559 -5.026 -0.662) 5.100 13.211 ( 0.600 0.698 0.329) 0.977 13.350 ( -1.353 1.116 -0.734) 1.902 18.594 ( 6.969 7.150 -3.911) 10.723 18.646 ( -2.440 4.949 4.485) 7.111 20.176 ( -2.387 3.918 0.123) 4.590 22.477 ( 0.257 -2.977 0.304) 3.003 23.848 ( 16.090 -3.466 7.501) 18.088 24.112 ( -16.488 2.427 -7.971) 18.474 27.126 ( 1.797 1.222 4.934) 5.391 27.270 ( -1.910 3.058 -5.098) 6.244 ======================= Grid point 41 (32/429) ======================= q-point: (-0.14 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( -0.000 26.825 -0.000) 26.825 2.479 ( -0.000 29.445 -0.000) 29.445 3.998 ( -0.000 3.159 -0.000) 3.159 4.437 ( -0.000 10.327 -0.000) 10.327 4.639 ( -0.000 13.527 -0.000) 13.527 4.817 ( -0.000 13.215 -0.000) 13.215 5.004 ( 0.000 -13.288 0.000) 13.288 5.915 ( -0.000 17.287 -0.000) 17.287 6.356 ( 0.000 -11.417 0.000) 11.417 6.444 ( 0.000 -1.995 0.000) 1.995 7.089 ( 0.000 -0.496 0.000) 0.496 7.130 ( -0.000 8.722 -0.000) 8.722 7.210 ( -0.000 1.934 -0.000) 1.934 8.072 ( -0.000 14.292 -0.000) 14.292 8.300 ( -0.000 36.071 -0.000) 36.071 9.009 ( -0.000 11.431 -0.000) 11.431 9.082 ( -0.000 9.442 -0.000) 9.442 9.580 ( 0.000 -2.023 0.000) 2.023 9.995 ( -0.000 5.770 -0.000) 5.770 10.024 ( -0.000 22.631 -0.000) 22.631 10.280 ( -0.000 20.329 -0.000) 20.329 10.547 ( -0.000 1.228 -0.000) 1.228 10.861 ( 0.000 -32.567 0.000) 32.567 11.627 ( 0.000 -28.442 0.000) 28.442 11.883 ( 0.000 -4.299 0.000) 4.299 12.938 ( 0.000 -3.625 0.000) 3.625 13.226 ( 0.000 -2.336 0.000) 2.336 13.354 ( 0.000 -2.534 0.000) 2.534 18.375 ( -0.000 22.798 -0.000) 22.798 18.461 ( -0.000 10.402 -0.000) 10.402 20.131 ( -0.000 0.258 -0.000) 0.258 22.540 ( 0.000 -3.505 0.000) 3.505 23.814 ( -0.000 12.583 -0.000) 12.583 24.169 ( 0.000 -13.929 0.000) 13.929 27.113 ( -0.000 1.508 -0.000) 1.508 27.189 ( -0.000 4.007 -0.000) 4.007 ======================= Grid point 46 (33/429) ======================= q-point: ( 0.21 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.075 ( 26.270 -0.000 6.509) 27.064 1.178 ( 30.143 -0.000 26.137) 39.897 2.381 ( 62.467 -0.000 15.843) 64.444 3.205 ( 0.966 -0.000 -2.088) 2.301 4.184 ( -9.830 0.000 2.435) 10.127 4.554 ( -2.429 0.000 -1.196) 2.708 4.832 ( 32.684 -0.000 -5.455) 33.136 5.366 ( 8.046 -0.000 -2.252) 8.355 5.370 ( 0.422 -0.000 1.542) 1.599 6.379 ( -6.188 0.000 -9.417) 11.268 6.724 ( -0.403 0.000 -0.601) 0.724 7.337 ( 0.017 -0.000 1.549) 1.549 7.523 ( -15.701 0.000 8.391) 17.803 7.589 ( -2.490 0.000 1.860) 3.108 7.773 ( 2.814 -0.000 -3.178) 4.245 7.870 ( -13.808 0.000 6.618) 15.312 8.424 ( 0.870 -0.000 12.668) 12.698 8.766 ( -4.420 0.000 1.947) 4.830 9.269 ( 10.811 -0.000 -42.356) 43.714 9.345 ( -16.804 0.000 -14.954) 22.494 10.224 ( -6.811 0.000 7.183) 9.898 10.727 ( -29.095 0.000 19.051) 34.778 12.180 ( 6.746 -0.000 8.855) 11.132 12.793 ( 9.265 -0.000 -4.357) 10.239 13.374 ( -0.515 0.000 3.398) 3.437 13.736 ( 1.452 -0.000 -0.703) 1.613 14.193 ( -1.120 0.000 0.065) 1.122 14.464 ( 15.043 -0.000 5.421) 15.990 15.810 ( -0.152 0.000 0.066) 0.166 16.366 ( 10.677 -0.000 -32.439) 34.151 19.107 ( 0.001 -0.000 -0.004) 0.004 20.232 ( -0.009 0.000 -0.035) 0.036 22.637 ( -3.503 0.000 0.123) 3.505 26.107 ( 6.014 -0.000 -22.944) 23.720 26.725 ( -8.587 0.000 10.207) 13.339 27.515 ( -9.638 0.000 50.626) 51.536 ======================= Grid point 47 (34/429) ======================= q-point: ( 0.29 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 23.163 -22.876 6.335) 33.166 1.526 ( 30.107 -13.460 20.845) 39.014 2.915 ( 45.111 -20.279 15.043) 51.697 3.559 ( 5.674 -29.573 -1.353) 30.143 4.129 ( -12.385 -0.562 2.067) 12.569 4.572 ( 4.261 -5.254 -2.032) 7.063 5.069 ( 22.100 -3.352 -4.340) 22.770 5.443 ( 0.135 -7.666 -4.314) 8.798 5.549 ( 13.910 -14.672 0.269) 20.220 6.370 ( -6.391 -5.766 -6.509) 10.791 6.740 ( -3.424 -1.015 0.703) 3.640 6.981 ( -7.801 25.728 -1.778) 26.944 7.305 ( 0.065 3.980 5.111) 6.478 7.544 ( -1.227 8.207 2.824) 8.766 7.997 ( -8.728 -19.219 5.038) 21.701 8.115 ( -8.542 -19.118 -0.296) 20.941 8.527 ( -1.396 -8.319 9.842) 12.962 8.757 ( -3.456 -1.633 1.450) 4.088 9.212 ( -11.396 0.221 -23.060) 25.723 9.300 ( 3.640 -3.712 -23.379) 23.950 10.155 ( -7.748 3.529 6.658) 10.808 10.541 ( -21.095 5.491 10.900) 24.371 12.191 ( 7.952 3.575 7.861) 11.739 12.599 ( 5.349 22.350 -3.549) 23.254 13.182 ( 4.246 9.061 2.188) 10.243 13.570 ( 1.709 18.403 0.352) 18.485 14.177 ( 18.174 12.954 -4.556) 22.779 14.464 ( 12.144 19.127 11.036) 25.202 15.619 ( -23.918 -20.254 9.694) 32.806 17.059 ( 5.579 -41.208 -35.136) 54.441 19.522 ( -14.789 -28.280 2.115) 31.984 20.613 ( -2.696 -42.972 -7.941) 43.783 22.612 ( -3.546 0.590 0.349) 3.612 26.030 ( 6.526 8.905 -11.052) 15.621 26.625 ( -6.009 4.672 5.865) 9.609 27.533 ( -3.702 1.602 32.532) 32.781 ======================= Grid point 48 (35/429) ======================= q-point: ( 0.36 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.054 ( 26.492 -21.178 12.866) 36.275 2.082 ( 23.127 -22.070 10.099) 33.525 3.640 ( 19.766 -31.640 10.101) 38.649 4.034 ( -7.752 -7.878 -2.682) 11.373 4.155 ( 7.863 -13.966 2.080) 16.162 4.797 ( -0.474 -14.547 0.385) 14.560 5.175 ( 15.658 -0.656 -1.480) 15.742 5.596 ( -3.054 -8.426 -3.246) 9.532 6.001 ( 19.459 -18.234 -5.048) 27.140 6.405 ( -9.053 22.087 -1.850) 23.941 6.551 ( -7.059 -16.865 -0.580) 18.292 6.816 ( -3.867 -6.672 -6.557) 10.123 7.234 ( -2.480 4.119 8.465) 9.735 7.504 ( 4.204 -3.319 1.856) 5.669 8.208 ( -8.169 -9.482 6.277) 14.001 8.457 ( -0.698 -18.557 0.400) 18.574 8.736 ( -4.336 -12.259 0.049) 13.004 8.816 ( -1.385 -8.162 -0.136) 8.280 9.117 ( -12.427 -2.544 -16.658) 20.938 9.392 ( 0.333 -8.507 -12.420) 15.058 10.052 ( -8.337 2.761 4.311) 9.783 10.374 ( -11.653 3.453 5.343) 13.276 12.125 ( 2.013 28.934 -1.407) 29.038 12.197 ( 7.980 2.738 6.423) 10.603 13.075 ( -2.620 13.856 -6.165) 15.390 13.106 ( 9.079 23.945 7.357) 26.645 13.969 ( 13.338 15.636 -3.611) 20.867 14.025 ( 10.146 29.234 10.736) 32.754 16.193 ( -29.186 -45.704 6.017) 54.561 17.698 ( 5.053 -30.073 -23.993) 38.802 19.865 ( -7.306 -18.129 3.588) 19.872 21.489 ( -10.848 -49.516 -11.425) 51.962 22.579 ( -3.598 0.750 0.870) 3.777 25.806 ( 8.310 17.594 1.234) 19.497 26.580 ( -3.751 -2.708 -3.118) 5.579 27.542 ( -0.151 1.381 19.088) 19.138 ======================= Grid point 49 (36/429) ======================= q-point: ( 0.43 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( 20.643 -18.250 4.824) 27.973 2.621 ( 22.219 -19.891 15.952) 33.820 4.026 ( -14.347 -4.594 -1.442) 15.133 4.253 ( 0.036 -23.170 1.951) 23.252 4.461 ( 15.062 -7.669 -1.593) 16.977 4.921 ( 1.246 1.683 0.567) 2.170 5.370 ( 3.690 -10.527 5.936) 12.636 5.618 ( 0.949 8.493 3.784) 9.346 5.982 ( -12.227 4.302 -8.855) 15.698 6.423 ( 22.645 -7.887 -1.493) 24.025 6.707 ( -14.355 -11.075 -10.756) 21.081 7.053 ( -0.052 -3.274 -6.285) 7.087 7.260 ( -4.069 -15.175 12.014) 19.778 7.762 ( 9.978 -22.094 2.777) 24.401 8.329 ( -2.859 -5.795 8.339) 10.549 8.714 ( 0.455 -5.798 -5.904) 8.287 8.877 ( -0.081 -11.519 -2.297) 11.746 9.048 ( -5.984 -9.650 -8.638) 14.267 9.257 ( -7.307 -27.300 -1.616) 28.307 9.548 ( -7.189 -10.293 -3.614) 13.065 10.038 ( -3.986 -6.496 0.161) 7.623 10.294 ( -6.037 0.813 3.327) 6.941 11.518 ( -3.467 33.904 2.124) 34.147 12.154 ( 10.125 14.520 3.702) 18.085 12.540 ( 3.981 21.781 -1.262) 22.178 12.992 ( 0.734 5.983 0.880) 6.092 13.631 ( 7.009 19.517 6.007) 21.590 13.764 ( 6.681 11.564 -1.045) 13.396 16.856 ( -23.929 -39.131 1.860) 45.905 18.155 ( 1.754 -20.223 -11.670) 23.415 20.171 ( 1.852 -15.056 1.754) 15.271 22.205 ( -7.477 -32.775 -8.843) 34.760 22.563 ( -4.878 -3.114 1.788) 6.057 25.509 ( 8.682 19.278 4.551) 21.627 26.648 ( -2.619 -6.688 -5.661) 9.145 27.551 ( 1.221 0.976 11.218) 11.326 ======================= Grid point 50 (37/429) ======================= q-point: ( 0.50 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.993 ( 15.828 -12.140 6.493) 20.978 3.091 ( 16.903 -14.723 13.769) 26.307 4.037 ( -13.317 -5.518 -4.157) 15.002 4.534 ( -9.056 -9.713 1.297) 13.343 4.579 ( 5.240 0.251 -5.744) 7.779 4.840 ( 4.911 7.027 -4.009) 9.464 5.252 ( -10.777 13.700 5.807) 18.373 5.664 ( 9.775 -4.690 7.369) 13.109 5.953 ( -4.528 -3.859 -0.784) 6.001 6.588 ( 1.872 -4.782 -5.319) 7.394 6.911 ( 2.009 -8.985 -13.908) 16.679 7.006 ( 2.616 -2.263 3.026) 4.596 7.495 ( -5.108 -8.820 2.404) 10.472 8.293 ( 4.394 -12.318 7.250) 14.954 8.469 ( 4.551 -12.327 3.360) 13.563 8.801 ( -0.752 -10.370 -4.264) 11.238 9.120 ( -1.971 -11.674 -0.914) 11.874 9.209 ( -1.488 -17.517 -5.146) 18.318 9.679 ( -10.642 -12.799 -3.589) 17.027 9.847 ( -2.884 -32.042 0.533) 32.176 10.182 ( 1.349 -3.002 -3.101) 4.522 10.356 ( -3.516 -14.466 4.245) 15.481 10.909 ( -5.097 26.485 3.407) 27.186 11.716 ( 4.717 28.802 0.868) 29.198 12.400 ( 9.915 5.290 -2.059) 11.425 12.881 ( -3.070 5.592 2.659) 6.911 13.384 ( 4.239 11.081 2.294) 12.084 13.612 ( 3.202 7.744 0.541) 8.397 17.384 ( -16.778 -29.884 -0.724) 34.279 18.440 ( -0.449 -11.810 -4.033) 12.488 20.421 ( 5.203 -8.498 0.416) 9.973 22.436 ( -1.044 -0.823 -1.877) 2.300 22.821 ( -6.624 -23.079 -1.940) 24.089 25.212 ( 7.358 17.968 4.084) 19.841 26.763 ( -1.796 -7.640 -4.545) 9.069 27.556 ( 1.638 1.178 6.264) 6.581 ======================= Grid point 51 (38/429) ======================= q-point: ( 0.57 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.261 ( 10.137 -7.637 7.604) 14.795 3.395 ( 10.418 -6.737 12.036) 17.285 4.050 ( -10.717 -3.306 -6.000) 12.719 4.522 ( -6.451 1.089 -8.382) 10.632 4.545 ( -4.444 4.982 5.157) 8.436 4.731 ( 3.391 5.875 -7.941) 10.444 5.045 ( -5.058 3.052 1.191) 6.026 5.761 ( 6.003 -1.045 8.366) 10.350 6.024 ( -0.083 -3.508 1.575) 3.846 6.618 ( -1.681 0.916 -5.671) 5.986 6.944 ( -4.149 -5.201 -3.268) 7.412 7.234 ( 12.165 -8.680 -2.519) 15.155 7.574 ( -5.205 -2.986 -0.418) 6.015 8.332 ( 3.358 4.090 9.971) 11.288 8.643 ( -5.485 -6.624 -7.748) 11.576 9.058 ( 2.434 -12.077 1.792) 12.450 9.355 ( -0.708 -15.055 -1.427) 15.139 9.598 ( 2.504 -16.326 -1.307) 16.569 9.962 ( -5.675 -22.501 -2.141) 23.304 10.188 ( -0.906 -0.024 3.637) 3.749 10.282 ( -0.974 -13.021 -2.233) 13.247 10.448 ( 0.718 10.621 5.351) 11.915 10.777 ( -4.992 -16.354 -2.938) 17.350 11.344 ( 2.766 7.859 1.335) 8.438 12.291 ( 7.893 12.736 -2.637) 15.214 12.762 ( -3.148 4.968 2.948) 6.579 13.279 ( 1.706 2.620 0.697) 3.203 13.510 ( 1.544 4.808 0.640) 5.090 17.799 ( -9.758 -23.134 -1.416) 25.147 18.596 ( -0.571 -6.054 -0.622) 6.112 20.536 ( 4.174 -0.946 -0.095) 4.281 22.420 ( -0.581 0.914 -0.336) 1.135 23.157 ( -3.083 -15.610 -1.484) 15.980 24.936 ( 4.807 15.923 2.650) 16.843 26.887 ( -1.123 -6.946 -2.665) 7.524 27.541 ( 1.401 2.419 3.142) 4.205 ======================= Grid point 52 (39/429) ======================= q-point: ( 0.64 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.425 ( 8.651 -1.144 9.393) 12.821 3.530 ( 2.496 -4.049 4.091) 6.274 3.991 ( -8.792 1.928 -5.911) 10.769 4.342 ( -0.574 12.186 0.921) 12.234 4.538 ( -4.333 -4.201 -3.056) 6.765 4.670 ( -1.834 -3.231 -6.416) 7.414 5.031 ( -1.238 -1.318 -0.262) 1.827 5.843 ( 9.374 -0.924 10.541) 14.136 6.062 ( -3.080 -2.050 -3.735) 5.258 6.554 ( -2.806 2.791 -2.430) 4.644 7.027 ( -1.496 -4.191 0.171) 4.454 7.401 ( 8.431 -2.754 -4.114) 9.777 7.557 ( -5.110 0.949 0.876) 5.270 8.326 ( 5.008 -0.817 6.669) 8.380 8.686 ( -7.631 -3.552 -7.007) 10.952 9.293 ( 2.850 -11.650 2.012) 12.161 9.634 ( 0.054 -14.320 -1.552) 14.404 9.771 ( -0.861 -2.938 -0.612) 3.122 10.078 ( -0.000 5.567 2.733) 6.202 10.199 ( 1.011 1.427 2.585) 3.122 10.291 ( -3.898 5.064 -4.693) 7.929 10.577 ( 4.101 -15.019 6.982) 17.063 10.991 ( -2.944 -11.993 -6.576) 13.991 11.467 ( 0.169 -10.999 2.407) 11.261 12.014 ( 2.323 17.768 -1.322) 17.968 12.696 ( -0.590 1.332 0.948) 1.738 13.271 ( 0.387 0.019 0.394) 0.552 13.450 ( 0.641 2.358 0.094) 2.445 18.145 ( -4.144 -18.401 -0.981) 18.887 18.673 ( 0.254 -2.584 0.389) 2.625 20.515 ( 1.689 4.449 -0.152) 4.761 22.405 ( -0.122 0.363 -0.001) 0.383 23.377 ( -0.793 -9.976 -0.589) 10.024 24.681 ( 1.844 13.674 1.079) 13.840 26.996 ( -0.577 -5.487 -1.105) 5.626 27.491 ( 0.748 3.928 1.216) 4.179 ======================= Grid point 53 (40/429) ======================= q-point: (-0.29 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.374 ( 4.348 11.108 3.288) 12.374 3.598 ( -0.236 2.118 0.173) 2.138 3.916 ( -4.135 0.197 -3.154) 5.205 4.169 ( -0.941 1.639 0.209) 1.902 4.559 ( 0.331 -0.455 -0.360) 0.668 4.867 ( -2.703 -17.466 -2.624) 17.867 5.038 ( 0.049 0.182 0.232) 0.299 5.880 ( 6.768 5.240 7.350) 11.282 6.101 ( -2.005 -5.761 -4.165) 7.386 6.482 ( -2.264 3.222 -0.986) 4.060 7.066 ( -0.674 -0.548 1.935) 2.121 7.366 ( 1.539 7.395 -3.978) 8.537 7.539 ( -1.170 0.274 1.518) 1.936 8.472 ( 7.868 -9.483 5.272) 13.402 8.671 ( -8.247 -1.288 -6.143) 10.364 9.536 ( 5.639 -10.677 1.599) 12.180 9.714 ( -3.131 5.644 1.571) 6.643 9.824 ( 1.337 -0.172 -4.353) 4.557 9.980 ( -0.311 3.792 7.398) 8.319 10.042 ( -5.045 5.713 -3.579) 8.420 10.337 ( 1.716 -5.420 -1.468) 5.872 10.735 ( 3.811 1.697 2.236) 4.733 11.149 ( -2.773 -6.346 -2.772) 7.460 11.590 ( 1.622 -1.138 1.504) 2.488 11.712 ( -2.081 14.052 -0.590) 14.218 12.703 ( 0.279 -1.891 -0.037) 1.912 13.262 ( -0.041 1.169 0.198) 1.186 13.420 ( 0.174 1.436 -0.212) 1.462 18.434 ( -0.796 -13.734 -0.195) 13.759 18.702 ( 0.898 -0.201 0.198) 0.942 20.407 ( -0.198 6.966 -0.030) 6.969 22.407 ( 0.061 -0.656 0.074) 0.663 23.543 ( 0.604 -8.396 0.128) 8.419 24.449 ( -0.447 11.631 -0.127) 11.640 27.079 ( -0.099 -3.696 -0.017) 3.697 27.414 ( 0.077 4.525 0.019) 4.526 ======================= Grid point 54 (41/429) ======================= q-point: (-0.21 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.108 ( -0.000 18.060 -0.000) 18.060 3.383 ( -0.000 18.343 -0.000) 18.343 3.919 ( 0.000 -2.085 0.000) 2.085 4.335 ( 0.000 -16.275 0.000) 16.275 4.566 ( -0.000 0.037 -0.000) 0.037 4.958 ( -0.000 5.163 -0.000) 5.163 5.226 ( 0.000 -12.795 0.000) 12.795 5.810 ( -0.000 0.182 -0.000) 0.182 6.204 ( 0.000 -4.233 0.000) 4.233 6.404 ( -0.000 3.724 -0.000) 3.724 7.063 ( -0.000 0.487 -0.000) 0.487 7.223 ( -0.000 6.266 -0.000) 6.266 7.483 ( -0.000 5.707 -0.000) 5.707 8.580 ( -0.000 5.724 -0.000) 5.724 8.773 ( 0.000 -14.599 0.000) 14.599 9.500 ( -0.000 14.835 -0.000) 14.835 9.578 ( -0.000 13.722 -0.000) 13.722 9.795 ( -0.000 14.879 -0.000) 14.879 9.870 ( 0.000 -14.589 0.000) 14.589 10.086 ( 0.000 -4.777 0.000) 4.777 10.376 ( -0.000 2.020 -0.000) 2.020 10.760 ( 0.000 -7.436 0.000) 7.436 11.104 ( -0.000 11.824 -0.000) 11.824 11.374 ( -0.000 21.060 -0.000) 21.060 11.649 ( 0.000 -5.333 0.000) 5.333 12.765 ( 0.000 -4.482 0.000) 4.482 13.235 ( -0.000 1.538 -0.000) 1.538 13.386 ( -0.000 2.321 -0.000) 2.321 18.628 ( 0.000 -6.431 0.000) 6.431 18.687 ( -0.000 2.345 -0.000) 2.345 20.273 ( -0.000 6.752 -0.000) 6.752 22.431 ( 0.000 -1.918 0.000) 1.918 23.715 ( 0.000 -9.909 0.000) 9.909 24.238 ( -0.000 10.675 -0.000) 10.675 27.129 ( 0.000 -1.522 0.000) 1.522 27.331 ( -0.000 4.127 -0.000) 4.127 ======================= Grid point 61 (42/429) ======================= q-point: ( 0.29 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 22.468 -0.000 5.785) 23.201 1.629 ( 32.777 -0.000 23.561) 40.367 3.126 ( 56.775 -0.000 18.388) 59.678 3.202 ( -0.125 0.000 -2.508) 2.511 4.048 ( -14.469 0.000 0.242) 14.471 4.524 ( -2.102 0.000 -1.031) 2.341 5.189 ( 31.528 -0.000 -8.154) 32.566 5.380 ( 0.289 -0.000 1.461) 1.489 5.465 ( 13.613 -0.000 -6.101) 14.918 6.254 ( -10.311 0.000 -6.698) 12.295 6.717 ( -0.404 0.000 -0.601) 0.724 7.343 ( 0.054 -0.000 1.691) 1.692 7.378 ( -14.514 0.000 6.588) 15.940 7.568 ( -2.081 0.000 1.225) 2.414 7.706 ( -19.323 0.000 7.202) 20.621 7.792 ( 2.372 -0.000 -2.682) 3.580 8.469 ( -0.256 0.000 10.016) 10.019 8.717 ( -6.046 0.000 2.454) 6.525 9.094 ( -15.540 0.000 -15.708) 22.096 9.277 ( 12.774 -0.000 -29.265) 31.931 10.148 ( -10.586 0.000 5.381) 11.875 10.487 ( -21.766 0.000 9.547) 23.767 12.271 ( 3.517 -0.000 8.216) 8.938 12.884 ( 9.111 -0.000 -2.175) 9.367 13.369 ( -1.395 0.000 -1.131) 1.796 13.752 ( 1.143 -0.000 1.754) 2.093 14.180 ( -1.124 0.000 0.064) 1.126 14.664 ( 16.507 -0.000 4.192) 17.031 15.808 ( -0.153 0.000 0.067) 0.167 16.365 ( 6.506 -0.000 -20.724) 21.721 19.107 ( 0.000 -0.000 -0.004) 0.004 20.232 ( -0.009 0.000 -0.035) 0.036 22.598 ( -3.401 0.000 0.146) 3.404 26.094 ( 3.469 -0.000 -13.260) 13.707 26.668 ( -6.900 0.000 6.613) 9.557 27.584 ( -4.930 0.000 31.077) 31.465 ======================= Grid point 62 (43/429) ======================= q-point: ( 0.36 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( 19.468 -23.157 5.320) 30.717 1.956 ( 32.191 -10.660 19.303) 39.019 3.325 ( 14.124 -15.240 6.518) 21.777 3.731 ( 20.773 -22.007 8.049) 31.314 3.992 ( -5.690 -3.954 0.167) 6.931 4.589 ( 0.593 -7.754 -1.075) 7.851 5.288 ( 17.871 1.780 -3.891) 18.376 5.415 ( -1.873 -4.924 -5.915) 7.921 5.757 ( 23.436 -17.549 -6.673) 30.029 6.251 ( -10.751 -7.818 -2.882) 13.602 6.708 ( -2.867 1.661 1.714) 3.731 6.888 ( -6.533 25.846 -2.929) 26.819 7.310 ( -3.029 3.793 6.092) 7.789 7.522 ( -5.430 2.722 4.394) 7.497 7.911 ( -8.727 -15.681 3.985) 18.383 8.029 ( -5.570 -22.413 -1.753) 23.161 8.545 ( -0.764 -6.357 7.219) 9.650 8.716 ( -5.221 -3.489 1.780) 6.527 8.985 ( -14.337 -0.389 -14.064) 20.088 9.314 ( 12.085 -1.414 -21.530) 24.730 10.061 ( -12.151 2.936 4.091) 13.153 10.366 ( -14.681 2.232 6.235) 16.105 12.282 ( 2.971 1.824 7.021) 7.839 12.669 ( 8.340 24.748 -1.053) 26.137 13.205 ( 0.434 7.594 -2.993) 8.174 13.598 ( 1.951 17.297 2.987) 17.662 14.359 ( 17.091 8.056 -5.709) 19.738 14.627 ( 9.526 14.062 9.892) 19.655 15.396 ( -20.446 -3.316 6.657) 21.756 17.018 ( 5.968 -40.688 -24.191) 47.711 19.406 ( -8.008 -24.461 3.126) 25.928 20.577 ( -0.436 -36.188 -4.239) 36.438 22.574 ( -3.136 0.558 0.242) 3.194 26.050 ( 3.389 5.423 -7.416) 9.792 26.583 ( -4.467 4.412 3.989) 7.438 27.598 ( -2.371 1.186 21.216) 21.381 ======================= Grid point 63 (44/429) ======================= q-point: ( 0.43 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.339 ( 19.249 -23.242 5.128) 30.611 2.435 ( 28.326 -17.415 15.464) 36.671 3.779 ( -3.949 -19.988 6.557) 21.404 3.877 ( -10.255 -8.938 -6.909) 15.257 4.375 ( 23.358 -14.157 6.899) 28.171 4.782 ( -1.897 -11.405 0.433) 11.570 5.359 ( 16.992 -0.434 0.425) 17.003 5.537 ( -4.394 -10.530 -4.344) 12.209 6.143 ( 4.134 2.717 -5.427) 7.343 6.326 ( -7.320 -4.982 -10.471) 13.713 6.478 ( 4.379 -2.280 3.766) 6.209 6.781 ( -0.039 -10.868 -3.071) 11.294 7.221 ( -5.820 4.056 9.372) 11.754 7.561 ( 4.837 -7.055 1.268) 8.648 8.108 ( -11.488 -12.672 3.128) 17.388 8.456 ( -0.192 -23.171 0.057) 23.172 8.704 ( -1.687 -9.362 1.455) 9.624 8.796 ( -1.962 -7.030 -0.899) 7.354 8.915 ( -13.984 -4.742 -9.264) 17.431 9.393 ( 6.916 -4.325 -10.845) 13.570 9.952 ( -10.562 0.739 1.648) 10.715 10.281 ( -7.759 1.031 3.941) 8.764 12.117 ( -1.365 27.299 0.817) 27.345 12.342 ( 11.709 5.715 4.466) 13.774 13.015 ( -3.831 17.394 -5.153) 18.541 13.214 ( 5.887 20.194 4.400) 21.490 14.099 ( 12.289 20.464 -5.556) 24.509 14.168 ( 7.333 31.147 11.639) 34.049 15.905 ( -23.384 -46.574 2.100) 52.157 17.675 ( 3.804 -30.188 -15.919) 34.340 19.814 ( -4.098 -22.456 3.262) 23.059 21.372 ( -4.876 -46.094 -6.241) 46.769 22.544 ( -2.858 0.827 0.453) 3.010 25.878 ( 4.346 14.295 -0.124) 14.942 26.538 ( -2.344 -1.948 -1.364) 3.340 27.597 ( -0.298 1.282 12.538) 12.607 ======================= Grid point 64 (45/429) ======================= q-point: ( 0.50 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.834 ( 17.562 -16.877 4.326) 24.738 2.938 ( 23.441 -16.587 14.095) 31.989 3.821 ( -19.354 -6.376 -5.240) 21.040 4.226 ( -4.510 -17.619 -0.031) 18.187 4.616 ( 12.906 -1.722 -2.262) 13.216 4.899 ( -4.883 -1.774 1.237) 5.340 5.460 ( 6.060 5.664 8.431) 11.827 5.711 ( 12.029 -1.241 6.555) 13.755 5.819 ( -10.603 0.907 -7.652) 13.107 6.448 ( -17.456 -6.227 -9.349) 20.758 6.712 ( 23.718 -13.521 -8.324) 28.543 7.026 ( -1.411 -1.058 -2.868) 3.367 7.226 ( -9.457 -13.674 10.665) 19.752 7.904 ( 12.889 -24.657 2.440) 27.929 8.285 ( -7.828 -11.806 3.563) 14.607 8.714 ( 2.009 -1.946 -2.799) 3.957 8.875 ( -0.090 -12.511 -2.067) 12.681 8.950 ( -6.860 -8.517 -3.261) 11.412 9.171 ( -6.225 -33.189 -0.519) 33.772 9.479 ( -2.529 -4.353 -4.279) 6.607 9.997 ( -2.642 -10.601 -1.037) 10.974 10.246 ( -4.582 -0.185 3.345) 5.676 11.495 ( -1.745 35.227 1.057) 35.286 12.280 ( 9.192 19.513 3.789) 21.899 12.553 ( -0.239 14.532 -2.345) 14.722 13.005 ( 0.845 8.910 0.829) 8.988 13.717 ( 4.535 20.901 4.302) 21.816 13.829 ( 5.099 13.850 -0.724) 14.777 16.628 ( -16.241 -40.805 0.045) 43.919 18.135 ( 0.814 -20.062 -6.775) 21.191 20.198 ( 1.746 -17.791 1.298) 17.923 22.116 ( -3.925 -35.192 -4.743) 35.726 22.524 ( -2.938 -1.386 0.904) 3.372 25.596 ( 4.702 17.970 2.368) 18.726 26.609 ( -1.498 -6.556 -3.138) 7.422 27.595 ( 0.653 1.012 6.804) 6.909 ======================= Grid point 65 (46/429) ======================= q-point: ( 0.57 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.172 ( 11.730 -9.633 3.407) 15.556 3.341 ( 17.154 -10.644 13.624) 24.355 3.851 ( -15.183 -8.488 -7.126) 18.798 4.393 ( -10.852 -5.317 -3.061) 12.466 4.660 ( 8.331 2.060 -0.525) 8.598 4.831 ( -3.429 4.600 -4.094) 7.048 5.194 ( -3.209 15.394 4.377) 16.323 5.761 ( 2.264 -2.508 2.522) 4.216 5.971 ( 5.986 -4.722 6.933) 10.305 6.502 ( -8.376 -10.086 -9.511) 16.197 6.888 ( 0.190 3.010 -6.167) 6.865 7.122 ( 14.251 -11.303 0.190) 18.190 7.418 ( -10.102 -9.392 2.584) 14.034 8.349 ( 1.643 -9.531 3.639) 10.334 8.519 ( 2.607 -7.306 0.922) 7.812 8.827 ( 6.087 -13.553 1.153) 14.902 9.095 ( -2.008 -11.925 0.211) 12.095 9.154 ( -5.381 -24.143 -4.404) 25.125 9.562 ( -6.538 -10.089 -3.139) 12.425 9.826 ( -1.175 -33.858 -0.245) 33.880 10.197 ( 2.780 -2.060 -2.502) 4.270 10.327 ( -4.149 -17.786 4.373) 18.780 10.874 ( -2.358 27.837 1.061) 27.956 11.761 ( 2.631 29.828 0.564) 29.949 12.486 ( 6.084 3.872 -1.377) 7.342 12.857 ( -2.453 6.695 1.745) 7.341 13.429 ( 2.293 12.426 1.288) 12.701 13.643 ( 1.872 8.484 0.309) 8.693 17.232 ( -9.139 -31.704 -0.744) 33.003 18.424 ( -0.342 -11.984 -1.918) 12.141 20.469 ( 2.884 -9.041 0.266) 9.494 22.422 ( -0.543 -1.387 -0.955) 1.769 22.761 ( -3.153 -23.831 -0.848) 24.053 25.285 ( 3.563 17.937 1.982) 18.394 26.735 ( -0.898 -7.845 -2.241) 8.208 27.588 ( 0.825 1.306 3.186) 3.541 ======================= Grid point 66 (47/429) ======================= q-point: ( 0.64 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.360 ( 3.900 -6.183 2.050) 7.592 3.561 ( 8.812 -2.527 9.862) 13.465 3.909 ( -8.064 -4.765 -6.490) 11.395 4.390 ( -6.011 -3.774 -3.637) 7.975 4.571 ( 0.949 10.765 2.837) 11.173 4.727 ( 0.573 5.247 -4.381) 6.859 5.013 ( -1.474 2.245 0.839) 2.814 5.839 ( 2.891 -3.978 3.806) 6.219 6.029 ( -0.093 -0.060 0.797) 0.805 6.583 ( -1.092 0.007 -2.646) 2.863 6.897 ( -1.799 -6.707 -1.810) 7.176 7.369 ( 11.985 -6.272 -1.177) 13.578 7.490 ( -9.324 -4.312 0.352) 10.279 8.418 ( 4.592 4.970 8.717) 11.035 8.549 ( -5.146 -5.315 -7.856) 10.791 9.085 ( 1.146 -11.419 0.636) 11.494 9.352 ( 0.329 -14.920 -0.083) 14.923 9.612 ( 0.683 -14.101 -0.565) 14.129 9.903 ( -2.788 -30.741 -0.972) 30.883 10.190 ( -0.377 2.204 1.482) 2.682 10.268 ( -0.360 -11.475 -0.779) 11.507 10.476 ( 0.897 10.151 2.355) 10.460 10.725 ( -2.125 -18.233 -1.659) 18.431 11.369 ( 0.960 8.335 0.430) 8.401 12.347 ( 2.984 14.268 -1.051) 14.615 12.743 ( -1.353 4.091 1.186) 4.470 13.294 ( 0.598 3.293 0.261) 3.358 13.524 ( 0.580 5.183 0.219) 5.220 17.720 ( -3.436 -24.618 -0.545) 24.863 18.590 ( -0.204 -6.455 -0.192) 6.461 20.568 ( 1.448 -0.514 -0.025) 1.537 22.414 ( -0.217 0.691 -0.100) 0.731 23.130 ( -0.949 -16.334 -0.481) 16.369 24.979 ( 1.589 16.527 0.885) 16.627 26.872 ( -0.383 -7.159 -0.893) 7.224 27.560 ( 0.480 2.627 1.064) 2.874 ======================= Grid point 67 (48/429) ======================= q-point: ( 0.71 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.488 ( 0.000 -5.320 0.000) 5.320 3.575 ( -0.000 3.288 -0.000) 3.288 3.910 ( -0.000 0.366 -0.000) 0.366 4.341 ( -0.000 13.059 -0.000) 13.059 4.501 ( 0.000 -8.148 0.000) 8.148 4.652 ( 0.000 -0.533 0.000) 0.533 5.024 ( 0.000 -1.677 0.000) 1.677 5.958 ( 0.000 -6.620 0.000) 6.620 5.996 ( -0.000 3.000 -0.000) 3.000 6.534 ( -0.000 3.111 -0.000) 3.111 7.018 ( 0.000 -4.910 0.000) 4.910 7.468 ( -0.000 2.234 -0.000) 2.234 7.503 ( 0.000 -3.197 0.000) 3.197 8.382 ( 0.000 -1.267 0.000) 1.267 8.615 ( 0.000 -2.960 0.000) 2.960 9.313 ( 0.000 -12.552 0.000) 12.552 9.634 ( 0.000 -14.381 0.000) 14.381 9.764 ( 0.000 -2.606 0.000) 2.606 10.083 ( -0.000 5.203 -0.000) 5.203 10.229 ( -0.000 11.661 -0.000) 11.661 10.239 ( 0.000 -5.009 0.000) 5.009 10.617 ( 0.000 -16.500 0.000) 16.500 10.958 ( 0.000 -10.870 0.000) 10.870 11.472 ( 0.000 -10.886 0.000) 10.886 12.024 ( -0.000 18.846 -0.000) 18.846 12.695 ( -0.000 0.992 -0.000) 0.992 13.274 ( -0.000 0.206 -0.000) 0.206 13.454 ( -0.000 2.518 -0.000) 2.518 18.120 ( 0.000 -19.242 0.000) 19.242 18.675 ( 0.000 -2.942 0.000) 2.942 20.525 ( -0.000 4.953 -0.000) 4.953 22.404 ( -0.000 0.260 -0.000) 0.260 23.372 ( 0.000 -10.435 0.000) 10.435 24.693 ( -0.000 14.344 -0.000) 14.344 26.990 ( 0.000 -5.634 0.000) 5.634 27.498 ( -0.000 4.133 -0.000) 4.133 ======================= Grid point 77 (49/429) ======================= q-point: ( 0.36 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( 16.994 -0.000 4.559) 17.595 2.089 ( 33.543 -0.000 20.292) 39.203 3.184 ( -1.214 0.000 -2.434) 2.720 3.684 ( 6.861 -0.000 11.425) 13.327 3.973 ( 23.904 -0.000 5.381) 24.503 4.501 ( -1.407 0.000 -0.708) 1.575 5.382 ( 7.697 -0.000 -9.814) 12.472 5.387 ( 0.142 -0.000 1.121) 1.130 5.682 ( 27.379 -0.000 -16.570) 32.003 6.120 ( -8.279 0.000 2.425) 8.627 6.710 ( -0.324 0.000 -0.482) 0.581 7.247 ( -12.259 0.000 5.345) 13.374 7.350 ( 0.079 -0.000 1.484) 1.486 7.492 ( -22.685 0.000 7.528) 23.901 7.551 ( -1.498 0.000 0.626) 1.624 7.807 ( 1.699 -0.000 -1.921) 2.564 8.500 ( 0.359 -0.000 7.959) 7.967 8.641 ( -8.270 0.000 1.241) 8.363 8.884 ( -11.395 0.000 -13.884) 17.962 9.349 ( 15.474 -0.000 -19.261) 24.707 10.022 ( -14.407 0.000 3.641) 14.860 10.315 ( -13.066 0.000 5.327) 14.110 12.322 ( 1.150 -0.000 5.816) 5.929 12.983 ( 8.607 -0.000 0.834) 8.647 13.331 ( -3.397 0.000 -4.108) 5.330 13.775 ( 1.297 -0.000 2.602) 2.907 14.169 ( -0.904 0.000 0.051) 0.906 14.856 ( 14.231 -0.000 2.845) 14.512 15.807 ( -0.123 0.000 0.054) 0.135 16.360 ( 3.432 -0.000 -12.576) 13.036 19.107 ( 0.000 -0.000 -0.003) 0.003 20.231 ( -0.007 0.000 -0.028) 0.029 22.563 ( -2.666 0.000 0.132) 2.670 26.088 ( 2.014 -0.000 -7.199) 7.476 26.619 ( -4.797 0.000 3.632) 6.017 27.631 ( -2.762 0.000 18.414) 18.620 ======================= Grid point 78 (50/429) ======================= q-point: ( 0.43 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 13.451 -23.675 3.832) 27.498 2.388 ( 31.744 -8.527 16.013) 36.562 3.388 ( -0.374 -19.740 1.709) 19.818 3.662 ( -20.863 -3.724 -4.437) 21.652 4.312 ( 37.934 -9.938 15.506) 42.169 4.590 ( 0.638 -8.859 -0.817) 8.920 5.346 ( -5.898 -2.307 -9.545) 11.455 5.445 ( 12.115 -1.579 -1.872) 12.360 5.910 ( 1.893 -13.777 -16.194) 21.346 6.201 ( 8.684 -7.709 5.861) 13.007 6.687 ( -2.321 2.704 2.597) 4.409 6.824 ( -1.743 23.911 -3.851) 24.282 7.271 ( -9.553 3.424 8.736) 13.390 7.456 ( -7.123 -5.969 2.280) 9.569 7.842 ( -4.942 -9.546 1.564) 10.863 7.978 ( -2.624 -23.746 -1.232) 23.923 8.569 ( 0.615 -5.169 6.555) 8.371 8.647 ( -7.289 -5.379 0.566) 9.076 8.803 ( -8.788 -0.224 -11.874) 14.774 9.404 ( 14.454 0.145 -13.264) 19.618 9.919 ( -14.488 2.163 2.677) 14.892 10.256 ( -8.007 0.392 3.698) 8.829 12.318 ( 0.345 2.230 4.145) 4.720 12.766 ( 7.945 24.089 1.346) 25.401 13.180 ( -1.929 7.042 -4.118) 8.383 13.631 ( 1.719 16.063 2.613) 16.365 14.519 ( 14.409 -3.710 -5.309) 15.797 14.749 ( 6.187 10.006 6.828) 13.602 15.208 ( -16.041 17.896 4.727) 24.493 17.008 ( 4.245 -40.301 -14.070) 42.897 19.350 ( -4.019 -22.097 2.393) 22.586 20.564 ( 0.060 -33.526 -2.190) 33.597 22.544 ( -2.155 0.581 0.140) 2.236 26.057 ( 1.668 3.999 -4.021) 5.912 26.553 ( -2.737 3.800 2.088) 5.128 27.637 ( -1.419 0.957 11.991) 12.113 ======================= Grid point 79 (51/429) ======================= q-point: ( 0.50 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.532 ( 11.264 -25.231 3.330) 27.831 2.810 ( 27.855 -14.644 12.191) 33.748 3.573 ( -23.553 -5.599 -3.899) 24.522 3.843 ( 0.031 -21.867 -2.086) 21.966 4.654 ( 18.390 -3.636 7.465) 20.178 4.765 ( -1.302 -8.851 0.529) 8.962 5.439 ( -4.157 -11.851 -6.262) 14.034 5.597 ( 18.435 -6.118 5.114) 20.086 6.110 ( -9.410 -3.626 -8.094) 12.931 6.121 ( -12.882 12.166 -3.126) 17.993 6.662 ( 19.242 -5.951 -2.771) 20.331 6.777 ( 0.155 -13.169 -0.412) 13.176 7.170 ( -8.430 4.085 8.106) 12.388 7.620 ( 4.617 -13.519 0.640) 14.300 7.991 ( -9.534 -12.103 1.045) 15.443 8.452 ( -0.307 -26.351 -0.009) 26.353 8.705 ( 0.107 -7.481 2.926) 8.034 8.744 ( -8.594 -8.062 -1.901) 11.935 8.773 ( -2.578 -4.500 -5.428) 7.508 9.453 ( 8.087 0.238 -5.946) 10.040 9.839 ( -9.122 -2.694 0.682) 9.535 10.226 ( -4.013 -0.094 2.262) 4.607 12.108 ( -0.756 26.232 0.620) 26.250 12.473 ( 8.017 6.377 3.120) 10.708 12.956 ( -3.463 18.542 -3.350) 19.157 13.275 ( 2.835 19.664 1.972) 19.965 14.200 ( 8.634 25.763 -5.500) 27.722 14.267 ( 3.002 31.617 9.127) 33.045 15.695 ( -13.432 -48.339 0.268) 50.171 17.665 ( 1.998 -29.842 -7.842) 30.919 19.792 ( -1.709 -24.937 1.903) 25.068 21.319 ( -1.865 -44.034 -2.773) 44.161 22.519 ( -1.600 0.892 0.180) 1.841 25.911 ( 1.844 12.389 -0.279) 12.528 26.515 ( -1.105 -1.565 -0.516) 1.984 27.628 ( -0.226 1.156 6.185) 6.296 ======================= Grid point 80 (52/429) ======================= q-point: ( 0.57 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.996 ( 7.441 -17.207 2.078) 18.862 3.253 ( 23.741 -13.335 11.043) 29.384 3.556 ( -22.574 -8.877 -8.233) 25.616 4.175 ( -3.014 -13.506 -0.440) 13.846 4.729 ( 7.940 0.809 -2.715) 8.431 4.842 ( -5.387 -0.317 2.487) 5.942 5.553 ( 5.518 16.234 5.844) 18.115 5.684 ( -7.524 -1.553 -6.376) 9.984 5.928 ( 18.203 -9.389 11.689) 23.583 6.193 ( -19.201 -10.135 -12.379) 24.993 6.940 ( 20.854 -9.462 -9.826) 24.919 7.007 ( -1.291 -1.217 1.762) 2.501 7.122 ( -14.766 -12.756 8.399) 21.244 8.057 ( 11.989 -25.866 0.887) 28.523 8.193 ( -9.362 -15.811 1.053) 18.405 8.731 ( 1.596 -5.064 -0.123) 5.311 8.828 ( -4.282 -6.803 -2.729) 8.489 8.907 ( -0.832 -9.319 0.614) 9.376 9.125 ( -1.723 -36.012 -0.238) 36.054 9.452 ( -0.431 -0.113 -1.880) 1.932 9.974 ( -0.803 -14.050 -0.580) 14.085 10.217 ( -1.860 -0.231 1.452) 2.371 11.485 ( -0.487 35.939 0.311) 35.944 12.378 ( 5.041 29.575 2.287) 30.088 12.528 ( -1.987 2.757 -1.803) 3.847 13.015 ( 0.362 10.919 0.312) 10.929 13.762 ( 1.494 21.373 1.450) 21.474 13.869 ( 1.991 15.543 -0.142) 15.670 16.500 ( -5.764 -41.856 -0.185) 42.252 18.125 ( 0.229 -19.929 -2.208) 20.053 20.216 ( 0.709 -19.130 0.479) 19.149 22.076 ( -1.196 -35.941 -1.481) 35.991 22.503 ( -1.013 -0.826 0.264) 1.333 25.636 ( 1.481 17.201 0.728) 17.280 26.590 ( -0.482 -6.437 -1.000) 6.532 27.616 ( 0.202 0.989 2.276) 2.489 ======================= Grid point 81 (53/429) ======================= q-point: ( 0.64 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.253 ( 0.000 -8.238 0.000) 8.238 3.521 ( 0.000 -5.792 0.000) 5.792 3.695 ( 0.000 -13.632 0.000) 13.632 4.316 ( 0.000 -3.763 0.000) 3.763 4.751 ( -0.000 7.004 -0.000) 7.004 4.756 ( 0.000 -0.574 0.000) 0.574 5.188 ( -0.000 16.560 -0.000) 16.560 5.770 ( 0.000 -4.480 0.000) 4.480 6.047 ( -0.000 1.008 -0.000) 1.008 6.415 ( 0.000 -16.332 0.000) 16.332 6.877 ( -0.000 5.102 -0.000) 5.102 7.276 ( 0.000 -11.706 0.000) 11.706 7.297 ( 0.000 -9.428 0.000) 9.428 8.363 ( 0.000 -9.797 0.000) 9.797 8.535 ( 0.000 -3.766 0.000) 3.766 8.892 ( 0.000 -9.693 0.000) 9.693 9.074 ( 0.000 -32.899 0.000) 32.899 9.100 ( 0.000 -11.867 0.000) 11.867 9.520 ( 0.000 -8.562 0.000) 8.562 9.818 ( 0.000 -34.374 0.000) 34.374 10.212 ( -0.000 0.363 -0.000) 0.363 10.307 ( 0.000 -21.054 0.000) 21.054 10.863 ( -0.000 28.314 -0.000) 28.314 11.777 ( -0.000 30.196 -0.000) 30.196 12.520 ( -0.000 3.162 -0.000) 3.162 12.845 ( -0.000 7.284 -0.000) 7.284 13.444 ( -0.000 12.877 -0.000) 12.877 13.654 ( -0.000 8.779 -0.000) 8.779 17.178 ( 0.000 -32.370 0.000) 32.370 18.419 ( 0.000 -12.050 0.000) 12.050 20.486 ( 0.000 -9.195 0.000) 9.195 22.417 ( 0.000 -1.538 0.000) 1.538 22.742 ( 0.000 -24.110 0.000) 24.110 25.309 ( -0.000 17.896 -0.000) 17.896 26.726 ( 0.000 -7.901 0.000) 7.901 27.598 ( -0.000 1.338 -0.000) 1.338 ======================= Grid point 93 (54/429) ======================= q-point: ( 0.43 0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( 9.408 -0.000 2.611) 9.763 2.524 ( 29.981 -0.000 15.265) 33.644 3.161 ( -1.274 0.000 -1.578) 2.029 3.495 ( -23.207 0.000 -4.298) 23.602 4.487 ( -0.660 0.000 -0.347) 0.746 4.503 ( 43.100 -0.000 18.999) 47.102 5.322 ( -10.310 0.000 -18.076) 20.810 5.391 ( 0.045 -0.000 0.605) 0.606 5.763 ( -1.407 0.000 -10.019) 10.117 6.224 ( 21.083 -0.000 2.653) 21.249 6.706 ( -0.180 0.000 -0.267) 0.322 7.131 ( -12.911 0.000 5.964) 14.222 7.273 ( -16.561 0.000 3.474) 16.921 7.355 ( 0.062 -0.000 0.885) 0.887 7.540 ( -0.790 0.000 0.220) 0.820 7.816 ( 0.884 -0.000 -0.999) 1.334 8.538 ( -0.182 0.000 5.911) 5.914 8.560 ( -4.084 0.000 2.954) 5.040 8.733 ( -6.896 0.000 -12.605) 14.368 9.475 ( 15.600 -0.000 -10.750) 18.946 9.861 ( -15.370 0.000 3.253) 15.710 10.225 ( -5.815 0.000 2.669) 6.398 12.345 ( 0.190 -0.000 2.932) 2.938 13.083 ( 7.652 -0.000 3.103) 8.258 13.265 ( -5.162 0.000 -4.929) 7.137 13.796 ( 0.884 -0.000 1.682) 1.900 14.161 ( -0.503 0.000 0.028) 0.504 14.995 ( 8.347 -0.000 1.477) 8.476 15.806 ( -0.069 0.000 0.030) 0.075 16.352 ( 1.302 -0.000 -6.003) 6.142 19.107 ( 0.000 -0.000 -0.002) 0.002 20.231 ( -0.004 0.000 -0.015) 0.016 22.540 ( -1.460 0.000 0.078) 1.462 26.086 ( 0.937 -0.000 -3.132) 3.270 26.587 ( -2.443 0.000 1.535) 2.885 27.657 ( -1.330 0.000 8.642) 8.744 ======================= Grid point 94 (55/429) ======================= q-point: ( 0.50 0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( 4.905 -24.116 1.440) 24.652 2.761 ( 21.758 -7.653 8.954) 24.742 3.355 ( -11.384 -8.046 3.767) 14.441 3.421 ( -7.845 -15.911 -8.715) 19.765 4.579 ( 0.525 -9.095 0.773) 9.142 4.775 ( 26.756 0.468 13.920) 30.164 5.194 ( -13.149 -5.010 -12.286) 18.681 5.558 ( 8.011 -11.411 -0.648) 13.957 5.781 ( -9.774 -6.140 -4.912) 12.544 6.367 ( 10.332 0.415 0.040) 10.340 6.676 ( -0.948 0.872 1.582) 2.040 6.831 ( 4.379 19.446 -3.019) 20.160 7.158 ( -11.992 -2.964 6.281) 13.858 7.409 ( -1.763 -7.280 -0.042) 7.490 7.811 ( -1.349 -6.025 0.372) 6.185 7.957 ( -0.729 -23.654 -0.428) 23.669 8.578 ( -3.398 -5.472 -0.086) 6.442 8.613 ( 2.013 -3.780 7.690) 8.802 8.691 ( -4.338 -1.656 -9.667) 10.724 9.525 ( 11.146 1.654 -5.762) 12.656 9.772 ( -11.112 0.754 2.317) 11.376 10.206 ( -2.561 -0.245 1.281) 2.874 12.329 ( -0.078 2.864 1.336) 3.161 12.841 ( 3.544 23.789 1.160) 24.079 13.145 ( -1.477 6.094 -2.058) 6.600 13.652 ( 0.664 15.429 0.959) 15.473 14.634 ( 7.114 -22.799 -2.623) 24.027 14.814 ( 2.161 7.865 2.444) 8.515 15.080 ( -7.590 42.066 2.224) 42.803 17.007 ( 1.519 -40.147 -4.618) 40.440 19.327 ( -1.230 -21.104 0.874) 21.158 20.560 ( 0.059 -32.549 -0.684) 32.556 22.528 ( -0.768 0.616 0.045) 0.986 26.059 ( 0.502 3.504 -1.252) 3.755 26.537 ( -0.916 3.386 0.627) 3.563 27.655 ( -0.488 0.841 3.881) 4.001 ======================= Grid point 95 (56/429) ======================= q-point: ( 0.57 0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.605 ( 0.000 -26.221 0.000) 26.221 3.073 ( 0.000 -15.985 0.000) 15.985 3.349 ( 0.000 -2.960 0.000) 2.960 3.837 ( 0.000 -21.805 0.000) 21.805 4.758 ( 0.000 -7.728 0.000) 7.728 4.786 ( -0.000 3.357 -0.000) 3.357 5.390 ( 0.000 -16.317 0.000) 16.317 5.833 ( 0.000 -8.215 0.000) 8.215 5.870 ( 0.000 -10.797 0.000) 10.797 6.092 ( -0.000 23.285 -0.000) 23.285 6.771 ( 0.000 -11.100 0.000) 11.100 6.795 ( 0.000 -8.968 0.000) 8.968 7.121 ( -0.000 4.243 -0.000) 4.243 7.654 ( 0.000 -18.684 0.000) 18.684 7.930 ( 0.000 -9.760 0.000) 9.760 8.450 ( 0.000 -27.231 0.000) 27.231 8.683 ( 0.000 -6.891 0.000) 6.891 8.720 ( 0.000 -5.251 0.000) 5.251 8.746 ( 0.000 -7.542 0.000) 7.542 9.498 ( -0.000 3.537 -0.000) 3.537 9.780 ( 0.000 -5.674 0.000) 5.674 10.207 ( 0.000 -0.392 0.000) 0.392 12.105 ( -0.000 25.936 -0.000) 25.936 12.528 ( -0.000 5.895 -0.000) 5.895 12.926 ( -0.000 19.423 -0.000) 19.423 13.294 ( -0.000 19.535 -0.000) 19.535 14.242 ( -0.000 28.609 -0.000) 28.609 14.301 ( -0.000 31.361 -0.000) 31.361 15.617 ( 0.000 -49.505 0.000) 49.505 17.662 ( 0.000 -29.658 0.000) 29.658 19.786 ( 0.000 -25.754 0.000) 25.754 21.304 ( 0.000 -43.375 0.000) 43.375 22.510 ( -0.000 0.921 -0.000) 0.921 25.921 ( -0.000 11.778 -0.000) 11.778 26.508 ( 0.000 -1.457 0.000) 1.457 27.638 ( -0.000 1.102 -0.000) 1.102 ======================= Grid point 110 (57/429) ======================= 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 232 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( 0.000 -0.000 0.000) 0.000 2.780 ( 0.000 -0.000 0.000) 0.000 3.150 ( 0.000 -0.000 0.000) 0.000 3.296 ( -0.000 0.000 -0.000) 0.000 4.483 ( 0.000 -0.000 0.000) 0.000 4.985 ( -0.000 0.000 -0.000) 0.000 5.027 ( 0.000 -0.000 0.000) 0.000 5.393 ( 0.000 -0.000 0.000) 0.000 5.729 ( 0.000 -0.000 0.000) 0.000 6.393 ( -0.000 0.000 0.000) 0.000 6.705 ( 0.000 -0.000 0.000) 0.000 7.031 ( 0.000 -0.000 -0.000) 0.000 7.191 ( 0.000 -0.000 -0.000) 0.000 7.357 ( 0.000 -0.000 0.000) 0.000 7.536 ( 0.000 -0.000 0.000) 0.000 7.819 ( 0.000 -0.000 0.000) 0.000 8.515 ( 0.000 -0.000 -0.000) 0.000 8.600 ( 0.000 -0.000 -0.000) 0.000 8.644 ( 0.000 -0.000 0.000) 0.000 9.577 ( -0.000 0.000 0.000) 0.000 9.746 ( 0.000 -0.000 -0.000) 0.000 10.197 ( 0.000 -0.000 0.000) 0.000 12.351 ( 0.000 -0.000 -0.000) 0.000 13.169 ( 0.000 -0.000 0.000) 0.000 13.190 ( 0.000 -0.000 0.000) 0.000 13.805 ( 0.000 -0.000 0.000) 0.000 14.158 ( 0.000 -0.000 0.000) 0.000 15.046 ( 0.000 -0.000 -0.000) 0.000 15.806 ( 0.000 -0.000 -0.000) 0.000 16.348 ( 0.000 -0.000 0.000) 0.000 19.107 ( 0.000 -0.000 0.000) 0.000 20.231 ( 0.000 -0.000 0.000) 0.000 22.532 ( 0.000 -0.000 0.000) 0.000 26.085 ( 0.000 -0.000 0.000) 0.000 26.576 ( 0.000 -0.000 0.000) 0.000 27.666 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 205 (58/429) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.614 ( -2.555 0.000 30.380) 30.487 0.619 ( -2.584 0.000 30.274) 30.384 1.545 ( -5.909 0.000 76.913) 77.140 3.169 ( -0.752 0.000 -1.455) 1.638 4.078 ( -2.401 0.000 -4.166) 4.808 4.432 ( 3.183 -0.000 1.370) 3.466 4.582 ( 0.118 -0.000 -3.248) 3.250 5.070 ( 5.179 -0.000 -12.480) 13.512 5.374 ( 0.353 -0.000 2.368) 2.394 6.511 ( -8.694 0.000 -0.650) 8.718 6.650 ( 2.114 -0.000 -7.473) 7.766 7.406 ( -1.598 0.000 6.702) 6.889 7.428 ( 50.144 -0.000 3.896) 50.295 7.567 ( 3.283 -0.000 -4.801) 5.816 7.783 ( -3.452 0.000 3.628) 5.008 7.970 ( -2.305 0.000 -1.742) 2.889 8.377 ( -0.574 0.000 10.024) 10.041 8.625 ( -0.410 0.000 -13.586) 13.593 8.972 ( -25.790 0.000 3.659) 26.049 9.629 ( -10.673 0.000 -18.540) 21.392 10.264 ( 8.372 -0.000 9.233) 12.464 11.880 ( 1.986 -0.000 -3.289) 3.842 12.533 ( 2.102 -0.000 -1.315) 2.480 12.983 ( -1.758 0.000 6.207) 6.451 13.381 ( -3.180 0.000 1.178) 3.391 13.947 ( 13.883 -0.000 0.696) 13.900 14.163 ( 1.757 -0.000 -0.066) 1.758 14.180 ( 1.126 -0.000 -3.313) 3.499 15.034 ( -49.675 0.000 0.330) 49.676 15.836 ( -0.667 0.000 2.196) 2.295 19.122 ( -0.486 0.000 1.491) 1.568 20.220 ( 0.370 -0.000 -1.218) 1.273 22.715 ( -0.314 0.000 0.403) 0.511 23.609 ( 84.532 -0.000 -7.135) 84.833 26.891 ( -5.885 0.000 2.994) 6.603 29.830 ( 0.079 -0.000 -0.491) 0.497 ======================= Grid point 206 (59/429) ======================= q-point: ( 0.07 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.880 ( 9.460 -19.405 23.309) 31.770 1.204 ( 2.212 -30.735 27.504) 41.304 2.009 ( 8.097 -38.619 53.734) 66.666 3.547 ( -2.634 -35.829 -0.972) 35.939 4.048 ( 5.414 0.124 -5.925) 8.027 4.355 ( 0.606 3.525 -0.848) 3.676 4.734 ( 3.897 -5.370 -1.854) 6.889 5.231 ( 3.400 -18.804 -11.807) 22.462 5.492 ( -0.348 -10.371 4.362) 11.256 6.458 ( -3.588 1.119 0.022) 3.759 6.717 ( 2.924 -6.047 -8.038) 10.475 7.152 ( 8.651 13.335 10.465) 19.031 7.256 ( -2.863 15.900 2.417) 16.335 7.554 ( -1.754 0.766 1.310) 2.319 8.058 ( 8.738 -7.128 -5.343) 12.478 8.413 ( 1.299 -11.339 -0.237) 11.415 8.572 ( 10.428 -18.828 -13.019) 25.154 8.655 ( 0.310 -7.116 -14.321) 15.995 8.950 ( -20.182 -12.320 2.063) 23.735 9.539 ( -10.695 -1.016 -19.112) 21.925 10.285 ( 4.872 3.274 9.104) 10.833 11.842 ( 2.751 17.980 6.677) 19.376 11.956 ( -26.277 41.817 32.375) 59.053 12.516 ( -1.142 6.517 3.489) 7.480 13.044 ( 20.963 17.842 15.164) 31.428 13.302 ( -6.407 6.803 -0.449) 9.356 13.825 ( -0.417 12.701 -0.331) 12.712 14.049 ( 15.382 21.427 4.919) 26.831 16.057 ( 18.995 -41.034 -19.393) 49.201 17.063 ( -43.473 -55.564 -21.132) 73.647 20.186 ( -10.182 -3.724 -3.216) 11.309 20.612 ( -19.195 -102.633 -76.999) 129.734 22.732 ( -6.416 -3.550 0.634) 7.360 24.146 ( 80.940 -6.450 -31.462) 87.079 26.855 ( -7.145 0.347 2.528) 7.587 29.010 ( -19.432 52.193 50.288) 75.037 ======================= Grid point 207 (60/429) ======================= q-point: ( 0.14 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( 10.515 -29.924 15.503) 35.303 1.758 ( 4.401 -23.648 32.730) 40.619 3.050 ( 13.366 -50.424 28.173) 59.287 4.022 ( -5.869 -11.885 -5.621) 14.398 4.286 ( 2.225 -5.910 -1.619) 6.519 4.450 ( 9.523 -30.324 -3.941) 32.028 4.769 ( 6.528 2.511 -0.612) 7.021 5.645 ( 1.574 -13.741 -2.758) 14.103 5.749 ( -4.003 -22.613 -1.087) 22.990 6.477 ( 4.411 -5.134 -0.265) 6.774 6.711 ( -5.547 14.198 -8.919) 17.661 6.960 ( -3.765 -4.259 -1.099) 5.790 7.225 ( 6.488 -7.648 5.044) 11.226 7.535 ( -5.385 0.386 10.006) 11.369 8.146 ( 9.732 2.260 -2.488) 10.296 8.557 ( -1.018 -7.226 -4.961) 8.824 8.763 ( 0.398 -5.272 -9.132) 10.552 8.848 ( -0.016 -16.287 -8.491) 18.368 9.186 ( -12.710 -16.579 -8.869) 22.695 9.526 ( -6.021 -8.647 -13.449) 17.085 10.249 ( 0.990 3.741 8.631) 9.459 11.157 ( -17.099 25.190 26.424) 40.313 11.826 ( 1.861 3.550 -7.037) 8.098 12.317 ( -1.197 17.480 9.044) 19.718 12.751 ( 16.614 29.399 6.201) 34.333 13.103 ( -7.480 6.074 -1.209) 9.711 13.625 ( 5.757 8.881 1.934) 10.759 13.717 ( 10.411 20.974 4.869) 23.916 16.974 ( 14.903 -46.364 -10.376) 49.793 17.554 ( -34.848 -31.078 -7.428) 47.280 20.158 ( -4.458 0.000 -0.062) 4.459 21.741 ( -16.372 -47.407 -58.670) 77.186 22.788 ( -12.967 -8.888 0.609) 15.732 24.537 ( 54.019 -0.047 -32.335) 62.957 26.817 ( -8.432 -0.940 2.885) 8.961 28.272 ( -11.716 28.298 51.106) 59.580 ======================= Grid point 208 (61/429) ======================= q-point: ( 0.21 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 9.645 -28.537 12.193) 32.497 2.292 ( 6.916 -23.838 27.176) 36.805 3.970 ( 11.803 -29.969 16.289) 36.094 4.220 ( 2.225 -12.262 -3.571) 12.964 4.342 ( -5.082 -8.078 -1.137) 9.611 4.718 ( 6.968 2.454 -1.432) 7.525 5.098 ( 6.729 -20.221 -0.361) 21.314 5.777 ( 4.521 -5.072 5.330) 8.636 6.082 ( -11.026 -13.602 -8.225) 19.345 6.337 ( -11.888 12.990 -8.358) 19.492 6.739 ( 12.864 -11.675 -6.924) 18.701 7.069 ( 0.379 -5.586 0.538) 5.625 7.503 ( -9.614 -4.190 14.688) 18.048 7.607 ( 0.138 -24.998 -1.308) 25.032 8.168 ( 12.977 -1.199 4.766) 13.876 8.683 ( -0.865 -8.020 -9.902) 12.772 8.856 ( -0.901 -7.650 -7.826) 10.981 9.143 ( -8.271 -13.713 -11.506) 19.719 9.379 ( -5.351 -19.515 -7.809) 21.690 9.774 ( -1.602 -18.989 -4.028) 19.478 10.204 ( -1.554 1.839 7.275) 7.663 10.741 ( -12.720 15.885 13.360) 24.344 11.684 ( -2.364 15.230 -2.421) 15.601 11.903 ( 5.855 23.416 8.780) 25.684 12.275 ( 7.338 25.948 -0.019) 26.965 13.020 ( -3.065 0.893 2.289) 3.928 13.435 ( 6.095 14.230 5.075) 16.291 13.541 ( 6.535 5.641 2.358) 8.949 17.791 ( 8.715 -29.370 -20.466) 36.843 17.904 ( -27.735 -30.720 10.415) 42.678 20.155 ( 0.409 -1.091 0.680) 1.349 22.169 ( -0.615 -15.667 -34.369) 37.776 22.942 ( -18.061 -17.037 -2.910) 24.999 24.669 ( 34.985 6.661 -19.957) 40.824 26.820 ( -7.748 -3.910 2.580) 9.054 27.919 ( -5.902 14.636 36.113) 39.410 ======================= Grid point 209 (62/429) ======================= q-point: ( 0.29 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.653 ( 7.950 -22.256 12.517) 26.743 2.814 ( 7.021 -22.512 20.409) 31.187 4.272 ( 3.807 -3.185 3.036) 5.818 4.362 ( -1.084 -6.241 -4.540) 7.793 4.519 ( 5.129 -1.117 -3.991) 6.594 4.922 ( -3.439 -19.823 13.686) 24.333 5.177 ( 6.985 10.404 2.902) 12.863 5.956 ( -7.350 -3.578 -6.070) 10.182 6.032 ( -2.378 5.721 -4.333) 7.561 6.270 ( -3.861 -12.496 -3.649) 13.579 6.867 ( 8.469 0.590 -6.721) 10.828 7.135 ( -8.510 -3.594 -3.429) 9.854 7.518 ( 2.621 -0.253 8.880) 9.263 8.208 ( -0.247 -29.098 3.931) 29.364 8.389 ( 5.097 -14.593 6.916) 16.934 8.804 ( -1.560 -8.869 -12.407) 15.330 9.053 ( 1.788 -15.278 -5.382) 16.296 9.240 ( -8.161 -7.363 -8.657) 13.991 9.816 ( -1.002 -23.707 -5.886) 24.447 10.139 ( -3.071 -19.169 5.306) 20.126 10.194 ( -1.224 1.145 -1.246) 2.089 10.476 ( -3.917 2.968 3.232) 5.882 11.278 ( -7.784 19.117 13.504) 24.666 11.542 ( 3.616 22.863 0.942) 23.166 11.969 ( 10.083 11.329 -3.741) 15.621 13.008 ( -2.145 0.794 5.010) 5.508 13.262 ( 2.995 7.547 2.937) 8.635 13.490 ( 4.807 3.917 2.694) 6.761 18.081 ( -16.609 -16.607 -11.042) 25.954 18.405 ( -2.814 -21.062 4.848) 21.795 20.209 ( 5.867 -2.575 0.631) 6.438 22.286 ( 4.046 -3.034 -20.363) 20.981 23.168 ( -15.342 -16.755 -5.140) 23.293 24.653 ( 23.324 8.978 -9.039) 26.576 26.882 ( -5.885 -6.057 2.243) 8.738 27.741 ( -2.773 8.511 23.773) 25.402 ======================= Grid point 210 (63/429) ======================= q-point: ( 0.36 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.055 ( 6.140 -13.374 12.394) 19.240 3.268 ( 4.294 -18.498 16.164) 24.938 4.310 ( 5.348 1.586 3.045) 6.355 4.378 ( -3.561 0.270 -6.390) 7.320 4.567 ( -1.123 -1.034 -3.131) 3.483 4.927 ( -0.868 9.585 5.058) 10.872 5.228 ( -6.686 -6.909 3.602) 10.267 5.727 ( -3.892 12.906 0.923) 13.511 6.045 ( 1.144 -2.379 -4.744) 5.429 6.503 ( 2.084 -9.208 -3.575) 10.095 6.922 ( 6.922 -3.797 -1.156) 7.979 7.136 ( -10.265 -4.943 -5.442) 12.626 7.579 ( 5.661 -1.031 8.073) 9.914 8.414 ( -2.368 -0.067 4.173) 4.799 8.756 ( -5.275 -15.292 -4.302) 16.738 8.985 ( -0.142 -12.103 -7.745) 14.370 9.335 ( -3.197 -10.499 -8.969) 14.174 9.446 ( 3.502 -21.165 2.102) 21.556 9.982 ( 5.510 12.095 -6.222) 14.676 10.136 ( 4.136 -7.989 0.437) 9.007 10.461 ( -5.878 -17.364 4.774) 18.943 10.697 ( -7.471 -10.848 7.428) 15.122 10.971 ( -4.921 8.936 1.017) 10.252 11.293 ( 0.389 -1.014 10.266) 10.323 11.848 ( 11.970 8.990 -6.262) 16.227 12.935 ( -2.873 6.389 6.497) 9.554 13.218 ( 1.493 -0.498 1.187) 1.971 13.456 ( 2.335 2.349 2.203) 3.977 18.246 ( -13.578 -12.418 -7.247) 19.776 18.649 ( -3.044 -6.997 3.424) 8.364 20.304 ( 7.713 -2.779 0.233) 8.202 22.298 ( 4.268 0.230 -14.501) 15.118 23.348 ( -10.134 -10.869 -3.809) 15.341 24.588 ( 14.944 8.012 -2.980) 17.216 26.976 ( -4.203 -6.346 2.771) 8.100 27.634 ( -1.265 5.965 15.357) 16.523 ======================= Grid point 211 (64/429) ======================= q-point: ( 0.43 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.245 ( 4.925 -1.128 9.599) 10.848 3.602 ( -0.074 -12.554 13.393) 18.357 4.263 ( -1.992 10.968 -0.363) 11.153 4.309 ( -1.010 1.318 -1.183) 2.039 4.502 ( -0.068 1.400 1.571) 2.106 4.893 ( -3.643 -5.427 -3.379) 7.358 5.194 ( -13.297 1.197 -4.531) 14.099 5.568 ( 9.968 6.545 8.677) 14.747 6.086 ( 1.923 -0.461 1.036) 2.232 6.604 ( -1.401 -3.296 -5.223) 6.333 7.019 ( 1.138 -3.364 -3.850) 5.237 7.235 ( -2.232 -9.023 -0.696) 9.321 7.618 ( 3.714 1.754 8.550) 9.485 8.356 ( -3.559 3.215 3.983) 6.234 8.872 ( -5.434 -4.214 -9.831) 11.997 9.177 ( -0.340 -8.674 -3.783) 9.469 9.472 ( 0.790 -4.554 -12.081) 12.935 9.758 ( -0.337 -7.123 0.829) 7.179 9.927 ( 9.719 -7.233 -2.693) 12.411 10.184 ( 7.848 7.205 -2.245) 10.888 10.621 ( -7.824 3.563 17.081) 19.123 10.683 ( -9.057 -4.658 9.441) 13.887 11.013 ( -2.233 -11.080 -4.222) 12.066 11.541 ( -1.620 -14.515 6.110) 15.832 11.742 ( 10.307 6.790 -5.540) 13.529 12.806 ( -2.924 5.827 5.126) 8.293 13.253 ( 0.859 -1.458 1.221) 2.087 13.434 ( 0.304 1.236 1.069) 1.662 18.377 ( -8.381 -9.578 -4.096) 13.370 18.686 ( -0.850 1.391 1.847) 2.464 20.385 ( 4.928 -1.763 0.095) 5.235 22.287 ( 4.033 0.558 -12.190) 12.852 23.451 ( -4.955 -5.579 -1.652) 7.642 24.519 ( 7.508 5.774 -1.127) 9.538 27.073 ( -3.072 -5.390 4.127) 7.452 27.550 ( -1.002 4.940 9.817) 11.035 ======================= Grid point 212 (65/429) ======================= q-point: (-0.50 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.211 ( 4.554 7.953 5.360) 10.617 3.717 ( -3.033 5.764 9.002) 11.111 4.052 ( -3.093 2.072 0.413) 3.746 4.285 ( -2.476 0.839 -2.554) 3.655 4.545 ( -1.809 -4.619 2.818) 5.706 4.991 ( 0.779 -3.599 -1.507) 3.979 5.143 ( -11.044 -6.894 -4.918) 13.917 5.571 ( 13.776 3.838 12.573) 19.042 6.080 ( 2.142 1.913 0.115) 2.874 6.610 ( -5.285 -0.568 -5.548) 7.684 7.063 ( -1.358 -2.233 -6.431) 6.941 7.340 ( -1.398 -0.712 4.124) 4.412 7.610 ( 1.935 1.163 8.340) 8.640 8.322 ( 0.762 -0.596 4.147) 4.258 8.861 ( -4.929 -0.403 -11.674) 12.679 9.252 ( 5.860 3.017 1.762) 6.823 9.510 ( 5.362 -3.643 -17.287) 18.462 9.881 ( -4.889 -5.956 -0.647) 7.732 9.996 ( 3.989 6.462 -8.579) 11.457 10.181 ( 5.991 -7.376 3.013) 9.969 10.550 ( -12.236 11.123 13.788) 21.530 10.613 ( 3.071 2.076 16.489) 16.900 11.200 ( -3.420 -8.225 -8.346) 12.207 11.589 ( 1.811 8.373 5.510) 10.185 11.788 ( -1.071 -6.104 -0.487) 6.216 12.725 ( -1.189 2.054 3.397) 4.144 13.273 ( 0.348 0.149 1.189) 1.248 13.413 ( -0.709 1.024 -0.180) 1.258 18.496 ( -1.271 -5.932 -0.192) 6.070 18.622 ( 1.677 4.835 -1.041) 5.222 20.421 ( -0.238 -0.512 0.426) 0.707 22.284 ( 4.013 -0.184 -11.598) 12.274 23.506 ( 0.320 -2.098 0.050) 2.123 24.453 ( 0.353 3.269 -2.132) 3.919 27.155 ( -2.198 -3.781 6.561) 7.886 27.472 ( -1.868 3.983 5.979) 7.423 ======================= Grid point 213 (66/429) ======================= q-point: (-0.43 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.045 ( 2.817 12.732 3.272) 13.444 3.458 ( -3.668 16.977 5.829) 18.320 4.092 ( -8.359 -4.381 -7.537) 12.078 4.279 ( 2.376 -2.324 2.634) 4.241 4.645 ( -1.484 -6.153 4.321) 7.664 4.980 ( 0.428 3.087 -0.796) 3.217 5.313 ( -6.664 -12.831 -2.508) 14.674 5.593 ( 14.063 4.592 13.894) 20.296 6.075 ( 5.829 -0.251 -2.201) 6.236 6.547 ( -8.094 2.402 -5.021) 9.823 7.040 ( -5.225 1.160 -11.717) 12.882 7.285 ( 0.185 5.267 12.664) 13.717 7.615 ( -2.554 0.694 4.838) 5.515 8.398 ( 6.761 -2.358 5.222) 8.862 8.807 ( -1.413 1.468 -11.076) 11.262 9.162 ( 10.016 10.256 -0.788) 14.357 9.542 ( -0.959 3.586 -12.450) 12.992 9.846 ( 5.464 0.994 -9.103) 10.663 10.009 ( -2.953 -2.653 -5.451) 6.744 10.143 ( -5.655 15.636 7.692) 18.320 10.434 ( 0.004 -6.862 16.047) 17.453 10.655 ( 2.987 -0.853 12.087) 12.480 11.157 ( -3.230 10.035 -10.116) 14.611 11.351 ( -0.385 16.985 6.643) 18.242 11.886 ( -7.645 -7.504 0.214) 10.715 12.734 ( 1.585 -2.369 2.219) 3.612 13.256 ( -0.200 1.823 1.572) 2.416 13.391 ( -1.461 0.308 -1.064) 1.834 18.460 ( 10.076 11.350 -1.766) 15.279 18.645 ( -0.500 -5.685 1.116) 5.815 20.401 ( -5.426 1.113 1.057) 5.639 22.299 ( 4.278 -1.248 -12.080) 12.876 23.534 ( 6.761 1.454 0.898) 6.974 24.393 ( -6.701 0.517 -5.333) 8.579 27.214 ( -1.083 -1.980 10.849) 11.081 27.401 ( -3.709 2.960 2.797) 5.508 ======================= Grid point 214 (67/429) ======================= q-point: (-0.36 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.772 ( -1.899 17.756 4.451) 18.404 3.098 ( -5.981 20.055 6.687) 21.970 4.074 ( -8.202 -2.029 -7.399) 11.231 4.375 ( 5.917 -2.815 -0.717) 6.592 4.729 ( 1.231 0.962 2.239) 2.730 4.933 ( -3.804 -0.511 1.637) 4.173 5.327 ( -7.970 6.595 9.367) 13.956 5.731 ( 17.126 -7.577 -0.716) 18.741 6.161 ( 10.317 -3.850 -1.299) 11.088 6.398 ( -10.483 7.030 -3.072) 12.990 6.942 ( -5.669 2.213 -14.308) 15.548 7.228 ( 1.334 4.666 11.869) 12.823 7.580 ( -6.212 -0.272 4.561) 7.712 8.371 ( 2.107 11.310 3.565) 12.045 8.704 ( 7.075 14.659 -4.828) 16.978 9.057 ( 7.896 3.483 -3.941) 9.488 9.321 ( -3.900 13.909 -6.829) 15.978 9.652 ( -0.027 14.464 0.535) 14.474 10.029 ( 0.222 2.204 0.667) 2.313 10.120 ( -1.166 -13.075 -6.971) 14.863 10.545 ( 9.747 20.254 -0.597) 22.486 10.600 ( -1.360 -5.118 24.189) 24.762 10.799 ( -3.912 22.449 -5.939) 23.549 11.234 ( -1.422 -12.280 2.936) 12.706 11.964 ( -10.984 -6.093 -2.011) 12.721 12.828 ( 2.845 -5.144 2.083) 6.237 13.221 ( -0.211 1.558 2.037) 2.573 13.391 ( -3.435 -2.241 -1.107) 4.248 18.251 ( 14.386 17.786 -5.995) 23.648 18.735 ( 1.324 -2.141 5.778) 6.303 20.323 ( -8.325 3.209 1.518) 9.050 22.333 ( 4.755 -2.161 -13.415) 14.395 23.522 ( 15.290 7.085 1.089) 16.887 24.338 ( -13.353 -2.269 -11.497) 17.766 27.265 ( 1.158 -0.780 17.498) 17.554 27.324 ( -6.837 2.272 0.048) 7.205 ======================= Grid point 215 (68/429) ======================= q-point: (-0.29 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -6.061 22.613 8.271) 24.830 2.650 ( -9.013 25.089 9.346) 28.250 4.058 ( -4.750 0.113 -2.915) 5.575 4.397 ( 1.504 3.479 -2.835) 4.733 4.614 ( 0.586 10.975 -0.272) 10.994 4.787 ( -1.854 16.259 2.786) 16.600 5.285 ( -12.877 -8.009 9.056) 17.663 5.860 ( 13.682 8.405 -8.276) 18.064 6.217 ( -1.172 2.818 5.663) 6.433 6.315 ( 9.958 -5.090 -3.249) 11.646 6.860 ( -3.980 0.898 -15.455) 15.984 7.126 ( -0.936 8.124 1.997) 8.418 7.610 ( -6.473 -3.914 10.364) 12.831 8.013 ( 0.978 26.327 0.486) 26.350 8.303 ( 1.561 25.476 1.464) 25.566 9.007 ( 4.724 6.558 -4.005) 9.020 9.012 ( -2.448 15.207 -5.763) 16.445 9.575 ( 2.884 -2.907 -1.471) 4.351 9.884 ( 3.382 27.066 -4.062) 27.577 10.013 ( 1.708 5.491 5.712) 8.105 10.323 ( -1.764 22.733 -1.166) 22.831 10.516 ( 3.983 -9.144 3.233) 10.484 10.874 ( 2.160 -23.638 8.661) 25.267 11.654 ( 0.055 -27.090 2.848) 27.239 11.981 ( -10.281 -3.165 -4.921) 11.829 12.941 ( 1.874 -4.787 3.018) 5.961 13.228 ( -0.213 -2.709 1.882) 3.306 13.433 ( -6.344 -5.225 -0.407) 8.229 17.917 ( 18.199 26.930 -10.096) 34.035 18.731 ( -2.332 4.760 10.657) 11.903 20.208 ( -6.138 4.167 1.064) 7.495 22.380 ( 5.260 -2.513 -15.825) 16.865 23.443 ( 25.132 13.707 1.310) 28.657 24.270 ( -17.959 -2.638 -23.153) 29.420 27.218 ( -5.071 4.521 0.481) 6.811 27.355 ( -1.377 -4.373 24.843) 25.262 ======================= Grid point 216 (69/429) ======================= q-point: (-0.21 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( -7.740 25.798 12.902) 29.865 2.099 ( -11.177 29.268 15.609) 35.003 3.798 ( -11.253 31.999 7.701) 34.783 4.232 ( -0.695 9.865 0.330) 9.895 4.354 ( 2.771 9.218 1.725) 9.778 4.644 ( 1.890 0.413 -10.976) 11.145 5.176 ( -13.402 20.469 2.135) 24.559 5.711 ( -0.619 1.933 2.680) 3.362 6.187 ( 12.555 11.626 -0.790) 17.129 6.443 ( 1.997 -2.811 -2.955) 4.541 6.806 ( -0.962 -1.230 -14.027) 14.113 6.924 ( -1.248 10.841 -3.473) 11.452 7.443 ( -1.529 19.853 13.936) 24.304 7.681 ( 1.066 11.586 7.601) 13.898 7.990 ( -2.152 1.641 -5.771) 6.374 8.730 ( 2.356 12.923 -5.203) 14.129 8.896 ( 2.535 6.109 -5.724) 8.747 9.288 ( 1.382 28.262 -3.112) 28.467 9.703 ( 2.884 -1.540 -11.981) 12.419 9.932 ( -6.806 13.056 -0.731) 14.742 10.024 ( 5.051 0.815 9.513) 10.802 10.717 ( 5.619 -8.841 21.406) 23.832 11.510 ( 3.957 -38.035 -0.813) 38.248 11.946 ( -4.452 -0.263 -4.408) 6.270 12.156 ( -2.502 -23.322 -1.004) 23.477 13.064 ( 0.821 -8.254 5.033) 9.703 13.343 ( -1.446 -9.952 0.958) 10.102 13.503 ( -8.705 -6.616 0.226) 10.936 17.392 ( 20.425 38.785 -13.360) 45.825 18.548 ( -10.982 13.323 14.202) 22.357 20.129 ( 1.297 2.354 -0.316) 2.706 22.419 ( 5.383 -1.686 -20.943) 21.690 23.317 ( 36.867 18.097 2.011) 41.118 24.096 ( -20.528 5.018 -43.789) 48.622 27.098 ( -6.570 4.565 0.253) 8.004 27.539 ( -0.169 -10.463 38.938) 40.320 ======================= Grid point 217 (70/429) ======================= q-point: (-0.14 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.357 ( -11.047 29.569 12.775) 34.052 1.556 ( -9.259 25.116 31.854) 41.608 2.888 ( -14.533 54.473 18.489) 59.333 4.057 ( 4.290 12.438 -2.609) 13.413 4.291 ( 3.185 1.757 1.146) 3.814 4.463 ( -11.321 29.462 -4.398) 31.868 4.722 ( -2.495 1.428 -5.883) 6.548 5.657 ( -2.124 7.465 3.402) 8.474 5.780 ( 3.335 30.881 -6.430) 31.719 6.463 ( -2.930 -3.024 -0.213) 4.216 6.782 ( 0.727 4.321 -4.765) 6.474 6.914 ( 11.749 -4.548 -0.879) 12.629 7.180 ( -6.836 3.553 -2.408) 8.071 7.561 ( -3.489 1.648 15.600) 16.070 8.029 ( 4.493 -1.235 -9.489) 10.571 8.545 ( 6.139 9.058 -4.586) 11.865 8.782 ( 5.319 8.825 -9.511) 14.022 8.816 ( 2.294 19.974 -3.102) 20.343 9.566 ( -13.074 9.966 -4.916) 17.159 9.774 ( -3.857 0.195 -14.760) 15.257 10.096 ( 4.426 -1.874 10.685) 11.717 11.059 ( 7.082 -20.129 35.361) 41.300 11.908 ( -3.336 0.079 -5.212) 6.188 12.211 ( 3.232 -29.858 3.443) 30.229 12.474 ( 2.641 -12.411 -3.491) 13.160 13.311 ( -6.050 -17.086 6.759) 19.345 13.576 ( -3.206 -13.669 -0.043) 14.040 13.597 ( -4.971 -11.104 -0.795) 12.192 16.666 ( 20.750 46.989 -15.458) 53.642 18.172 ( -19.523 19.702 11.704) 30.104 20.134 ( 7.432 0.103 -1.485) 7.580 22.385 ( 3.867 5.601 -41.615) 42.168 23.217 ( 62.669 23.178 -1.735) 66.841 23.580 ( -32.642 25.420 -62.867) 75.259 26.987 ( -6.829 3.044 2.234) 7.803 27.947 ( 2.442 -25.279 57.691) 63.034 ======================= Grid point 218 (71/429) ======================= q-point: (-0.07 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.809 ( -12.258 21.490 21.315) 32.656 1.134 ( -8.150 26.614 31.748) 42.222 1.848 ( -14.189 44.819 47.182) 66.605 3.561 ( 0.610 35.216 -0.428) 35.223 4.098 ( -10.480 0.417 -4.284) 11.329 4.330 ( 3.694 -3.156 0.308) 4.868 4.709 ( 2.314 3.821 -4.715) 6.495 5.242 ( 2.827 20.706 -12.347) 24.273 5.480 ( -0.326 10.253 3.880) 10.968 6.514 ( -6.795 -4.182 0.571) 7.999 6.703 ( 3.732 4.447 -6.401) 8.642 7.002 ( 8.372 -3.317 7.771) 11.895 7.301 ( -4.633 -13.963 1.977) 14.844 7.570 ( -2.140 -1.244 2.874) 3.793 7.986 ( 8.084 7.970 -9.626) 14.884 8.363 ( 12.107 19.408 -6.686) 23.832 8.485 ( 5.000 13.940 1.345) 14.870 8.689 ( 3.483 4.202 -14.927) 15.894 9.249 ( -28.576 9.840 -6.414) 30.895 9.716 ( -8.366 -0.283 -16.692) 18.673 10.177 ( 6.928 -1.646 10.137) 12.388 11.793 ( 2.661 -38.318 34.130) 51.383 11.930 ( 7.185 -19.402 20.039) 28.803 12.523 ( -3.058 -7.936 3.044) 9.033 12.786 ( 11.308 -13.584 3.385) 17.996 13.481 ( -24.653 -8.541 7.641) 27.187 13.852 ( -0.032 -12.444 1.192) 12.501 13.900 ( 5.621 -21.295 -2.648) 22.183 15.906 ( 20.134 39.539 -19.641) 48.524 17.572 ( -32.127 37.771 -10.788) 50.746 20.178 ( 9.385 0.956 -3.387) 10.024 21.321 ( -13.890 120.091 -141.674) 186.243 22.796 ( 7.491 16.267 -6.336) 18.996 23.300 ( 50.051 7.850 6.306) 51.054 26.922 ( -6.184 0.728 3.628) 7.207 28.846 ( 12.919 -56.238 61.277) 84.169 ======================= Grid point 220 (72/429) ======================= q-point: ( 0.07 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.789 ( 12.150 -0.000 26.596) 29.240 0.926 ( 30.689 -0.000 24.932) 39.540 1.862 ( 13.447 -0.000 71.166) 72.425 3.159 ( 0.115 -0.000 -2.134) 2.137 4.100 ( 8.893 -0.000 -6.259) 10.875 4.462 ( 1.827 -0.000 0.483) 1.890 4.565 ( -0.875 0.000 -3.377) 3.489 5.100 ( 7.267 -0.000 -9.267) 11.777 5.388 ( 0.397 -0.000 2.611) 2.641 6.442 ( -5.123 0.000 -0.643) 5.163 6.646 ( 1.988 -0.000 -7.490) 7.749 7.408 ( -2.028 0.000 5.678) 6.030 7.590 ( 3.208 -0.000 -3.291) 4.596 7.759 ( -2.808 0.000 3.036) 4.135 7.849 ( -0.655 0.000 -3.841) 3.896 8.003 ( 31.553 -0.000 -11.054) 33.433 8.362 ( -6.092 0.000 10.097) 11.792 8.595 ( 2.084 -0.000 -8.487) 8.739 8.814 ( -6.930 0.000 -0.382) 6.941 9.426 ( -12.163 0.000 -20.492) 23.829 10.363 ( 3.021 -0.000 7.451) 8.041 11.916 ( 2.231 -0.000 -0.594) 2.308 12.525 ( -32.522 0.000 12.435) 34.818 12.586 ( -26.865 0.000 14.894) 30.718 13.331 ( 1.289 -0.000 -3.835) 4.046 13.855 ( -13.130 0.000 6.452) 14.629 14.178 ( 0.631 -0.000 -3.286) 3.346 14.218 ( 10.520 -0.000 -1.160) 10.583 15.253 ( 45.115 -0.000 -13.850) 47.193 15.836 ( -0.755 0.000 2.201) 2.327 19.122 ( -0.484 0.000 1.491) 1.568 20.219 ( 0.370 -0.000 -1.228) 1.282 22.683 ( -3.499 0.000 -1.000) 3.639 24.480 ( 75.633 -0.000 -40.531) 85.809 26.828 ( -6.332 0.000 1.533) 6.515 29.499 ( -51.138 0.000 25.506) 57.145 ======================= Grid point 221 (73/429) ======================= q-point: ( 0.14 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( 19.585 -16.040 19.775) 32.123 1.393 ( 12.792 -24.663 27.639) 39.190 2.398 ( 25.245 -32.712 50.949) 65.598 3.507 ( -2.692 -31.270 -2.164) 31.460 4.155 ( 15.528 -4.072 -7.273) 17.624 4.338 ( -2.082 4.670 -2.760) 5.811 4.777 ( 4.130 -8.608 -0.227) 9.550 5.240 ( 5.421 -15.278 -9.953) 19.023 5.504 ( -0.217 -10.289 4.430) 11.205 6.420 ( -3.132 -1.519 -1.199) 3.682 6.708 ( 1.073 -6.334 -8.664) 10.787 7.156 ( -6.635 26.426 1.607) 27.294 7.333 ( 5.978 8.274 9.285) 13.799 7.548 ( 0.510 2.558 0.836) 2.739 8.116 ( 2.348 -10.874 -1.143) 11.184 8.406 ( -5.914 -6.127 5.323) 10.042 8.584 ( 8.775 -22.194 -22.576) 32.852 8.630 ( 0.835 -4.954 -8.267) 9.674 8.810 ( -7.134 -6.763 0.589) 9.848 9.343 ( -11.004 -3.099 -19.077) 22.240 10.343 ( -0.264 3.805 7.672) 8.567 11.651 ( -43.161 31.797 31.979) 62.422 11.957 ( 14.105 12.314 0.327) 18.727 12.516 ( -0.886 6.316 1.964) 6.674 13.158 ( -1.528 9.928 2.488) 10.349 13.406 ( 14.829 21.893 4.355) 26.798 13.859 ( 6.704 11.789 0.610) 13.575 14.266 ( 17.414 23.408 9.228) 30.600 16.195 ( 15.991 -40.457 -14.109) 45.733 16.512 ( -36.727 -56.605 -22.249) 71.050 19.912 ( -21.825 -40.948 -13.052) 48.202 20.420 ( 5.103 -42.198 -22.003) 47.863 22.670 ( -4.666 -1.274 -1.212) 4.987 24.791 ( 57.343 0.280 -42.123) 71.152 26.783 ( -7.049 0.988 2.260) 7.468 28.864 ( -34.167 33.186 48.333) 67.858 ======================= Grid point 222 (74/429) ======================= q-point: ( 0.21 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 17.706 -25.382 14.480) 34.167 1.956 ( 10.077 -23.281 29.186) 38.670 3.372 ( 22.613 -43.125 32.150) 58.350 3.952 ( -2.232 -16.172 -5.497) 17.226 4.268 ( -3.820 0.531 -3.828) 5.434 4.578 ( 15.428 -30.655 -7.189) 35.063 4.848 ( 6.780 2.304 1.475) 7.311 5.654 ( 2.173 -23.571 -10.952) 26.082 5.710 ( -1.831 -9.117 7.839) 12.162 6.530 ( 3.988 -11.247 -2.832) 12.265 6.599 ( -7.554 20.951 -4.260) 22.675 6.890 ( -6.706 -9.387 -4.878) 12.525 7.314 ( 4.536 -1.709 7.612) 9.024 7.515 ( -3.113 0.503 6.431) 7.163 8.256 ( 9.426 -0.958 0.738) 9.503 8.517 ( -3.266 -7.632 -3.555) 9.031 8.722 ( -1.174 -3.912 -13.005) 13.631 8.786 ( -3.613 -14.514 -10.392) 18.213 9.035 ( -7.824 -14.343 -6.671) 17.648 9.419 ( -5.456 -14.553 -10.352) 18.674 10.268 ( -3.051 4.337 7.565) 9.238 11.014 ( -23.303 20.655 23.338) 38.915 11.859 ( 8.473 7.918 -6.137) 13.120 12.317 ( -3.853 14.753 8.076) 17.254 12.942 ( 11.598 35.110 1.637) 37.012 13.044 ( -1.348 3.282 0.730) 3.622 13.716 ( 8.560 8.462 1.820) 12.173 13.875 ( 13.112 25.850 7.962) 30.059 17.048 ( -23.961 -44.295 14.260) 52.341 17.150 ( -0.308 -38.496 -34.447) 51.659 20.088 ( -7.495 -5.401 1.026) 9.296 21.419 ( -7.906 -52.273 -39.217) 65.825 22.679 ( -7.587 -4.026 -0.069) 8.589 24.947 ( 40.089 5.062 -33.638) 52.576 26.739 ( -7.532 -0.682 3.991) 8.551 28.283 ( -16.769 22.374 44.863) 52.863 ======================= Grid point 223 (75/429) ======================= q-point: ( 0.29 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( 13.883 -25.362 11.548) 31.134 2.493 ( 11.248 -22.147 25.113) 35.322 4.137 ( 7.126 -12.547 0.737) 14.448 4.245 ( -1.355 -5.028 -3.797) 6.444 4.309 ( 4.309 -27.722 15.011) 31.818 4.799 ( 7.355 4.957 0.993) 8.925 5.175 ( 7.999 -19.183 -3.989) 21.164 5.838 ( -2.602 -4.257 7.042) 8.630 5.962 ( -0.079 -9.774 -10.306) 14.204 6.183 ( -8.806 9.930 -5.040) 14.197 6.849 ( 10.097 -9.607 -5.870) 15.123 6.990 ( -12.726 -5.789 -3.624) 14.443 7.488 ( -2.794 -7.523 14.843) 16.874 7.617 ( 2.804 -21.690 -1.384) 21.914 8.337 ( 12.141 -1.996 7.033) 14.172 8.627 ( -2.129 -6.984 -10.979) 13.185 8.801 ( -2.433 -9.401 -11.075) 14.729 9.007 ( -6.866 -11.743 -11.430) 17.767 9.310 ( -3.186 -23.661 -4.672) 24.327 9.728 ( -4.669 -20.537 -2.661) 21.228 10.192 ( -4.969 2.057 5.785) 7.898 10.646 ( -12.400 12.629 14.546) 22.909 11.638 ( -4.151 18.919 -2.064) 19.479 11.995 ( 5.686 19.610 6.918) 21.557 12.367 ( 8.473 28.104 -1.659) 29.400 13.007 ( -0.788 0.691 2.353) 2.576 13.537 ( 7.856 17.660 6.191) 20.296 13.625 ( 6.565 6.634 2.414) 9.640 17.509 ( -30.506 -29.095 -8.245) 42.955 17.901 ( 7.197 -33.628 -2.708) 34.496 20.167 ( 1.083 -5.041 1.624) 5.405 22.046 ( 0.432 -24.113 -30.023) 38.510 22.767 ( -12.554 -12.514 0.246) 17.728 24.948 ( 27.642 9.352 -21.370) 36.169 26.752 ( -6.372 -4.250 4.133) 8.703 27.962 ( -8.461 13.032 32.091) 35.655 ======================= Grid point 224 (76/429) ======================= q-point: ( 0.36 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.799 ( 10.103 -20.256 11.303) 25.301 2.991 ( 10.396 -19.378 20.538) 30.090 4.223 ( -8.461 -3.820 -6.638) 11.413 4.370 ( 4.467 -6.586 -4.505) 9.145 4.616 ( 10.050 5.619 1.417) 11.602 4.895 ( -10.321 -12.307 13.888) 21.233 5.296 ( 11.331 8.934 1.184) 14.478 5.779 ( -15.008 -0.894 0.184) 15.036 6.021 ( -0.626 -0.808 -6.378) 6.459 6.301 ( 10.000 -12.998 -0.752) 16.418 6.924 ( 3.634 0.172 -8.040) 8.825 6.975 ( -13.373 -3.595 -4.474) 14.552 7.588 ( 2.985 -2.914 8.787) 9.727 8.229 ( 2.275 -29.002 0.568) 29.096 8.470 ( 3.985 -4.831 8.050) 10.200 8.749 ( -0.399 -10.615 -10.097) 14.655 9.049 ( 0.802 -20.062 -6.592) 21.132 9.131 ( -4.418 -8.180 -9.391) 13.214 9.786 ( -1.085 -24.918 -4.393) 25.325 10.065 ( -11.400 -12.810 2.900) 17.392 10.196 ( 0.624 -8.748 1.130) 8.843 10.468 ( -0.864 1.286 7.037) 7.206 11.197 ( -12.304 19.341 7.575) 24.142 11.604 ( 5.093 24.939 2.737) 25.600 12.084 ( 12.404 10.465 -4.303) 16.789 12.998 ( -2.726 0.883 4.626) 5.441 13.321 ( 4.714 10.087 3.926) 11.806 13.549 ( 3.916 5.133 2.327) 6.863 17.817 ( -21.998 -21.696 -7.993) 31.915 18.407 ( 0.039 -18.430 2.109) 18.551 20.287 ( 6.997 -4.500 1.012) 8.380 22.264 ( 4.815 -4.920 -18.898) 20.112 22.998 ( -12.036 -18.040 -2.752) 21.860 24.855 ( 18.824 10.915 -11.056) 24.407 26.833 ( -4.577 -6.602 3.734) 8.859 27.783 ( -4.330 8.128 21.246) 23.156 ======================= Grid point 225 (77/429) ======================= q-point: ( 0.43 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.180 ( 7.668 -12.163 11.661) 18.513 3.390 ( 6.188 -14.026 17.409) 23.197 4.224 ( -10.952 -3.217 -6.871) 13.323 4.418 ( 5.199 4.314 -3.539) 7.627 4.558 ( 1.457 1.724 -3.931) 4.533 4.899 ( -9.162 5.683 9.997) 14.703 5.151 ( -5.779 4.728 -3.158) 8.107 5.737 ( 3.044 3.909 6.695) 8.329 6.062 ( 2.545 -3.452 1.918) 4.698 6.513 ( 2.845 -5.350 -6.426) 8.832 6.921 ( -7.551 -4.060 -12.913) 15.500 7.065 ( 4.257 -8.801 2.966) 10.217 7.662 ( 2.933 -1.061 9.157) 9.674 8.415 ( -0.458 2.502 6.238) 6.737 8.669 ( -6.078 -11.374 -7.827) 15.086 8.972 ( 2.695 -12.353 -7.448) 14.674 9.257 ( -3.623 -10.737 -9.362) 14.699 9.503 ( 4.815 -21.747 0.835) 22.289 10.017 ( 2.750 5.494 -2.197) 6.525 10.181 ( 3.562 -17.342 -1.777) 17.793 10.420 ( -4.450 -9.384 7.051) 12.553 10.634 ( -8.689 -4.788 8.818) 13.273 10.909 ( -6.391 1.321 0.990) 6.601 11.327 ( 0.175 1.237 6.471) 6.591 11.971 ( 13.286 9.881 -6.100) 17.646 12.919 ( -4.153 6.329 6.141) 9.747 13.247 ( 2.469 0.960 1.769) 3.186 13.486 ( 1.701 3.597 1.749) 4.346 18.057 ( -14.785 -16.813 -5.799) 23.128 18.632 ( -2.092 -6.849 2.676) 7.645 20.395 ( 7.798 -1.909 0.321) 8.035 22.295 ( 4.338 -0.056 -13.450) 14.132 23.237 ( -7.292 -13.211 -2.680) 15.325 24.726 ( 11.889 10.409 -4.834) 16.525 26.947 ( -3.225 -6.814 4.019) 8.543 27.667 ( -2.284 6.104 13.688) 15.160 ======================= Grid point 226 (78/429) ======================= q-point: ( 0.50 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.357 ( 7.829 0.544 10.312) 12.958 3.647 ( -0.967 -8.908 14.126) 16.728 4.154 ( -11.179 4.247 -5.759) 13.273 4.320 ( 0.968 6.187 -3.299) 7.078 4.517 ( 1.108 1.629 1.017) 2.217 4.817 ( -8.079 -4.402 0.825) 9.237 5.069 ( -5.981 0.206 -2.705) 6.568 5.728 ( 11.870 2.814 9.709) 15.591 6.112 ( 0.160 0.149 2.609) 2.619 6.554 ( -2.678 -1.395 -6.361) 7.041 6.960 ( -3.865 -5.443 -13.354) 14.930 7.271 ( 5.295 -7.402 5.963) 10.880 7.682 ( 0.965 2.125 10.038) 10.306 8.353 ( -0.107 3.164 6.480) 7.212 8.752 ( -7.826 -4.901 -11.726) 14.925 9.182 ( 3.839 -9.431 -6.371) 12.011 9.433 ( 0.557 -9.349 -12.630) 15.724 9.760 ( 0.277 -4.328 0.221) 4.343 10.033 ( 9.297 -4.196 1.127) 10.262 10.236 ( 3.274 10.428 -5.503) 12.237 10.579 ( -12.934 0.242 19.619) 23.500 10.645 ( -2.202 -11.257 8.844) 14.484 10.973 ( -1.750 -8.174 -3.330) 8.998 11.535 ( -2.659 -13.915 3.773) 14.661 11.836 ( 9.261 9.552 -4.574) 14.069 12.789 ( -3.289 5.203 4.908) 7.873 13.269 ( 0.938 -0.938 1.356) 1.897 13.440 ( 0.282 2.185 0.686) 2.307 18.268 ( -8.085 -13.747 -3.212) 16.268 18.685 ( -0.443 0.000 1.499) 1.563 20.440 ( 4.478 0.852 0.079) 4.559 22.289 ( 3.967 0.479 -11.657) 12.323 23.400 ( -3.026 -8.083 -1.143) 8.707 24.587 ( 5.667 9.013 -2.228) 10.878 27.058 ( -2.521 -5.844 4.946) 8.060 27.569 ( -1.614 5.520 8.842) 10.548 ======================= Grid point 227 (79/429) ======================= q-point: (-0.43 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.306 ( 7.292 10.181 7.354) 14.522 3.710 ( -3.831 6.699 8.762) 11.676 3.988 ( -6.643 1.689 -4.525) 8.213 4.241 ( -3.583 -0.341 0.255) 3.608 4.551 ( 0.566 -3.445 2.996) 4.601 4.967 ( -4.886 -14.054 -1.668) 14.972 5.040 ( -3.200 0.168 -0.906) 3.330 5.778 ( 13.551 3.176 12.667) 18.820 6.092 ( -0.153 0.520 -2.012) 2.083 6.528 ( -4.962 0.773 -4.434) 6.699 6.990 ( -3.283 -1.692 -13.610) 14.102 7.376 ( 2.315 0.531 9.606) 9.895 7.647 ( -1.360 2.710 8.176) 8.720 8.374 ( 5.334 -3.296 5.682) 8.462 8.749 ( -6.833 -2.053 -11.434) 13.477 9.333 ( 7.672 -2.613 -3.002) 8.643 9.513 ( 6.214 -0.553 -15.657) 16.854 9.821 ( -5.001 -4.214 -1.202) 6.649 9.992 ( 1.004 6.992 -7.725) 10.467 10.260 ( 5.447 -7.421 2.834) 9.632 10.456 ( -13.309 9.022 16.217) 22.837 10.730 ( 5.754 3.234 16.491) 17.763 11.128 ( -3.108 -7.552 -9.419) 12.466 11.618 ( -0.346 7.039 5.364) 8.857 11.766 ( -2.062 -1.481 -1.292) 2.848 12.727 ( -0.674 0.783 3.371) 3.526 13.280 ( -0.030 0.480 1.481) 1.557 13.407 ( -0.051 1.591 -0.474) 1.661 18.470 ( -2.495 -11.358 -0.538) 11.642 18.649 ( 3.085 4.515 -0.690) 5.512 20.418 ( -0.537 2.584 0.396) 2.669 22.286 ( 3.977 -0.219 -11.544) 12.212 23.515 ( 1.151 -5.215 0.060) 5.341 24.446 ( -0.198 7.374 -2.151) 7.684 27.153 ( -2.341 -4.590 6.531) 8.319 27.474 ( -1.766 5.064 6.010) 8.055 ======================= Grid point 228 (80/429) ======================= q-point: (-0.36 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.106 ( 4.078 15.853 6.021) 17.441 3.444 ( -2.578 17.802 6.525) 19.135 3.966 ( -7.582 -2.547 -6.831) 10.519 4.323 ( 2.575 -6.742 4.241) 8.371 4.642 ( -2.134 -6.254 4.053) 7.752 4.971 ( -1.100 4.800 -1.195) 5.067 5.250 ( -2.936 -14.413 -0.500) 14.717 5.770 ( 7.903 4.813 10.030) 13.646 6.138 ( 6.844 -3.856 -1.726) 8.043 6.446 ( -6.712 4.040 -2.922) 8.361 6.930 ( -3.978 2.372 -15.623) 16.295 7.346 ( 1.285 4.542 13.859) 14.641 7.589 ( -5.086 3.115 4.199) 7.294 8.500 ( 7.133 -0.397 4.525) 8.456 8.757 ( -0.587 -5.476 -8.246) 9.916 9.285 ( 11.746 12.138 -0.591) 16.902 9.486 ( -0.141 5.623 -13.957) 15.047 9.838 ( -0.578 -5.067 -10.353) 11.541 9.955 ( -2.129 2.233 -6.880) 7.540 10.092 ( -8.968 13.856 10.438) 19.529 10.519 ( 3.540 -9.781 15.774) 18.895 10.740 ( 3.604 0.827 12.629) 13.159 11.084 ( -2.511 9.960 -10.762) 14.877 11.368 ( -0.382 18.197 5.722) 19.079 11.793 ( -8.514 -4.763 -0.142) 9.757 12.763 ( 1.685 -3.447 2.882) 4.799 13.260 ( -0.459 1.636 2.144) 2.736 13.375 ( -0.425 1.463 -1.218) 1.950 18.550 ( 6.892 8.756 -3.864) 11.793 18.653 ( 1.147 -7.940 2.512) 8.406 20.344 ( -5.092 3.581 1.018) 6.308 22.301 ( 4.173 -1.286 -12.469) 13.211 23.617 ( 6.944 -3.236 0.232) 7.665 24.299 ( -6.224 5.797 -4.028) 9.411 27.226 ( -3.288 -3.311 8.203) 9.438 27.385 ( -1.446 4.336 5.618) 7.243 ======================= Grid point 229 (81/429) ======================= q-point: (-0.29 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 0.019 20.711 7.913) 22.171 3.070 ( -3.789 21.887 8.217) 23.683 3.981 ( -3.792 -3.719 -3.773) 6.515 4.438 ( 5.389 -1.107 -0.772) 5.555 4.760 ( 2.501 0.581 2.526) 3.602 4.870 ( -7.716 -2.289 0.494) 8.063 5.280 ( -5.615 9.741 8.866) 14.318 5.889 ( 10.777 -10.131 -4.361) 15.421 6.263 ( 2.457 -1.116 4.670) 5.394 6.300 ( -0.210 3.293 -4.598) 5.660 6.836 ( -2.257 1.984 -16.531) 16.802 7.281 ( 1.365 6.734 8.436) 10.880 7.517 ( -8.509 -0.481 6.826) 10.919 8.392 ( 0.607 13.505 1.773) 13.634 8.787 ( 8.283 14.519 -0.978) 16.744 9.133 ( 7.126 5.275 -2.387) 9.181 9.247 ( -3.765 13.900 -8.750) 16.851 9.638 ( -2.592 12.314 0.440) 12.591 10.011 ( -1.421 -3.877 -6.348) 7.572 10.085 ( -1.129 -11.056 -3.638) 11.693 10.608 ( 0.522 19.391 1.998) 19.501 10.717 ( 5.615 4.086 17.385) 18.721 10.751 ( 0.039 14.673 0.135) 14.674 11.225 ( -2.254 -12.683 2.755) 13.173 11.841 ( -8.804 -5.346 -2.755) 10.662 12.867 ( 2.165 -5.144 3.455) 6.564 13.233 ( 0.440 1.270 2.893) 3.190 13.352 ( -2.399 -0.384 -1.369) 2.789 18.374 ( 11.318 14.943 -7.506) 20.193 18.765 ( -0.168 -1.989 5.954) 6.279 20.240 ( -6.809 3.732 1.332) 7.878 22.334 ( 4.437 -2.163 -14.319) 15.146 23.711 ( 16.933 0.873 -0.319) 16.958 24.140 ( -13.947 3.792 -9.041) 17.048 27.233 ( -7.775 1.355 1.596) 8.052 27.357 ( 2.148 -0.384 16.431) 16.575 ======================= Grid point 230 (82/429) ======================= q-point: (-0.21 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( -1.549 24.349 12.173) 27.267 2.606 ( -5.360 26.760 11.854) 29.755 4.019 ( -0.861 0.161 1.383) 1.637 4.407 ( 1.588 6.681 -2.692) 7.376 4.620 ( 0.526 9.722 -2.805) 10.132 4.784 ( -0.114 17.703 3.113) 17.975 5.182 ( -10.472 -6.921 9.454) 15.714 5.899 ( 0.757 13.183 -5.337) 14.243 6.294 ( 7.783 -6.931 1.288) 10.501 6.403 ( 6.328 -3.363 -1.244) 7.274 6.765 ( -0.394 2.044 -19.111) 19.224 7.116 ( -1.150 10.834 0.340) 10.900 7.563 ( -8.720 -5.565 12.772) 16.435 8.054 ( 4.665 21.960 3.115) 22.665 8.319 ( -0.296 31.394 2.026) 31.461 8.965 ( -0.971 12.648 -8.404) 15.217 9.038 ( 2.307 8.598 -2.083) 9.143 9.564 ( -2.565 -1.183 -4.951) 5.700 9.903 ( 2.646 23.514 -5.782) 24.358 10.046 ( 1.317 5.791 3.737) 7.017 10.277 ( -3.250 18.620 -3.792) 19.278 10.566 ( 1.864 -11.881 1.532) 12.124 10.968 ( 5.703 -19.079 17.681) 26.630 11.647 ( -2.956 -27.368 0.570) 27.533 11.877 ( -4.342 -3.795 -4.074) 7.061 12.972 ( 1.092 -4.299 4.537) 6.345 13.245 ( 1.067 -1.959 2.957) 3.704 13.367 ( -4.072 -3.621 -0.856) 5.516 18.069 ( 15.345 24.639 -11.348) 31.166 18.712 ( -7.896 7.496 9.825) 14.665 20.155 ( -3.636 1.792 0.708) 4.115 22.374 ( 4.483 -2.182 -17.728) 18.416 23.742 ( 23.710 10.186 2.186) 25.897 23.980 ( -15.499 0.054 -22.850) 27.611 27.131 ( -8.402 3.885 -0.729) 9.285 27.463 ( 1.567 -5.261 27.084) 27.635 ======================= Grid point 231 (83/429) ======================= q-point: (-0.14 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( -1.231 28.316 13.833) 31.539 2.075 ( -5.080 28.596 21.884) 36.366 3.748 ( -3.464 34.808 11.656) 36.870 4.228 ( 0.417 9.145 -2.332) 9.447 4.387 ( 1.186 8.945 2.356) 9.325 4.635 ( 3.482 -0.280 -9.792) 10.396 5.061 ( -7.323 22.391 2.994) 23.748 5.711 ( -1.088 2.423 4.289) 5.045 6.310 ( 5.578 18.707 -5.967) 20.412 6.434 ( 2.288 -0.442 -1.773) 2.929 6.716 ( -4.531 -5.371 -16.652) 18.074 6.934 ( 4.125 6.854 1.065) 8.070 7.500 ( 0.839 16.222 15.607) 22.527 7.688 ( -4.254 18.353 5.686) 19.679 7.967 ( 2.287 -1.705 -4.356) 5.207 8.732 ( 1.970 10.503 -7.022) 12.787 8.898 ( 0.995 6.339 -4.679) 7.941 9.284 ( 0.211 25.783 -4.607) 26.192 9.635 ( -5.417 3.358 -14.740) 16.059 9.854 ( -4.689 14.227 -3.382) 15.357 10.113 ( 4.248 -0.092 8.305) 9.329 10.822 ( -1.610 -13.555 19.267) 23.612 11.582 ( 7.085 -36.112 6.260) 37.330 11.862 ( -4.475 -3.276 -8.039) 9.766 12.168 ( 2.408 -22.050 2.108) 22.281 13.079 ( -2.123 -7.047 5.434) 9.148 13.344 ( 0.184 -8.311 2.206) 8.601 13.438 ( -1.721 -5.855 -0.001) 6.103 17.560 ( 17.822 37.646 -13.595) 43.815 18.425 ( -18.568 16.670 10.419) 27.041 20.142 ( 1.014 -0.928 -0.234) 1.394 22.382 ( 3.205 0.344 -26.283) 26.480 23.537 ( -16.508 13.552 -8.827) 23.111 23.916 ( 33.222 7.747 -29.809) 45.302 27.006 ( -8.836 3.732 0.058) 9.591 27.692 ( 0.197 -13.086 40.612) 42.669 ======================= Grid point 232 (84/429) ======================= q-point: (-0.07 0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -0.271 32.214 14.876) 35.484 1.618 ( -1.962 23.834 34.683) 42.128 2.879 ( -0.337 54.801 23.286) 59.544 4.087 ( 0.924 5.165 -5.417) 7.541 4.277 ( -3.014 17.339 -1.137) 17.636 4.395 ( 1.677 25.553 -0.009) 25.608 4.716 ( 4.035 -2.077 -4.425) 6.339 5.646 ( -1.003 9.585 0.715) 9.664 5.783 ( 0.221 29.571 -4.571) 29.923 6.447 ( 0.605 -0.522 -0.113) 0.807 6.771 ( 0.171 -1.767 -7.234) 7.449 6.989 ( 0.153 -10.545 0.208) 10.548 7.147 ( 3.370 15.027 1.058) 15.437 7.558 ( -5.877 0.498 13.118) 14.383 8.065 ( 7.150 -2.474 -6.434) 9.932 8.572 ( 1.892 7.170 -5.030) 8.960 8.785 ( 1.261 5.733 -7.707) 9.688 8.846 ( 4.902 19.568 -6.925) 21.328 9.375 ( -15.011 15.467 -7.418) 22.794 9.654 ( -6.654 3.017 -15.558) 17.188 10.185 ( 4.076 -2.570 9.359) 10.527 11.189 ( -6.491 -25.003 31.440) 40.692 11.855 ( -1.847 -2.073 -6.642) 7.199 12.273 ( 2.880 -23.578 8.659) 25.283 12.561 ( 12.724 -19.437 1.249) 23.265 13.213 ( -11.827 -9.491 3.033) 15.465 13.579 ( 1.144 -11.614 1.153) 11.727 13.606 ( 6.604 -15.951 1.625) 17.340 16.831 ( 18.070 46.744 -14.141) 52.072 17.926 ( -28.390 24.232 2.601) 37.416 20.179 ( 1.223 -1.788 -0.680) 2.271 22.154 ( -11.025 24.354 -63.964) 69.326 23.029 ( -28.922 19.378 -13.671) 37.402 23.954 ( 67.597 12.284 -27.612) 74.045 26.905 ( -8.504 1.695 2.070) 8.915 28.160 ( -3.359 -30.161 56.412) 64.057 ======================= Grid point 235 (85/429) ======================= q-point: ( 0.14 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.056 ( 17.971 -0.000 21.770) 28.229 1.371 ( 29.077 -0.000 26.761) 39.518 2.373 ( 33.838 -0.000 57.803) 66.979 3.154 ( 0.555 -0.000 -2.852) 2.906 4.184 ( 6.651 -0.000 -7.849) 10.288 4.511 ( 10.381 -0.000 -2.250) 10.622 4.539 ( -1.409 0.000 -3.213) 3.508 5.163 ( 8.579 -0.000 -6.456) 10.736 5.401 ( 0.213 -0.000 2.576) 2.585 6.375 ( -5.932 0.000 -1.524) 6.125 6.640 ( 1.923 -0.000 -7.432) 7.677 7.403 ( -2.005 0.000 3.888) 4.375 7.612 ( 1.680 -0.000 -0.471) 1.745 7.729 ( -12.855 0.000 -1.941) 13.001 7.745 ( -1.181 0.000 1.881) 2.221 8.174 ( -4.577 0.000 8.228) 9.416 8.453 ( 23.126 -0.000 -12.951) 26.506 8.572 ( -1.612 0.000 -5.563) 5.792 8.758 ( -2.190 0.000 -4.580) 5.077 9.208 ( -12.750 0.000 -20.390) 24.048 10.386 ( -3.215 0.000 6.385) 7.149 11.694 ( -48.756 0.000 23.268) 54.024 12.274 ( 1.148 -0.000 13.545) 13.594 12.595 ( 4.990 -0.000 -4.794) 6.920 13.336 ( 1.438 -0.000 -5.160) 5.357 13.789 ( -3.788 0.000 4.702) 6.038 14.170 ( 0.221 -0.000 -3.259) 3.267 14.353 ( 13.466 -0.000 -0.049) 13.466 15.637 ( 32.592 -0.000 -18.094) 37.277 15.835 ( -0.826 0.000 2.180) 2.331 19.122 ( -0.482 0.000 1.495) 1.571 20.219 ( 0.374 -0.000 -1.230) 1.286 22.635 ( -3.535 0.000 -3.181) 4.756 25.023 ( 49.817 -0.000 -44.583) 66.854 26.761 ( -6.203 0.000 1.019) 6.286 29.041 ( -48.878 0.000 42.049) 64.476 ======================= Grid point 236 (86/429) ======================= q-point: ( 0.21 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( 20.233 -18.192 16.344) 31.740 1.684 ( 19.462 -14.786 28.276) 37.376 2.929 ( 35.062 -25.442 45.452) 62.789 3.483 ( 0.923 -28.685 -3.204) 28.878 4.216 ( -4.973 -3.352 -7.597) 9.678 4.376 ( 14.540 2.111 -5.389) 15.650 4.835 ( 7.526 -10.614 -1.370) 13.083 5.279 ( 6.648 -11.494 -7.318) 15.161 5.523 ( 1.057 -10.818 3.974) 11.573 6.374 ( -4.039 -4.646 -1.685) 6.383 6.683 ( 0.144 -4.398 -8.429) 9.509 7.075 ( -8.162 28.713 1.454) 29.886 7.389 ( -0.216 3.339 4.730) 5.794 7.579 ( 3.287 6.591 3.144) 8.008 8.100 ( -3.992 -17.761 -0.621) 18.214 8.314 ( -12.956 -10.848 7.036) 18.304 8.567 ( 0.299 -4.385 -19.797) 20.279 8.684 ( 13.700 -4.764 -7.000) 16.105 8.755 ( -2.214 -7.106 -2.043) 7.718 9.151 ( -10.957 -6.371 -17.284) 21.433 10.336 ( -5.407 3.498 6.673) 9.274 11.267 ( -42.012 17.612 27.148) 53.030 12.154 ( 18.393 14.908 2.841) 23.846 12.508 ( -1.064 8.743 -0.209) 8.810 13.144 ( -0.252 9.609 -3.598) 10.263 13.538 ( 6.480 20.415 3.008) 21.629 13.973 ( 12.188 12.326 0.313) 17.337 14.491 ( 14.920 19.300 10.601) 26.598 16.062 ( -31.747 -36.787 -1.958) 48.631 16.341 ( 19.712 -43.114 -25.723) 53.936 19.683 ( -13.652 -37.872 -3.866) 40.443 20.424 ( 5.252 -29.735 -11.763) 32.406 22.612 ( -3.999 -0.548 -3.522) 5.357 25.176 ( 38.942 2.518 -40.986) 56.592 26.715 ( -6.461 1.150 2.688) 7.091 28.647 ( -33.182 19.346 45.318) 59.406 ======================= Grid point 237 (87/429) ======================= q-point: ( 0.29 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.953 ( 21.242 -21.614 12.858) 32.920 2.197 ( 14.418 -22.001 25.264) 36.472 3.753 ( 18.112 -34.758 30.468) 49.643 3.947 ( 7.356 -15.742 -2.933) 17.622 4.180 ( -7.370 -1.171 -5.505) 9.273 4.716 ( 11.969 -26.682 -6.633) 29.987 4.938 ( 9.599 2.423 -0.540) 9.915 5.603 ( -3.779 -17.357 -5.705) 18.657 5.786 ( 9.825 -13.064 2.862) 16.595 6.448 ( -9.317 18.230 -7.056) 21.655 6.602 ( 1.644 -12.000 2.576) 12.383 6.785 ( -7.069 -4.937 -5.194) 10.066 7.371 ( 0.965 -1.064 5.584) 5.766 7.519 ( 0.139 1.023 5.094) 5.197 8.339 ( 2.773 -7.746 0.759) 8.262 8.450 ( -6.549 -9.709 -2.041) 11.888 8.638 ( -1.206 -5.870 -18.360) 19.313 8.731 ( -0.142 -6.860 -7.955) 10.505 8.959 ( -3.161 -11.619 -3.859) 12.644 9.322 ( -5.432 -18.315 -7.134) 20.392 10.234 ( -7.568 4.452 6.783) 11.095 10.823 ( -23.648 13.299 21.300) 34.493 11.962 ( 12.169 16.598 -5.083) 21.200 12.304 ( -2.803 11.415 7.348) 13.861 12.961 ( -0.416 18.034 -8.922) 20.124 13.127 ( 7.741 19.569 7.354) 22.292 13.823 ( 9.231 10.333 0.693) 13.873 14.066 ( 14.008 30.299 10.490) 34.990 16.621 ( -37.472 -42.039 -5.067) 56.543 17.231 ( 14.399 -42.489 -13.521) 46.856 20.008 ( -7.395 -11.810 2.822) 14.217 21.257 ( -0.776 -48.998 -25.351) 55.173 22.601 ( -5.541 -2.070 -2.530) 6.433 25.214 ( 29.218 6.715 -33.025) 44.604 26.677 ( -6.284 -0.823 5.315) 8.271 28.236 ( -18.192 16.374 38.566) 45.677 ======================= Grid point 238 (88/429) ======================= q-point: ( 0.36 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.497 ( 17.096 -21.476 10.727) 29.471 2.724 ( 13.999 -20.716 21.332) 32.866 4.082 ( -10.414 -4.105 -9.246) 14.519 4.249 ( 5.816 -9.893 -5.454) 12.706 4.474 ( 5.563 -22.469 24.130) 33.437 4.885 ( 6.256 7.014 1.663) 9.545 5.266 ( 12.296 -21.131 -4.562) 24.870 5.766 ( -8.750 1.448 5.248) 10.306 5.926 ( -4.945 3.121 -11.038) 12.491 6.193 ( 12.280 -7.073 1.207) 14.223 6.779 ( -18.689 -3.660 -7.022) 20.297 6.926 ( 5.569 -7.176 -3.509) 9.738 7.519 ( -2.209 -7.972 13.356) 15.711 7.667 ( 7.011 -23.752 -1.270) 24.797 8.457 ( 0.813 -4.270 3.987) 5.898 8.575 ( 3.144 -5.746 -7.105) 9.663 8.735 ( -0.405 -10.751 -13.669) 17.395 8.914 ( -3.014 -11.471 -10.006) 15.518 9.260 ( -3.346 -25.639 -3.719) 26.123 9.650 ( -7.580 -19.601 -0.484) 21.021 10.136 ( -7.882 1.149 4.605) 9.201 10.576 ( -9.978 7.155 16.564) 20.618 11.578 ( -4.980 25.128 -1.471) 25.659 12.092 ( 8.154 17.238 3.498) 19.387 12.442 ( 6.193 25.706 -3.389) 26.658 13.014 ( 0.209 2.636 2.723) 3.796 13.645 ( 6.583 18.123 4.695) 19.845 13.712 ( 7.254 10.896 3.964) 13.677 17.137 ( -29.026 -34.114 -7.375) 45.395 17.968 ( 6.213 -30.244 -2.214) 30.955 20.191 ( 1.701 -9.339 2.574) 9.836 21.964 ( 2.581 -29.034 -23.701) 37.568 22.646 ( -9.046 -8.911 -0.443) 12.706 25.143 ( 21.084 10.333 -22.380) 32.437 26.706 ( -4.909 -4.606 5.812) 8.893 27.967 ( -10.018 10.834 27.699) 31.384 ======================= Grid point 239 (89/429) ======================= q-point: ( 0.43 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.965 ( 11.887 -17.224 10.394) 23.367 3.193 ( 12.240 -16.881 18.076) 27.596 4.071 ( -12.573 -4.194 -9.523) 16.320 4.418 ( 7.079 -3.965 -5.375) 9.733 4.713 ( 5.171 6.351 0.362) 8.198 4.794 ( -14.300 -4.618 10.134) 18.125 5.384 ( 0.620 16.894 0.056) 16.905 5.696 ( 0.923 -10.466 6.233) 12.216 6.003 ( 0.333 -5.834 1.840) 6.126 6.438 ( 13.394 -5.979 -2.851) 14.942 6.725 ( -17.657 -5.701 -14.767) 23.714 6.992 ( 5.634 -2.861 -0.419) 6.332 7.636 ( -0.765 -4.368 9.308) 10.310 8.258 ( 3.500 -23.628 -3.485) 24.139 8.532 ( 2.242 -1.276 6.185) 6.701 8.731 ( 2.307 -12.083 -4.269) 13.021 9.006 ( -2.322 -17.449 -9.357) 19.935 9.087 ( 1.738 -15.761 -9.037) 18.251 9.753 ( -2.975 -22.605 -1.792) 22.870 9.930 ( -12.202 -16.747 0.664) 20.731 10.207 ( -0.092 -12.752 3.205) 13.149 10.500 ( 0.194 -0.166 10.526) 10.529 11.071 ( -13.036 20.774 4.228) 24.887 11.668 ( 4.832 26.844 1.094) 27.297 12.212 ( 12.575 9.107 -4.395) 16.137 12.978 ( -3.620 1.829 4.090) 5.760 13.390 ( 4.452 12.008 4.183) 13.472 13.596 ( 3.138 6.437 1.830) 7.391 17.546 ( -20.115 -26.242 -6.397) 33.677 18.415 ( 0.114 -16.209 2.002) 16.332 20.370 ( 6.614 -6.121 1.421) 9.123 22.256 ( 5.461 -5.863 -16.930) 18.730 22.872 ( -8.863 -19.178 -1.792) 21.203 25.000 ( 14.363 11.921 -12.831) 22.651 26.805 ( -3.306 -6.941 5.415) 9.404 27.800 ( -5.618 7.270 18.371) 20.541 ======================= Grid point 240 (90/429) ======================= q-point: ( 0.50 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.307 ( 7.152 -11.196 10.192) 16.745 3.532 ( 7.338 -9.184 16.315) 20.109 4.058 ( -12.569 -3.463 -9.069) 15.881 4.429 ( 0.353 3.497 -7.331) 8.130 4.555 ( 0.010 6.682 -4.372) 7.985 4.821 ( -9.504 -0.574 12.224) 15.495 5.089 ( -3.485 9.918 -2.214) 10.743 5.827 ( 6.694 -0.736 8.655) 10.966 6.097 ( -0.450 -1.932 5.572) 5.915 6.520 ( 2.633 -0.609 -6.024) 6.602 6.765 ( -6.389 -9.042 -17.828) 20.986 7.169 ( 9.247 -8.837 4.842) 13.676 7.705 ( -1.839 -1.634 10.283) 10.573 8.453 ( 2.601 2.970 7.573) 8.540 8.562 ( -6.832 -6.803 -10.257) 14.078 8.987 ( 4.746 -12.192 -7.934) 15.301 9.192 ( -1.322 -11.418 -10.109) 15.307 9.556 ( 4.039 -19.845 0.273) 20.254 10.016 ( -2.927 -9.950 1.029) 10.423 10.200 ( 2.574 -18.984 -5.031) 19.807 10.421 ( -0.933 -1.766 9.226) 9.440 10.568 ( -8.888 3.086 9.556) 13.410 10.840 ( -6.554 -8.141 2.581) 10.765 11.347 ( 0.543 4.144 2.701) 4.976 12.097 ( 12.435 10.991 -5.701) 17.548 12.887 ( -5.130 5.935 5.330) 9.484 13.282 ( 2.098 2.507 2.090) 3.880 13.508 ( 1.240 4.537 1.173) 4.848 17.881 ( -12.272 -20.756 -4.313) 24.495 18.620 ( -1.588 -6.674 2.403) 7.269 20.478 ( 6.449 -1.023 0.517) 6.550 22.296 ( 4.153 -0.098 -12.470) 13.144 23.162 ( -4.392 -15.058 -2.079) 15.823 24.822 ( 8.628 11.959 -6.523) 16.125 26.933 ( -2.280 -6.985 5.462) 9.155 27.682 ( -3.308 5.861 11.763) 13.552 ======================= Grid point 241 (91/429) ======================= q-point: ( 0.57 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.477 ( 6.109 -0.090 7.621) 9.768 3.684 ( -1.881 -3.917 13.863) 14.528 3.997 ( -10.715 1.536 -7.240) 13.023 4.301 ( -1.041 7.380 -5.247) 9.115 4.518 ( -0.758 -2.615 -1.900) 3.321 4.759 ( -4.147 -0.127 10.103) 10.921 5.022 ( -1.646 -1.577 -2.256) 3.207 5.901 ( 11.415 -0.093 10.883) 15.772 6.081 ( -6.448 0.764 -1.744) 6.723 6.510 ( -1.479 0.496 -5.252) 5.479 6.881 ( 0.316 -6.508 -13.305) 14.814 7.366 ( 6.506 -5.304 6.181) 10.424 7.707 ( -3.274 2.125 11.128) 11.793 8.394 ( 1.975 2.316 6.404) 7.090 8.626 ( -6.004 -4.781 -10.363) 12.895 9.205 ( 4.982 -10.124 -9.663) 14.856 9.399 ( 1.890 -11.636 -12.273) 17.017 9.762 ( -0.007 -3.484 -0.637) 3.542 10.143 ( 8.196 -0.625 3.648) 8.993 10.223 ( -0.959 10.046 -5.988) 11.735 10.492 ( -12.650 -0.948 13.737) 18.698 10.663 ( -2.379 -17.310 10.106) 20.185 10.962 ( 0.881 -5.752 1.788) 6.088 11.511 ( -3.064 -13.072 1.164) 13.476 11.914 ( 7.152 12.651 -3.515) 14.952 12.768 ( -3.255 3.977 4.334) 6.722 13.282 ( 0.349 -0.341 1.315) 1.403 13.447 ( 0.464 2.727 0.345) 2.787 18.177 ( -5.839 -17.072 -2.167) 18.173 18.686 ( -0.385 -1.187 1.131) 1.684 20.485 ( 3.332 3.086 0.178) 4.545 22.290 ( 3.764 0.417 -11.307) 11.925 23.373 ( -1.272 -9.819 -0.810) 9.934 24.631 ( 3.689 11.187 -3.240) 12.217 27.053 ( -1.933 -5.887 5.930) 8.576 27.578 ( -2.319 5.630 7.686) 9.806 ======================= Grid point 242 (92/429) ======================= q-point: (-0.36 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.404 ( 3.926 11.056 5.401) 12.916 3.698 ( -3.848 6.232 8.592) 11.291 3.898 ( -4.173 1.213 -4.443) 6.215 4.209 ( -3.012 -2.302 2.082) 4.325 4.569 ( 0.576 -2.329 2.266) 3.300 4.916 ( -2.839 -15.750 3.413) 16.364 5.028 ( 0.015 1.082 -0.697) 1.288 5.925 ( 1.715 5.418 4.893) 7.499 6.087 ( 4.002 -4.537 1.617) 6.262 6.465 ( -3.901 1.976 -4.377) 6.187 6.922 ( 0.725 0.183 -12.324) 12.347 7.445 ( 2.967 1.401 9.336) 9.896 7.637 ( -5.053 4.058 7.402) 9.838 8.477 ( 7.562 -7.069 5.925) 11.927 8.633 ( -5.868 -1.854 -8.826) 10.760 9.387 ( 6.448 -7.373 -12.107) 15.573 9.541 ( 7.110 -0.745 -10.598) 12.784 9.759 ( -4.774 0.780 -2.014) 5.240 9.975 ( 0.775 6.768 -5.458) 8.730 10.292 ( -4.915 1.976 4.775) 7.132 10.401 ( -3.643 -0.989 13.707) 14.217 10.840 ( 1.460 0.934 15.728) 15.824 11.076 ( 0.738 -4.871 -7.330) 8.832 11.618 ( -2.177 2.320 2.252) 3.898 11.740 ( -1.771 5.984 0.265) 6.246 12.733 ( -0.482 -0.617 3.303) 3.395 13.281 ( -0.707 0.726 1.419) 1.744 13.409 ( 0.708 1.824 -0.381) 1.993 18.443 ( -1.685 -13.562 -0.366) 13.671 18.678 ( 2.316 2.304 -0.854) 3.377 20.413 ( -0.546 5.203 0.417) 5.248 22.288 ( 3.811 -0.223 -11.623) 12.233 23.529 ( 1.176 -7.488 -0.111) 7.581 24.435 ( -0.149 10.211 -1.993) 10.404 27.150 ( -2.329 -4.461 6.541) 8.253 27.476 ( -1.792 5.113 6.000) 8.084 ======================= Grid point 243 (93/429) ======================= q-point: (-0.29 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.163 ( 1.137 16.874 6.299) 18.047 3.449 ( -1.124 18.004 7.470) 19.524 3.896 ( -0.825 -2.617 -2.664) 3.824 4.362 ( 1.222 -10.763 4.913) 11.894 4.621 ( -3.795 -4.452 2.628) 6.413 4.956 ( -0.449 6.257 -0.904) 6.338 5.241 ( 0.620 -15.011 1.874) 15.140 5.817 ( -2.931 3.083 0.319) 4.266 6.228 ( 6.864 -4.939 5.063) 9.857 6.371 ( -3.475 4.576 -4.715) 7.433 6.859 ( 1.297 3.694 -12.826) 13.410 7.409 ( 1.261 4.462 11.872) 12.746 7.533 ( -6.729 4.659 3.037) 8.730 8.560 ( 1.218 4.742 -1.532) 5.130 8.758 ( 4.140 -13.390 0.590) 14.028 9.415 ( 9.950 11.443 -2.462) 15.363 9.441 ( 3.090 10.044 -12.921) 16.655 9.758 ( -6.170 -9.197 -10.433) 15.215 9.917 ( -0.527 10.496 -6.133) 12.168 10.029 ( -7.550 5.851 8.319) 12.667 10.611 ( 2.452 -12.074 13.863) 18.547 10.818 ( 0.678 2.835 13.990) 14.290 11.028 ( -0.175 10.255 -9.504) 13.983 11.392 ( 1.428 19.193 4.496) 19.765 11.698 ( -7.611 -3.344 -0.694) 8.342 12.791 ( 0.995 -4.338 3.579) 5.711 13.258 ( -1.156 1.201 1.938) 2.556 13.375 ( 0.932 2.359 -0.542) 2.594 18.583 ( 2.025 3.096 -4.166) 5.571 18.688 ( 2.654 -5.649 2.188) 6.613 20.298 ( -3.376 5.629 0.906) 6.626 22.301 ( 3.962 -1.211 -12.870) 13.521 23.679 ( 3.489 -7.367 -1.433) 8.276 24.237 ( -2.172 10.092 -1.726) 10.466 27.203 ( -4.601 -1.374 5.023) 6.949 27.406 ( 0.002 2.371 8.950) 9.259 ======================= Grid point 244 (94/429) ======================= q-point: (-0.21 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.824 ( 0.768 21.099 10.115) 23.411 3.073 ( -1.489 22.898 9.883) 24.984 3.969 ( 2.840 -4.428 0.752) 5.314 4.486 ( 3.564 0.816 -1.732) 4.046 4.772 ( -9.167 -4.886 0.572) 10.404 4.802 ( 3.284 0.563 1.737) 3.758 5.264 ( -3.491 12.660 9.842) 16.411 5.934 ( 2.173 -12.853 -8.887) 15.777 6.212 ( -6.249 3.899 -0.443) 7.379 6.384 ( 8.176 -2.915 1.517) 8.812 6.783 ( 3.064 2.573 -14.032) 14.591 7.317 ( 1.137 9.597 2.233) 9.919 7.450 ( -8.028 -1.669 10.458) 13.289 8.408 ( 0.999 12.578 1.873) 12.755 8.860 ( 3.579 14.996 1.076) 15.455 9.161 ( -3.287 12.265 -5.931) 14.015 9.214 ( 6.598 11.242 -5.999) 14.349 9.597 ( -4.878 10.409 0.725) 11.518 9.964 ( -0.012 -10.876 -11.951) 16.159 10.069 ( -0.179 -6.962 -1.392) 7.102 10.589 ( -3.725 22.700 1.405) 23.047 10.747 ( 1.338 17.808 0.986) 17.886 10.877 ( 6.338 -3.244 19.151) 20.432 11.205 ( -2.476 -11.323 2.379) 11.832 11.752 ( -4.399 -5.759 -3.640) 8.110 12.900 ( 1.040 -5.288 4.715) 7.161 13.239 ( -1.587 0.270 2.093) 2.641 13.340 ( 1.277 1.368 -0.015) 1.871 18.449 ( 6.977 11.751 -8.352) 16.016 18.768 ( -3.340 0.173 5.658) 6.573 20.186 ( -3.172 3.993 0.999) 5.196 22.328 ( 4.097 -1.887 -15.111) 15.770 23.824 ( -2.332 -6.309 -9.005) 11.240 24.034 ( 6.232 10.631 0.788) 12.349 27.153 ( -7.074 3.148 0.932) 7.799 27.441 ( 1.504 -2.627 17.434) 17.695 ======================= Grid point 245 (95/429) ======================= q-point: (-0.14 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.429 ( 2.328 24.397 14.207) 28.328 2.617 ( -1.291 26.993 14.696) 30.761 4.055 ( 4.882 0.699 5.527) 7.408 4.408 ( 0.354 8.373 -3.090) 8.932 4.592 ( -2.209 7.331 -6.642) 10.136 4.817 ( 2.817 19.670 5.942) 20.740 5.126 ( -5.610 -7.318 9.492) 13.233 5.893 ( 2.063 12.854 -3.423) 13.461 6.312 ( -4.443 -12.270 -4.712) 13.874 6.433 ( -0.908 1.453 -1.977) 2.616 6.739 ( 7.577 3.550 -16.729) 18.705 7.124 ( 2.964 10.399 0.896) 10.850 7.515 ( -7.572 -5.907 12.166) 15.500 8.131 ( 4.952 16.768 6.818) 18.766 8.312 ( -1.442 36.365 1.186) 36.413 8.923 ( -0.914 10.641 -9.675) 14.411 9.048 ( 1.295 9.923 -2.783) 10.387 9.487 ( -6.569 1.729 -7.461) 10.090 9.892 ( -0.445 20.909 -6.803) 21.992 10.079 ( 2.967 10.929 1.178) 11.386 10.239 ( -2.079 10.348 -0.470) 10.565 10.564 ( -2.357 -10.148 -0.023) 10.418 11.116 ( 6.454 -17.815 21.892) 28.953 11.594 ( -4.704 -23.332 -3.139) 24.007 11.854 ( 1.710 -8.785 -2.312) 9.243 12.997 ( -0.079 -3.503 5.507) 6.527 13.249 ( -2.155 -2.757 1.735) 3.906 13.362 ( 3.185 -2.484 1.159) 4.202 18.177 ( 11.287 21.512 -12.458) 27.301 18.621 ( -14.103 12.073 8.885) 20.582 20.134 ( -0.179 0.515 0.439) 0.700 22.352 ( 3.828 -1.083 -19.561) 19.961 23.651 ( -20.397 11.401 -12.415) 26.460 24.094 ( 29.087 -1.876 -6.085) 29.775 27.035 ( -8.094 4.511 0.023) 9.266 27.576 ( 0.620 -6.981 26.813) 27.713 ======================= Grid point 246 (96/429) ======================= q-point: (-0.07 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( 4.591 29.731 12.902) 32.733 2.144 ( 1.324 26.097 26.436) 37.171 3.809 ( 5.395 34.770 15.117) 38.296 4.222 ( 0.645 9.464 -4.322) 10.424 4.387 ( -2.515 8.665 0.942) 9.072 4.658 ( 5.697 -1.328 -5.908) 8.314 5.041 ( 1.683 22.302 2.406) 22.494 5.726 ( 1.077 3.220 4.828) 5.903 6.234 ( -9.322 16.410 -8.700) 20.782 6.471 ( -3.758 -8.093 -2.944) 9.396 6.641 ( 7.086 6.899 -14.127) 17.245 7.010 ( 6.518 5.055 3.443) 8.938 7.545 ( -4.437 2.999 15.116) 16.036 7.635 ( -5.691 29.643 1.162) 30.207 8.026 ( 9.423 -1.356 0.119) 9.521 8.719 ( 0.602 9.100 -8.538) 12.493 8.884 ( -0.076 6.794 -5.449) 8.709 9.247 ( -3.403 20.568 -7.383) 22.116 9.498 ( -8.251 10.616 -13.214) 18.852 9.805 ( -1.614 16.437 -4.496) 17.117 10.176 ( 1.466 -1.134 7.992) 8.204 10.819 ( -9.251 -16.265 14.844) 23.884 11.686 ( 3.411 -26.694 6.651) 27.721 11.821 ( 2.943 -12.886 -2.371) 13.429 12.210 ( 3.882 -22.946 1.497) 23.320 13.055 ( -4.527 -3.427 3.676) 6.764 13.368 ( 2.818 -10.539 3.299) 11.397 13.466 ( 4.888 -5.584 1.691) 7.612 17.696 ( 15.019 35.860 -13.494) 41.153 18.203 ( -25.838 21.219 6.384) 34.038 20.150 ( 0.398 -1.264 0.044) 1.326 22.296 ( 0.773 6.152 -32.443) 33.030 23.211 ( -24.606 18.719 -11.499) 32.986 24.303 ( 41.452 -1.137 -18.836) 45.545 26.907 ( -8.744 3.668 1.182) 9.556 27.828 ( -2.592 -14.795 39.201) 41.980 ======================= Grid point 250 (97/429) ======================= q-point: ( 0.21 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( 18.612 -0.000 18.294) 26.097 1.782 ( 25.274 -0.000 29.729) 39.021 3.026 ( 45.947 -0.000 45.801) 64.876 3.148 ( 0.388 -0.000 -3.533) 3.554 4.137 ( -8.682 0.000 -9.092) 12.571 4.512 ( -1.396 0.000 -2.826) 3.152 4.715 ( 26.400 -0.000 -6.147) 27.106 5.238 ( 7.872 -0.000 -4.757) 9.197 5.411 ( -0.132 0.000 2.310) 2.314 6.298 ( -6.505 0.000 -1.156) 6.607 6.635 ( 1.934 -0.000 -7.309) 7.560 7.392 ( -1.769 0.000 1.978) 2.653 7.564 ( -14.380 0.000 -2.510) 14.597 7.621 ( -0.748 0.000 2.624) 2.729 7.749 ( 1.091 -0.000 0.574) 1.233 8.091 ( -15.126 0.000 12.491) 19.617 8.503 ( 0.821 -0.000 -16.880) 16.900 8.665 ( 8.350 -0.000 -3.345) 8.995 8.749 ( 10.191 -0.000 -5.215) 11.447 8.988 ( -13.016 0.000 -18.599) 22.701 10.345 ( -7.814 0.000 6.146) 9.942 11.223 ( -46.824 0.000 26.460) 53.784 12.389 ( 5.089 -0.000 11.384) 12.470 12.661 ( 12.258 -0.000 -8.806) 15.093 13.320 ( -0.653 0.000 -5.415) 5.454 13.781 ( -0.475 0.000 2.687) 2.729 14.159 ( -0.024 0.000 -3.238) 3.238 14.521 ( 15.882 -0.000 0.433) 15.888 15.833 ( -0.867 0.000 2.136) 2.306 15.881 ( 22.044 -0.000 -14.781) 26.541 19.123 ( -0.482 0.000 1.500) 1.576 20.219 ( 0.381 -0.000 -1.225) 1.283 22.580 ( -3.210 0.000 -5.172) 6.087 25.329 ( 33.418 -0.000 -41.185) 53.038 26.697 ( -5.752 0.000 1.586) 5.966 28.705 ( -38.549 0.000 42.751) 57.565 ======================= Grid point 251 (98/429) ======================= q-point: ( 0.29 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( 18.433 -20.443 14.379) 31.055 2.027 ( 22.696 -8.469 26.463) 35.876 3.369 ( 7.389 -20.659 14.478) 26.287 3.635 ( 33.613 -24.524 22.188) 47.155 4.071 ( -13.346 -1.918 -9.207) 16.327 4.502 ( 8.787 -3.457 -4.488) 10.455 4.961 ( 16.885 -6.498 -5.117) 18.801 5.320 ( 3.470 -7.946 -4.779) 9.900 5.567 ( 5.017 -13.873 1.789) 14.860 6.317 ( -4.937 -6.784 -0.811) 8.429 6.653 ( 0.123 -1.529 -7.995) 8.141 6.986 ( -8.594 28.556 2.171) 29.900 7.385 ( -1.732 0.897 1.335) 2.364 7.625 ( 1.583 7.834 4.506) 9.175 8.036 ( -5.883 -21.359 -1.912) 22.237 8.174 ( -15.528 -11.661 5.454) 20.170 8.508 ( 1.629 -3.169 -16.224) 16.610 8.704 ( -2.202 -1.741 -3.693) 4.639 8.825 ( 6.349 -1.803 -6.099) 8.986 8.993 ( -1.893 -11.046 -11.832) 16.297 10.275 ( -9.626 3.259 6.744) 12.196 10.920 ( -34.908 9.320 23.711) 43.216 12.361 ( 11.374 8.996 8.161) 16.640 12.506 ( 5.090 17.322 -5.379) 18.839 13.123 ( -0.232 9.574 -6.137) 11.375 13.598 ( 3.224 17.671 1.562) 18.031 14.122 ( 13.886 12.453 -1.141) 18.687 14.670 ( 9.972 8.768 8.742) 15.898 15.744 ( -23.610 -14.733 -0.170) 27.831 16.478 ( 18.453 -41.701 -18.413) 49.179 19.553 ( -9.130 -31.997 1.324) 33.300 20.443 ( 4.559 -27.444 -8.448) 29.075 22.554 ( -3.236 -0.188 -5.553) 6.430 25.401 ( 27.271 3.082 -38.195) 47.032 26.658 ( -5.596 0.920 3.881) 6.872 28.454 ( -28.459 11.702 39.930) 50.411 ======================= Grid point 252 (99/429) ======================= q-point: ( 0.36 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.242 ( 20.963 -20.494 11.279) 31.411 2.464 ( 17.501 -19.297 20.824) 33.351 3.850 ( -2.983 -20.485 -0.940) 20.723 3.974 ( -11.688 -7.791 -2.986) 14.361 4.303 ( 25.029 -13.282 22.408) 36.125 4.790 ( 4.535 -21.442 -0.840) 21.933 5.079 ( 17.274 -0.807 -6.001) 18.305 5.539 ( -4.601 -14.230 -3.270) 15.308 5.922 ( 12.016 -15.129 -1.717) 19.396 6.316 ( -9.642 18.467 -5.594) 21.571 6.575 ( -6.222 -8.042 1.112) 10.228 6.744 ( 1.729 -6.656 -0.083) 6.878 7.385 ( -0.807 -2.558 3.431) 4.355 7.545 ( 0.828 0.834 3.521) 3.712 8.266 ( -11.884 -10.120 -3.916) 16.093 8.412 ( 0.167 -17.358 -2.024) 17.476 8.587 ( 3.021 -7.112 -16.455) 18.179 8.711 ( 0.281 -1.953 -4.985) 5.361 8.902 ( -5.844 -9.440 -3.370) 11.603 9.271 ( 1.112 -17.341 -3.095) 17.650 10.149 ( -11.570 4.437 7.198) 14.330 10.652 ( -19.503 6.214 19.653) 28.377 12.065 ( 7.504 26.830 -4.307) 28.191 12.330 ( 3.953 5.705 6.280) 9.360 12.917 ( -1.271 15.856 -9.230) 18.391 13.223 ( 5.209 20.448 4.518) 21.579 13.927 ( 8.932 13.505 -0.935) 16.218 14.257 ( 11.819 33.436 11.576) 37.305 16.207 ( -31.319 -43.254 -6.149) 53.755 17.346 ( 12.901 -40.386 -8.522) 43.244 19.945 ( -6.165 -17.106 4.422) 18.713 21.193 ( 2.759 -45.326 -17.334) 48.606 22.533 ( -3.992 -1.046 -4.824) 6.348 25.379 ( 21.452 7.055 -32.233) 39.357 26.635 ( -4.966 -1.234 6.894) 8.586 28.162 ( -17.742 11.776 32.538) 38.887 ======================= Grid point 253 (100/429) ======================= q-point: ( 0.43 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.739 ( 18.221 -17.998 9.702) 27.387 2.961 ( 15.055 -19.279 16.314) 29.402 3.890 ( -16.377 -4.460 -10.756) 20.095 4.292 ( 3.639 -16.261 -3.459) 17.018 4.572 ( -0.480 -4.743 15.080) 15.815 4.937 ( 1.639 5.602 1.864) 6.127 5.439 ( 18.066 -20.011 1.111) 26.982 5.719 ( -2.888 12.284 4.278) 13.324 5.824 ( -5.332 -4.941 -3.803) 8.204 6.351 ( 9.401 -14.010 -7.966) 18.658 6.551 ( -12.056 1.728 -1.617) 12.286 6.963 ( 3.224 -5.198 -2.640) 6.662 7.519 ( -6.219 -8.216 11.664) 15.564 7.766 ( 10.992 -25.867 -1.671) 28.156 8.385 ( -8.276 -10.964 -4.028) 14.315 8.650 ( 7.035 -4.398 0.005) 8.297 8.697 ( 2.705 -8.041 -13.266) 15.747 8.855 ( -1.298 -11.680 -8.819) 14.693 9.197 ( -5.535 -28.968 -3.779) 29.733 9.572 ( -5.777 -14.487 2.750) 15.836 10.059 ( -7.921 -2.090 4.137) 9.177 10.533 ( -9.185 1.908 17.908) 20.216 11.521 ( -3.842 30.612 -1.894) 30.910 12.202 ( 9.413 19.232 0.690) 21.424 12.481 ( 3.157 18.884 -4.245) 19.611 13.027 ( 0.112 5.819 2.559) 6.358 13.712 ( 3.636 15.130 1.331) 15.618 13.817 ( 7.060 18.187 6.299) 20.501 16.812 ( -23.044 -37.825 -6.280) 44.735 18.028 ( 5.132 -27.084 -0.273) 27.567 20.221 ( 1.545 -13.167 3.218) 13.642 21.927 ( 4.421 -31.566 -18.265) 36.736 22.554 ( -6.306 -6.549 -2.251) 9.366 25.267 ( 15.690 10.531 -23.235) 29.949 26.683 ( -3.528 -4.956 7.602) 9.737 27.942 ( -10.807 8.651 23.345) 27.141 ======================= Grid point 254 (101/429) ======================= q-point: ( 0.50 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.139 ( 11.782 -13.444 9.104) 20.061 3.391 ( 11.780 -14.750 13.263) 23.070 3.875 ( -15.040 -5.687 -10.568) 19.241 4.483 ( 6.456 2.506 -4.993) 8.538 4.638 ( -14.247 -10.388 8.505) 19.576 4.761 ( 1.855 12.101 -3.512) 12.736 5.340 ( -6.418 16.796 3.354) 18.291 5.785 ( 6.529 -8.611 5.325) 12.047 6.057 ( 3.824 -6.138 10.938) 13.113 6.468 ( -13.670 -9.173 -11.899) 20.313 6.572 ( 11.522 -0.651 -10.691) 15.732 7.071 ( 8.143 -7.195 1.296) 10.943 7.632 ( -6.335 -5.798 9.877) 13.089 8.274 ( 2.678 -16.224 -7.485) 18.067 8.570 ( 1.132 -2.732 4.454) 5.346 8.772 ( 5.971 -11.053 -0.097) 12.563 8.951 ( -0.283 -15.717 -11.181) 19.290 9.072 ( 0.577 -23.131 -8.309) 24.585 9.695 ( -7.641 -12.412 3.662) 15.028 9.824 ( -5.148 -28.303 -2.458) 28.872 10.219 ( 0.143 -15.255 3.507) 15.653 10.535 ( -2.746 -3.171 14.380) 14.979 10.945 ( -10.174 24.360 0.591) 26.406 11.719 ( 3.842 28.191 -0.700) 28.460 12.332 ( 11.065 7.575 -4.291) 14.079 12.946 ( -4.465 3.146 3.282) 6.372 13.445 ( 2.419 12.930 3.651) 13.652 13.634 ( 2.395 7.936 1.424) 8.411 17.327 ( -14.449 -29.757 -4.727) 33.416 18.425 ( 0.197 -14.376 2.625) 14.615 20.442 ( 4.881 -7.292 1.728) 8.943 22.261 ( 5.712 -5.669 -15.090) 17.101 22.783 ( -5.603 -20.641 -1.627) 21.450 25.089 ( 10.192 12.377 -14.412) 21.558 26.798 ( -2.109 -7.098 7.238) 10.355 27.792 ( -6.663 6.190 15.394) 17.880 ======================= Grid point 255 (102/429) ======================= q-point: ( 0.57 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.405 ( 3.522 -8.620 7.882) 12.200 3.642 ( 0.562 -4.902 6.912) 8.492 3.902 ( -6.898 -5.414 -4.745) 9.971 4.384 ( -2.307 4.214 -5.950) 7.647 4.531 ( -1.160 8.174 -2.660) 8.674 4.803 ( -1.254 -4.913 10.038) 11.246 5.051 ( -3.135 10.418 1.041) 10.929 5.933 ( 4.809 -3.865 10.053) 11.795 6.054 ( -8.721 1.734 -1.679) 9.049 6.533 ( 3.356 3.087 -5.437) 7.096 6.696 ( 4.501 -12.564 -10.063) 16.714 7.289 ( 8.944 -8.158 2.159) 12.297 7.699 ( -6.092 -2.846 12.397) 14.103 8.441 ( -7.033 -3.370 -11.753) 14.105 8.524 ( 4.607 1.999 7.780) 9.260 9.013 ( 4.685 -11.061 -8.720) 14.844 9.157 ( 1.920 -11.901 -10.334) 15.878 9.595 ( 2.768 -16.808 -0.147) 17.035 9.966 ( -5.726 -25.038 1.510) 25.729 10.214 ( 3.092 -13.792 -4.886) 14.955 10.447 ( -0.388 2.004 6.171) 6.500 10.501 ( -9.754 7.308 12.148) 17.209 10.791 ( -4.007 -16.429 5.049) 17.648 11.359 ( 0.595 6.894 0.082) 6.920 12.206 ( 10.115 12.246 -5.175) 16.705 12.843 ( -5.538 5.176 4.250) 8.691 13.306 ( 0.791 3.610 2.031) 4.217 13.523 ( 0.705 5.130 0.597) 5.212 17.755 ( -7.341 -23.625 -2.790) 24.896 18.613 ( -1.106 -6.370 2.359) 6.882 20.542 ( 4.145 -0.334 0.740) 4.224 22.297 ( 3.904 0.022 -11.780) 12.411 23.120 ( -1.714 -16.363 -1.718) 16.542 24.875 ( 5.362 12.800 -8.036) 16.037 26.935 ( -1.361 -6.889 7.043) 9.945 27.679 ( -4.322 5.333 9.723) 11.902 ======================= Grid point 256 (103/429) ======================= q-point: ( 0.64 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.512 ( -3.821 -0.612 -0.442) 3.895 3.674 ( -7.580 -3.443 6.344) 10.467 3.924 ( 1.499 1.914 2.808) 3.714 4.272 ( 0.168 6.833 -5.464) 8.750 4.506 ( 0.298 -4.934 0.116) 4.945 4.790 ( 0.387 2.811 14.657) 14.929 5.005 ( -0.131 -2.965 -1.903) 3.526 5.957 ( -10.955 1.123 -7.742) 13.461 6.057 ( 7.460 -3.490 11.740) 14.341 6.476 ( 0.245 2.486 -7.653) 8.050 6.884 ( 5.645 -4.881 -5.381) 9.200 7.447 ( 4.337 -4.103 1.826) 6.243 7.699 ( -5.452 2.510 13.564) 14.832 8.387 ( -5.335 -2.228 -3.809) 6.923 8.594 ( 4.506 -1.861 0.816) 4.943 9.216 ( 3.728 -10.290 -12.038) 16.270 9.391 ( 4.537 -12.459 -11.080) 17.280 9.753 ( -0.710 -2.554 -2.119) 3.393 10.178 ( -1.708 11.794 -5.257) 13.025 10.247 ( 6.098 -2.575 4.652) 8.091 10.400 ( -10.848 -2.396 9.939) 14.906 10.651 ( -5.347 -16.714 8.120) 19.336 11.008 ( 3.509 -7.393 7.714) 11.246 11.476 ( -2.951 -11.930 -1.411) 12.371 11.971 ( 4.804 15.292 -2.435) 16.213 12.747 ( -2.931 2.422 3.551) 5.203 13.286 ( -0.416 0.142 1.070) 1.157 13.453 ( 0.384 2.782 0.132) 2.811 18.124 ( -2.347 -19.095 -1.125) 19.271 18.684 ( -0.537 -1.858 0.768) 2.081 20.516 ( 1.813 4.578 0.357) 4.937 22.291 ( 3.586 0.393 -11.187) 11.754 23.363 ( 0.009 -10.728 -0.551) 10.743 24.648 ( 1.779 12.197 -4.123) 12.998 27.058 ( -1.307 -5.568 7.014) 9.050 27.573 ( -3.079 5.300 6.447) 8.895 ======================= Grid point 257 (104/429) ======================= q-point: (-0.29 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.399 ( -5.845 7.757 -1.427) 9.817 3.690 ( -3.168 4.370 8.787) 10.312 3.901 ( 5.380 2.056 2.082) 6.125 4.187 ( -1.924 -2.747 2.212) 4.018 4.580 ( 0.200 -1.336 1.961) 2.381 4.933 ( 1.754 -14.562 6.354) 15.985 5.028 ( 0.402 1.202 0.766) 1.481 5.849 ( -9.751 2.785 -7.398) 12.553 6.189 ( 3.863 -4.149 9.709) 11.243 6.416 ( 1.414 2.731 -6.852) 7.511 6.922 ( 4.657 2.220 -5.691) 7.681 7.500 ( 1.816 0.932 3.928) 4.427 7.597 ( -6.542 5.935 8.482) 12.246 8.482 ( -6.493 -9.798 -4.200) 12.481 8.650 ( 9.464 -1.335 4.108) 10.403 9.394 ( 4.451 -8.777 -16.718) 19.400 9.577 ( 4.025 -3.510 -8.982) 10.450 9.708 ( -1.245 4.116 -2.957) 5.218 9.977 ( 2.563 7.270 -2.918) 8.242 10.214 ( -10.430 8.790 7.285) 15.464 10.443 ( 1.293 -7.427 9.163) 11.865 10.853 ( -6.536 -5.062 9.429) 12.540 11.115 ( 7.002 1.248 1.525) 7.274 11.584 ( -3.461 -1.897 -2.266) 4.552 11.735 ( -0.140 11.520 3.010) 11.907 12.739 ( -0.742 -1.805 3.238) 3.781 13.276 ( -0.990 0.890 1.098) 1.726 13.418 ( 0.825 1.628 -0.013) 1.825 18.432 ( -0.191 -14.117 -0.022) 14.118 18.692 ( 0.685 0.659 -1.195) 1.527 20.410 ( -0.256 6.799 0.475) 6.821 22.287 ( 3.642 -0.179 -11.772) 12.324 23.538 ( 0.334 -8.239 -0.341) 8.253 24.430 ( 0.505 10.989 -1.770) 11.142 27.149 ( -2.175 -3.488 6.584) 7.762 27.477 ( -1.922 4.189 5.957) 7.531 ======================= Grid point 258 (105/429) ======================= q-point: (-0.21 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.175 ( -2.327 13.940 5.205) 15.061 3.471 ( -0.394 17.556 8.880) 19.678 3.935 ( 7.397 -1.605 2.153) 7.869 4.384 ( -0.860 -14.934 5.426) 15.913 4.582 ( -3.828 -0.437 0.918) 3.961 4.952 ( 0.270 6.796 -1.604) 6.988 5.274 ( 2.925 -14.558 4.953) 15.653 5.730 ( -9.634 0.164 -5.445) 11.068 6.228 ( -6.797 0.765 -2.500) 7.283 6.413 ( 10.240 -0.023 2.115) 10.457 6.862 ( 5.038 5.093 -6.540) 9.700 7.454 ( -3.856 4.068 11.168) 12.495 7.470 ( -1.971 5.515 -0.959) 5.934 8.528 ( -3.943 0.693 -3.589) 5.377 8.833 ( 5.976 -9.328 4.324) 11.892 9.395 ( 0.128 10.627 -12.102) 16.106 9.553 ( 11.983 14.657 -1.720) 19.010 9.637 ( -7.381 -9.706 -10.428) 16.044 9.884 ( -2.496 15.048 -3.401) 15.628 9.997 ( -1.015 -2.795 2.617) 3.961 10.668 ( -0.916 -13.183 11.991) 17.844 10.839 ( -5.321 3.518 11.633) 13.267 11.023 ( 3.427 11.901 -4.239) 13.090 11.436 ( 3.492 19.292 4.063) 20.022 11.623 ( -4.368 -3.717 -1.655) 5.969 12.810 ( -0.123 -5.045 4.167) 6.545 13.250 ( -1.263 1.307 1.341) 2.259 13.390 ( 1.485 2.155 0.509) 2.666 18.577 ( -0.167 0.645 -3.943) 3.998 18.713 ( 0.206 -4.158 1.525) 4.434 20.278 ( -0.562 6.608 0.715) 6.670 22.297 ( 3.801 -1.046 -13.128) 13.707 23.674 ( -2.764 -6.648 -3.010) 7.804 24.248 ( 4.516 9.057 0.364) 10.127 27.166 ( -4.586 1.101 3.644) 5.960 27.444 ( 0.174 -0.197 10.428) 10.432 ======================= Grid point 259 (106/429) ======================= q-point: (-0.14 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.878 ( 1.813 19.023 11.425) 22.264 3.108 ( 0.590 22.792 11.881) 25.709 4.047 ( 8.654 -4.313 4.236) 10.557 4.499 ( -0.085 2.871 -3.172) 4.279 4.676 ( -7.241 -2.770 -0.690) 7.783 4.848 ( 3.675 -4.395 1.962) 6.056 5.266 ( -3.259 14.598 11.154) 18.658 5.893 ( -3.183 -17.587 -9.107) 20.059 6.133 ( -4.901 3.438 -5.992) 8.470 6.464 ( 4.027 1.447 2.265) 4.842 6.794 ( 5.914 3.155 -8.764) 11.034 7.314 ( -2.551 7.891 -0.417) 8.303 7.431 ( -1.346 -0.413 10.031) 10.129 8.424 ( 0.296 9.247 2.331) 9.541 8.868 ( -2.509 15.146 0.995) 15.385 9.093 ( -3.183 14.004 -8.490) 16.683 9.278 ( 7.309 14.880 -3.998) 17.053 9.534 ( -6.507 9.553 0.176) 11.560 9.937 ( 3.198 -13.589 -12.183) 18.529 10.071 ( 1.396 -4.108 -1.014) 4.455 10.550 ( -4.232 23.018 2.142) 23.501 10.760 ( -1.223 17.095 3.854) 17.567 10.989 ( 1.632 -9.735 13.347) 16.601 11.200 ( -0.210 -4.544 5.517) 7.150 11.720 ( 1.644 -6.989 -4.757) 8.612 12.924 ( -0.245 -5.659 5.690) 8.029 13.220 ( -2.009 0.827 0.759) 2.302 13.373 ( 3.222 0.660 1.820) 3.759 18.466 ( 1.173 9.094 -8.989) 12.841 18.731 ( -6.382 3.748 5.474) 9.206 20.180 ( 1.664 3.907 0.615) 4.291 22.317 ( 3.940 -1.370 -15.501) 16.053 23.670 ( -13.442 3.107 -8.211) 16.055 24.208 ( 17.968 0.708 0.991) 18.009 27.081 ( -6.190 4.493 1.141) 7.733 27.518 ( 0.676 -4.243 17.359) 17.883 ======================= Grid point 260 (107/429) ======================= q-point: (-0.07 0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( 5.491 23.494 14.016) 27.903 2.686 ( 2.903 25.477 17.896) 31.269 4.162 ( 8.817 1.124 7.661) 11.735 4.392 ( -0.917 8.184 -3.485) 8.942 4.535 ( -2.038 5.328 -8.257) 10.036 4.880 ( 2.485 21.938 9.518) 24.042 5.123 ( -0.336 -10.231 7.151) 12.487 5.928 ( 6.176 11.351 -3.851) 13.484 6.186 ( -12.613 -11.949 -6.458) 18.536 6.366 ( -7.578 7.351 -4.978) 11.672 6.792 ( 9.748 1.047 -10.365) 14.267 7.171 ( 2.694 6.981 -0.067) 7.483 7.487 ( -3.816 -3.974 10.190) 11.584 8.193 ( 0.405 19.512 7.681) 20.973 8.320 ( 2.835 30.848 2.446) 31.074 8.869 ( -1.685 9.002 -11.504) 14.704 9.051 ( 1.535 12.002 -4.079) 12.769 9.369 ( -8.585 4.818 -8.447) 12.972 9.853 ( -1.398 21.705 -6.842) 22.801 10.119 ( 2.863 15.849 1.461) 16.172 10.218 ( -2.343 2.703 1.624) 3.928 10.522 ( -4.636 -6.356 0.572) 7.888 11.249 ( 1.611 -18.775 20.996) 28.212 11.538 ( -1.974 -21.610 -3.799) 22.030 11.889 ( 6.019 -11.255 -2.684) 13.042 13.009 ( -1.406 -1.994 5.502) 6.019 13.237 ( -0.149 -4.737 1.642) 5.016 13.422 ( 5.231 -2.866 2.583) 6.500 18.216 ( 2.460 16.762 -14.596) 22.362 18.476 ( -15.028 18.699 9.299) 25.729 20.154 ( 3.307 0.939 0.410) 3.462 22.319 ( 3.631 0.791 -20.629) 20.961 23.387 ( -18.564 14.518 -9.009) 25.230 24.394 ( 27.205 -5.796 -6.952) 28.671 26.950 ( -7.119 5.327 0.998) 8.948 27.671 ( -1.031 -8.163 25.695) 26.981 ======================= Grid point 265 (108/429) ======================= q-point: ( 0.29 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( 16.013 -0.000 15.777) 22.480 2.172 ( 24.489 -0.000 28.823) 37.822 3.136 ( -0.069 0.000 -4.005) 4.006 3.720 ( 45.217 -0.000 37.121) 58.502 3.951 ( -14.127 0.000 -10.091) 17.361 4.489 ( -0.940 0.000 -2.338) 2.520 5.015 ( 29.167 -0.000 -8.694) 30.435 5.297 ( 5.353 -0.000 -5.090) 7.387 5.415 ( -0.525 0.000 1.889) 1.961 6.227 ( -5.375 0.000 0.766) 5.429 6.631 ( 2.021 -0.000 -7.142) 7.422 7.377 ( -1.451 0.000 0.288) 1.480 7.390 ( -13.861 0.000 -3.729) 14.354 7.617 ( -2.202 0.000 4.376) 4.899 7.771 ( 2.247 -0.000 0.411) 2.284 7.927 ( -21.195 0.000 10.428) 23.621 8.461 ( 1.577 -0.000 -14.565) 14.650 8.651 ( -2.253 0.000 -5.197) 5.665 8.766 ( -11.199 0.000 -12.143) 16.519 8.952 ( 19.244 -0.000 -4.578) 19.781 10.260 ( -11.225 0.000 7.057) 13.259 10.846 ( -35.670 0.000 23.608) 42.774 12.436 ( -2.114 0.000 7.436) 7.730 12.808 ( 16.912 -0.000 -5.747) 17.861 13.283 ( -2.388 0.000 -5.337) 5.847 13.789 ( 0.439 -0.000 0.900) 1.001 14.147 ( -0.054 0.000 -3.226) 3.226 14.710 ( 16.527 -0.000 0.749) 16.544 15.831 ( -0.870 0.000 2.079) 2.253 16.044 ( 15.360 -0.000 -10.941) 18.858 19.123 ( -0.484 0.000 1.506) 1.582 20.219 ( 0.389 -0.000 -1.214) 1.275 22.526 ( -2.343 0.000 -6.870) 7.258 25.503 ( 23.641 -0.000 -38.266) 44.980 26.645 ( -5.003 0.000 3.197) 5.937 28.465 ( -30.382 0.000 38.020) 48.668 ======================= Grid point 266 (109/429) ======================= q-point: ( 0.36 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.952 ( 14.342 -21.639 12.816) 28.952 2.384 ( 23.740 -5.291 22.490) 33.127 3.399 ( -0.484 -23.621 0.506) 23.632 3.802 ( -20.271 -1.455 -9.909) 22.610 4.244 ( 41.624 -15.168 31.433) 54.320 4.549 ( 2.831 -7.038 -2.649) 8.035 5.151 ( 19.189 -0.525 -8.131) 20.847 5.310 ( -2.680 -4.805 -3.195) 6.362 5.640 ( 7.012 -17.636 -3.009) 19.216 6.271 ( -2.293 -6.909 1.726) 7.481 6.629 ( 0.840 1.010 -7.379) 7.495 6.902 ( -7.466 25.336 2.952) 26.577 7.369 ( -1.284 0.125 -0.152) 1.299 7.631 ( -4.567 7.302 4.571) 9.750 7.951 ( -8.437 -18.216 -3.283) 20.341 8.024 ( -11.199 -15.870 2.603) 19.597 8.478 ( 2.307 -3.714 -14.786) 15.419 8.657 ( -3.752 -3.244 -8.415) 9.768 8.739 ( -7.738 -4.165 -1.637) 8.939 9.096 ( 16.919 -5.330 -3.892) 18.160 10.172 ( -12.992 3.413 8.391) 15.838 10.657 ( -25.608 3.987 20.599) 33.106 12.406 ( -3.470 3.116 4.173) 6.258 12.639 ( 16.160 24.098 -1.360) 29.046 13.093 ( -0.676 9.015 -7.415) 11.692 13.629 ( 1.746 15.900 0.153) 15.996 14.276 ( 14.289 10.858 -2.554) 18.127 14.777 ( 4.542 -4.206 4.429) 7.611 15.516 ( -18.238 9.409 4.630) 21.038 16.623 ( 17.555 -41.302 -13.633) 46.903 19.473 ( -6.873 -27.933 3.603) 28.991 20.464 ( 4.039 -27.401 -6.680) 28.491 22.500 ( -1.999 0.069 -7.217) 7.489 25.529 ( 19.958 3.190 -36.569) 41.783 26.617 ( -4.590 0.482 5.737) 7.363 28.293 ( -24.039 7.568 33.920) 42.258 ======================= Grid point 267 (110/429) ======================= q-point: ( 0.43 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.491 ( 15.032 -22.559 9.731) 28.802 2.748 ( 20.514 -15.154 15.682) 29.940 3.679 ( -20.423 -4.709 -12.145) 24.224 3.895 ( -2.491 -23.427 2.080) 23.650 4.610 ( 12.148 -0.432 11.646) 16.834 4.865 ( 6.934 -15.796 13.805) 22.095 5.279 ( 21.666 -6.855 -8.152) 24.142 5.483 ( -2.393 -15.948 -0.971) 16.156 6.001 ( 2.854 -13.446 -6.220) 15.087 6.180 ( -10.846 17.378 -4.767) 21.032 6.558 ( 4.071 -0.470 2.751) 4.935 6.781 ( 2.840 -11.199 3.376) 12.037 7.381 ( -3.071 -2.741 4.838) 6.352 7.556 ( 0.691 -3.195 -1.203) 3.483 8.107 ( -12.246 -11.118 -5.792) 17.525 8.401 ( -0.324 -23.277 -3.760) 23.581 8.570 ( 3.905 -7.384 -15.559) 17.659 8.688 ( -2.067 -3.052 -3.916) 5.378 8.816 ( -6.162 -8.385 0.919) 10.446 9.327 ( 9.071 -11.211 -0.884) 14.448 10.035 ( -13.120 3.782 8.701) 16.191 10.526 ( -14.966 1.318 18.104) 23.526 12.095 ( 1.134 28.950 -2.965) 29.124 12.432 ( 9.017 5.452 4.249) 11.362 12.866 ( -1.252 16.663 -9.531) 19.237 13.280 ( 2.653 19.424 2.452) 19.757 14.017 ( 7.990 17.513 -2.786) 19.450 14.408 ( 6.830 35.521 11.453) 37.942 15.874 ( -23.030 -44.991 -5.278) 50.818 17.462 ( 11.817 -37.568 -4.389) 39.627 19.898 ( -5.259 -21.062 5.153) 22.312 21.181 ( 4.384 -43.055 -12.588) 45.071 22.477 ( -2.163 -0.382 -6.652) 7.006 25.472 ( 16.020 7.029 -32.113) 36.569 26.615 ( -3.754 -1.784 8.708) 9.649 28.076 ( -16.625 8.582 27.122) 32.949 ======================= Grid point 268 (111/429) ======================= q-point: ( 0.50 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.960 ( 13.234 -16.557 7.799) 22.586 3.187 ( 16.424 -16.644 11.017) 25.849 3.637 ( -20.721 -6.633 -11.299) 24.516 4.292 ( -2.970 -19.068 1.965) 19.398 4.608 ( 2.536 5.132 2.474) 6.236 4.943 ( -2.054 5.836 2.904) 6.835 5.613 ( 8.616 -10.330 5.323) 14.467 5.670 ( -6.419 18.697 -2.875) 19.977 5.888 ( 15.397 -20.487 8.902) 27.130 6.190 ( -18.467 -6.089 -13.383) 23.605 6.635 ( 15.048 -1.847 0.016) 15.161 6.991 ( 3.095 -6.129 -0.507) 6.885 7.459 ( -11.619 -8.161 10.170) 17.465 7.894 ( 12.543 -26.054 -2.781) 29.050 8.272 ( -8.769 -16.558 -5.566) 19.545 8.670 ( 3.710 -8.498 -13.625) 16.481 8.726 ( 3.522 -1.969 1.427) 4.280 8.819 ( -0.080 -11.260 -5.894) 12.709 9.118 ( -4.795 -32.928 -3.843) 33.496 9.550 ( -0.986 -7.429 5.729) 9.433 9.993 ( -5.935 -6.683 3.244) 9.508 10.493 ( -9.791 -1.314 18.509) 20.981 11.480 ( -1.817 34.251 -2.481) 34.389 12.300 ( 7.629 26.342 -2.322) 27.523 12.488 ( 1.150 7.874 -3.504) 8.694 13.034 ( -0.400 8.947 1.955) 9.167 13.742 ( 1.405 15.168 -0.605) 15.245 13.905 ( 3.849 21.244 6.369) 22.510 16.579 ( -14.107 -40.498 -4.683) 43.140 18.086 ( 4.613 -24.017 2.037) 24.540 20.245 ( 0.372 -16.152 3.381) 16.506 21.926 ( 5.777 -32.904 -14.180) 36.292 22.486 ( -3.535 -4.991 -4.024) 7.322 25.332 ( 11.270 10.520 -24.257) 28.741 26.682 ( -2.272 -5.319 9.508) 11.129 27.895 ( -11.136 6.789 19.331) 23.320 ======================= Grid point 269 (112/429) ======================= q-point: ( 0.57 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.275 ( 5.613 -9.912 6.396) 13.064 3.518 ( -0.610 -8.196 0.754) 8.253 3.693 ( -5.318 -12.074 -3.456) 13.639 4.456 ( -8.432 3.007 5.691) 10.608 4.620 ( 7.683 -7.506 -3.322) 11.243 4.755 ( -0.482 10.122 -2.354) 10.404 5.285 ( -6.126 15.404 5.061) 17.333 5.848 ( 0.319 -7.890 6.310) 10.108 6.045 ( -10.516 3.081 -5.113) 12.092 6.409 ( 8.993 -19.845 3.393) 22.050 6.659 ( 9.508 5.815 -7.602) 13.491 7.176 ( 9.037 -9.519 -0.608) 13.139 7.569 ( -11.023 -8.182 11.274) 17.764 8.262 ( 0.863 -9.972 -10.378) 14.418 8.593 ( -0.090 -4.243 4.610) 6.267 8.837 ( 4.390 -8.546 -6.168) 11.417 8.924 ( 2.825 -17.491 -7.831) 19.371 9.048 ( 1.056 -28.133 -3.850) 28.414 9.635 ( -5.218 -6.299 6.829) 10.656 9.785 ( -0.391 -33.957 -3.699) 34.160 10.237 ( 0.972 -17.671 2.276) 17.843 10.529 ( -9.126 -5.271 17.654) 20.561 10.860 ( -3.679 27.845 -2.274) 28.179 11.748 ( 2.127 28.749 -1.907) 28.891 12.426 ( 8.057 6.004 -4.091) 10.849 12.903 ( -4.613 4.694 2.345) 6.987 13.469 ( -0.262 12.725 2.505) 12.972 13.659 ( 1.113 9.409 1.192) 9.549 17.192 ( -6.575 -32.028 -3.101) 32.843 18.441 ( 0.647 -12.685 3.552) 13.189 20.490 ( 2.160 -8.114 1.855) 8.599 22.273 ( 5.681 -4.537 -13.680) 15.492 22.733 ( -2.117 -22.320 -1.670) 22.482 25.126 ( 6.277 12.544 -15.911) 21.211 26.811 ( -0.965 -7.106 9.181) 11.650 27.763 ( -7.535 5.084 12.515) 15.468 ======================= Grid point 270 (113/429) ======================= q-point: (-0.36 -0.71 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.422 ( -5.408 -4.606 2.073) 7.399 3.545 ( -12.259 -4.102 -6.273) 14.369 3.922 ( 6.134 -7.115 5.397) 10.834 4.371 ( 3.189 4.030 -2.472) 5.703 4.522 ( 0.751 7.019 1.215) 7.163 4.850 ( 3.521 -6.622 6.967) 10.237 5.021 ( -3.764 10.129 3.819) 11.461 5.880 ( -13.917 0.151 -5.618) 15.009 6.026 ( 2.677 -4.519 4.108) 6.668 6.562 ( 5.661 6.073 -4.714) 9.548 6.771 ( 9.340 -11.286 1.690) 14.747 7.366 ( 3.841 -6.530 -3.390) 8.300 7.675 ( -6.270 -5.046 15.685) 17.629 8.320 ( -6.396 -0.707 -11.646) 13.305 8.608 ( 5.205 -0.394 6.453) 8.300 9.019 ( 2.022 -10.069 -9.775) 14.179 9.161 ( 5.184 -12.402 -8.941) 16.144 9.617 ( 1.394 -13.959 -0.468) 14.037 9.919 ( -2.620 -30.161 0.807) 30.285 10.229 ( 2.564 -11.704 -4.673) 12.861 10.412 ( -6.291 14.266 -1.606) 15.674 10.480 ( -5.042 -4.790 19.793) 20.979 10.787 ( -0.772 -19.597 6.255) 20.585 11.360 ( -0.140 8.985 -1.383) 9.092 12.284 ( 6.574 13.342 -4.434) 15.520 12.796 ( -5.004 4.144 3.047) 7.176 13.314 ( -0.721 4.009 1.643) 4.392 13.528 ( -0.148 5.353 0.125) 5.357 17.698 ( -1.167 -25.116 -1.506) 25.189 18.613 ( -0.538 -5.756 2.483) 6.291 20.576 ( 1.312 -0.045 0.943) 1.616 22.298 ( 3.867 0.249 -11.438) 12.077 23.109 ( 0.633 -16.979 -1.360) 17.045 24.885 ( 2.133 12.991 -9.376) 16.162 26.954 ( -0.459 -6.547 8.720) 10.914 27.656 ( -5.300 4.605 7.696) 10.418 ======================= Grid point 271 (114/429) ======================= q-point: (-0.29 -0.71 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.390 ( -12.240 -0.232 -8.524) 14.918 3.610 ( -6.613 -7.749 5.650) 11.649 3.995 ( 5.470 2.765 5.202) 8.039 4.279 ( 3.527 7.110 -2.478) 8.315 4.538 ( 4.233 -3.777 3.327) 6.577 4.852 ( 0.388 2.820 13.134) 13.439 5.010 ( 1.925 -3.803 1.115) 4.406 5.789 ( -11.734 0.059 -10.825) 15.965 6.134 ( -0.787 -4.432 5.974) 7.481 6.492 ( 7.120 4.079 -3.342) 8.860 6.947 ( 6.010 -2.758 0.549) 6.635 7.462 ( -1.313 -4.152 -3.017) 5.298 7.695 ( -4.304 3.632 13.600) 14.719 8.296 ( -5.844 -4.694 -4.772) 8.886 8.682 ( 7.795 -1.629 3.473) 8.688 9.196 ( 0.831 -10.130 -13.207) 16.665 9.425 ( 8.014 -12.686 -8.573) 17.282 9.730 ( -1.134 -0.432 -4.133) 4.308 10.144 ( -0.791 6.635 -5.208) 8.472 10.298 ( -4.703 6.018 6.365) 9.943 10.343 ( 0.130 -9.526 3.936) 10.308 10.614 ( -7.102 -12.793 11.386) 18.540 11.086 ( 4.158 -10.680 9.867) 15.123 11.433 ( -2.799 -10.730 -3.774) 11.714 12.006 ( 2.560 16.679 -1.410) 16.933 12.728 ( -2.450 1.018 2.766) 3.833 13.281 ( -0.930 0.301 0.733) 1.222 13.455 ( -0.151 2.451 0.002) 2.456 18.117 ( 1.658 -19.609 -0.276) 19.681 18.679 ( -0.761 -1.805 0.453) 2.011 20.528 ( 0.122 5.110 0.567) 5.143 22.290 ( 3.568 0.461 -11.242) 11.803 23.367 ( 0.933 -10.730 -0.265) 10.774 24.641 ( -0.051 11.955 -4.865) 12.907 27.075 ( -0.689 -4.916 8.143) 9.537 27.555 ( -3.821 4.555 5.212) 7.907 ======================= Grid point 272 (115/429) ======================= q-point: (-0.21 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.299 ( -8.419 2.699 -3.633) 9.559 3.691 ( -2.402 2.040 9.137) 9.665 3.991 ( 6.304 -0.123 3.930) 7.430 4.192 ( 1.637 0.243 3.108) 3.521 4.590 ( 0.019 0.727 2.400) 2.508 4.969 ( 1.313 -9.277 0.318) 9.375 5.067 ( 4.253 -2.316 8.476) 9.762 5.691 ( -11.852 1.533 -9.351) 15.175 6.177 ( -6.214 -1.529 -0.929) 6.466 6.491 ( 10.749 1.403 2.401) 11.103 6.968 ( 4.917 2.960 -0.967) 5.821 7.500 ( -2.555 -0.955 -1.725) 3.228 7.566 ( -4.293 7.806 8.148) 12.073 8.395 ( -6.131 -7.951 -1.070) 10.097 8.778 ( 9.552 -3.279 3.398) 10.655 9.361 ( -0.238 -10.551 -15.358) 18.635 9.554 ( -0.204 5.971 -10.182) 11.805 9.734 ( 7.163 -4.888 -3.709) 9.432 10.009 ( 4.045 8.355 -1.236) 9.365 10.125 ( -8.969 9.766 4.669) 14.058 10.481 ( -0.235 -7.593 7.828) 10.908 10.795 ( -9.065 -7.288 9.841) 15.236 11.209 ( 6.532 4.267 4.385) 8.950 11.534 ( -2.736 -3.395 -4.100) 5.985 11.753 ( 0.976 11.991 3.541) 12.541 12.739 ( -1.229 -2.620 3.222) 4.331 13.269 ( -0.817 0.881 0.819) 1.454 13.426 ( 0.349 1.111 0.291) 1.201 18.439 ( 1.355 -13.071 0.317) 13.145 18.685 ( -1.072 0.097 -1.535) 1.875 20.411 ( 0.114 7.016 0.525) 7.037 22.285 ( 3.594 -0.087 -11.883) 12.415 23.534 ( -0.721 -7.140 -0.446) 7.190 24.434 ( 1.253 9.369 -1.660) 9.597 27.150 ( -1.993 -1.870 6.627) 7.169 27.476 ( -2.059 2.481 5.913) 6.735 ======================= Grid point 273 (116/429) ======================= q-point: (-0.14 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.165 ( -2.156 8.998 5.572) 10.801 3.506 ( 0.188 16.507 10.650) 19.645 4.057 ( 11.035 -0.948 4.067) 11.798 4.383 ( -2.893 -16.920 5.656) 18.073 4.545 ( -2.936 2.942 -0.414) 4.177 4.946 ( 0.031 6.368 -3.095) 7.081 5.342 ( 4.832 -12.475 7.638) 15.405 5.574 ( -13.387 -1.669 -7.144) 15.265 6.137 ( -5.110 0.986 -6.075) 7.999 6.535 ( 8.158 1.460 3.409) 8.962 6.911 ( 5.887 5.604 -1.853) 8.336 7.390 ( -7.290 5.977 1.599) 9.561 7.499 ( 2.057 2.513 4.126) 5.251 8.462 ( -5.577 -2.614 -1.350) 6.306 8.904 ( 4.140 -3.228 1.488) 5.456 9.332 ( -5.175 12.400 -8.357) 15.823 9.540 ( -2.008 -8.944 -11.097) 14.394 9.677 ( 9.970 15.248 0.048) 18.218 9.841 ( -1.686 12.303 -4.952) 13.369 10.023 ( 4.388 -4.997 0.343) 6.659 10.678 ( -4.483 -12.546 10.519) 16.975 10.803 ( -7.757 4.103 11.006) 14.076 11.049 ( 1.952 13.139 -1.659) 13.386 11.492 ( 2.401 18.801 6.042) 19.894 11.599 ( 2.548 -5.663 -4.249) 7.524 12.818 ( -1.262 -5.573 4.638) 7.360 13.242 ( -0.693 1.639 1.041) 2.061 13.409 ( 1.226 1.170 1.155) 2.051 18.547 ( -2.740 1.782 -4.428) 5.504 18.707 ( -1.873 -3.406 1.813) 4.289 20.291 ( 2.342 6.095 0.468) 6.546 22.292 ( 3.801 -0.846 -13.096) 13.662 23.607 ( -6.224 -2.100 -3.065) 7.248 24.327 ( 8.288 3.784 0.694) 9.137 27.129 ( -4.144 3.057 3.322) 6.128 27.484 ( -0.083 -2.290 10.779) 11.020 ======================= Grid point 274 (117/429) ======================= q-point: (-0.07 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.953 ( 3.792 15.914 12.223) 20.421 3.174 ( 2.471 21.399 14.109) 25.751 4.182 ( 11.166 -4.082 5.223) 12.985 4.459 ( -4.362 3.083 -4.508) 6.990 4.607 ( -4.139 -0.336 -2.047) 4.630 4.897 ( 3.189 -8.323 2.328) 9.212 5.264 ( -4.440 14.150 10.166) 17.980 5.804 ( -6.697 -19.452 -5.906) 21.404 6.070 ( -1.331 2.894 -7.985) 8.597 6.493 ( 1.092 7.490 -0.134) 7.570 6.848 ( 7.250 3.443 -3.754) 8.861 7.254 ( -7.528 4.183 -1.419) 8.728 7.487 ( 4.782 1.448 7.444) 8.966 8.426 ( -1.624 4.447 2.781) 5.491 8.823 ( -4.881 16.081 -0.976) 16.834 9.030 ( -2.285 13.079 -8.362) 15.690 9.343 ( 6.409 17.104 -5.453) 19.062 9.458 ( -6.221 11.582 0.299) 13.151 9.947 ( 5.510 -13.938 -9.697) 17.851 10.094 ( 2.953 0.554 -0.113) 3.006 10.508 ( -5.018 21.230 3.458) 22.087 10.743 ( -4.771 15.083 5.781) 16.843 11.008 ( -3.006 -13.387 4.313) 14.383 11.243 ( 1.312 1.350 11.098) 11.257 11.755 ( 7.833 -8.147 -5.836) 12.720 12.936 ( -1.540 -6.118 6.317) 8.928 13.208 ( -0.375 1.189 0.685) 1.422 13.417 ( 3.036 -0.867 2.345) 3.933 18.399 ( -7.315 9.024 -8.717) 14.523 18.680 ( -5.291 6.514 4.788) 9.662 20.225 ( 5.693 3.477 0.329) 6.679 22.305 ( 4.047 -0.752 -15.282) 15.827 23.494 ( -12.519 7.783 -5.667) 15.793 24.411 ( 17.338 -4.526 -1.009) 17.947 27.022 ( -5.207 5.567 1.787) 7.829 27.583 ( -0.267 -5.359 16.625) 17.470 ======================= Grid point 280 (118/429) ======================= q-point: ( 0.36 0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.811 ( 10.515 -0.000 13.616) 17.204 2.545 ( 23.121 -0.000 25.013) 34.063 3.120 ( 0.051 -0.000 -3.980) 3.980 3.639 ( -24.516 0.000 -12.684) 27.603 4.426 ( 47.535 -0.000 33.285) 58.030 4.474 ( -0.288 0.000 -1.874) 1.896 5.230 ( 4.449 -0.000 -2.631) 5.169 5.345 ( 14.529 -0.000 -14.806) 20.744 5.413 ( -0.850 0.000 1.390) 1.629 6.208 ( 2.264 -0.000 3.816) 4.437 6.628 ( 2.166 -0.000 -6.964) 7.293 7.231 ( -10.900 0.000 -5.249) 12.098 7.362 ( -1.083 0.000 -0.973) 1.456 7.606 ( -2.561 0.000 4.900) 5.529 7.685 ( -27.134 0.000 7.538) 28.161 7.799 ( 2.189 -0.000 1.088) 2.444 8.413 ( -0.543 0.000 -16.125) 16.134 8.559 ( -4.994 0.000 -16.785) 17.513 8.691 ( -1.017 0.000 8.541) 8.601 9.160 ( 19.607 -0.000 -4.012) 20.013 10.147 ( -13.765 0.000 9.626) 16.797 10.586 ( -24.436 0.000 20.197) 31.702 12.418 ( -3.906 0.000 3.062) 4.964 12.976 ( 14.769 -0.000 -2.217) 14.935 13.229 ( -3.670 0.000 -4.737) 5.992 13.793 ( 0.090 -0.000 -1.064) 1.068 14.135 ( 0.139 -0.000 -3.225) 3.228 14.889 ( 13.730 -0.000 1.148) 13.778 15.829 ( -0.833 0.000 2.018) 2.183 16.159 ( 11.282 -0.000 -7.632) 13.621 19.123 ( -0.486 0.000 1.512) 1.588 20.219 ( 0.397 -0.000 -1.200) 1.264 22.479 ( -0.930 0.000 -8.209) 8.261 25.596 ( 17.708 -0.000 -37.317) 41.305 26.609 ( -4.099 0.000 5.474) 6.839 28.284 ( -24.643 0.000 32.389) 40.698 ======================= Grid point 281 (119/429) ======================= q-point: ( 0.43 0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 7.242 -22.290 10.836) 25.821 2.719 ( 21.307 -4.154 16.809) 27.455 3.382 ( -5.027 -19.514 -3.949) 20.534 3.507 ( -19.802 -6.662 -8.333) 22.493 4.561 ( 1.073 -8.698 -1.904) 8.968 4.815 ( 34.905 -4.951 31.438) 47.236 5.228 ( -9.134 -5.731 0.150) 10.784 5.322 ( 16.670 0.173 -12.737) 20.979 5.668 ( 0.073 -16.760 -5.467) 17.629 6.302 ( 6.313 -3.531 2.745) 7.737 6.623 ( 2.623 1.180 -5.970) 6.626 6.847 ( -3.775 19.499 3.114) 20.103 7.356 ( -1.155 -0.243 -0.228) 1.202 7.520 ( -18.185 0.959 2.816) 18.427 7.836 ( -6.709 -10.335 -3.753) 12.880 7.959 ( -2.410 -19.185 -0.236) 19.338 8.439 ( 0.507 -5.856 -15.007) 16.117 8.557 ( -4.039 -5.053 -10.984) 12.747 8.728 ( 0.763 -1.885 8.905) 9.134 9.282 ( 17.785 -2.537 -3.537) 18.310 10.051 ( -14.370 3.517 11.470) 18.719 10.487 ( -17.179 0.799 17.791) 24.744 12.369 ( -3.864 4.056 0.443) 5.619 12.798 ( 10.241 23.856 2.051) 26.042 13.061 ( 0.821 7.506 -7.870) 10.907 13.638 ( 0.219 14.762 -1.682) 14.859 14.425 ( 13.830 6.146 -3.565) 15.548 14.806 ( -0.512 -13.021 -0.781) 13.055 15.356 ( -14.640 29.837 8.975) 34.426 16.776 ( 16.413 -41.390 -8.501) 45.330 19.418 ( -5.592 -25.107 4.274) 26.075 20.486 ( 3.661 -28.176 -5.461) 28.933 22.458 ( -0.284 0.267 -8.449) 8.458 25.593 ( 15.332 3.210 -36.673) 39.878 26.596 ( -3.640 -0.008 7.946) 8.740 28.155 ( -20.477 5.282 28.545) 35.525 ======================= Grid point 282 (120/429) ======================= q-point: ( 0.50 0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( 4.423 -24.640 6.946) 25.980 3.036 ( 19.715 -13.321 11.145) 26.275 3.369 ( -23.664 -5.051 -13.004) 27.471 3.890 ( -0.100 -23.291 3.001) 23.483 4.681 ( 1.226 -1.141 -1.070) 1.987 4.976 ( -2.082 -0.378 13.420) 13.586 5.418 ( 4.743 -11.511 1.361) 12.524 5.581 ( 19.258 -18.720 -4.974) 27.314 5.936 ( -7.388 -12.523 -1.765) 14.647 6.084 ( -2.686 23.348 -1.620) 23.558 6.659 ( 10.181 -3.042 -0.212) 10.628 6.833 ( 3.585 -10.520 6.051) 12.654 7.324 ( -12.122 -0.048 6.447) 13.730 7.565 ( 3.426 -13.451 -6.066) 15.148 7.959 ( -8.841 -10.355 -6.522) 15.097 8.377 ( -0.414 -26.005 -6.977) 26.928 8.559 ( 3.772 -8.072 -13.693) 16.337 8.648 ( -1.027 -6.950 -1.442) 7.172 8.795 ( -0.372 -4.085 5.553) 6.903 9.447 ( 11.910 -6.112 -0.826) 13.412 9.925 ( -12.105 2.521 10.456) 16.193 10.442 ( -11.365 -1.116 17.035) 20.509 12.087 ( -0.247 27.176 -2.650) 27.306 12.526 ( 3.703 6.402 2.132) 7.697 12.833 ( 2.449 19.015 -8.773) 21.084 13.301 ( -0.025 18.244 0.685) 18.257 14.083 ( 5.722 21.911 -4.670) 23.122 14.487 ( -0.512 36.531 10.601) 38.041 15.656 ( -11.870 -47.870 -4.025) 49.484 17.583 ( 11.030 -34.453 -0.030) 36.176 19.860 ( -4.863 -23.804 4.876) 24.780 21.196 ( 5.385 -42.097 -9.499) 43.490 22.437 ( 0.015 0.069 -7.940) 7.941 25.511 ( 12.077 7.043 -33.069) 35.903 26.614 ( -2.687 -2.425 10.713) 11.308 27.985 ( -15.384 6.510 22.635) 28.132 ======================= Grid point 283 (121/429) ======================= q-point: (-0.43 -0.64 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.059 ( -0.393 -17.369 3.975) 17.822 3.337 ( -21.867 -7.590 -11.212) 25.719 3.431 ( 17.587 -14.556 8.104) 24.224 4.264 ( -3.141 -15.903 5.474) 17.110 4.657 ( 6.550 2.825 -4.282) 8.319 4.910 ( -5.831 6.059 3.432) 9.082 5.575 ( -8.754 14.381 -3.733) 17.245 5.709 ( 6.162 -4.102 6.069) 9.572 5.920 ( -15.369 -8.905 -12.486) 21.712 6.166 ( 19.388 -13.673 14.072) 27.584 6.789 ( 12.764 0.540 -4.083) 13.413 7.033 ( 3.773 -9.663 1.133) 10.436 7.333 ( -16.386 -8.994 9.592) 21.010 8.018 ( 11.032 -23.200 -4.458) 26.073 8.134 ( -11.176 -21.158 -8.575) 25.419 8.670 ( 4.062 -6.360 -10.617) 13.026 8.767 ( 4.463 -6.733 -0.111) 8.078 8.815 ( 1.485 -8.751 0.062) 8.876 9.078 ( 0.293 -34.047 -3.548) 34.232 9.581 ( 1.366 -1.877 7.741) 8.082 9.950 ( -3.088 -10.793 1.311) 11.302 10.451 ( -9.455 -2.281 18.510) 20.909 11.459 ( -0.289 35.922 -2.713) 36.026 12.333 ( 0.342 30.880 -6.346) 31.527 12.502 ( 3.364 0.877 -0.898) 3.590 13.031 ( -1.115 10.813 1.169) 10.933 13.739 ( -1.113 16.045 -2.122) 16.223 13.947 ( -0.417 21.606 5.724) 22.356 16.463 ( -3.605 -42.064 -3.311) 42.348 18.150 ( 4.670 -21.045 4.673) 22.058 20.251 ( -1.476 -18.155 3.047) 18.468 21.953 ( 7.109 -33.511 -11.209) 36.044 22.445 ( -0.656 -4.025 -5.363) 6.737 25.345 ( 7.381 10.580 -25.728) 28.781 26.702 ( -1.043 -5.718 11.573) 12.950 27.833 ( -11.273 5.381 15.879) 20.204 ======================= Grid point 284 (122/429) ======================= q-point: (-0.36 -0.64 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.278 ( -9.446 -8.036 0.946) 12.438 3.349 ( -15.956 -7.413 -8.718) 19.636 3.784 ( 12.054 -12.190 5.522) 18.011 4.427 ( -0.044 -1.898 5.302) 5.632 4.695 ( 5.640 4.868 -3.305) 8.150 4.759 ( 3.906 -0.439 0.347) 3.946 5.226 ( -7.580 13.737 3.220) 16.017 5.788 ( -11.486 -0.837 -4.374) 12.319 5.944 ( -1.184 -5.405 -1.702) 5.789 6.575 ( 11.050 -14.273 12.611) 22.019 6.743 ( 10.052 6.817 -5.387) 13.286 7.237 ( 1.430 -8.244 -5.099) 9.799 7.493 ( -8.265 -12.463 13.651) 20.248 8.219 ( -0.876 -5.806 -12.444) 13.760 8.590 ( -4.041 -10.982 3.257) 12.147 8.803 ( -0.788 -12.159 -11.240) 16.577 8.962 ( 5.389 -10.204 -2.194) 11.746 9.102 ( 8.356 -27.854 0.647) 29.088 9.632 ( -0.123 -4.761 7.276) 8.696 9.780 ( 1.712 -34.941 -3.702) 35.178 10.255 ( 1.444 -20.216 -0.721) 20.280 10.472 ( -11.333 -1.835 18.497) 21.770 10.838 ( 0.230 26.748 -1.786) 26.809 11.752 ( -0.081 28.503 -2.565) 28.619 12.478 ( 3.284 4.544 -3.648) 6.688 12.864 ( -3.232 6.305 1.350) 7.213 13.458 ( -2.728 11.763 1.128) 12.128 13.666 ( -0.737 10.261 1.104) 10.347 17.156 ( 2.009 -32.976 -2.056) 33.101 18.468 ( 1.419 -10.935 4.750) 12.006 20.503 ( -0.977 -8.705 1.817) 8.946 22.289 ( 5.685 -2.943 -12.781) 14.295 22.723 ( 1.517 -23.696 -1.563) 23.796 25.114 ( 2.442 12.514 -17.439) 21.603 26.844 ( 0.185 -6.954 11.251) 13.228 27.714 ( -8.307 4.068 9.895) 13.545 ======================= Grid point 285 (123/429) ======================= q-point: (-0.29 -0.64 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.270 ( -15.678 -2.429 -8.839) 18.161 3.425 ( -8.624 -8.022 1.048) 11.824 4.020 ( 7.410 -5.277 4.140) 9.995 4.404 ( 3.589 5.094 -6.427) 8.952 4.585 ( 7.466 4.064 9.433) 12.699 4.925 ( 6.050 -7.061 3.408) 9.903 4.987 ( -5.801 8.730 6.153) 12.154 5.707 ( -10.085 0.292 -9.341) 13.750 6.043 ( -1.736 -4.981 1.691) 5.539 6.630 ( 6.968 5.998 0.561) 9.211 6.887 ( 7.977 -7.918 5.231) 12.398 7.341 ( -4.780 -5.945 -5.071) 9.160 7.683 ( -2.644 -6.060 13.779) 15.284 8.220 ( -3.863 -0.060 -9.139) 9.922 8.683 ( 4.314 -2.995 3.631) 6.384 8.987 ( -0.499 -10.022 -10.937) 14.843 9.209 ( 7.679 -13.149 -4.930) 16.005 9.624 ( 0.095 -13.110 -0.692) 13.128 9.916 ( 1.854 -26.656 -0.928) 26.737 10.234 ( 1.572 -4.845 -6.259) 8.069 10.342 ( -4.950 2.997 1.531) 5.985 10.497 ( -4.871 -1.677 19.325) 19.999 10.812 ( 1.169 -20.985 5.409) 21.703 11.344 ( -1.548 10.387 -2.062) 10.702 12.318 ( 1.634 13.583 -3.337) 14.082 12.757 ( -3.033 3.406 1.766) 4.891 13.303 ( -1.985 3.624 1.081) 4.271 13.520 ( -1.189 5.242 -0.170) 5.378 17.717 ( 5.110 -25.208 -0.819) 25.734 18.620 ( 0.118 -4.698 2.804) 5.472 20.578 ( -1.644 -0.242 1.122) 2.005 22.301 ( 4.104 0.589 -11.400) 12.130 23.124 ( 2.842 -16.812 -0.878) 17.073 24.854 ( -1.098 12.520 -10.540) 16.403 26.989 ( 0.406 -5.951 10.465) 12.045 27.615 ( -6.205 3.727 5.784) 9.265 ======================= Grid point 286 (124/429) ======================= q-point: (-0.21 -0.64 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.219 ( -11.240 -2.640 -8.345) 14.246 3.560 ( -5.784 -10.335 5.102) 12.896 4.065 ( 4.528 3.591 2.649) 6.357 4.314 ( 2.836 5.291 -1.022) 6.090 4.617 ( 5.847 0.767 4.819) 7.616 4.886 ( -0.061 0.002 6.681) 6.682 5.067 ( 5.154 -3.490 7.939) 10.088 5.627 ( -9.147 0.875 -10.430) 13.900 6.100 ( -5.109 -2.967 -1.210) 6.031 6.594 ( 8.984 2.883 3.193) 9.960 7.010 ( 3.928 -1.315 2.581) 4.881 7.409 ( -5.250 -5.312 -2.888) 8.008 7.686 ( -4.491 4.994 7.048) 9.736 8.243 ( -1.721 -5.176 0.579) 5.485 8.777 ( 7.156 -3.037 0.848) 7.820 9.141 ( -1.581 -9.467 -13.029) 16.182 9.510 ( 11.074 -13.227 -4.797) 17.905 9.699 ( -0.747 2.558 -6.734) 7.242 10.120 ( -0.240 2.142 -5.344) 5.763 10.242 ( -6.247 1.158 3.945) 7.479 10.380 ( 2.493 -4.044 1.664) 5.033 10.579 ( -8.027 -8.328 17.013) 20.572 11.169 ( 3.775 -13.236 9.812) 16.904 11.384 ( -2.801 -9.902 -5.759) 11.793 12.019 ( 0.217 16.324 -0.546) 16.335 12.713 ( -1.733 0.233 2.142) 2.765 13.271 ( -1.104 0.031 0.473) 1.202 13.448 ( -0.889 1.899 -0.122) 2.101 18.158 ( 5.478 -18.676 0.198) 19.464 18.671 ( -0.937 -0.951 0.247) 1.358 20.522 ( -1.618 4.639 0.768) 4.973 22.289 ( 3.724 0.638 -11.387) 11.997 23.383 ( 1.902 -9.798 0.102) 9.982 24.611 ( -1.880 10.452 -5.445) 11.934 27.102 ( -0.172 -3.918 9.258) 10.054 27.525 ( -4.446 3.402 4.062) 6.917 ======================= Grid point 287 (125/429) ======================= q-point: (-0.14 0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.207 ( -5.420 -1.523 -1.624) 5.859 3.701 ( -1.922 -0.819 9.276) 9.508 4.048 ( 1.735 -3.687 2.997) 5.058 4.246 ( 4.718 3.029 2.833) 6.282 4.592 ( -1.545 3.338 2.527) 4.462 4.975 ( 0.906 -3.745 -1.838) 4.269 5.175 ( 7.954 -5.113 9.796) 13.615 5.522 ( -12.067 2.186 -7.490) 14.369 6.101 ( -4.423 -0.973 -3.467) 5.703 6.615 ( 7.491 1.456 3.388) 8.349 7.018 ( 3.779 2.511 0.877) 4.621 7.448 ( -5.208 0.166 -0.957) 5.297 7.550 ( -2.028 4.995 3.613) 6.490 8.341 ( -3.954 -5.457 2.261) 7.108 8.881 ( 7.255 -3.165 -0.242) 7.919 9.280 ( -4.812 -9.389 -9.627) 14.283 9.525 ( 2.968 8.904 -13.635) 16.553 9.821 ( 9.835 -9.610 -3.414) 14.169 10.045 ( -7.171 10.635 4.747) 13.677 10.056 ( 4.886 7.933 -3.898) 10.100 10.501 ( -0.751 -6.762 7.633) 10.225 10.725 ( -10.973 -7.974 13.606) 19.212 11.273 ( 2.071 7.372 0.914) 7.712 11.509 ( 0.864 -6.176 -1.623) 6.444 11.777 ( 1.022 10.708 2.663) 11.081 12.735 ( -1.602 -2.996 3.274) 4.719 13.264 ( -0.384 0.658 0.721) 1.049 13.427 ( -0.302 0.422 0.369) 0.637 18.463 ( 2.387 -10.092 0.533) 10.384 18.659 ( -2.226 0.194 -1.757) 2.843 20.416 ( 0.282 5.823 0.529) 5.854 22.282 ( 3.702 0.025 -11.871) 12.435 23.521 ( -1.161 -4.586 -0.345) 4.743 24.444 ( 1.499 5.849 -1.749) 6.286 27.152 ( -1.917 0.135 6.639) 6.912 27.474 ( -2.105 0.266 5.901) 6.270 ======================= Grid point 288 (126/429) ======================= q-point: (-0.07 0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.180 ( 0.913 4.447 7.506) 8.772 3.552 ( 0.408 14.958 12.233) 19.328 4.192 ( 9.505 -2.993 2.660) 10.314 4.358 ( -4.789 -13.345 3.961) 14.721 4.513 ( -2.085 2.422 -0.341) 3.215 4.929 ( -0.799 5.665 -3.904) 6.926 5.382 ( -15.403 0.186 -5.454) 16.341 5.440 ( 7.201 -11.785 7.315) 15.628 6.082 ( -1.026 0.666 -3.548) 3.753 6.607 ( 3.191 3.472 -0.552) 4.748 6.976 ( 5.571 4.751 0.442) 7.335 7.306 ( -7.134 7.128 -2.183) 10.319 7.548 ( 3.440 -0.051 5.821) 6.762 8.398 ( -5.379 -3.339 1.313) 6.466 8.928 ( 0.429 1.541 -4.296) 4.584 9.232 ( -6.420 9.835 -4.975) 12.755 9.501 ( 1.468 -2.638 -11.373) 11.766 9.755 ( 0.977 13.603 3.402) 14.056 9.840 ( 7.572 8.385 -7.985) 13.834 10.095 ( 7.734 -5.679 -0.085) 9.595 10.653 ( -6.646 -9.365 11.386) 16.171 10.749 ( -9.126 4.053 11.818) 15.472 11.046 ( -0.922 12.869 -2.900) 13.224 11.527 ( -0.414 15.875 7.521) 17.572 11.650 ( 9.032 -5.433 -6.083) 12.170 12.816 ( -2.217 -5.883 4.993) 8.028 13.243 ( 0.163 1.728 1.056) 2.032 13.424 ( 0.689 -0.057 1.294) 1.467 18.479 ( -6.281 5.246 -4.618) 9.397 18.693 ( -1.650 -2.597 2.059) 3.703 20.331 ( 4.292 4.280 0.237) 6.066 22.288 ( 3.932 -0.674 -12.740) 13.350 23.523 ( -6.387 2.236 -2.363) 7.168 24.428 ( 8.715 -1.497 -0.052) 8.842 27.097 ( -3.612 4.474 3.550) 6.758 27.520 ( -0.492 -3.867 10.505) 11.205 ======================= Grid point 295 (127/429) ======================= q-point: ( 0.43 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 2.224 -0.000 11.325) 11.542 2.843 ( 10.461 -0.000 16.208) 19.291 3.114 ( 1.511 -0.000 -3.142) 3.487 3.318 ( -18.818 0.000 -10.693) 21.644 4.468 ( 0.337 -0.000 -1.517) 1.554 5.059 ( 42.224 -0.000 30.705) 52.208 5.114 ( -19.349 0.000 -2.175) 19.471 5.406 ( -1.038 0.000 0.885) 1.364 5.455 ( 10.728 -0.000 -15.616) 18.946 6.325 ( 14.634 -0.000 4.527) 15.318 6.629 ( 2.339 -0.000 -6.811) 7.201 7.104 ( -8.418 0.000 -7.067) 10.991 7.347 ( -0.659 0.000 -1.695) 1.818 7.379 ( -28.588 0.000 3.859) 28.847 7.595 ( -2.467 0.000 4.753) 5.355 7.827 ( 1.568 -0.000 1.951) 2.503 8.342 ( 0.104 -0.000 -17.613) 17.613 8.473 ( -1.089 0.000 -10.442) 10.499 8.747 ( 3.514 -0.000 11.296) 11.830 9.364 ( 19.037 -0.000 -4.404) 19.539 10.028 ( -14.155 0.000 13.574) 19.611 10.432 ( -15.288 0.000 17.199) 23.012 12.378 ( -4.000 0.000 0.035) 4.000 13.114 ( 8.922 -0.000 -3.529) 9.594 13.174 ( -1.779 0.000 -0.602) 1.879 13.781 ( -0.840 0.000 -3.358) 3.462 14.127 ( 0.519 -0.000 -3.237) 3.278 15.014 ( 6.867 -0.000 1.233) 6.977 15.827 ( -0.764 0.000 1.966) 2.110 16.253 ( 9.513 -0.000 -4.446) 10.500 19.123 ( -0.488 0.000 1.516) 1.593 20.219 ( 0.402 -0.000 -1.184) 1.250 22.446 ( 0.868 -0.000 -9.146) 9.187 25.636 ( 14.056 -0.000 -38.465) 40.952 26.592 ( -3.280 0.000 7.944) 8.594 28.139 ( -20.451 0.000 27.626) 34.372 ======================= Grid point 296 (128/429) ======================= q-point: (-0.50 -0.57 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.187 ( -2.250 -22.340 8.219) 23.911 2.898 ( -9.107 -6.950 3.279) 11.916 3.187 ( -2.635 -3.501 -8.310) 9.394 3.466 ( 4.226 -21.040 5.027) 22.041 4.561 ( 0.192 -8.436 -1.630) 8.594 4.969 ( -20.989 1.026 2.415) 21.153 5.306 ( 13.018 -3.179 18.874) 23.148 5.472 ( 18.187 -4.067 -18.487) 26.251 5.653 ( 4.403 -15.528 9.556) 18.757 6.395 ( 6.735 6.813 0.223) 9.583 6.641 ( 2.339 -1.696 -3.179) 4.296 6.858 ( 5.255 10.605 1.681) 11.954 7.233 ( -26.532 -2.405 1.793) 26.701 7.371 ( -0.066 -4.713 -3.266) 5.735 7.780 ( -1.208 -7.129 -4.604) 8.572 7.948 ( 0.343 -16.499 -0.545) 16.511 8.391 ( 1.294 -7.612 -15.134) 16.990 8.511 ( 1.097 -5.664 -4.836) 7.528 8.792 ( 3.855 -0.150 10.201) 10.906 9.468 ( 17.181 -0.902 -4.202) 17.710 9.942 ( -13.009 3.386 15.137) 20.244 10.391 ( -10.775 -0.658 15.970) 19.277 12.326 ( -3.347 3.812 -1.723) 5.357 12.857 ( -0.897 23.372 0.281) 23.391 13.081 ( 7.165 7.329 -4.338) 11.129 13.620 ( -1.483 14.206 -4.086) 14.857 14.558 ( 11.541 -3.221 -3.890) 12.598 14.767 ( -4.228 -9.892 -4.475) 11.651 15.242 ( -11.958 40.030 10.526) 43.083 16.933 ( 14.991 -42.001 -2.738) 44.680 19.376 ( -4.507 -22.911 3.889) 23.672 20.507 ( 3.427 -29.438 -4.470) 29.972 22.433 ( 1.697 0.390 -9.253) 9.415 25.610 ( 12.223 3.290 -38.730) 40.746 26.593 ( -2.816 -0.517 10.305) 10.695 28.037 ( -17.647 4.087 24.506) 30.474 ======================= Grid point 297 (129/429) ======================= q-point: (-0.43 -0.57 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( -7.051 -24.819 3.551) 26.045 2.966 ( -28.670 -12.018 -8.408) 32.204 3.359 ( 20.602 -8.936 3.684) 22.757 3.915 ( 1.780 -21.597 4.709) 22.176 4.670 ( -2.025 -3.153 -2.731) 4.637 4.899 ( -14.623 -2.562 4.249) 15.442 5.492 ( 5.955 -8.404 1.388) 10.393 5.592 ( -9.027 -8.809 -12.462) 17.731 6.037 ( 16.432 -7.353 14.579) 23.165 6.085 ( 4.839 15.128 0.067) 15.883 6.748 ( 5.661 -9.051 -1.725) 10.814 6.907 ( 3.646 -4.778 7.687) 9.758 7.146 ( -20.447 -2.332 1.817) 20.659 7.575 ( 1.616 -17.817 -7.058) 19.232 7.887 ( 1.157 -8.018 -5.750) 9.934 8.344 ( 0.772 -24.762 -10.752) 27.007 8.559 ( 4.368 -10.953 -10.320) 15.670 8.676 ( 4.831 -9.924 2.828) 11.394 8.832 ( 2.691 -0.748 7.029) 7.564 9.579 ( 11.215 -2.300 -0.702) 11.470 9.844 ( -8.885 1.212 11.580) 14.646 10.394 ( -7.844 -1.876 16.393) 18.270 12.075 ( 0.039 25.583 -2.761) 25.732 12.510 ( -5.982 7.974 -2.264) 10.222 12.873 ( 8.381 20.123 -4.969) 22.357 13.283 ( -3.074 16.857 -1.264) 17.182 14.106 ( 1.570 25.571 -6.235) 26.367 14.472 ( -8.428 34.493 9.468) 36.748 15.582 ( 1.248 -49.405 -3.239) 49.526 17.714 ( 10.492 -31.345 4.946) 33.422 19.823 ( -4.410 -25.301 3.707) 25.948 21.233 ( 6.596 -42.256 -7.263) 43.380 22.419 ( 2.239 0.350 -8.769) 9.057 25.503 ( 8.739 7.261 -35.467) 37.242 26.633 ( -1.575 -3.190 12.968) 13.447 27.894 ( -14.314 5.362 19.343) 24.654 ======================= Grid point 298 (130/429) ======================= q-point: (-0.36 -0.57 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.984 ( -14.539 -16.229 0.362) 21.792 3.026 ( -23.383 -13.393 -8.659) 28.304 3.672 ( 18.321 -10.101 5.506) 21.633 4.273 ( 0.690 -14.627 6.120) 15.871 4.720 ( 7.162 -2.790 -5.664) 9.548 4.837 ( -8.731 3.076 3.198) 9.794 5.423 ( -13.037 9.853 -11.219) 19.822 5.750 ( -8.881 -0.544 -1.855) 9.089 5.811 ( 8.351 -1.728 4.410) 9.601 6.432 ( 16.956 -11.985 13.584) 24.813 6.893 ( 8.804 2.470 -7.108) 11.582 7.039 ( -8.335 -9.906 2.695) 13.223 7.204 ( -7.546 -14.702 9.782) 19.203 7.960 ( -12.783 -24.101 -9.598) 28.920 8.106 ( 7.984 -15.791 -6.786) 18.951 8.669 ( 2.180 -8.963 -10.129) 13.700 8.839 ( 5.724 -11.803 -0.283) 13.121 8.872 ( 9.119 -4.573 6.115) 11.893 9.092 ( 3.766 -33.002 -2.722) 33.328 9.628 ( 1.128 0.874 9.679) 9.783 9.934 ( 0.380 -12.682 -1.376) 12.762 10.421 ( -7.331 -1.901 18.003) 19.531 11.451 ( 0.476 36.380 -2.775) 36.489 12.273 ( -5.438 22.711 -7.528) 24.537 12.545 ( 3.602 8.302 -0.481) 9.062 13.017 ( -1.783 10.618 0.328) 10.772 13.700 ( -3.943 16.604 -3.259) 17.374 13.939 ( -4.235 20.187 5.068) 21.240 16.470 ( 6.628 -42.498 -2.979) 43.115 18.228 ( 5.083 -18.132 7.720) 20.352 20.234 ( -3.225 -19.073 2.355) 19.487 22.006 ( 9.075 -33.322 -9.127) 35.722 22.431 ( 1.984 -3.736 -6.154) 7.468 25.309 ( 3.485 10.727 -27.899) 30.093 26.744 ( 0.342 -6.113 13.860) 15.152 27.757 ( -11.432 4.461 13.179) 18.008 ======================= Grid point 299 (131/429) ======================= q-point: (-0.29 -0.57 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.061 ( -20.030 -8.105 -8.305) 23.148 3.187 ( -13.997 -11.765 0.843) 18.304 3.941 ( 11.733 -8.386 3.614) 14.868 4.461 ( 3.006 -1.957 -1.861) 4.041 4.738 ( 1.230 4.601 10.373) 11.414 4.840 ( 9.574 -5.816 -4.244) 11.979 5.129 ( -8.543 10.936 -3.653) 14.350 5.657 ( -6.988 1.129 -4.266) 8.264 5.947 ( 0.800 -4.739 1.406) 5.008 6.697 ( 2.040 -5.447 8.439) 10.250 6.860 ( 11.955 1.604 -0.074) 12.062 7.161 ( -9.962 -8.653 -1.659) 13.299 7.503 ( 0.929 -13.816 9.269) 16.663 8.155 ( -1.982 -5.346 -12.429) 13.674 8.515 ( -8.703 -20.745 -1.632) 22.556 8.791 ( 3.960 -6.721 -5.852) 9.752 9.027 ( 6.581 -9.477 0.496) 11.548 9.203 ( 8.017 -22.067 0.851) 23.494 9.681 ( 3.765 -5.948 7.081) 9.985 9.795 ( 3.155 -34.175 -3.445) 34.493 10.256 ( 0.070 -19.560 -3.567) 19.882 10.434 ( -6.722 -0.322 18.351) 19.546 10.839 ( 0.637 25.156 -1.043) 25.185 11.729 ( -2.169 27.611 -2.663) 27.824 12.469 ( -2.819 3.936 -2.914) 5.650 12.846 ( -0.427 7.168 0.349) 7.189 13.417 ( -4.697 10.283 -0.064) 11.305 13.651 ( -2.542 10.291 1.114) 10.659 17.218 ( 9.821 -32.765 -2.089) 34.269 18.509 ( 2.316 -9.007 6.246) 11.203 20.482 ( -3.879 -9.046 1.705) 9.989 22.308 ( 5.877 -1.316 -12.394) 13.779 22.757 ( 5.323 -24.278 -1.154) 24.881 25.052 ( -1.524 12.197 -19.060) 22.680 26.898 ( 1.374 -6.563 13.439) 15.019 27.647 ( -9.029 3.183 7.666) 12.265 ======================= Grid point 300 (132/429) ======================= q-point: (-0.21 -0.57 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.063 ( -14.153 -5.032 -8.057) 17.045 3.328 ( -9.385 -10.925 2.312) 14.587 4.116 ( 7.136 -3.121 2.409) 8.152 4.399 ( 0.432 5.124 -7.948) 9.467 4.720 ( 7.269 3.831 8.037) 11.494 4.936 ( -5.766 4.462 5.402) 9.074 5.019 ( 8.989 -6.468 3.940) 11.754 5.601 ( -3.722 1.506 -5.805) 7.058 6.013 ( -2.689 -3.221 -1.338) 4.404 6.695 ( 2.148 2.884 1.637) 3.951 6.985 ( 5.688 -4.240 6.244) 9.450 7.250 ( -7.587 -6.957 -2.614) 10.621 7.693 ( -3.030 -3.795 6.893) 8.432 8.180 ( 1.227 -2.089 -3.237) 4.043 8.723 ( 1.427 -6.976 -0.956) 7.184 8.944 ( 0.821 -8.556 -10.246) 13.374 9.294 ( 8.599 -14.040 -1.053) 16.498 9.615 ( -0.999 -13.972 -0.452) 14.015 9.944 ( 3.956 -18.235 -2.935) 18.889 10.214 ( -0.529 7.855 -6.778) 10.388 10.326 ( 0.710 -14.016 2.550) 14.264 10.509 ( -5.703 1.530 20.199) 21.044 10.848 ( 2.015 -22.712 3.376) 23.050 11.310 ( -2.924 11.398 -2.021) 11.940 12.294 ( -4.059 12.230 -2.118) 13.059 12.744 ( -0.099 3.712 0.676) 3.774 13.278 ( -2.739 2.504 0.620) 3.762 13.500 ( -2.115 4.890 -0.315) 5.337 17.804 ( 10.460 -24.146 -1.008) 26.334 18.637 ( 0.795 -3.154 3.369) 4.683 20.548 ( -4.372 -0.848 1.292) 4.637 22.307 ( 4.463 1.031 -11.601) 12.473 23.168 ( 5.311 -15.830 -0.250) 16.699 24.782 ( -4.376 11.325 -11.487) 16.714 27.040 ( 1.178 -5.058 12.242) 13.298 27.558 ( -6.976 2.715 4.063) 8.517 ======================= Grid point 301 (133/429) ======================= q-point: (-0.14 -0.57 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.089 ( -6.806 -5.739 -5.143) 10.282 3.517 ( -5.000 -12.971 4.916) 14.745 4.122 ( 4.036 5.580 1.690) 7.091 4.321 ( -0.734 1.896 -2.715) 3.392 4.666 ( -0.618 4.629 3.517) 5.846 4.922 ( 3.221 -1.991 3.228) 4.976 5.186 ( 9.766 -3.692 11.357) 15.427 5.507 ( -6.774 4.263 -6.713) 10.447 6.041 ( -2.753 -2.276 -2.962) 4.640 6.676 ( 2.386 1.138 1.325) 2.957 7.058 ( 2.881 -0.312 3.659) 4.668 7.336 ( -5.989 -6.693 -0.953) 9.032 7.649 ( -4.356 4.908 2.736) 7.109 8.258 ( 2.153 -3.482 4.355) 5.978 8.845 ( 5.233 -4.776 -3.361) 7.842 9.079 ( -0.749 -8.246 -10.242) 13.170 9.617 ( 5.984 -13.952 -2.869) 15.450 9.679 ( 5.994 5.114 -9.024) 11.980 10.094 ( -1.023 -0.033 -5.203) 5.302 10.195 ( -3.913 -2.090 2.147) 4.928 10.404 ( -0.218 -1.839 3.889) 4.308 10.563 ( -6.015 -3.533 18.886) 20.133 11.235 ( 1.668 -13.992 6.984) 15.727 11.332 ( -2.079 -10.540 -5.492) 12.065 12.005 ( -2.523 14.231 0.050) 14.453 12.707 ( -0.627 0.337 1.790) 1.927 13.261 ( -0.944 -0.603 0.476) 1.217 13.434 ( -1.500 1.258 -0.319) 1.984 18.239 ( 8.496 -16.604 0.161) 18.652 18.660 ( -0.989 0.660 0.213) 1.208 20.498 ( -3.287 3.289 0.928) 4.742 22.291 ( 3.975 0.878 -11.566) 12.261 23.413 ( 3.285 -7.954 0.522) 8.621 24.558 ( -3.748 7.785 -5.804) 10.408 27.138 ( 0.110 -2.505 10.281) 10.582 27.485 ( -4.819 1.806 3.084) 6.000 ======================= Grid point 302 (134/429) ======================= q-point: (-0.07 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.173 ( -0.407 -5.053 1.893) 5.411 3.713 ( -2.174 -3.663 9.212) 10.149 4.064 ( -0.527 -3.245 2.701) 4.255 4.294 ( 2.194 1.048 -0.440) 2.471 4.570 ( -3.570 4.667 2.180) 6.268 4.982 ( 1.338 -0.199 -1.406) 1.951 5.265 ( -1.956 1.778 -2.667) 3.755 5.415 ( 1.232 -1.690 7.024) 7.329 6.066 ( -0.033 -1.624 -1.491) 2.205 6.661 ( -0.250 1.504 -1.723) 2.301 7.060 ( 2.735 1.995 0.610) 3.440 7.380 ( -5.462 1.380 -1.199) 5.759 7.561 ( 1.178 1.202 5.738) 5.980 8.318 ( -2.051 -2.326 3.407) 4.607 8.923 ( 1.486 -1.498 -7.342) 7.639 9.217 ( -1.047 -6.790 -1.452) 7.022 9.515 ( 4.669 6.735 -16.192) 18.148 9.906 ( 4.522 -5.795 -2.181) 7.667 9.986 ( -1.369 5.322 -3.853) 6.712 10.110 ( 4.949 8.003 1.244) 9.491 10.533 ( 1.450 -6.033 9.024) 10.952 10.645 ( -12.952 -7.784 17.005) 22.749 11.260 ( -2.260 8.605 -5.193) 10.301 11.541 ( 3.287 -8.031 3.350) 9.302 11.792 ( 0.175 8.834 1.137) 8.908 12.729 ( -1.601 -2.835 3.356) 4.676 13.266 ( 0.118 0.272 0.857) 0.907 13.422 ( -0.754 -0.318 0.186) 0.840 18.491 ( 1.830 -3.850 0.459) 4.287 18.628 ( -1.613 -1.020 -1.689) 2.549 20.420 ( 0.125 3.499 0.485) 3.534 22.282 ( 3.890 0.120 -11.744) 12.372 23.508 ( -0.691 -1.314 -0.126) 1.490 24.453 ( 1.091 1.363 -1.957) 2.623 27.154 ( -2.008 2.169 6.610) 7.241 27.472 ( -2.020 -2.058 5.930) 6.594 ======================= Grid point 310 (135/429) ======================= q-point: (-0.50 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( -7.347 0.000 8.959) 11.586 2.704 ( -31.018 0.000 -6.529) 31.697 3.134 ( 3.456 -0.000 -1.650) 3.830 3.335 ( 16.169 -0.000 6.456) 17.411 4.470 ( 0.909 -0.000 -1.286) 1.574 4.797 ( -34.253 0.000 -0.978) 34.267 5.397 ( -1.080 0.000 0.449) 1.169 5.474 ( 4.000 -0.000 -16.232) 16.718 5.608 ( 33.775 -0.000 30.537) 45.533 6.500 ( 5.369 -0.000 6.994) 8.817 6.631 ( 2.505 -0.000 -6.715) 7.167 6.923 ( -15.263 0.000 -10.466) 18.507 7.179 ( -3.800 0.000 -2.093) 4.339 7.335 ( -0.186 0.000 -1.850) 1.859 7.585 ( -2.215 0.000 4.172) 4.723 7.848 ( 0.709 -0.000 2.741) 2.831 8.292 ( 2.564 -0.000 -18.842) 19.015 8.459 ( 3.209 -0.000 -3.382) 4.662 8.842 ( 5.677 -0.000 11.344) 12.685 9.555 ( 17.237 -0.000 -5.155) 17.992 9.937 ( -11.400 0.000 18.018) 21.322 10.358 ( -8.376 0.000 15.357) 17.493 12.329 ( -3.760 0.000 -2.127) 4.319 13.084 ( -4.312 0.000 -5.345) 6.868 13.254 ( 7.964 -0.000 3.061) 8.532 13.750 ( -1.539 0.000 -5.764) 5.966 14.123 ( 1.009 -0.000 -3.257) 3.410 15.044 ( -2.451 0.000 0.593) 2.522 15.826 ( -0.675 0.000 1.934) 2.049 16.349 ( 9.321 -0.000 -0.824) 9.357 19.123 ( -0.491 0.000 1.518) 1.595 20.219 ( 0.405 -0.000 -1.170) 1.238 22.432 ( 2.788 -0.000 -9.726) 10.118 25.633 ( 11.499 -0.000 -42.054) 43.598 26.593 ( -2.537 0.000 10.509) 10.811 28.022 ( -17.265 0.000 24.546) 30.010 ======================= Grid point 311 (136/429) ======================= q-point: (-0.43 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( -11.484 -21.849 5.749) 25.344 2.575 ( -33.884 -8.117 -7.863) 35.719 3.283 ( 10.832 -10.669 -1.459) 15.273 3.577 ( 10.581 -14.795 7.097) 19.525 4.535 ( -8.835 -5.333 -1.025) 10.371 4.669 ( -25.293 -8.347 0.512) 26.639 5.416 ( 1.674 -3.666 4.974) 6.402 5.461 ( -0.952 -0.324 -16.790) 16.821 5.949 ( 24.830 -10.434 22.758) 35.260 6.421 ( -5.564 9.607 2.317) 11.341 6.613 ( -5.551 -2.548 -2.475) 6.590 6.954 ( -17.138 1.159 -2.875) 17.416 6.979 ( 14.558 2.735 -1.941) 14.939 7.378 ( 2.574 -5.483 -2.501) 6.553 7.766 ( 1.748 -7.882 -4.756) 9.370 7.958 ( 1.728 -14.435 -1.180) 14.586 8.357 ( 2.354 -8.733 -15.016) 17.530 8.542 ( 5.324 -6.460 -0.090) 8.372 8.888 ( 6.551 1.004 10.421) 12.350 9.633 ( 13.914 0.263 -4.341) 14.578 9.879 ( -8.187 3.513 18.454) 20.492 10.357 ( -5.396 -1.028 14.927) 15.905 12.280 ( -3.110 2.981 -3.332) 5.446 12.809 ( -5.499 22.156 -2.232) 22.937 13.164 ( 7.439 8.646 -0.157) 11.407 13.575 ( -2.707 14.610 -7.010) 16.429 14.642 ( 3.433 -24.401 -1.580) 24.692 14.687 ( -5.537 14.018 -6.761) 16.518 15.168 ( -6.376 38.232 7.771) 39.531 17.097 ( 13.578 -43.181 3.686) 45.415 19.345 ( -2.969 -21.177 2.686) 21.552 20.531 ( 3.437 -31.261 -3.574) 31.652 22.428 ( 3.617 0.448 -9.756) 10.414 25.583 ( 9.468 3.487 -43.316) 44.476 26.609 ( -1.861 -1.110 12.959) 13.139 27.935 ( -15.472 3.693 22.287) 27.381 ======================= Grid point 312 (137/429) ======================= q-point: (-0.36 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.513 ( -16.024 -23.812 1.500) 28.740 2.591 ( -30.913 -14.190 -7.211) 34.770 3.591 ( 16.913 -12.051 1.537) 20.824 3.957 ( 1.583 -18.871 6.319) 19.964 4.574 ( -16.947 -10.375 0.607) 19.879 4.761 ( -6.254 -6.006 -2.349) 8.984 5.387 ( -11.434 1.014 -15.620) 19.385 5.592 ( 4.422 -9.774 5.903) 12.244 6.122 ( 5.738 19.377 0.365) 20.212 6.323 ( 17.440 -12.746 12.834) 25.126 6.769 ( -11.780 -18.074 4.765) 22.094 6.827 ( -13.086 -1.329 2.520) 13.392 7.046 ( 5.713 -0.232 -1.782) 5.990 7.546 ( -1.900 -11.248 -6.134) 12.952 7.930 ( 8.516 -9.680 -5.519) 14.025 8.317 ( 2.278 -21.804 -13.504) 25.748 8.588 ( 5.955 -15.748 -5.563) 17.732 8.745 ( 4.266 -11.528 1.435) 12.376 8.926 ( 9.515 1.046 9.814) 13.709 9.681 ( 4.594 1.062 4.898) 6.798 9.824 ( -0.204 0.165 7.827) 7.832 10.385 ( -4.175 -1.631 15.648) 16.278 12.069 ( 0.773 24.308 -2.892) 24.492 12.399 ( -10.262 10.009 -4.586) 15.051 12.962 ( 9.092 20.974 -2.663) 23.015 13.220 ( -6.481 14.787 -3.479) 16.516 14.070 ( -3.508 27.260 -6.965) 28.353 14.377 ( -13.549 29.398 8.605) 33.495 15.650 ( 12.243 -48.517 -3.949) 50.193 17.860 ( 9.976 -28.359 10.657) 31.895 19.790 ( -2.976 -25.455 1.862) 25.696 21.296 ( 8.849 -43.554 -5.490) 44.782 22.422 ( 4.105 0.523 -9.350) 10.225 25.444 ( 5.033 7.602 -39.760) 40.791 26.676 ( -0.065 -4.079 15.580) 16.106 27.803 ( -13.592 5.045 17.570) 22.779 ======================= Grid point 313 (138/429) ======================= q-point: (-0.29 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( -25.079 -14.920 -6.494) 29.895 2.809 ( -19.112 -18.508 1.187) 26.631 3.872 ( 14.045 -7.751 2.066) 16.174 4.306 ( 0.332 -16.009 5.447) 16.914 4.696 ( -13.640 -7.910 6.854) 17.193 4.807 ( 6.252 -2.369 -10.001) 12.030 5.243 ( -7.228 4.958 -13.923) 16.452 5.682 ( -5.226 4.409 4.832) 8.372 5.935 ( 11.399 2.559 2.434) 11.933 6.609 ( 2.439 -5.963 7.954) 10.236 6.846 ( -11.084 -11.788 -0.182) 16.182 6.988 ( 3.577 -1.240 -0.984) 3.911 7.234 ( 3.144 -18.124 9.297) 20.610 7.788 ( -11.003 -22.023 -8.766) 26.133 8.149 ( 4.403 -9.997 -8.109) 13.605 8.654 ( 2.386 -13.554 -10.037) 17.034 8.891 ( 2.609 -8.919 2.595) 9.648 9.045 ( 16.245 -5.356 4.956) 17.809 9.139 ( 5.601 -31.923 -0.835) 32.421 9.678 ( 0.935 0.399 12.096) 12.139 9.947 ( 3.260 -11.483 -3.418) 12.417 10.419 ( -4.420 -1.178 16.750) 17.363 11.449 ( 1.077 36.434 -3.041) 36.576 12.171 ( -7.327 16.144 -6.861) 19.010 12.564 ( -0.210 15.401 -1.417) 15.468 12.997 ( -1.532 8.508 -0.187) 8.647 13.628 ( -6.353 16.477 -3.664) 18.036 13.892 ( -6.949 17.743 4.496) 19.579 16.582 ( 14.867 -42.127 -4.137) 44.865 18.323 ( 5.349 -15.283 11.102) 19.632 20.199 ( -4.065 -18.720 1.505) 19.216 22.095 ( 12.253 -31.608 -8.029) 34.838 22.444 ( 4.186 -4.708 -6.231) 8.861 25.216 ( -0.936 10.688 -30.939) 32.747 26.813 ( 2.011 -6.348 16.317) 17.623 27.671 ( -11.728 4.026 11.489) 16.904 ======================= Grid point 314 (139/429) ======================= q-point: (-0.21 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.811 ( -18.737 -11.204 -5.972) 22.633 3.023 ( -15.350 -15.228 2.785) 21.801 4.065 ( 8.494 -6.104 0.612) 10.477 4.465 ( 0.542 0.998 -6.196) 6.299 4.787 ( -0.738 -3.582 10.768) 11.372 4.857 ( -8.977 -5.957 -0.280) 10.777 5.115 ( 15.043 7.476 -8.250) 18.715 5.592 ( -4.828 0.456 1.922) 5.217 5.979 ( 5.119 0.124 -0.292) 5.128 6.666 ( -10.541 -4.068 0.846) 11.331 6.989 ( 8.852 -1.462 2.837) 9.410 7.062 ( -6.259 -8.008 2.380) 10.439 7.553 ( 2.337 -11.225 6.007) 12.944 8.092 ( -1.669 -10.195 -8.988) 13.693 8.407 ( -7.911 -21.954 -3.384) 23.579 8.832 ( 6.194 -5.427 -4.797) 9.531 9.098 ( 4.278 -11.609 0.344) 12.377 9.292 ( 7.290 -13.553 2.848) 15.651 9.763 ( 5.791 -9.534 6.178) 12.751 9.825 ( 4.041 -30.944 -2.114) 31.278 10.241 ( 0.008 -14.558 -2.385) 14.752 10.448 ( -2.226 -3.949 14.651) 15.336 10.841 ( 0.501 24.955 -1.338) 24.996 11.688 ( -3.143 26.443 -1.885) 26.696 12.396 ( -7.935 4.423 -2.561) 9.439 12.854 ( 1.658 6.820 -0.096) 7.019 13.355 ( -5.697 8.409 -0.637) 10.177 13.618 ( -4.004 9.643 1.062) 10.495 17.355 ( 15.676 -31.765 -3.378) 35.583 18.566 ( 2.980 -6.945 7.959) 10.975 20.431 ( -6.049 -8.954 1.596) 10.923 22.330 ( 6.115 0.164 -12.509) 13.925 22.838 ( 9.629 -23.799 -0.447) 25.677 24.938 ( -5.760 11.344 -20.739) 24.331 26.974 ( 2.556 -5.814 15.637) 16.878 27.566 ( -9.700 2.432 5.989) 11.656 ======================= Grid point 315 (140/429) ======================= q-point: (-0.14 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.901 ( -10.085 -8.874 -4.492) 14.164 3.234 ( -8.943 -14.355 3.619) 17.295 4.195 ( 5.360 -2.976 0.739) 6.175 4.354 ( -2.753 6.292 -9.132) 11.426 4.750 ( -3.299 3.458 1.416) 4.985 4.930 ( 0.138 -0.380 6.020) 6.034 5.178 ( 14.238 -4.683 8.360) 17.162 5.561 ( -1.697 3.183 -2.219) 4.235 5.998 ( 2.448 -0.645 -2.604) 3.632 6.665 ( -7.087 -1.733 -2.448) 7.695 7.067 ( 4.187 -1.463 6.552) 7.912 7.164 ( -6.216 -7.092 -0.355) 9.437 7.666 ( -4.219 -0.973 2.682) 5.094 8.222 ( 5.712 -5.093 2.556) 8.069 8.708 ( -1.034 -12.274 -5.855) 13.638 8.943 ( 4.772 -4.978 -7.604) 10.265 9.373 ( 4.794 -14.522 -1.383) 15.355 9.609 ( 0.391 -15.196 1.090) 15.240 9.978 ( 3.692 -9.781 -2.677) 10.791 10.184 ( -0.593 10.185 -5.763) 11.717 10.366 ( 4.633 -18.913 1.647) 19.542 10.520 ( -5.316 3.718 20.552) 21.552 10.873 ( 0.760 -23.911 0.193) 23.924 11.269 ( -3.085 12.195 -0.744) 12.601 12.214 ( -8.521 9.910 -1.442) 13.149 12.758 ( 2.041 4.555 0.364) 5.004 13.249 ( -2.679 0.911 0.583) 2.889 13.471 ( -2.812 4.338 -0.452) 5.189 17.940 ( 14.066 -22.346 -2.143) 26.491 18.663 ( 1.365 -1.223 4.165) 4.550 20.490 ( -6.600 -1.668 1.446) 6.960 22.317 ( 4.764 1.506 -12.005) 13.004 23.245 ( 8.339 -13.983 0.446) 16.287 24.670 ( -7.672 9.309 -12.113) 17.095 27.105 ( 1.768 -3.805 14.006) 14.621 27.488 ( -7.537 1.551 2.577) 8.115 ======================= Grid point 316 (141/429) ======================= q-point: (-0.07 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.031 ( -1.485 -9.183 -0.859) 9.342 3.483 ( -4.322 -15.315 5.251) 16.757 4.159 ( 0.736 8.391 -0.735) 8.455 4.280 ( -3.083 -1.961 -3.381) 4.978 4.653 ( -2.642 5.454 3.584) 7.041 4.964 ( 2.414 -2.106 0.661) 3.271 5.368 ( 12.747 0.673 8.931) 15.579 5.414 ( -5.740 4.374 0.590) 7.241 6.031 ( 2.679 -1.774 -2.251) 3.923 6.648 ( -5.636 -0.772 -3.981) 6.943 7.095 ( 0.587 0.476 0.044) 0.757 7.275 ( -4.513 -7.173 3.675) 9.237 7.622 ( -2.295 2.575 3.721) 5.073 8.315 ( 4.574 -0.155 5.004) 6.782 8.856 ( 0.568 -4.885 -9.477) 10.677 9.077 ( 5.511 -8.208 -3.752) 10.575 9.596 ( -1.177 -3.231 -9.809) 10.394 9.778 ( 11.026 -3.917 -6.017) 13.158 10.057 ( -2.192 1.334 -4.795) 5.438 10.168 ( -2.874 -8.904 3.303) 9.923 10.407 ( -3.526 1.628 11.602) 12.235 10.589 ( -0.359 0.201 14.624) 14.629 11.226 ( -2.938 -10.434 -6.358) 12.567 11.326 ( 0.603 -15.365 5.213) 16.236 11.961 ( -5.411 10.963 0.304) 12.229 12.713 ( 0.671 1.207 1.809) 2.276 13.255 ( -0.533 -1.359 0.868) 1.698 13.413 ( -1.755 0.560 -0.648) 1.953 18.347 ( 10.199 -13.920 -0.456) 17.263 18.651 ( -0.886 2.907 0.433) 3.069 20.456 ( -4.674 1.284 1.027) 4.955 22.294 ( 4.199 1.102 -11.783) 12.557 23.463 ( 5.093 -5.197 0.868) 7.328 24.484 ( -5.512 4.090 -5.829) 9.005 27.179 ( -0.047 -0.543 11.031) 11.045 27.441 ( -4.727 -0.322 2.451) 5.334 ======================= Grid point 325 (142/429) ======================= q-point: (-0.43 -0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( -15.677 0.000 7.292) 17.290 2.278 ( -36.883 0.000 -7.361) 37.611 3.174 ( 3.915 -0.000 -0.314) 3.928 3.541 ( 13.544 -0.000 3.774) 14.060 4.357 ( -41.729 0.000 2.603) 41.810 4.479 ( 1.552 -0.000 -1.172) 1.945 5.386 ( -1.022 0.000 0.150) 1.033 5.433 ( -0.782 0.000 -15.486) 15.506 6.047 ( 24.499 -0.000 26.915) 36.395 6.308 ( -37.390 0.000 6.938) 38.028 6.636 ( 2.628 -0.000 -6.699) 7.196 6.910 ( 15.335 -0.000 -12.610) 19.854 7.224 ( 12.556 -0.000 -4.613) 13.376 7.329 ( 0.292 -0.000 -1.466) 1.495 7.576 ( -1.885 0.000 3.264) 3.770 7.862 ( -0.235 0.000 3.372) 3.380 8.254 ( 2.949 -0.000 -19.179) 19.404 8.515 ( 6.764 -0.000 0.662) 6.796 8.962 ( 8.540 -0.000 10.705) 13.694 9.700 ( 9.832 -0.000 -3.132) 10.318 9.922 ( -2.594 0.000 20.298) 20.463 10.352 ( -2.333 0.000 14.002) 14.195 12.276 ( -3.846 0.000 -3.726) 5.355 13.016 ( -4.527 0.000 -3.762) 5.887 13.334 ( 3.971 -0.000 1.669) 4.308 13.711 ( -0.492 0.000 -6.996) 7.013 14.126 ( 1.510 -0.000 -3.284) 3.614 14.965 ( -11.095 0.000 -0.526) 11.107 15.826 ( -0.585 0.000 1.928) 2.015 16.459 ( 9.266 -0.000 3.123) 9.778 19.123 ( -0.493 0.000 1.517) 1.595 20.219 ( 0.404 -0.000 -1.161) 1.229 22.438 ( 4.534 -0.000 -10.117) 11.086 25.582 ( 8.693 -0.000 -49.032) 49.797 26.613 ( -1.504 0.000 13.520) 13.603 27.928 ( -14.783 0.000 23.778) 27.999 ======================= Grid point 326 (143/429) ======================= q-point: (-0.36 -0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.978 ( -18.393 -21.174 4.391) 28.389 2.153 ( -35.403 -10.083 -4.902) 37.136 3.357 ( 2.098 -15.531 -0.677) 15.687 3.723 ( 9.035 -11.647 3.602) 15.174 4.213 ( -35.282 -8.825 4.038) 36.593 4.582 ( -0.226 -8.618 -1.912) 8.830 5.345 ( -6.329 2.539 -12.167) 13.948 5.462 ( 2.127 -6.569 -1.051) 6.984 6.184 ( -26.014 -8.228 3.137) 27.464 6.291 ( 10.719 -7.406 22.231) 25.768 6.582 ( 3.427 6.776 -5.191) 9.198 6.860 ( 0.874 8.913 -5.354) 10.434 7.138 ( 12.947 5.731 -0.688) 14.176 7.408 ( 4.414 -5.475 -2.734) 7.545 7.784 ( 4.341 -10.943 -4.377) 12.560 7.978 ( 3.151 -13.565 -3.292) 14.310 8.333 ( 2.610 -10.535 -13.025) 16.954 8.611 ( 5.782 -5.826 0.733) 8.241 9.026 ( 11.285 0.923 10.298) 15.305 9.732 ( 4.081 0.715 2.891) 5.052 9.913 ( 3.033 4.390 15.516) 16.408 10.377 ( -0.320 -0.574 13.613) 13.629 12.227 ( -3.819 2.051 -4.664) 6.367 12.735 ( -5.646 23.264 -1.966) 24.020 13.225 ( 2.021 7.217 0.515) 7.512 13.518 ( -1.090 16.770 -9.139) 19.130 14.574 ( -8.626 -0.961 -5.174) 10.105 14.624 ( -8.288 5.087 1.027) 9.779 15.174 ( 4.959 21.968 0.799) 22.534 17.272 ( 12.599 -44.819 10.643) 47.758 19.332 ( -0.206 -20.288 0.782) 20.304 20.561 ( 3.969 -34.107 -2.731) 34.445 22.442 ( 5.167 0.495 -10.195) 11.440 25.497 ( 5.653 3.689 -51.318) 51.760 26.649 ( -0.313 -1.836 16.142) 16.249 27.851 ( -13.767 4.067 22.525) 26.710 ======================= Grid point 327 (144/429) ======================= q-point: (-0.29 -0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( -29.925 -17.353 -2.945) 34.718 2.303 ( -21.450 -22.767 1.674) 31.325 3.717 ( 2.319 -20.011 0.009) 20.144 3.998 ( 2.255 -11.609 6.601) 13.543 4.336 ( -22.127 -19.335 3.001) 29.537 4.726 ( 1.021 -7.098 -6.837) 9.908 5.219 ( -8.660 2.415 -11.999) 14.993 5.650 ( 2.415 -8.215 4.260) 9.564 6.198 ( 4.702 9.037 1.982) 10.378 6.419 ( -14.714 -9.266 -3.673) 17.772 6.571 ( -3.004 -9.883 12.037) 15.861 6.842 ( 4.147 -7.816 -0.232) 8.851 7.128 ( 7.403 1.288 4.430) 8.723 7.496 ( -3.042 -5.382 -4.982) 7.940 8.011 ( 8.672 -8.871 -6.900) 14.195 8.299 ( 3.683 -19.361 -13.755) 24.033 8.648 ( 6.709 -21.080 -1.997) 22.212 8.775 ( 1.361 -9.033 -1.027) 9.192 9.115 ( 16.210 -0.668 9.749) 18.928 9.732 ( -0.181 1.883 14.366) 14.490 9.886 ( 6.253 1.639 2.013) 6.771 10.413 ( -0.739 -0.641 14.165) 14.199 12.072 ( 1.524 22.208 -3.204) 22.489 12.258 ( -10.998 12.069 -4.338) 16.895 13.042 ( 4.291 28.020 -5.034) 28.790 13.119 ( -6.456 7.088 -2.603) 9.934 13.980 ( -7.476 26.807 -6.524) 28.585 14.238 ( -15.888 24.014 7.886) 29.855 15.814 ( 19.324 -47.486 -6.332) 51.657 18.018 ( 8.739 -25.338 16.672) 31.565 19.776 ( 0.400 -24.032 -0.341) 24.037 21.402 ( 13.441 -46.131 -4.070) 48.221 22.441 ( 5.344 0.655 -9.928) 11.294 25.316 ( -0.062 7.605 -46.301) 46.921 26.749 ( 2.051 -4.949 18.310) 19.078 27.716 ( -13.140 5.601 17.959) 22.947 ======================= Grid point 328 (145/429) ======================= q-point: (-0.21 -0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( -23.345 -17.924 -2.468) 29.535 2.589 ( -20.521 -20.626 3.265) 29.279 4.002 ( 8.359 -6.782 -1.531) 10.872 4.308 ( -3.406 -19.012 5.137) 19.986 4.534 ( -18.112 -12.906 6.537) 23.181 4.797 ( -1.119 0.060 -12.733) 12.782 5.218 ( 9.954 -5.826 -9.163) 14.730 5.651 ( -4.231 8.090 6.483) 11.197 6.086 ( 13.756 5.697 1.166) 14.935 6.464 ( -22.677 -7.342 1.440) 23.879 6.847 ( 4.033 -12.798 1.827) 13.542 7.016 ( 2.666 -4.182 -5.592) 7.475 7.323 ( 4.322 -17.038 15.227) 23.257 7.653 ( -7.321 -18.846 -7.390) 21.526 8.146 ( 0.532 -5.519 -8.466) 10.120 8.657 ( 4.136 -16.865 -8.149) 19.182 8.911 ( 0.325 -7.981 -0.806) 8.028 9.203 ( 6.035 -31.389 -1.563) 32.002 9.262 ( 17.570 -2.105 6.385) 18.813 9.748 ( 2.678 -1.152 15.034) 15.314 9.976 ( 3.752 -9.418 -3.478) 10.718 10.441 ( -1.906 -0.326 14.621) 14.749 11.454 ( 1.968 36.538 -3.690) 36.776 12.068 ( -6.455 11.615 -4.862) 14.150 12.520 ( -6.110 19.649 -3.351) 20.848 12.988 ( 0.096 6.490 0.336) 6.500 13.535 ( -7.380 15.700 -3.159) 17.633 13.818 ( -8.787 14.881 3.809) 17.696 16.765 ( 20.171 -41.390 -6.589) 46.513 18.428 ( 4.579 -12.729 14.323) 19.701 20.158 ( -3.532 -16.782 0.685) 17.163 22.226 ( 16.027 -25.116 -9.149) 31.167 22.485 ( 7.154 -9.710 -4.501) 12.874 25.055 ( -6.243 9.889 -34.782) 36.695 26.911 ( 3.813 -6.224 18.393) 19.788 27.577 ( -12.072 4.140 11.417) 17.124 ======================= Grid point 329 (146/429) ======================= q-point: (-0.14 -0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.601 ( -15.391 -15.138 -1.756) 21.660 2.868 ( -14.262 -18.955 4.844) 24.211 4.133 ( 3.678 -4.603 -2.538) 6.416 4.436 ( -1.136 2.652 -6.426) 7.044 4.714 ( -10.019 -4.500 -3.700) 11.590 4.807 ( -3.309 -12.744 9.846) 16.441 5.320 ( 19.148 8.105 -1.457) 20.844 5.550 ( -2.625 -3.113 2.465) 4.760 6.065 ( 10.200 4.228 -1.466) 11.138 6.499 ( -16.772 -7.923 -0.914) 18.572 7.011 ( -2.670 -5.611 -3.396) 7.081 7.080 ( 3.618 -1.966 4.804) 6.327 7.596 ( 1.480 -6.065 5.684) 8.443 8.052 ( -1.423 -19.008 -3.849) 19.446 8.321 ( -4.593 -20.248 -3.191) 21.006 8.891 ( 7.020 -5.695 -4.483) 10.090 9.110 ( -0.892 -14.415 -3.273) 14.808 9.401 ( 8.955 -5.021 4.808) 11.337 9.831 ( 3.532 -24.350 0.070) 24.604 9.885 ( 5.615 -14.902 4.760) 16.621 10.251 ( 2.646 -12.194 0.424) 12.485 10.476 ( -1.251 -5.793 9.346) 11.067 10.841 ( 0.402 25.868 -1.419) 25.910 11.652 ( -2.209 25.549 -0.013) 25.645 12.276 ( -11.091 4.849 -3.040) 12.480 12.878 ( 2.356 6.035 0.342) 6.488 13.290 ( -5.169 6.342 -0.366) 8.190 13.568 ( -5.205 8.483 0.790) 9.984 17.538 ( 18.937 -30.360 -5.622) 36.221 18.632 ( 2.862 -5.074 9.575) 11.208 20.360 ( -7.240 -8.172 1.497) 11.020 22.353 ( 6.166 1.388 -13.127) 14.569 22.976 ( 14.736 -21.994 0.405) 26.477 24.768 ( -10.228 9.609 -22.267) 26.321 27.070 ( 3.560 -4.683 17.403) 18.370 27.473 ( -10.246 1.877 5.245) 11.663 ======================= Grid point 330 (147/429) ======================= q-point: (-0.07 -0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.804 ( -5.533 -13.395 0.029) 14.493 3.155 ( -7.730 -17.517 5.146) 19.827 4.194 ( -5.992 -2.026 -6.615) 9.152 4.320 ( 3.805 6.377 -3.246) 8.104 4.722 ( -1.555 0.445 1.659) 2.317 4.947 ( -0.645 -0.784 3.283) 3.436 5.341 ( 2.775 -5.557 12.528) 13.984 5.567 ( 8.475 6.153 -3.036) 10.905 6.055 ( 8.724 1.975 -2.291) 9.234 6.540 ( -11.440 -5.228 -4.186) 13.256 7.053 ( -5.304 -2.952 -9.371) 11.165 7.165 ( 1.463 -4.042 12.590) 13.304 7.626 ( -4.528 0.122 2.935) 5.398 8.308 ( 5.918 -7.726 4.956) 10.921 8.679 ( 1.377 -14.866 -7.494) 16.705 8.988 ( 7.092 -3.321 -5.572) 9.611 9.377 ( -1.567 -14.199 -4.741) 15.051 9.634 ( 2.124 -15.828 1.810) 16.072 10.009 ( 2.506 -4.612 0.275) 5.256 10.156 ( -0.634 11.126 -6.308) 12.805 10.441 ( 7.381 -18.554 1.891) 20.058 10.547 ( -3.179 3.766 20.392) 20.980 10.857 ( -2.450 -23.599 -3.771) 24.024 11.242 ( -1.826 12.288 1.606) 12.526 12.097 ( -10.853 7.719 -1.489) 13.401 12.789 ( 2.885 5.047 0.931) 5.887 13.226 ( -1.687 -0.647 1.110) 2.120 13.433 ( -3.302 3.503 -0.714) 4.867 18.098 ( 15.420 -20.190 -3.989) 25.716 18.697 ( 1.641 0.767 5.065) 5.380 20.411 ( -8.057 -2.499 1.542) 8.575 22.326 ( 4.880 1.915 -12.613) 13.659 23.363 ( 11.860 -11.152 1.016) 16.311 24.520 ( -10.806 6.353 -12.225) 17.510 27.182 ( 2.046 -2.116 15.717) 15.990 27.408 ( -7.773 0.162 1.311) 7.884 ======================= Grid point 340 (148/429) ======================= q-point: (-0.36 -0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -21.787 0.000 6.921) 22.859 1.837 ( -37.017 0.000 -1.860) 37.064 3.213 ( 2.544 -0.000 0.348) 2.567 3.538 ( -26.133 0.000 0.937) 26.150 4.001 ( -12.823 0.000 5.945) 14.134 4.497 ( 2.289 -0.000 -1.182) 2.576 5.346 ( -4.094 0.000 -16.240) 16.749 5.375 ( -0.915 0.000 0.056) 0.917 5.861 ( -41.622 0.000 2.345) 41.688 6.363 ( 14.468 -0.000 24.417) 28.382 6.641 ( 2.685 -0.000 -6.766) 7.279 7.042 ( 14.822 -0.000 -11.351) 18.669 7.331 ( 0.699 -0.000 -0.588) 0.913 7.402 ( 20.299 -0.000 -5.823) 21.118 7.566 ( -1.468 0.000 2.080) 2.546 7.868 ( -1.170 0.000 3.816) 3.991 8.218 ( 2.728 -0.000 -17.247) 17.461 8.594 ( 6.046 -0.000 0.247) 6.051 9.122 ( 13.105 -0.000 9.755) 16.337 9.762 ( 2.456 -0.000 4.534) 5.157 10.020 ( 5.315 -0.000 18.356) 19.110 10.408 ( 3.862 -0.000 12.014) 12.620 12.213 ( -4.571 0.000 -4.845) 6.661 12.957 ( -3.947 0.000 -1.612) 4.264 13.340 ( -2.487 0.000 -4.245) 4.920 13.704 ( 3.271 -0.000 -4.129) 5.268 14.133 ( 1.921 -0.000 -3.311) 3.828 14.799 ( -16.927 0.000 -1.625) 17.005 15.827 ( -0.512 0.000 1.949) 2.015 16.581 ( 8.859 -0.000 6.693) 11.103 19.123 ( -0.494 0.000 1.514) 1.592 20.220 ( 0.400 -0.000 -1.158) 1.226 22.459 ( 5.846 -0.000 -10.597) 12.103 25.456 ( 3.788 -0.000 -60.547) 60.665 26.662 ( 0.294 -0.000 17.137) 17.140 27.865 ( -12.319 0.000 26.344) 29.082 ======================= Grid point 341 (149/429) ======================= q-point: (-0.29 -0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( -31.851 -13.377 2.280) 34.621 1.760 ( -24.799 -19.713 4.551) 32.005 3.277 ( -21.208 -13.830 2.851) 25.479 3.692 ( -15.593 -27.360 2.367) 31.580 4.008 ( 1.128 -1.930 3.450) 4.111 4.577 ( 0.456 -6.483 -2.633) 7.012 5.216 ( -8.802 4.660 -11.670) 15.342 5.473 ( 0.701 -9.716 -1.373) 9.838 5.814 ( -33.221 -17.255 0.586) 37.440 6.487 ( 7.204 -1.179 14.848) 16.545 6.623 ( 5.750 5.267 -2.319) 8.135 6.885 ( 5.911 12.430 -6.112) 15.060 7.254 ( 6.804 5.861 2.991) 9.465 7.458 ( 5.809 0.600 -2.708) 6.437 7.832 ( 6.739 -15.087 -4.214) 17.053 8.000 ( 4.220 -12.860 -8.016) 15.731 8.326 ( 3.398 -13.302 -7.922) 15.850 8.664 ( 3.569 -4.258 -1.393) 5.728 9.218 ( 15.702 0.020 8.828) 18.013 9.781 ( 2.153 0.549 7.753) 8.065 10.024 ( 4.902 5.725 15.998) 17.684 10.450 ( 5.001 0.912 11.903) 12.943 12.156 ( -5.477 1.767 -5.403) 7.894 12.676 ( -3.725 24.422 -0.246) 24.706 13.186 ( -7.744 6.381 -5.052) 11.234 13.509 ( 4.661 18.463 -5.965) 19.955 14.441 ( -10.868 18.962 -7.289) 23.039 14.489 ( -16.737 1.964 6.707) 18.137 15.272 ( 13.031 1.276 -5.553) 14.222 17.464 ( 12.127 -46.070 17.490) 50.749 19.355 ( 5.191 -21.264 -1.714) 21.956 20.606 ( 5.794 -39.209 -2.046) 39.688 22.468 ( 6.129 0.590 -10.887) 12.507 25.317 ( -1.084 3.397 -63.311) 63.412 26.724 ( 2.010 -2.610 19.261) 19.541 27.794 ( -11.684 5.479 26.581) 29.548 ======================= Grid point 342 (150/429) ======================= q-point: (-0.21 -0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -26.921 -20.019 3.771) 33.760 2.053 ( -23.789 -23.066 3.613) 33.332 3.608 ( -21.690 -32.057 5.064) 39.035 4.068 ( 6.435 -3.837 2.761) 7.985 4.150 ( -11.641 -21.894 2.337) 24.906 4.708 ( 0.738 -7.771 -9.945) 12.643 5.100 ( -6.439 -2.090 -7.590) 10.170 5.679 ( 0.278 -7.234 3.173) 7.904 6.062 ( -23.645 -22.296 0.962) 32.514 6.384 ( 11.262 15.625 -3.055) 19.502 6.609 ( 0.368 -7.949 3.965) 8.890 6.874 ( 1.850 -5.688 -3.929) 7.157 7.252 ( 8.412 0.438 13.393) 15.822 7.439 ( -4.016 -2.343 -4.535) 6.495 8.057 ( 4.756 -5.128 -10.407) 12.539 8.313 ( 6.995 -18.893 -9.856) 22.428 8.714 ( 5.332 -24.393 -1.019) 24.990 8.778 ( 0.994 -6.722 -3.401) 7.599 9.344 ( 17.930 -1.768 6.339) 19.100 9.799 ( 2.390 0.820 14.012) 14.238 9.957 ( 3.131 4.438 6.624) 8.566 10.473 ( 2.958 1.315 12.923) 13.323 12.069 ( -1.249 9.571 -4.740) 10.753 12.142 ( -5.385 23.602 -1.257) 24.242 12.923 ( -13.054 19.683 -10.661) 25.913 13.154 ( 6.228 15.048 1.731) 16.378 13.862 ( -9.151 24.886 -5.190) 27.019 14.077 ( -17.141 19.177 6.857) 26.620 16.029 ( 23.039 -47.163 -9.655) 53.370 18.171 ( 5.248 -22.113 21.450) 31.251 19.806 ( 6.025 -20.325 -2.259) 21.319 21.587 ( 22.621 -49.610 -3.399) 54.630 22.468 ( 5.892 0.711 -10.654) 12.196 25.090 ( -7.503 6.241 -54.880) 55.741 26.856 ( 4.228 -5.547 19.606) 20.810 27.643 ( -12.226 7.384 22.167) 26.370 ======================= Grid point 343 (151/429) ======================= q-point: (-0.14 -0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( -19.662 -20.713 2.969) 28.713 2.378 ( -19.180 -23.935 6.258) 31.303 4.035 ( -2.458 -12.391 -2.816) 12.943 4.274 ( -5.985 -22.283 7.478) 24.254 4.373 ( -10.660 -9.401 2.533) 14.437 4.727 ( -1.805 1.502 -12.281) 12.503 5.322 ( 8.348 -18.034 -4.260) 20.324 5.640 ( -0.146 10.987 4.285) 11.794 6.220 ( -16.028 -7.829 3.496) 18.177 6.251 ( 11.367 5.747 -1.239) 12.798 6.872 ( 1.341 -10.943 -4.850) 12.045 7.005 ( -0.356 -8.642 -6.786) 10.994 7.424 ( -0.084 -15.602 20.134) 25.472 7.577 ( -0.421 -15.241 -5.855) 16.332 8.104 ( -2.254 -3.473 -7.838) 8.865 8.685 ( 4.756 -17.740 -5.447) 19.157 8.901 ( 0.220 -6.793 -4.763) 8.299 9.253 ( 3.568 -30.015 -1.124) 30.247 9.480 ( 17.197 0.383 1.924) 17.308 9.845 ( 3.747 -1.535 15.703) 16.217 10.000 ( 1.446 -9.137 -0.808) 9.286 10.485 ( 0.959 1.245 13.337) 13.429 11.466 ( 2.789 37.025 -4.421) 37.392 11.998 ( -3.355 7.867 -1.858) 8.752 12.404 ( -10.838 20.607 -5.447) 23.911 13.002 ( 1.561 6.477 1.779) 6.895 13.444 ( -6.635 14.352 -2.017) 15.940 13.722 ( -10.064 11.903 2.855) 15.846 16.980 ( 22.441 -40.548 -9.545) 47.317 18.523 ( 1.664 -11.127 16.408) 19.895 20.128 ( -1.763 -12.967 0.057) 13.087 22.360 ( 13.299 -7.254 -14.588) 21.031 22.610 ( 18.203 -24.313 0.692) 30.380 24.813 ( -12.417 7.491 -38.908) 41.522 27.030 ( 4.809 -5.846 17.821) 19.362 27.487 ( -11.763 5.216 15.012) 19.772 ======================= Grid point 344 (152/429) ======================= q-point: (-0.07 -0.36 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.454 ( -10.896 -19.271 3.301) 22.383 2.740 ( -12.015 -22.367 7.034) 26.347 4.123 ( -2.788 -2.022 -4.750) 5.867 4.403 ( -0.461 0.989 -4.517) 4.647 4.628 ( -3.617 -9.704 -0.489) 10.368 4.800 ( -2.748 -14.725 5.204) 15.857 5.386 ( -9.077 9.973 8.844) 16.127 5.663 ( 21.969 -5.546 -6.617) 23.605 6.185 ( 10.544 5.273 -0.421) 11.796 6.318 ( -12.860 -8.644 -0.445) 15.502 6.952 ( -3.678 -2.599 -9.570) 10.577 7.118 ( 0.630 -4.737 3.588) 5.976 7.623 ( -1.454 -0.021 7.255) 7.399 8.024 ( -2.065 -26.124 -0.799) 26.217 8.288 ( 0.105 -20.787 -0.982) 20.810 8.954 ( 6.532 -6.390 -3.575) 9.812 9.068 ( -2.928 -15.041 -5.701) 16.349 9.512 ( 7.482 0.672 2.429) 7.895 9.860 ( 2.860 -28.357 -2.260) 28.591 9.961 ( 3.669 -8.280 6.424) 11.103 10.301 ( 3.950 -15.692 3.268) 16.508 10.486 ( -0.602 -1.604 3.584) 3.972 10.844 ( 0.495 26.382 1.377) 26.423 11.642 ( -0.251 25.621 2.127) 25.710 12.129 ( -12.164 4.395 -4.062) 13.557 12.909 ( 2.312 5.333 1.480) 5.998 13.242 ( -3.071 4.332 0.595) 5.343 13.506 ( -6.137 6.947 0.272) 9.274 17.734 ( 19.609 -28.762 -8.107) 35.742 18.695 ( 1.273 -4.076 10.599) 11.427 20.281 ( -7.318 -6.529 1.341) 9.898 22.372 ( 5.877 2.212 -14.245) 15.567 23.178 ( 20.337 -18.568 1.085) 27.560 24.542 ( -14.580 6.687 -23.228) 28.229 27.178 ( 3.768 -3.815 16.358) 17.214 27.377 ( -10.181 2.149 7.622) 12.898 ======================= Grid point 355 (153/429) ======================= q-point: (-0.29 -0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( -25.944 0.000 8.039) 27.161 1.439 ( -34.407 0.000 8.691) 35.488 3.039 ( -55.786 0.000 8.932) 56.496 3.231 ( 0.468 -0.000 0.419) 0.628 4.038 ( 8.491 -0.000 1.387) 8.604 4.522 ( 2.870 -0.000 -1.358) 3.175 5.209 ( -13.261 0.000 -12.246) 18.050 5.366 ( -0.767 0.000 0.214) 0.796 5.421 ( -31.646 0.000 -4.501) 31.964 6.564 ( 6.757 -0.000 20.534) 21.617 6.647 ( 2.668 -0.000 -6.899) 7.397 7.160 ( 13.421 -0.000 -12.995) 18.681 7.341 ( 0.923 -0.000 0.745) 1.186 7.558 ( -0.906 0.000 0.627) 1.101 7.603 ( 18.216 -0.000 -7.544) 19.716 7.864 ( -2.025 0.000 4.075) 4.550 8.196 ( 3.329 -0.000 -11.768) 12.229 8.645 ( 3.786 -0.000 -2.933) 4.789 9.324 ( 16.024 -0.000 7.700) 17.778 9.811 ( 3.489 -0.000 3.649) 5.049 10.145 ( 2.598 -0.000 22.244) 22.396 10.535 ( 11.095 -0.000 13.153) 17.208 12.136 ( -5.507 0.000 -5.104) 7.508 12.911 ( -4.444 0.000 1.048) 4.566 13.259 ( -5.358 0.000 -11.587) 12.766 13.749 ( 5.270 -0.000 0.419) 5.287 14.144 ( 2.160 -0.000 -3.333) 3.972 14.582 ( -19.298 0.000 -2.567) 19.468 15.829 ( -0.471 0.000 1.993) 2.048 16.709 ( 8.649 -0.000 8.494) 12.122 19.123 ( -0.494 0.000 1.508) 1.587 20.220 ( 0.394 -0.000 -1.163) 1.228 22.489 ( 6.505 -0.000 -11.577) 13.279 25.197 ( -6.051 0.000 -76.717) 76.955 26.748 ( 2.677 -0.000 19.896) 20.076 27.857 ( -7.683 0.000 34.507) 35.352 ======================= Grid point 356 (154/429) ======================= q-point: (-0.21 -0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( -29.488 -14.481 13.320) 35.449 1.502 ( -25.267 -20.610 6.551) 33.259 2.891 ( -46.078 -20.985 11.250) 51.866 3.586 ( -4.806 -29.819 1.352) 30.234 4.090 ( 8.569 -0.190 0.165) 8.573 4.563 ( -1.615 -3.772 -3.346) 5.294 5.045 ( -15.487 2.344 -8.003) 17.590 5.449 ( -7.539 -16.375 -7.286) 19.444 5.512 ( -13.077 -15.322 1.547) 20.203 6.571 ( 1.952 3.282 6.390) 7.445 6.686 ( 4.986 0.756 1.084) 5.158 6.922 ( 4.404 15.461 -8.599) 18.231 7.320 ( 1.988 1.725 6.006) 6.558 7.514 ( 4.629 8.149 0.339) 9.378 7.901 ( 8.092 -15.873 -5.128) 18.540 8.011 ( 4.946 -14.107 -12.973) 19.794 8.356 ( 4.642 -15.422 -1.283) 16.156 8.685 ( 2.507 -3.176 -4.956) 6.398 9.430 ( 15.832 -0.405 5.781) 16.859 9.836 ( 3.863 0.079 1.265) 4.066 10.119 ( -1.238 6.917 20.782) 21.938 10.594 ( 12.261 4.140 17.005) 21.369 12.068 ( -6.395 2.110 -4.656) 8.187 12.650 ( -1.631 23.968 1.815) 24.092 13.032 ( -12.904 8.689 -10.946) 19.022 13.564 ( 6.777 17.816 -1.878) 19.154 14.268 ( -15.942 19.773 -3.734) 25.672 14.315 ( -17.436 11.898 4.978) 21.687 15.416 ( 17.048 -15.070 -10.309) 24.981 17.670 ( 10.508 -44.196 21.941) 50.450 19.457 ( 15.886 -24.982 -4.510) 29.947 20.691 ( 11.585 -49.985 -2.333) 51.363 22.497 ( 6.335 0.725 -12.242) 13.803 24.981 ( -13.298 1.354 -78.135) 79.270 26.832 ( 3.844 -3.165 19.470) 20.097 27.800 ( -6.619 8.892 37.413) 39.020 ======================= Grid point 357 (155/429) ======================= q-point: (-0.14 -0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -22.038 -21.799 11.229) 32.969 1.803 ( -23.271 -25.036 8.465) 35.214 3.331 ( -29.366 -41.778 10.184) 52.073 4.064 ( -4.601 -18.016 0.208) 18.595 4.156 ( 6.551 -3.786 1.630) 7.740 4.665 ( -1.214 -7.655 -11.764) 14.088 4.989 ( -10.768 -9.746 -3.829) 15.020 5.682 ( -1.729 -7.205 3.261) 8.095 5.846 ( -11.855 -24.194 -2.533) 27.061 6.497 ( 6.663 8.686 -1.943) 11.118 6.636 ( 5.403 -2.154 1.930) 6.128 6.854 ( -1.260 -4.713 -6.971) 8.508 7.367 ( -5.334 1.706 -4.128) 6.957 7.401 ( 6.076 -3.026 17.311) 18.594 8.050 ( 2.111 -2.289 -12.432) 12.816 8.381 ( 9.519 -17.452 -6.227) 20.832 8.750 ( 2.221 -19.648 -3.443) 20.071 8.785 ( 3.053 -10.732 -3.934) 11.831 9.549 ( 14.475 -2.500 2.292) 14.867 9.863 ( 3.323 -1.230 -1.792) 3.971 10.002 ( -3.483 6.391 18.588) 19.962 10.592 ( 8.834 5.317 18.129) 20.856 12.006 ( -4.555 -0.017 -2.904) 5.402 12.137 ( 2.577 31.342 -0.935) 31.462 12.720 ( -14.705 16.398 -10.945) 24.595 13.230 ( 5.513 17.682 2.832) 18.737 13.742 ( -8.703 22.184 -3.574) 24.097 13.901 ( -17.710 14.550 5.211) 23.506 16.257 ( 24.032 -47.162 -12.880) 54.476 18.277 ( -1.663 -19.299 22.489) 29.681 19.898 ( 11.500 -13.550 -2.966) 18.018 21.914 ( 38.560 -50.770 -5.817) 64.018 22.495 ( 6.068 0.027 -10.927) 12.499 24.729 ( -17.895 1.715 -63.859) 66.342 26.974 ( 3.808 -5.700 15.360) 16.820 27.621 ( -8.464 11.256 33.697) 36.522 ======================= Grid point 358 (156/429) ======================= q-point: (-0.07 -0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( -14.235 -23.310 8.738) 28.676 2.207 ( -15.982 -27.298 10.277) 33.260 3.928 ( -13.694 -25.721 2.755) 29.269 4.245 ( -3.048 -13.028 4.260) 14.042 4.327 ( 0.275 -9.294 0.629) 9.319 4.674 ( 0.133 0.295 -11.541) 11.545 5.310 ( -8.861 -19.889 0.665) 21.784 5.686 ( 4.560 3.421 0.572) 5.729 6.108 ( -1.789 -9.236 2.489) 9.731 6.384 ( 9.663 7.649 -1.408) 12.404 6.852 ( 0.262 -7.631 -10.058) 12.628 6.965 ( -2.210 -10.812 -5.802) 12.468 7.439 ( -5.569 -18.101 12.779) 22.847 7.617 ( 4.985 -11.077 5.478) 13.325 8.045 ( -3.099 -2.905 -6.727) 7.956 8.715 ( 3.347 -16.097 -4.055) 16.933 8.891 ( 2.049 -5.957 -6.673) 9.177 9.278 ( 2.016 -29.255 -1.965) 29.391 9.647 ( 12.317 2.317 -5.118) 13.538 9.937 ( 3.815 -1.645 11.001) 11.759 9.992 ( -3.773 -10.562 2.546) 11.501 10.575 ( 5.323 4.365 16.947) 18.292 11.483 ( 2.998 37.876 -4.097) 38.215 11.976 ( -0.740 3.710 -0.091) 3.784 12.253 ( -10.839 21.321 -5.779) 24.606 13.032 ( 1.847 7.526 3.481) 8.496 13.375 ( -4.397 12.385 -0.600) 13.157 13.613 ( -10.507 8.992 1.603) 13.922 17.195 ( 22.232 -39.691 -12.014) 47.053 18.574 ( -3.836 -11.291 16.414) 20.288 20.120 ( 0.282 -7.632 -0.261) 7.641 22.416 ( 7.851 1.111 -17.661) 19.359 22.907 ( 31.967 -26.447 1.918) 41.533 24.486 ( -18.570 2.598 -42.204) 46.182 27.122 ( 0.936 -5.816 8.412) 10.270 27.448 ( -7.194 7.986 27.863) 29.864 ======================= Grid point 370 (157/429) ======================= q-point: (-0.21 -0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.126 ( -28.248 0.000 10.992) 30.311 1.137 ( -28.829 0.000 23.929) 37.467 2.416 ( -61.372 0.000 18.505) 64.101 3.228 ( -1.180 0.000 0.146) 1.189 4.140 ( 8.531 -0.000 -0.316) 8.537 4.550 ( 2.948 -0.000 -1.736) 3.421 4.890 ( -33.449 0.000 -0.724) 33.457 5.195 ( -5.143 0.000 -17.615) 18.351 5.360 ( -0.547 0.000 0.629) 0.833 6.651 ( 2.580 -0.000 -7.069) 7.526 6.682 ( 2.522 -0.000 16.768) 16.957 7.223 ( 6.521 -0.000 -20.368) 21.386 7.357 ( 0.829 -0.000 2.491) 2.625 7.551 ( -0.112 0.000 -1.104) 1.110 7.749 ( 12.671 -0.000 -7.264) 14.605 7.852 ( -2.739 0.000 4.167) 4.986 8.216 ( 4.896 -0.000 -3.426) 5.975 8.664 ( 3.112 -0.000 -6.960) 7.624 9.523 ( 14.205 -0.000 3.588) 14.652 9.857 ( 4.203 -0.000 -4.283) 6.001 10.212 ( -4.826 0.000 15.793) 16.514 10.796 ( 22.412 -0.000 32.358) 39.362 12.055 ( -5.648 0.000 -3.981) 6.910 12.844 ( -9.174 0.000 1.239) 9.257 13.170 ( -0.514 0.000 -13.597) 13.606 13.814 ( 4.177 -0.000 4.108) 5.859 14.157 ( 2.181 -0.000 -3.346) 3.994 14.356 ( -17.813 0.000 -3.671) 18.188 15.831 ( -0.470 0.000 2.051) 2.105 16.832 ( 8.119 -0.000 4.039) 9.068 19.123 ( -0.493 0.000 1.502) 1.581 20.220 ( 0.387 -0.000 -1.174) 1.236 22.517 ( 6.242 -0.000 -13.674) 15.031 24.716 ( -25.234 0.000 -92.835) 96.203 26.857 ( 3.285 -0.000 17.848) 18.148 27.987 ( 5.264 -0.000 51.756) 52.023 ======================= Grid point 371 (158/429) ======================= q-point: (-0.14 -0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.180 ( -24.473 -16.101 19.856) 35.390 1.254 ( -23.783 -20.506 16.862) 35.643 2.400 ( -48.012 -32.469 20.087) 61.343 3.557 ( -1.489 -29.347 0.475) 29.389 4.182 ( 7.565 0.234 -0.424) 7.580 4.491 ( -10.601 -0.641 -3.095) 11.062 4.833 ( -14.021 -4.113 -5.735) 15.697 5.313 ( -4.383 -20.341 -11.041) 23.556 5.477 ( -1.355 -10.888 1.812) 11.120 6.598 ( -0.224 5.379 3.948) 6.676 6.727 ( 1.720 -2.291 -2.070) 3.534 6.917 ( 1.204 15.272 -8.506) 17.523 7.346 ( -1.082 2.414 5.402) 6.015 7.559 ( 1.548 7.832 4.102) 8.976 7.947 ( 4.367 -8.135 -11.096) 14.435 8.061 ( 12.519 -22.743 -8.780) 27.406 8.409 ( 3.593 -15.014 2.738) 15.679 8.691 ( 3.174 -2.816 -8.870) 9.833 9.592 ( 8.692 -0.105 0.418) 8.703 9.862 ( 2.752 0.474 -7.892) 8.372 10.126 ( -8.755 5.805 13.946) 17.459 10.887 ( 22.261 11.417 37.686) 45.235 11.985 ( -5.377 1.754 -2.989) 6.397 12.641 ( -2.589 19.865 3.548) 20.345 12.840 ( -11.432 13.370 -12.603) 21.640 13.640 ( 6.626 17.365 1.355) 18.636 14.056 ( -21.552 12.862 3.774) 25.380 14.134 ( -14.872 23.375 -2.021) 27.779 15.578 ( 19.314 -27.188 -14.423) 36.335 17.833 ( 2.968 -36.117 19.077) 40.953 19.700 ( 30.035 -25.180 -7.331) 39.873 20.896 ( 31.725 -75.387 -9.771) 82.372 22.517 ( 5.607 0.692 -14.485) 15.548 24.411 ( -33.780 -4.670 -87.888) 94.271 26.931 ( 1.765 -3.067 13.451) 13.909 27.961 ( 6.129 16.951 56.521) 59.325 ======================= Grid point 372 (159/429) ======================= q-point: (-0.07 -0.21 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.475 ( -17.075 -24.025 13.428) 32.389 1.612 ( -18.084 -26.942 20.048) 38.142 3.058 ( -25.217 -49.586 14.301) 57.438 4.036 ( 0.051 -16.393 -0.889) 16.417 4.232 ( 5.714 -2.272 1.449) 6.318 4.592 ( -5.091 -13.678 -10.263) 17.842 4.830 ( -12.904 -10.580 -3.275) 17.005 5.669 ( -2.662 -7.358 4.655) 9.104 5.774 ( 0.591 -27.288 -6.182) 27.986 6.501 ( -2.711 3.248 -0.607) 4.274 6.758 ( 12.106 3.057 0.716) 12.506 6.813 ( 0.056 -5.491 -6.878) 8.801 7.277 ( -7.278 0.601 -4.332) 8.491 7.513 ( 1.443 -1.969 17.784) 17.951 8.029 ( 2.576 -0.421 -11.626) 11.915 8.471 ( 9.402 -13.761 -4.850) 17.358 8.759 ( 3.643 -13.706 -7.502) 16.044 8.805 ( 2.191 -15.897 -2.783) 16.287 9.655 ( 1.624 -4.399 -1.182) 4.835 9.848 ( -0.569 -0.847 -12.406) 12.448 10.028 ( -1.847 3.823 16.268) 16.813 10.811 ( 12.896 12.215 30.019) 34.881 11.958 ( -2.841 -1.136 -2.574) 3.999 12.170 ( 3.405 31.395 -0.361) 31.581 12.538 ( -9.583 13.495 -8.176) 18.460 13.296 ( 3.121 19.083 4.828) 19.930 13.643 ( -6.849 18.996 -1.876) 20.280 13.721 ( -15.732 10.106 2.437) 18.857 16.473 ( 22.981 -47.126 -15.002) 54.535 18.286 ( -10.524 -18.221 18.784) 28.206 20.027 ( 12.011 -5.549 -2.424) 13.451 22.360 ( 34.869 -24.300 -28.762) 51.319 22.591 ( 29.004 -20.628 2.564) 35.683 24.209 ( -30.116 -8.310 -68.474) 75.264 27.027 ( -1.924 -4.808 6.179) 8.062 27.725 ( -0.526 17.574 50.020) 53.020 ======================= Grid point 385 (160/429) ======================= q-point: (-0.14 -0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.854 ( -27.665 0.000 16.638) 32.283 0.957 ( -23.459 0.000 34.490) 41.712 1.819 ( -58.234 0.000 35.598) 68.253 3.209 ( -1.855 0.000 -0.301) 1.880 4.218 ( 4.371 -0.000 -0.061) 4.371 4.541 ( -25.041 0.000 -1.169) 25.068 4.573 ( 2.380 -0.000 -2.277) 3.294 5.104 ( 0.111 -0.000 -17.447) 17.448 5.358 ( -0.237 0.000 1.229) 1.252 6.653 ( 2.441 -0.000 -7.243) 7.643 6.758 ( 1.823 -0.000 12.174) 12.310 7.122 ( -8.966 0.000 -27.275) 28.711 7.377 ( 0.287 -0.000 4.501) 4.511 7.548 ( 0.991 -0.000 -3.012) 3.171 7.833 ( -3.259 0.000 4.116) 5.250 7.858 ( 10.128 -0.000 -2.128) 10.349 8.270 ( 4.215 -0.000 2.699) 5.005 8.669 ( 3.674 -0.000 -10.980) 11.578 9.619 ( -0.048 0.000 -9.665) 9.665 9.876 ( 2.907 -0.000 -7.676) 8.208 10.140 ( -11.749 0.000 4.382) 12.540 11.338 ( 45.204 -0.000 59.754) 74.926 11.984 ( -4.650 0.000 -1.695) 4.950 12.717 ( -11.471 0.000 -0.966) 11.512 13.162 ( 6.080 -0.000 -8.794) 10.691 13.862 ( -0.695 0.000 8.687) 8.714 14.168 ( 1.984 -0.000 -3.347) 3.891 14.170 ( -10.493 0.000 -5.667) 11.925 15.833 ( -0.509 0.000 2.112) 2.173 16.856 ( -4.873 0.000 -22.365) 22.890 19.123 ( -0.491 0.000 1.497) 1.575 20.220 ( 0.379 -0.000 -1.189) 1.247 22.524 ( 4.872 -0.000 -16.557) 17.259 23.932 ( -52.231 0.000 -82.255) 97.437 26.931 ( -0.257 0.000 10.900) 10.903 28.433 ( 36.199 -0.000 70.746) 79.470 ======================= Grid point 386 (161/429) ======================= q-point: (-0.07 -0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.962 ( -23.652 -19.012 15.087) 33.890 1.139 ( -14.812 -20.099 34.743) 42.784 1.999 ( -37.040 -43.331 32.145) 65.443 3.552 ( 0.477 -31.184 -0.078) 31.188 4.244 ( -1.114 -2.223 -0.434) 2.524 4.315 ( -11.207 2.425 -2.322) 11.699 4.725 ( -2.218 -4.439 -6.208) 7.948 5.260 ( 1.508 -20.929 -11.917) 24.132 5.474 ( -0.795 -10.416 2.798) 10.815 6.587 ( -4.888 8.146 2.582) 9.845 6.705 ( -0.401 -3.697 -7.660) 8.515 6.922 ( 3.499 5.886 -0.192) 6.850 7.337 ( -3.260 7.837 3.502) 9.182 7.576 ( -1.167 3.685 4.401) 5.858 7.952 ( 5.109 -8.003 -12.128) 15.403 8.208 ( 17.007 -22.809 -6.559) 29.198 8.449 ( 1.289 -13.578 4.188) 14.267 8.694 ( 4.113 -3.051 -12.282) 13.307 9.553 ( -14.662 -1.569 -9.716) 17.659 9.836 ( -2.561 1.710 -11.402) 11.811 10.090 ( -0.803 1.240 9.843) 9.953 11.362 ( 28.367 29.107 56.825) 69.864 11.923 ( -3.669 0.206 -3.114) 4.817 12.584 ( -8.228 9.012 1.019) 12.246 12.738 ( -0.039 21.408 -5.051) 21.996 13.699 ( -7.001 17.205 10.953) 21.564 13.826 ( -12.618 12.161 -1.192) 17.565 13.978 ( -10.146 21.434 -4.027) 24.054 15.745 ( 20.331 -35.255 -17.760) 44.404 17.834 ( -12.657 -29.241 6.494) 32.518 20.008 ( 24.877 -10.232 -7.764) 27.997 21.374 ( 67.968 -114.820 -66.416) 149.045 22.535 ( 9.868 -1.995 -8.579) 13.227 23.610 ( -51.621 -11.774 -59.511) 79.655 26.959 ( -3.164 -2.048 6.662) 7.654 28.365 ( 21.705 34.783 69.993) 81.117 ======================= Grid point 400 (162/429) ======================= q-point: (-0.07 -0.07 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.649 ( -20.222 0.000 25.287) 32.378 0.770 ( -31.512 0.000 26.432) 41.130 1.470 ( -31.880 0.000 67.026) 74.222 3.187 ( -1.584 0.000 -0.841) 1.794 4.177 ( -10.949 0.000 -1.495) 11.051 4.395 ( 0.244 -0.000 0.082) 0.257 4.585 ( 1.322 -0.000 -2.841) 3.133 5.068 ( 3.887 -0.000 -14.991) 15.487 5.363 ( 0.104 -0.000 1.868) 1.871 6.653 ( 2.275 -0.000 -7.386) 7.728 6.710 ( -17.330 0.000 -15.519) 23.263 7.005 ( 10.622 -0.000 14.085) 17.641 7.395 ( -0.668 0.000 6.227) 6.262 7.553 ( 2.305 -0.000 -4.574) 5.122 7.809 ( -3.529 0.000 3.943) 5.291 7.952 ( 5.939 -0.000 -0.085) 5.939 8.326 ( 2.732 -0.000 6.823) 7.349 8.663 ( 3.180 -0.000 -14.425) 14.771 9.370 ( -33.173 0.000 -13.995) 36.004 9.800 ( -8.427 0.000 -14.236) 16.544 10.132 ( 6.228 -0.000 10.276) 12.016 11.898 ( -0.774 0.000 -2.174) 2.308 12.283 ( 64.104 -0.000 43.303) 77.360 12.641 ( 3.707 -0.000 9.926) 10.595 13.239 ( 12.275 -0.000 -2.555) 12.539 13.848 ( -6.360 0.000 11.367) 13.026 14.107 ( 2.884 -0.000 -4.370) 5.236 14.177 ( 1.608 -0.000 -3.335) 3.702 15.835 ( -0.579 0.000 2.164) 2.240 16.257 ( -83.677 0.000 -64.457) 105.625 19.122 ( -0.489 0.000 1.493) 1.571 20.220 ( 0.373 -0.000 -1.204) 1.261 22.570 ( 17.259 -0.000 -2.552) 17.447 23.215 ( -24.930 0.000 -10.144) 26.915 26.934 ( -4.110 0.000 5.676) 7.008 29.297 ( 66.811 -0.000 46.094) 81.169 ======================= Grid point 401 (163/429) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.174 ( -1.839 0.000 25.158) 25.225 1.182 ( -2.554 0.000 26.363) 26.486 3.007 ( -5.244 0.000 69.638) 69.835 3.128 ( -1.249 0.000 -2.599) 2.884 3.960 ( -4.779 0.000 -7.162) 8.611 4.358 ( 2.606 -0.000 -10.226) 10.553 4.505 ( 0.394 -0.000 -4.115) 4.133 4.928 ( 10.029 -0.000 1.175) 10.097 5.429 ( 0.342 -0.000 2.827) 2.847 6.486 ( 2.398 -0.000 -8.295) 8.635 6.487 ( -4.401 0.000 -1.395) 4.617 7.464 ( 0.186 -0.000 -3.817) 3.821 7.514 ( 25.408 -0.000 4.431) 25.791 7.564 ( 1.324 -0.000 6.959) 7.084 7.842 ( -3.375 0.000 2.144) 3.999 7.898 ( -5.294 0.000 -7.527) 9.202 8.301 ( 9.271 -0.000 -17.887) 20.147 8.598 ( -0.866 0.000 9.958) 9.995 8.970 ( -17.378 0.000 -4.538) 17.961 9.297 ( -15.346 0.000 -11.722) 19.311 10.415 ( 6.393 -0.000 6.056) 8.806 11.797 ( 3.151 -0.000 -4.287) 5.320 12.582 ( 0.095 -0.000 5.947) 5.948 13.084 ( 1.950 -0.000 3.699) 4.182 13.424 ( -7.705 0.000 3.244) 8.360 13.959 ( 1.674 -0.000 0.387) 1.718 14.099 ( 1.504 -0.000 -4.388) 4.639 14.151 ( 0.403 -0.000 -1.303) 1.364 15.030 ( -12.735 0.000 -1.038) 12.777 15.888 ( -0.848 0.000 2.801) 2.927 19.161 ( -0.731 0.000 2.246) 2.362 20.188 ( 0.565 -0.000 -1.855) 1.939 22.716 ( -0.241 0.000 -0.477) 0.534 23.437 ( 41.440 -0.000 -9.134) 42.435 26.965 ( -7.529 0.000 4.167) 8.605 29.814 ( 1.150 -0.000 -1.113) 1.600 ======================= Grid point 402 (164/429) ======================= q-point: ( 0.07 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.360 ( 5.227 -13.577 23.528) 27.663 1.671 ( 4.815 -35.676 21.521) 41.941 3.120 ( 4.980 -13.042 42.824) 45.042 3.586 ( -7.067 -33.430 12.221) 36.288 3.916 ( 5.445 -1.011 -6.183) 8.301 4.250 ( 0.130 3.166 -6.816) 7.517 4.750 ( 2.017 -11.978 -0.197) 12.148 5.048 ( 7.971 -11.658 -2.920) 14.422 5.579 ( -0.189 -14.016 4.069) 14.596 6.449 ( -3.840 0.985 -0.660) 4.019 6.533 ( 2.297 -4.900 -9.313) 10.771 7.248 ( -5.622 25.104 0.900) 25.742 7.402 ( 8.844 9.650 9.048) 15.912 7.557 ( -2.127 -8.074 -0.960) 8.405 7.902 ( 12.338 -8.290 -8.101) 16.929 8.278 ( 5.278 -6.608 -22.827) 24.343 8.347 ( -0.229 -13.427 -1.862) 13.557 8.645 ( -1.259 -4.416 8.167) 9.369 8.974 ( -13.954 -11.750 -1.259) 18.286 9.202 ( -12.603 -1.413 -11.899) 17.390 10.428 ( 4.047 2.842 5.522) 7.413 11.764 ( 5.726 5.246 -4.810) 9.135 12.433 ( -17.640 33.229 13.328) 39.912 12.665 ( -5.254 16.644 9.102) 19.684 13.280 ( -11.519 6.265 3.753) 13.639 13.383 ( 6.196 26.773 10.853) 29.546 13.818 ( 2.047 12.775 -0.447) 12.946 14.160 ( 22.325 26.233 6.067) 34.977 15.532 ( 13.095 -53.423 -27.067) 61.304 16.870 ( -32.297 -62.056 -2.096) 69.989 19.726 ( 1.506 -54.075 -20.131) 57.721 20.184 ( 2.055 0.285 -1.953) 2.849 22.736 ( -7.712 -4.446 -0.321) 8.907 23.712 ( 46.449 -4.234 -16.827) 49.584 26.930 ( -7.403 -0.018 4.665) 8.750 29.516 ( -7.696 25.613 11.151) 28.976 ======================= Grid point 403 (165/429) ======================= q-point: ( 0.14 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( 7.124 -25.290 18.918) 32.377 2.334 ( 3.238 -26.148 25.463) 36.641 3.695 ( 14.931 -30.872 26.293) 43.213 3.877 ( -2.733 -8.820 -8.500) 12.551 4.208 ( -1.603 -4.176 -9.951) 10.910 4.408 ( 5.461 -31.853 12.868) 34.785 4.873 ( 3.906 -3.036 7.362) 8.869 5.442 ( 3.790 -22.259 -9.637) 24.550 5.875 ( -3.723 -14.070 7.457) 16.353 6.438 ( 1.319 -0.183 -3.609) 3.847 6.575 ( -0.082 5.590 -3.448) 6.568 6.878 ( -6.570 0.026 -6.325) 9.120 7.367 ( 6.210 -0.430 6.918) 9.306 7.693 ( -9.151 -7.911 5.318) 13.213 8.073 ( 14.971 -3.671 -4.059) 15.940 8.294 ( 4.837 -2.556 -21.863) 22.537 8.541 ( -6.277 -8.802 -9.984) 14.716 8.801 ( -2.572 -12.478 3.587) 13.236 9.104 ( -11.998 -5.092 -2.442) 13.261 9.321 ( -3.127 -20.683 -6.293) 21.844 10.385 ( 1.184 4.042 5.196) 6.689 11.576 ( -9.002 28.682 11.606) 32.224 11.719 ( -5.456 11.502 0.761) 12.753 12.510 ( -3.408 10.017 8.293) 13.444 12.826 ( 8.620 37.978 2.287) 39.011 13.132 ( -5.679 4.582 3.620) 8.145 13.658 ( 7.064 7.375 1.131) 10.274 13.819 ( 14.244 21.704 4.942) 26.427 16.572 ( 10.599 -50.839 -23.742) 57.102 17.603 ( -33.460 -40.871 8.291) 53.467 20.154 ( -3.066 -1.097 -0.213) 3.263 20.760 ( 7.967 -48.789 -38.148) 62.443 22.798 ( -12.568 -8.629 0.228) 15.247 24.020 ( 39.937 -5.287 -21.221) 45.533 26.906 ( -7.039 -1.062 5.654) 9.091 28.981 ( -9.170 27.076 22.659) 36.478 ======================= Grid point 404 (166/429) ======================= q-point: ( 0.21 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.387 ( 6.988 -26.713 15.630) 31.729 2.817 ( 4.238 -19.625 24.852) 31.949 4.037 ( -1.130 -11.011 -7.556) 13.402 4.166 ( -0.631 -6.474 -6.278) 9.040 4.421 ( 16.270 -12.839 5.155) 21.357 4.865 ( 5.355 -13.828 16.851) 22.446 5.140 ( -2.862 -21.092 6.575) 22.277 5.737 ( 4.482 -6.612 -6.421) 10.249 6.028 ( -8.259 -7.084 3.838) 11.538 6.202 ( -7.563 11.738 -4.764) 14.754 6.634 ( 11.243 -3.502 -5.358) 12.938 7.048 ( -4.399 -10.519 -1.704) 11.528 7.577 ( 0.132 -18.272 -1.203) 18.312 7.761 ( -7.825 -9.141 10.040) 15.671 8.264 ( 13.081 -8.249 3.067) 15.766 8.365 ( 3.193 -6.371 -21.177) 22.344 8.679 ( -5.811 -13.277 -7.634) 16.380 9.020 ( -9.968 -9.696 -0.552) 13.917 9.248 ( -0.657 -20.578 -5.927) 21.425 9.710 ( -0.985 -21.845 -2.280) 21.986 10.321 ( -1.663 3.623 4.398) 5.936 10.982 ( -8.330 27.452 10.045) 30.396 11.583 ( 0.401 7.122 -4.904) 8.657 12.160 ( -0.172 29.224 11.987) 31.587 12.248 ( 2.937 22.466 -0.929) 22.677 13.076 ( -2.852 -0.380 3.295) 4.375 13.529 ( 7.667 14.296 3.544) 16.605 13.600 ( 6.537 6.295 3.440) 9.705 17.363 ( -2.265 -34.701 -20.271) 40.252 18.154 ( -18.564 -31.567 13.686) 39.095 20.169 ( 1.875 -1.230 0.908) 2.419 21.452 ( 8.997 -27.333 -34.547) 44.961 22.927 ( -15.095 -13.584 0.393) 20.311 24.263 ( 29.815 -3.269 -19.452) 35.749 26.920 ( -6.043 -3.244 6.565) 9.494 28.523 ( -7.638 21.101 23.482) 32.481 ======================= Grid point 405 (167/429) ======================= q-point: ( 0.29 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.914 ( 6.060 -21.890 13.654) 26.502 3.236 ( 5.762 -17.790 20.537) 27.775 4.181 ( -7.429 -7.196 -8.919) 13.658 4.267 ( -0.313 -7.777 -4.940) 9.218 4.505 ( 10.918 6.801 -1.084) 12.908 5.167 ( 9.007 -0.232 1.297) 9.103 5.367 ( -13.831 -8.184 19.692) 25.418 5.829 ( 2.049 -7.571 0.158) 7.845 5.944 ( -3.103 8.874 -3.920) 10.185 6.232 ( 1.566 -10.734 -0.834) 10.880 6.721 ( 7.553 -3.433 -7.905) 11.459 7.091 ( -11.970 -1.341 -0.371) 12.050 7.707 ( 2.411 -2.695 9.279) 9.959 8.239 ( -6.125 -25.866 -1.219) 26.609 8.429 ( 5.248 -7.698 -13.941) 16.767 8.576 ( 6.576 -14.571 -2.090) 16.123 8.948 ( -0.823 -16.323 -2.653) 16.557 9.145 ( -10.145 -14.738 -0.237) 17.894 9.699 ( 0.863 -22.593 -5.508) 23.271 10.155 ( 6.080 -15.407 -1.055) 16.597 10.214 ( -9.012 -3.749 0.803) 9.794 10.567 ( 2.485 12.197 4.462) 13.223 11.362 ( -5.189 15.852 -0.942) 16.707 11.725 ( -1.474 16.745 11.357) 20.286 11.910 ( 4.865 14.931 -0.327) 15.707 13.102 ( -2.491 -2.145 4.201) 5.334 13.331 ( 4.413 10.736 3.643) 12.166 13.544 ( 3.947 4.026 2.347) 6.107 17.814 ( -10.853 -22.653 -13.436) 28.486 18.569 ( -8.499 -17.381 10.154) 21.851 20.230 ( 6.170 -2.451 1.692) 6.852 21.796 ( 9.754 -11.168 -26.694) 30.536 23.123 ( -13.851 -15.320 -0.043) 20.653 24.408 ( 20.887 -0.262 -13.922) 25.103 26.983 ( -4.613 -5.338 7.009) 9.945 28.186 ( -5.615 15.423 19.330) 25.358 ======================= Grid point 406 (168/429) ======================= q-point: ( 0.36 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.294 ( 5.672 -11.692 11.772) 17.535 3.616 ( 4.822 -15.251 17.144) 23.447 4.228 ( -11.278 -5.313 -7.878) 14.747 4.324 ( 2.733 3.609 -2.203) 5.035 4.475 ( 0.536 -3.391 -5.481) 6.467 5.021 ( 4.423 13.269 1.359) 14.053 5.347 ( -19.338 2.971 7.079) 20.806 5.768 ( 8.105 8.583 3.808) 12.404 6.063 ( 4.936 -9.284 7.605) 12.977 6.405 ( 0.782 -6.667 -3.863) 7.745 6.812 ( -3.696 -3.607 -8.759) 10.168 7.097 ( -3.579 -8.207 1.651) 9.104 7.808 ( 5.016 -2.489 13.578) 14.687 8.417 ( 1.394 -2.973 -6.402) 7.195 8.602 ( -5.635 -8.516 -12.946) 16.489 8.825 ( -2.837 -8.794 -3.644) 9.933 9.190 ( -2.405 -13.121 -5.587) 14.462 9.531 ( -1.476 -22.170 6.005) 23.016 9.899 ( 9.229 8.150 -2.572) 12.578 10.076 ( 3.845 -7.466 -5.859) 10.240 10.525 ( -2.299 -6.163 1.669) 6.786 10.808 ( -2.425 -30.769 3.116) 31.021 11.017 ( -3.824 13.421 3.970) 14.509 11.558 ( -8.046 1.888 15.011) 17.136 11.725 ( 11.085 9.884 -5.706) 15.910 13.060 ( -3.748 6.801 5.324) 9.415 13.248 ( 2.650 0.062 1.859) 3.238 13.497 ( 1.511 3.066 1.648) 3.794 18.090 ( -10.805 -16.368 -7.608) 21.037 18.740 ( -4.686 -4.013 5.296) 8.131 20.323 ( 7.112 -2.661 2.076) 7.873 21.931 ( 8.504 -3.428 -21.087) 22.994 23.314 ( -9.892 -11.769 0.291) 15.377 24.466 ( 13.499 2.186 -8.340) 16.017 27.084 ( -3.360 -6.228 7.247) 10.129 27.941 ( -3.914 11.404 14.260) 18.674 ======================= Grid point 407 (169/429) ======================= q-point: ( 0.43 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.437 ( 6.034 2.000 10.205) 12.023 3.887 ( 1.404 -7.576 12.445) 14.637 4.173 ( -12.272 4.061 -8.092) 15.251 4.272 ( 0.473 0.719 0.041) 0.862 4.543 ( -2.982 -4.635 -0.578) 5.541 4.876 ( 0.838 1.463 0.622) 1.797 5.182 ( -10.309 4.389 4.287) 11.997 5.729 ( 12.922 3.770 7.655) 15.485 6.173 ( -1.493 -0.000 5.439) 5.641 6.491 ( -1.624 -3.998 -4.109) 5.959 6.817 ( -7.108 -4.160 -10.505) 13.349 7.313 ( 4.094 -10.485 5.001) 12.317 7.877 ( 3.473 1.091 16.607) 17.002 8.421 ( 1.911 2.819 0.192) 3.411 8.613 ( -8.135 -2.077 -15.311) 17.461 8.956 ( 0.022 -9.098 -13.681) 16.430 9.354 ( -3.620 -5.074 -3.149) 6.983 9.759 ( 0.151 -4.497 -0.508) 4.528 9.912 ( 12.551 0.952 -1.262) 12.650 10.095 ( 3.523 1.287 -4.041) 5.513 10.740 ( -6.930 -15.040 -1.535) 16.631 10.912 ( 3.988 2.253 10.317) 11.288 11.128 ( -9.907 -4.266 11.740) 15.943 11.639 ( -4.272 -10.806 5.138) 12.705 11.662 ( 9.216 1.105 -1.665) 9.430 12.904 ( -3.124 7.282 4.080) 8.913 13.285 ( 0.731 -1.439 1.868) 2.469 13.452 ( -0.165 2.428 0.597) 2.506 18.300 ( -7.210 -13.028 -3.388) 15.271 18.720 ( -0.964 4.328 1.467) 4.670 20.405 ( 4.065 -1.987 2.228) 5.044 21.971 ( 7.117 -0.568 -18.509) 19.838 23.446 ( -5.212 -6.814 1.150) 8.655 24.456 ( 6.884 3.577 -4.705) 9.073 27.199 ( -2.733 -6.238 7.739) 10.309 27.758 ( -2.916 8.673 10.144) 13.661 ======================= Grid point 408 (170/429) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.363 ( 6.345 10.282 10.068) 15.727 3.887 ( -3.836 11.873 5.135) 13.493 3.994 ( -7.503 1.136 -5.740) 9.515 4.320 ( -0.794 -4.335 7.986) 9.122 4.619 ( -2.295 -4.831 2.775) 6.025 4.944 ( 0.109 -4.818 -2.878) 5.613 5.117 ( -5.074 -2.581 2.362) 6.163 5.788 ( 16.443 0.656 7.980) 18.289 6.114 ( -6.135 3.332 2.766) 7.510 6.525 ( -3.421 -1.712 -2.043) 4.337 6.831 ( -5.712 -1.912 -10.689) 12.269 7.488 ( 2.162 -4.403 6.253) 7.948 7.861 ( -0.913 4.600 16.664) 17.311 8.389 ( 4.058 0.254 1.193) 4.238 8.584 ( -3.239 -1.244 -15.260) 15.649 9.109 ( 1.135 -9.405 -16.046) 18.634 9.316 ( 6.045 8.386 -0.715) 10.362 9.793 ( 2.983 8.459 -11.290) 14.419 9.856 ( -2.048 -5.675 -2.327) 6.466 10.256 ( 4.323 -10.267 4.493) 12.012 10.749 ( -3.171 13.276 10.044) 16.947 10.923 ( -0.600 -3.183 -1.419) 3.536 11.147 ( -6.050 -1.328 12.498) 13.949 11.696 ( 3.339 3.347 5.731) 7.429 11.784 ( -4.870 -5.821 0.397) 7.600 12.797 ( -1.102 3.075 3.222) 4.588 13.306 ( 0.442 -0.043 2.074) 2.121 13.407 ( -1.064 1.941 -0.444) 2.257 18.492 ( -2.356 -10.734 -0.070) 10.990 18.594 ( 2.963 9.270 -1.784) 9.894 20.448 ( -1.017 -1.157 2.610) 3.031 21.977 ( 6.270 0.251 -18.222) 19.272 23.520 ( -0.086 -2.524 1.396) 2.886 24.398 ( 0.680 4.048 -3.229) 5.222 27.314 ( -2.960 -6.144 8.636) 11.004 27.618 ( -2.414 6.425 7.929) 10.487 ======================= Grid point 409 (171/429) ======================= q-point: (-0.43 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.196 ( 4.153 12.723 11.540) 17.672 3.599 ( -3.279 15.879 6.649) 17.525 3.945 ( -6.327 -0.782 -5.797) 8.617 4.407 ( 2.821 -1.401 9.747) 10.243 4.714 ( -1.261 -5.985 2.007) 6.437 4.943 ( -0.043 2.850 -2.942) 4.097 5.249 ( -1.862 -11.142 -4.144) 12.032 5.894 ( 14.564 1.690 13.423) 19.878 6.026 ( -2.722 1.972 0.304) 3.375 6.503 ( -6.035 1.216 -0.034) 6.157 6.762 ( -7.252 2.376 -12.369) 14.533 7.515 ( -0.538 3.223 6.783) 7.529 7.773 ( -5.637 4.740 11.202) 13.406 8.469 ( 6.046 -1.390 -1.064) 6.295 8.581 ( 5.173 -2.905 -8.783) 10.599 9.138 ( 9.855 14.521 -2.569) 17.736 9.227 ( -0.501 -4.049 -15.186) 15.724 9.668 ( 3.483 4.446 -8.426) 10.144 9.913 ( -5.356 -3.149 -4.697) 7.788 10.313 ( -0.868 10.971 7.897) 13.546 10.643 ( 1.036 -7.598 9.106) 11.905 10.900 ( -3.599 6.339 -9.954) 12.338 11.086 ( -0.889 6.351 19.810) 20.822 11.487 ( -1.852 18.074 6.291) 19.227 11.865 ( -7.235 -5.600 -1.561) 9.281 12.798 ( 2.345 -2.130 3.645) 4.829 13.301 ( 0.726 1.346 2.871) 3.253 13.372 ( -2.204 0.392 -0.784) 2.371 18.395 ( 8.275 14.472 -4.231) 17.199 18.681 ( 0.402 -9.230 2.125) 9.480 20.442 ( -6.190 0.274 3.346) 7.042 21.970 ( 6.060 0.484 -19.860) 20.769 23.544 ( 6.198 2.124 0.338) 6.561 24.302 ( -5.294 4.201 -3.617) 7.666 27.408 ( -6.259 -3.234 6.065) 9.296 27.538 ( 0.399 1.401 11.874) 11.963 ======================= Grid point 410 (172/429) ======================= q-point: (-0.36 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.965 ( -0.869 15.807 13.922) 21.082 3.283 ( -4.116 17.764 10.516) 21.049 3.954 ( -2.262 -4.010 -3.497) 5.781 4.418 ( 3.923 3.679 4.212) 6.831 4.736 ( 1.393 6.827 -1.359) 7.100 4.952 ( -3.389 -6.985 -0.063) 7.764 5.414 ( 0.943 -5.871 -5.469) 8.079 5.830 ( 0.520 9.352 15.315) 17.952 6.100 ( 13.646 -3.623 -2.148) 14.281 6.410 ( -8.572 3.617 1.233) 9.386 6.657 ( -6.712 1.513 -12.195) 14.002 7.394 ( -2.705 9.535 4.822) 11.022 7.694 ( -4.616 1.662 5.592) 7.439 8.401 ( -0.368 8.409 -2.991) 8.933 8.664 ( 12.324 8.112 2.216) 14.920 8.928 ( 9.004 9.794 -9.892) 16.578 9.150 ( -2.486 7.110 -8.148) 11.096 9.565 ( 3.734 9.419 -5.404) 11.483 9.975 ( -6.373 -10.669 -4.682) 13.280 10.193 ( -4.355 -0.795 9.430) 10.418 10.472 ( 5.065 28.851 -6.817) 30.076 10.717 ( -2.016 16.066 -1.825) 16.295 11.112 ( 1.753 -2.281 24.432) 24.601 11.295 ( -1.502 -9.768 3.138) 10.369 11.885 ( -10.033 -2.554 -4.999) 11.497 12.901 ( 4.393 -5.207 4.797) 8.332 13.283 ( 0.779 1.277 4.100) 4.364 13.374 ( -4.506 -2.916 -0.657) 5.407 18.118 ( 12.323 20.626 -6.943) 25.010 18.839 ( 1.721 -5.812 4.473) 7.533 20.376 ( -9.542 2.769 4.102) 10.749 21.951 ( 6.397 1.230 -23.765) 24.641 23.504 ( 14.273 8.301 -2.039) 16.637 24.160 ( -11.090 5.297 -5.840) 13.607 27.355 ( -7.920 3.014 2.155) 8.744 27.649 ( 1.594 -7.385 19.755) 21.150 ======================= Grid point 411 (173/429) ======================= q-point: (-0.29 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.638 ( -4.798 20.468 15.775) 26.283 2.922 ( -6.075 19.888 17.043) 26.887 4.037 ( 1.290 -3.802 0.683) 4.073 4.337 ( 2.046 6.578 -2.340) 7.276 4.557 ( -1.594 9.748 -4.531) 10.867 4.945 ( -4.253 12.311 9.594) 16.177 5.435 ( -5.102 1.146 0.395) 5.244 5.704 ( 6.743 6.540 0.479) 9.405 6.245 ( 9.486 -4.024 -1.687) 10.441 6.330 ( 0.177 1.602 2.857) 3.280 6.579 ( -8.742 0.032 -11.324) 14.305 7.160 ( -3.154 13.773 2.466) 14.343 7.682 ( 2.011 -0.329 -1.351) 2.445 8.117 ( -0.803 22.516 4.229) 22.924 8.383 ( 2.372 21.549 7.877) 23.066 8.747 ( 0.023 10.524 -17.792) 20.671 8.989 ( 2.737 10.941 -0.328) 11.283 9.455 ( 3.408 1.367 -7.097) 7.991 9.803 ( 0.408 33.961 -4.974) 34.326 10.114 ( 1.099 -3.750 3.810) 5.458 10.239 ( -5.978 17.719 -5.139) 19.394 10.565 ( 0.600 -23.767 1.891) 23.850 11.233 ( 7.454 -6.352 21.517) 23.641 11.710 ( -2.307 -26.865 3.125) 27.144 11.845 ( -7.045 -0.525 -7.518) 10.316 13.033 ( 3.956 -5.060 5.595) 8.518 13.295 ( 0.578 -1.736 4.755) 5.095 13.428 ( -7.876 -6.576 -0.210) 10.263 17.718 ( 15.770 29.618 -9.529) 34.882 18.907 ( -1.933 0.628 6.982) 7.272 20.254 ( -8.241 5.142 3.788) 10.426 21.893 ( 6.843 4.276 -31.474) 32.492 23.387 ( 23.731 14.885 -5.241) 28.499 23.940 ( -16.318 8.893 -8.984) 20.642 27.248 ( -8.449 3.628 2.100) 9.432 27.886 ( 2.436 -12.532 25.686) 28.684 ======================= Grid point 412 (174/429) ======================= q-point: (-0.21 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( -7.471 25.897 15.678) 31.182 2.559 ( -6.540 19.126 27.281) 33.954 3.961 ( -1.178 17.727 5.517) 18.603 4.223 ( -4.623 5.818 -1.799) 7.646 4.381 ( -0.394 6.662 -7.561) 10.085 4.571 ( -1.220 18.614 14.973) 23.920 5.174 ( -4.019 23.299 -2.630) 23.789 5.713 ( 0.999 -0.175 -1.453) 1.772 6.187 ( 4.293 15.261 0.987) 15.884 6.375 ( 0.757 -2.719 -3.129) 4.214 6.587 ( -6.388 -9.084 -7.845) 13.597 6.915 ( 3.593 9.679 3.130) 10.789 7.534 ( 7.282 27.974 -0.427) 28.909 7.787 ( -1.081 -0.530 -5.331) 5.465 8.051 ( -3.388 14.361 15.174) 21.165 8.527 ( -0.422 8.829 -17.107) 19.256 8.791 ( 4.259 11.082 -2.793) 12.196 9.196 ( 2.578 28.113 -6.348) 28.936 9.473 ( -3.392 -2.607 -9.489) 10.409 9.856 ( -3.768 17.722 -4.757) 18.732 10.196 ( 0.195 -3.379 6.931) 7.713 11.131 ( -2.746 -29.730 13.613) 32.813 11.602 ( 14.014 -25.024 11.520) 30.908 11.792 ( -6.565 -1.672 -8.372) 10.770 12.187 ( 1.377 -20.439 3.196) 20.733 13.173 ( 3.040 -7.574 5.037) 9.590 13.391 ( -0.516 -8.083 3.762) 8.930 13.517 ( -11.198 -8.285 1.191) 13.981 17.135 ( 18.099 41.044 -12.045) 46.446 18.775 ( -12.801 11.645 8.599) 19.324 20.135 ( -0.010 4.645 1.202) 4.798 21.699 ( 6.071 15.216 -46.527) 49.327 23.202 ( 32.350 20.629 -9.162) 39.446 23.613 ( -18.987 12.329 -7.117) 23.731 27.140 ( -8.731 2.932 2.746) 9.611 28.257 ( 4.538 -19.936 30.675) 36.865 ======================= Grid point 413 (175/429) ======================= q-point: (-0.14 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( -8.704 25.810 18.616) 32.992 2.201 ( -8.138 22.659 29.704) 38.236 3.401 ( -8.156 35.314 27.172) 45.298 4.017 ( -4.105 9.342 -0.457) 10.214 4.260 ( 2.620 9.214 -11.693) 15.116 4.345 ( -3.815 17.499 3.831) 18.315 4.734 ( -0.716 10.629 6.967) 12.729 5.483 ( 0.581 24.178 -12.390) 27.174 5.861 ( 0.034 17.777 7.266) 19.205 6.446 ( -2.070 -5.003 -1.223) 5.551 6.638 ( 0.052 2.594 -7.842) 8.260 6.980 ( 6.881 -11.468 4.338) 14.060 7.150 ( -0.278 8.626 0.474) 8.643 7.805 ( 5.908 6.802 -3.689) 9.735 7.855 ( -3.124 4.024 4.883) 7.057 8.361 ( 3.082 5.980 -17.535) 18.782 8.596 ( 6.550 12.306 -5.934) 15.151 8.797 ( -0.155 14.638 1.277) 14.694 9.463 ( -11.814 -1.538 -8.705) 14.756 9.500 ( -7.194 14.958 -8.551) 18.672 10.270 ( 2.543 -2.345 7.137) 7.931 11.673 ( -5.720 -21.051 12.205) 24.997 11.813 ( -0.304 -15.607 6.414) 16.877 12.331 ( 20.245 -33.746 6.760) 39.929 12.471 ( 0.414 -9.288 4.926) 10.521 13.395 ( -1.338 -15.551 1.100) 15.648 13.569 ( -5.951 -8.508 -0.359) 10.389 13.648 ( -6.893 -13.991 5.661) 16.592 16.350 ( 18.569 50.347 -15.454) 55.843 18.321 ( -26.159 27.786 2.961) 38.277 20.090 ( 10.315 4.055 -3.265) 11.555 21.077 ( 0.033 45.729 -61.587) 76.708 22.945 ( 22.865 20.352 -6.747) 31.346 23.343 ( -0.378 7.949 -0.660) 7.985 27.056 ( -8.464 1.420 3.587) 9.302 28.806 ( 7.810 -28.766 29.409) 41.873 ======================= Grid point 414 (176/429) ======================= q-point: (-0.07 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.279 ( -7.095 14.357 24.021) 28.870 1.631 ( -11.522 35.647 21.992) 43.441 2.949 ( -5.889 12.295 50.485) 52.293 3.590 ( -0.726 36.080 8.209) 37.009 3.977 ( -11.234 -1.580 -7.746) 13.736 4.267 ( 1.488 -2.259 -6.635) 7.165 4.706 ( 4.050 5.002 4.353) 7.770 4.995 ( 5.410 19.618 -9.708) 22.547 5.563 ( 0.192 13.872 4.139) 14.477 6.495 ( -3.528 -2.092 -1.743) 4.456 6.538 ( 2.605 4.998 -8.735) 10.396 7.212 ( 11.063 -9.116 11.066) 18.109 7.329 ( -3.770 -20.884 0.832) 21.238 7.589 ( -2.100 11.138 -1.439) 11.425 7.810 ( 7.430 6.099 -5.530) 11.090 8.289 ( 8.840 2.070 -16.346) 18.698 8.338 ( 1.918 19.715 -6.593) 20.876 8.621 ( -0.466 4.891 8.557) 9.867 9.166 ( -16.419 9.360 -6.167) 19.880 9.402 ( -14.302 -0.633 -12.051) 18.713 10.346 ( 5.717 -1.875 6.914) 9.165 11.764 ( -1.930 -3.370 -5.244) 6.525 12.488 ( -0.662 -19.939 11.962) 23.261 12.683 ( -2.458 -31.293 7.225) 32.210 13.011 ( 28.101 -22.351 19.196) 40.715 13.619 ( -28.898 -13.331 5.374) 32.275 13.821 ( 0.352 -21.703 -3.562) 21.996 13.937 ( 9.632 -17.869 6.184) 21.221 15.469 ( 13.704 46.850 -21.951) 53.522 17.284 ( -33.209 70.302 -14.092) 79.018 19.746 ( 12.405 54.653 -28.173) 62.726 20.213 ( -6.262 5.828 -4.688) 9.755 22.760 ( 9.442 8.127 -1.060) 12.503 23.299 ( 24.543 4.346 -3.085) 25.115 27.002 ( -7.904 0.226 4.020) 8.870 29.466 ( 9.126 -28.400 13.758) 32.850 ======================= Grid point 416 (177/429) ======================= q-point: ( 0.07 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( 7.116 -0.000 23.358) 24.418 1.422 ( 25.472 -0.000 23.964) 34.972 3.107 ( -0.621 0.000 -2.916) 2.982 3.239 ( 2.274 -0.000 64.807) 64.847 3.945 ( 5.968 -0.000 -8.435) 10.333 4.351 ( 3.541 -0.000 -9.821) 10.440 4.490 ( -0.327 0.000 -3.823) 3.837 5.045 ( 8.978 -0.000 3.550) 9.655 5.442 ( 0.168 -0.000 2.575) 2.581 6.428 ( -5.520 0.000 -0.548) 5.547 6.482 ( 2.316 -0.000 -8.243) 8.562 7.442 ( -1.595 0.000 -2.602) 3.052 7.614 ( 3.076 -0.000 5.761) 6.531 7.774 ( -4.000 0.000 -5.394) 6.715 7.812 ( -3.204 0.000 2.075) 3.818 7.818 ( 19.496 -0.000 -9.878) 21.856 8.333 ( 7.449 -0.000 -13.988) 15.848 8.613 ( -2.833 0.000 8.271) 8.743 8.786 ( -12.534 0.000 -2.417) 12.765 9.095 ( -13.062 0.000 -9.003) 15.864 10.487 ( 2.200 -0.000 4.914) 5.383 11.866 ( 10.912 -0.000 -3.696) 11.521 12.579 ( -5.530 0.000 5.262) 7.634 12.967 ( -33.562 0.000 14.951) 36.742 13.266 ( -6.575 0.000 -2.537) 7.048 13.915 ( -8.748 0.000 0.789) 8.784 14.097 ( 1.020 -0.000 -4.383) 4.500 14.183 ( 10.568 -0.000 -1.888) 10.736 15.164 ( 25.533 -0.000 -1.139) 25.559 15.888 ( -0.982 0.000 2.783) 2.951 19.161 ( -0.724 0.000 2.249) 2.362 20.188 ( 0.573 -0.000 -1.852) 1.939 22.654 ( -7.497 0.000 -2.113) 7.789 23.908 ( 47.344 -0.000 -22.146) 52.267 26.900 ( -6.862 0.000 5.157) 8.584 29.714 ( -17.320 0.000 3.365) 17.644 ======================= Grid point 417 (178/429) ======================= q-point: ( 0.14 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( 12.551 -13.031 19.802) 26.823 1.889 ( 17.794 -26.861 23.338) 39.784 3.347 ( 11.833 -21.717 15.523) 29.199 3.573 ( -2.651 -19.029 27.593) 33.622 3.999 ( 8.837 -6.770 -6.812) 13.052 4.239 ( 2.722 3.129 -0.234) 4.154 4.759 ( 1.602 -15.911 -4.276) 16.553 5.144 ( 8.615 -7.269 1.668) 11.395 5.589 ( -0.591 -13.767 3.776) 14.287 6.402 ( -3.976 -1.258 -0.233) 4.177 6.521 ( 1.604 -4.066 -9.205) 10.190 7.179 ( -6.604 27.645 0.544) 28.428 7.461 ( -2.423 0.588 2.257) 3.363 7.574 ( 4.973 2.670 1.991) 5.985 7.989 ( 7.802 -9.639 -13.006) 17.971 8.247 ( -0.475 -14.357 -15.664) 21.254 8.337 ( 3.901 -0.120 -7.028) 8.040 8.651 ( -2.135 -4.333 8.314) 9.615 8.847 ( -8.646 -13.935 1.631) 16.480 9.036 ( -9.642 -3.668 -8.754) 13.530 10.470 ( -0.318 3.105 5.066) 5.950 11.849 ( 9.112 6.960 -3.141) 11.888 12.198 ( -29.682 36.501 17.662) 50.252 12.635 ( -6.150 6.217 8.967) 12.525 13.119 ( -8.787 7.481 -3.432) 12.040 13.527 ( 6.731 21.724 4.566) 23.197 13.877 ( 7.908 10.932 1.006) 13.530 14.442 ( 21.147 25.189 8.076) 33.867 15.564 ( 11.080 -50.774 -30.678) 60.349 16.566 ( -22.723 -49.141 8.893) 54.866 19.664 ( -2.068 -44.950 -9.720) 46.035 20.216 ( 4.965 -4.749 -4.502) 8.214 22.632 ( -9.019 -3.028 -2.774) 9.910 24.143 ( 42.040 -2.061 -26.186) 49.572 26.871 ( -6.404 0.004 6.245) 8.945 29.402 ( -18.914 20.024 13.290) 30.583 ======================= Grid point 418 (179/429) ======================= q-point: ( 0.21 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( 13.057 -22.580 16.161) 30.685 2.494 ( 7.848 -23.453 25.482) 35.510 3.820 ( -0.133 -12.449 -6.885) 14.227 3.991 ( 15.806 -18.579 10.552) 26.577 4.162 ( 3.870 -13.972 -2.457) 14.704 4.536 ( 6.748 -26.718 16.684) 32.214 4.924 ( 2.178 -3.089 1.991) 4.272 5.468 ( 5.319 -19.312 -5.460) 20.761 5.862 ( -2.587 -12.025 6.964) 14.135 6.408 ( -3.520 7.834 -5.351) 10.119 6.598 ( 4.134 -6.480 1.098) 7.764 6.777 ( -6.744 1.282 -6.007) 9.122 7.425 ( 0.527 0.608 3.145) 3.246 7.624 ( -5.040 -5.021 2.547) 7.556 8.182 ( 7.102 -8.922 -14.870) 18.739 8.306 ( 9.574 -0.126 -10.539) 14.239 8.407 ( -8.947 -8.785 -12.049) 17.390 8.778 ( -4.420 -9.557 7.243) 12.780 8.993 ( -6.585 -6.418 -0.598) 9.215 9.269 ( -2.926 -23.141 -4.331) 23.724 10.398 ( -2.389 4.454 5.523) 7.486 11.447 ( -22.336 27.987 19.573) 40.808 11.740 ( 9.358 9.920 -5.370) 14.657 12.481 ( -6.556 10.822 7.519) 14.719 12.833 ( -1.715 23.770 -7.332) 24.934 13.168 ( 4.866 14.783 6.588) 16.900 13.748 ( 7.740 8.028 1.003) 11.197 14.023 ( 17.509 27.986 6.303) 33.608 16.516 ( -5.036 -48.548 -28.036) 56.288 17.344 ( -17.916 -45.221 15.902) 51.174 20.108 ( -4.550 -7.154 1.069) 8.546 20.750 ( 10.814 -43.266 -27.917) 52.614 22.659 ( -11.369 -6.798 -1.916) 13.385 24.349 ( 33.346 -2.054 -26.422) 42.594 26.859 ( -5.663 -1.189 7.692) 9.626 28.920 ( -15.094 22.548 20.823) 34.203 ======================= Grid point 419 (180/429) ======================= q-point: ( 0.29 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( 10.703 -24.276 13.661) 29.841 2.968 ( 6.596 -18.976 22.848) 30.424 3.996 ( -2.400 -7.797 -9.160) 12.266 4.115 ( -1.390 -6.598 -7.049) 9.755 4.646 ( 19.069 -4.976 -1.107) 19.739 4.998 ( 3.601 -16.973 25.154) 30.558 5.109 ( -2.676 -18.075 -1.703) 18.351 5.764 ( 3.785 -8.919 -4.847) 10.834 5.953 ( -8.415 3.736 5.056) 10.504 6.158 ( 1.903 1.614 1.424) 2.873 6.709 ( 4.706 -1.112 -8.437) 9.724 6.957 ( -9.168 -9.671 0.612) 13.340 7.583 ( 1.957 -16.705 -0.888) 16.843 7.724 ( -3.909 -13.377 5.812) 15.100 8.306 ( 2.931 -6.296 -20.753) 21.884 8.428 ( 10.303 -6.774 -0.245) 12.332 8.583 ( -4.832 -16.474 -6.384) 18.316 8.922 ( -7.592 -7.186 2.976) 10.869 9.221 ( -1.020 -22.747 -4.273) 23.167 9.682 ( -2.943 -23.168 -1.762) 23.420 10.301 ( -4.805 5.043 4.959) 8.550 10.937 ( -7.036 21.535 13.105) 26.173 11.568 ( -0.941 11.012 -3.342) 11.546 12.149 ( -4.743 22.569 6.802) 24.044 12.303 ( 6.714 25.740 -4.188) 26.929 13.074 ( -0.585 0.808 4.217) 4.334 13.626 ( 6.589 12.796 2.155) 14.553 13.697 ( 8.441 12.881 4.347) 16.003 17.177 ( -16.297 -34.570 -18.707) 42.551 18.069 ( -6.307 -33.869 14.221) 37.270 20.202 ( 2.954 -4.412 2.055) 5.693 21.447 ( 10.566 -28.246 -29.056) 41.878 22.765 ( -13.465 -12.711 -0.370) 18.521 24.495 ( 24.635 -0.661 -22.380) 33.290 26.888 ( -4.493 -3.496 8.689) 10.388 28.498 ( -10.953 18.527 20.666) 29.838 ======================= Grid point 420 (181/429) ======================= q-point: ( 0.36 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.042 ( 7.894 -20.149 12.183) 24.834 3.380 ( 6.692 -16.939 18.422) 25.905 4.047 ( -10.334 -5.125 -9.063) 14.670 4.261 ( 3.007 -7.035 -6.141) 9.810 4.601 ( 7.554 9.890 -4.467) 13.222 5.219 ( -18.102 -4.119 10.143) 21.155 5.282 ( 7.270 5.732 -1.511) 9.380 5.833 ( -2.873 -6.316 9.717) 11.940 5.972 ( 7.798 -4.446 2.678) 9.367 6.295 ( 8.311 -6.555 0.679) 10.607 6.715 ( -6.382 -1.554 -9.113) 11.234 6.964 ( -6.052 -2.966 1.085) 6.826 7.770 ( 2.429 -6.245 7.703) 10.210 8.169 ( -3.557 -20.898 -6.745) 22.246 8.428 ( 5.424 -7.357 -15.393) 17.902 8.657 ( 6.425 -9.968 1.680) 11.978 8.934 ( 0.180 -20.871 -2.882) 21.070 9.038 ( -8.903 -16.330 1.915) 18.698 9.695 ( 1.472 -23.674 -4.511) 24.145 10.093 ( -12.246 -8.690 0.427) 15.022 10.217 ( 4.498 -14.768 0.736) 15.455 10.624 ( 3.794 12.110 6.276) 14.158 11.288 ( -9.021 15.362 3.003) 18.066 11.715 ( -4.979 18.283 7.320) 20.313 12.000 ( 11.563 13.449 -3.863) 18.152 13.084 ( -3.558 -0.978 3.695) 5.222 13.403 ( 5.407 12.354 3.961) 14.055 13.590 ( 3.010 5.398 1.426) 6.343 17.610 ( -16.002 -25.461 -10.974) 32.012 18.534 ( -4.596 -16.791 9.482) 19.823 20.317 ( 7.536 -3.755 2.274) 8.721 21.817 ( 10.423 -11.297 -24.439) 28.871 22.976 ( -12.026 -16.716 0.093) 20.593 24.570 ( 17.187 1.660 -15.921) 23.487 26.969 ( -3.166 -5.547 8.914) 10.966 28.177 ( -7.604 14.018 16.806) 23.168 ======================= Grid point 421 (182/429) ======================= q-point: ( 0.43 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.403 ( 6.021 -11.184 10.562) 16.520 3.731 ( 4.193 -13.028 15.851) 20.941 4.057 ( -12.879 -4.450 -9.006) 16.333 4.314 ( -0.771 1.587 -6.328) 6.569 4.482 ( 2.803 2.963 -3.047) 5.091 5.048 ( -1.397 11.369 -5.465) 12.691 5.179 ( -12.876 2.444 12.289) 17.966 5.888 ( 8.434 2.756 8.670) 12.406 6.142 ( 4.637 -3.967 4.055) 7.327 6.414 ( 0.659 -2.998 -2.217) 3.786 6.668 ( -11.092 -4.194 -7.159) 13.852 7.135 ( 6.196 -11.976 2.773) 13.766 7.901 ( 2.371 -3.587 13.203) 13.885 8.385 ( -2.488 -9.008 -11.863) 15.102 8.518 ( -0.209 -0.989 -9.236) 9.291 8.794 ( -0.077 -5.567 -4.003) 6.858 9.137 ( -3.394 -10.889 -3.475) 11.923 9.543 ( 0.583 -21.729 2.786) 21.915 9.989 ( 7.471 -0.045 -1.062) 7.547 10.080 ( 0.603 -13.234 -6.938) 14.955 10.500 ( -2.785 2.550 1.529) 4.074 10.794 ( -2.629 -28.835 5.183) 29.415 11.000 ( -2.847 8.069 7.544) 11.407 11.494 ( -10.397 2.251 10.411) 14.884 11.853 ( 14.025 9.987 -5.355) 18.031 13.024 ( -5.473 5.836 3.779) 8.848 13.291 ( 3.150 2.501 2.587) 4.782 13.515 ( 0.838 4.064 0.882) 4.243 17.934 ( -11.652 -19.747 -5.889) 23.672 18.712 ( -3.640 -4.444 5.058) 7.654 20.416 ( 7.513 -1.440 2.205) 7.961 21.951 ( 8.333 -2.990 -20.062) 21.929 23.215 ( -7.735 -13.966 0.407) 15.970 24.571 ( 10.811 4.138 -9.741) 15.129 27.082 ( -2.219 -6.228 8.779) 10.990 27.939 ( -5.194 10.693 12.337) 17.133 ======================= Grid point 422 (183/429) ======================= q-point: ( 0.50 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.543 ( 5.316 1.608 8.995) 10.572 3.938 ( -2.178 -4.654 11.496) 12.592 3.995 ( -10.714 2.585 -8.338) 13.820 4.257 ( -2.722 0.106 -1.324) 3.029 4.513 ( -1.354 -5.570 -0.247) 5.738 4.889 ( 1.133 3.613 -0.614) 3.836 5.110 ( -6.562 0.978 9.554) 11.632 5.919 ( 14.741 2.227 8.842) 17.333 6.125 ( -8.054 2.642 -2.247) 8.769 6.447 ( -4.696 -3.554 -5.665) 8.171 6.741 ( 0.599 -4.771 -1.930) 5.182 7.386 ( 4.873 -9.312 4.264) 11.342 7.956 ( -0.599 1.797 16.174) 16.285 8.447 ( -2.334 3.204 -2.830) 4.871 8.478 ( -0.334 -4.350 -11.862) 12.639 8.923 ( 2.895 -8.593 -13.555) 16.308 9.304 ( -2.596 -8.507 -3.550) 9.577 9.744 ( -1.529 -4.547 -2.661) 5.486 10.034 ( 8.348 12.768 -6.964) 16.769 10.130 ( 5.960 -6.008 1.664) 8.625 10.641 ( -8.886 -14.907 -2.180) 17.491 11.008 ( 5.524 -1.138 10.930) 12.300 11.063 ( -9.795 -3.496 14.707) 18.013 11.586 ( -6.546 -12.858 2.536) 14.650 11.771 ( 9.649 4.658 -1.293) 10.793 12.877 ( -3.923 6.098 3.297) 7.966 13.301 ( 0.726 -0.737 1.738) 2.022 13.451 ( -0.182 3.086 0.283) 3.104 18.209 ( -6.554 -16.255 -2.456) 17.698 18.715 ( -0.853 2.690 1.380) 3.141 20.459 ( 3.874 0.739 2.209) 4.521 21.983 ( 6.759 -0.149 -18.121) 19.341 23.400 ( -3.535 -9.137 1.154) 9.864 24.506 ( 5.211 5.969 -5.420) 9.600 27.202 ( -2.019 -6.003 8.784) 10.829 27.756 ( -3.706 8.343 8.917) 12.762 ======================= Grid point 423 (184/429) ======================= q-point: (-0.43 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.468 ( 4.332 9.997 9.152) 14.229 3.824 ( -6.299 8.123 -3.511) 10.862 3.932 ( -2.594 3.806 4.316) 6.312 4.327 ( -3.658 -8.072 8.489) 12.272 4.607 ( -0.846 -3.969 1.675) 4.390 4.934 ( 0.184 -5.977 -2.988) 6.685 5.093 ( -1.972 -0.917 6.176) 6.547 6.006 ( 16.497 -0.116 7.017) 17.928 6.022 ( -9.604 1.520 -2.594) 10.064 6.460 ( -7.264 -1.778 -3.570) 8.287 6.777 ( 1.759 1.802 -2.583) 3.608 7.528 ( 1.045 -2.922 4.323) 5.322 7.875 ( -6.221 6.871 12.576) 15.622 8.468 ( 7.468 -4.516 2.309) 9.028 8.506 ( -0.773 -1.688 -11.518) 11.667 9.075 ( 3.168 -8.141 -15.674) 17.944 9.370 ( 4.886 2.605 -3.532) 6.568 9.741 ( -4.082 3.216 -9.230) 10.592 9.859 ( 3.139 3.358 -3.381) 5.706 10.323 ( 4.368 -8.547 3.748) 10.304 10.694 ( -10.817 5.829 8.612) 15.006 10.927 ( 2.914 3.499 -7.407) 8.694 11.170 ( -0.886 -1.950 20.882) 20.992 11.702 ( -6.427 -0.100 1.403) 6.579 11.761 ( 1.536 0.909 3.270) 3.725 12.798 ( -0.758 1.089 3.148) 3.416 13.316 ( -0.207 -0.215 2.014) 2.036 13.398 ( -0.038 2.499 -0.395) 2.530 18.462 ( -2.479 -13.537 -0.165) 13.763 18.625 ( 3.287 7.164 -1.684) 8.060 20.445 ( -1.236 1.947 2.611) 3.484 21.980 ( 6.052 0.627 -18.274) 19.260 23.527 ( 0.492 -5.306 1.270) 5.478 24.392 ( 0.354 7.031 -3.110) 7.697 27.312 ( -3.016 -5.169 8.627) 10.500 27.620 ( -2.398 5.544 7.936) 9.974 ======================= Grid point 424 (185/429) ======================= q-point: (-0.36 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.277 ( 1.806 13.981 10.741) 17.722 3.594 ( -1.358 14.576 6.453) 15.998 3.886 ( -1.577 -0.948 0.275) 1.860 4.473 ( 1.985 -3.190 10.354) 11.015 4.691 ( -3.660 -8.281 0.098) 9.054 4.926 ( -0.535 5.769 -3.547) 6.793 5.236 ( 1.606 -12.089 -2.040) 12.365 5.941 ( -8.599 2.319 6.851) 11.236 6.130 ( 15.367 -1.775 1.113) 15.509 6.405 ( -10.188 1.766 -1.887) 10.511 6.700 ( 2.141 5.756 -4.186) 7.432 7.520 ( -1.904 4.227 3.273) 5.675 7.731 ( -7.811 5.028 8.642) 12.687 8.481 ( 1.260 2.081 -7.744) 8.117 8.687 ( 12.466 -9.543 2.211) 15.854 9.152 ( 1.105 1.842 -16.627) 16.765 9.257 ( 9.192 10.202 -2.462) 13.952 9.661 ( -0.045 0.437 -7.123) 7.137 9.835 ( -4.132 0.869 -5.535) 6.962 10.291 ( -8.341 10.955 8.749) 16.313 10.696 ( 2.870 -10.714 7.084) 13.161 10.837 ( 0.258 9.103 -12.528) 15.488 11.165 ( 0.357 5.209 21.821) 22.437 11.480 ( -2.700 17.790 4.530) 18.555 11.775 ( -7.610 -2.507 -0.186) 8.014 12.841 ( 2.348 -4.034 4.329) 6.365 13.314 ( -1.217 0.388 2.954) 3.219 13.355 ( 0.561 2.097 -0.508) 2.229 18.460 ( 5.970 11.561 -4.832) 13.880 18.699 ( 1.349 -10.406 1.997) 10.681 20.384 ( -5.970 2.827 3.282) 7.376 21.964 ( 6.015 0.888 -20.210) 21.104 23.612 ( 5.346 -1.826 -0.223) 5.654 24.236 ( -3.889 8.075 -2.429) 9.286 27.354 ( -6.348 0.252 4.843) 7.989 27.592 ( 0.506 -2.255 13.251) 13.451 ======================= Grid point 425 (186/429) ======================= q-point: (-0.29 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.010 ( -0.352 17.425 13.693) 22.164 3.290 ( -1.981 18.600 12.340) 22.409 3.954 ( 2.879 -5.223 1.772) 6.221 4.467 ( 2.284 5.097 2.706) 6.206 4.737 ( -0.452 10.560 -4.091) 11.334 4.901 ( -4.721 -11.617 1.650) 12.648 5.429 ( 3.499 -3.697 -0.429) 5.109 5.851 ( -3.554 4.726 8.640) 10.470 6.203 ( -0.726 -1.281 -6.744) 6.903 6.337 ( 1.321 -0.062 2.058) 2.446 6.599 ( 2.235 5.366 -5.561) 8.045 7.372 ( -3.330 10.022 2.654) 10.890 7.656 ( -5.536 0.101 5.448) 7.768 8.399 ( 1.892 7.240 -3.035) 8.075 8.805 ( 10.121 12.442 2.770) 16.276 8.954 ( 3.383 12.609 -15.548) 20.302 9.123 ( 1.670 6.095 -1.971) 6.620 9.587 ( 2.758 10.313 -2.822) 11.042 9.873 ( -7.557 -14.669 -5.959) 17.544 10.147 ( -7.748 1.717 5.632) 9.731 10.491 ( 3.765 24.218 -8.580) 25.968 10.726 ( 3.249 19.283 0.804) 19.571 11.216 ( -0.679 -10.973 19.916) 22.749 11.285 ( -0.584 -4.647 4.696) 6.633 11.769 ( -7.525 -2.088 -2.391) 8.168 12.967 ( 3.455 -5.823 5.990) 9.040 13.305 ( -2.449 -0.240 3.009) 3.887 13.331 ( 0.311 0.425 0.435) 0.683 18.219 ( 9.977 18.114 -7.671) 22.057 18.866 ( -0.110 -5.486 4.125) 6.865 20.287 ( -8.256 3.649 3.650) 9.736 21.935 ( 6.463 1.976 -24.339) 25.260 23.650 ( 11.624 2.806 -3.984) 12.604 24.030 ( -7.525 10.160 -2.821) 12.954 27.274 ( -7.688 3.640 2.607) 8.897 27.739 ( 1.246 -8.816 19.540) 21.473 ======================= Grid point 426 (187/429) ======================= q-point: (-0.21 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.661 ( -1.453 22.631 15.555) 27.500 2.939 ( -2.853 19.709 19.678) 27.997 4.085 ( 5.412 -3.781 4.610) 8.053 4.344 ( 0.837 8.824 -2.978) 9.350 4.505 ( -3.836 10.011 -7.263) 12.950 4.949 ( -0.918 11.398 9.154) 14.648 5.394 ( -4.821 4.100 9.596) 11.495 5.752 ( 3.384 6.295 -3.924) 8.153 6.275 ( -3.550 -9.987 -4.316) 11.444 6.368 ( 3.736 0.829 -3.007) 4.867 6.488 ( 1.530 6.809 -7.145) 9.988 7.146 ( -0.644 12.111 3.593) 12.649 7.685 ( -1.764 -4.453 1.888) 5.148 8.160 ( 6.106 23.904 2.421) 24.790 8.411 ( -2.957 24.755 8.415) 26.313 8.681 ( 0.721 11.873 -19.534) 22.871 9.007 ( 0.549 10.123 -0.963) 10.184 9.440 ( -2.261 3.790 -5.284) 6.885 9.784 ( -0.103 30.658 -6.464) 31.332 10.081 ( -4.815 2.020 -0.955) 5.309 10.232 ( 4.058 9.009 0.313) 9.885 10.564 ( -0.807 -19.673 -0.933) 19.712 11.398 ( 7.335 -9.582 19.402) 22.849 11.625 ( -9.428 -16.418 -2.994) 19.168 11.822 ( 1.886 -12.242 1.793) 12.516 13.093 ( 2.185 -4.368 6.788) 8.362 13.316 ( -3.043 -2.442 2.800) 4.802 13.360 ( -0.360 -3.576 1.232) 3.800 17.847 ( 13.226 27.470 -10.520) 32.252 18.878 ( -7.837 4.098 6.879) 11.204 20.186 ( -5.500 2.964 2.645) 6.785 21.852 ( 6.850 6.319 -32.240) 33.560 23.605 ( 10.238 9.004 -10.621) 17.283 23.766 ( -1.326 13.055 -2.045) 13.280 27.160 ( -8.306 3.930 2.582) 9.544 28.003 ( 1.428 -14.512 25.197) 29.112 ======================= Grid point 427 (188/429) ======================= q-point: (-0.14 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( -1.907 27.866 16.494) 32.438 2.607 ( -3.000 19.165 27.599) 33.734 4.004 ( 4.439 20.846 8.249) 22.854 4.159 ( -5.398 10.094 -2.178) 11.652 4.343 ( -0.253 4.429 -9.530) 10.512 4.643 ( 3.497 14.867 14.550) 21.094 5.132 ( -3.242 23.861 4.334) 24.468 5.716 ( 1.112 2.293 -3.368) 4.223 6.202 ( -3.567 15.715 -1.907) 16.227 6.399 ( 7.583 1.162 -2.798) 8.165 6.470 ( -8.624 -11.709 -8.059) 16.626 6.990 ( 6.057 6.149 3.799) 9.430 7.590 ( 1.889 31.806 -1.039) 31.879 7.795 ( 4.134 -5.148 -0.959) 6.671 8.052 ( -4.184 14.854 13.847) 20.734 8.468 ( 1.987 8.083 -20.427) 22.058 8.801 ( -0.268 9.973 -3.946) 10.728 9.192 ( -0.324 26.370 -4.671) 26.783 9.377 ( -6.125 1.627 -10.185) 11.996 9.782 ( -4.971 18.176 -3.484) 19.163 10.250 ( 3.811 -2.328 5.484) 7.072 11.109 ( -7.043 -32.349 8.012) 34.062 11.669 ( -4.260 -5.188 -6.885) 9.616 11.849 ( 14.054 -25.672 14.641) 32.725 12.219 ( 1.312 -19.940 4.280) 20.437 13.190 ( -4.520 -5.775 4.604) 8.659 13.399 ( -0.255 -7.862 2.603) 8.286 13.458 ( 1.219 -6.039 2.672) 6.716 17.282 ( 15.684 39.727 -13.595) 44.822 18.610 ( -21.273 17.753 7.996) 28.838 20.142 ( 0.573 0.471 0.406) 0.845 21.591 ( 5.536 20.418 -45.738) 50.394 23.305 ( -13.664 16.482 -7.280) 22.613 23.627 ( 30.439 11.621 -7.600) 33.457 27.052 ( -8.481 2.849 3.341) 9.550 28.403 ( 1.299 -22.212 28.915) 36.485 ======================= Grid point 428 (189/429) ======================= q-point: (-0.07 0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( -0.274 26.676 19.971) 33.324 2.238 ( -3.123 25.962 26.605) 37.304 3.481 ( 3.761 33.686 29.475) 44.918 3.953 ( -4.542 5.864 -7.295) 10.404 4.247 ( 1.794 7.033 -11.324) 13.450 4.335 ( -0.679 29.992 9.812) 31.564 4.791 ( 4.067 4.654 9.865) 11.641 5.451 ( 1.910 23.850 -12.094) 26.809 5.880 ( -1.733 16.922 7.455) 18.573 6.431 ( 0.442 -2.078 -1.405) 2.547 6.606 ( -0.793 -3.088 -7.277) 7.945 6.968 ( -5.147 -5.422 -4.566) 8.760 7.244 ( 9.495 4.875 8.506) 13.648 7.778 ( -9.445 10.287 8.029) 16.109 7.924 ( 13.493 0.693 -6.239) 14.881 8.327 ( 3.762 4.047 -21.360) 22.063 8.612 ( -0.412 9.914 -6.743) 11.997 8.803 ( 0.145 14.173 1.764) 14.283 9.276 ( -15.165 3.348 -4.967) 16.305 9.396 ( -5.270 16.834 -8.648) 19.645 10.335 ( 3.808 -3.214 5.800) 7.646 11.618 ( -5.653 -16.957 3.442) 18.203 11.797 ( -8.201 -23.785 8.713) 26.626 12.498 ( -0.254 -9.715 8.247) 12.746 12.618 ( 21.530 -37.055 9.010) 43.792 13.266 ( -16.393 -7.894 1.714) 18.275 13.584 ( 5.713 -8.304 -0.280) 10.084 13.677 ( 6.836 -16.284 4.757) 18.290 16.489 ( 16.460 51.012 -18.418) 56.677 17.981 ( -34.191 34.807 2.616) 48.860 20.160 ( 3.161 -0.725 -1.271) 3.484 20.868 ( 1.889 50.512 -51.599) 72.232 22.939 ( -11.325 12.134 -0.644) 16.611 23.615 ( 40.398 8.986 -12.273) 43.167 26.975 ( -8.079 1.113 4.188) 9.168 28.950 ( -0.627 -29.779 25.458) 39.183 ======================= Grid point 431 (190/429) ======================= q-point: ( 0.14 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 12.498 -0.000 20.707) 24.186 1.862 ( 34.069 -0.000 23.050) 41.134 3.091 ( -0.357 0.000 -3.302) 3.321 3.542 ( 13.207 -0.000 53.055) 54.675 3.974 ( 2.210 -0.000 -11.119) 11.337 4.408 ( 13.310 -0.000 -4.081) 13.922 4.471 ( -0.651 0.000 -3.431) 3.492 5.155 ( 7.739 -0.000 3.648) 8.555 5.451 ( -0.195 0.000 2.232) 2.240 6.361 ( -5.989 0.000 0.324) 5.998 6.478 ( 2.306 -0.000 -8.189) 8.508 7.412 ( -2.047 0.000 -2.268) 3.055 7.629 ( -11.552 0.000 -9.534) 14.978 7.672 ( 3.137 -0.000 5.647) 6.459 7.785 ( -2.682 0.000 1.849) 3.258 7.973 ( 10.537 -0.000 -17.711) 20.608 8.369 ( 5.147 -0.000 -9.765) 11.038 8.617 ( 2.610 -0.000 2.672) 3.735 8.665 ( -9.353 0.000 2.689) 9.732 8.942 ( -9.844 0.000 -2.703) 10.209 10.501 ( -2.710 0.000 4.932) 5.627 11.957 ( -2.509 0.000 4.697) 5.325 12.436 ( -18.354 0.000 4.226) 18.834 12.686 ( -16.123 0.000 12.817) 20.596 13.242 ( 0.808 -0.000 -3.774) 3.860 13.837 ( -4.939 0.000 0.179) 4.942 14.090 ( 0.613 -0.000 -4.379) 4.421 14.332 ( 15.535 -0.000 -1.039) 15.569 15.459 ( 25.987 -0.000 -4.197) 26.324 15.887 ( -1.091 0.000 2.738) 2.947 19.161 ( -0.719 0.000 2.254) 2.366 20.187 ( 0.585 -0.000 -1.843) 1.933 22.551 ( -7.823 0.000 -5.327) 9.464 24.308 ( 39.317 -0.000 -29.849) 49.364 26.850 ( -5.812 0.000 7.052) 9.138 29.487 ( -25.610 0.000 10.152) 27.549 ======================= Grid point 432 (191/429) ======================= q-point: ( 0.21 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( 15.746 -14.417 16.654) 27.077 2.209 ( 21.354 -15.104 24.922) 36.128 3.414 ( 0.768 -27.732 -3.503) 27.963 3.823 ( 22.267 -11.311 30.990) 39.802 3.976 ( -5.693 -3.575 -13.124) 14.746 4.360 ( 12.261 -1.857 12.525) 17.625 4.774 ( 5.392 -15.328 -5.305) 17.093 5.245 ( 7.306 -6.200 2.728) 9.963 5.595 ( -0.499 -13.635 3.111) 13.994 6.357 ( -3.971 -3.693 0.530) 5.449 6.504 ( 1.224 -2.546 -8.683) 9.131 7.105 ( -7.020 27.180 1.010) 28.090 7.421 ( -3.975 -1.394 -0.542) 4.247 7.632 ( 3.794 6.132 0.014) 7.211 7.979 ( 0.351 -12.068 -14.714) 19.034 8.137 ( -6.754 -10.090 -17.434) 21.245 8.374 ( 4.007 0.317 -3.368) 5.244 8.673 ( -1.666 -2.779 7.572) 8.236 8.795 ( 0.417 -16.502 1.394) 16.566 8.917 ( -7.395 -4.259 -2.681) 8.945 10.462 ( -4.308 2.821 5.707) 7.687 11.736 ( -34.515 15.698 19.542) 42.657 12.136 ( 15.166 21.982 -2.818) 26.854 12.588 ( -6.956 4.319 6.843) 10.671 13.045 ( -2.644 11.194 -5.157) 12.605 13.584 ( 2.573 17.539 0.685) 17.740 13.990 ( 10.663 11.373 1.030) 15.624 14.671 ( 13.297 11.727 7.393) 19.209 15.562 ( 7.837 -29.850 -27.376) 41.253 16.422 ( -9.843 -43.523 12.424) 46.319 19.613 ( -2.780 -38.392 -3.255) 38.630 20.256 ( 5.361 -9.633 -5.928) 12.517 22.517 ( -8.160 -2.270 -6.074) 10.423 24.464 ( 33.243 -0.479 -31.219) 45.607 26.833 ( -5.142 -0.109 8.497) 9.932 29.209 ( -23.665 14.769 15.653) 31.987 ======================= Grid point 433 (192/429) ======================= q-point: ( 0.29 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.225 ( 17.229 -19.931 13.244) 29.487 2.688 ( 9.524 -19.780 24.606) 32.976 3.798 ( -0.033 -12.958 -6.223) 14.375 3.967 ( -8.375 -4.952 -9.360) 13.501 4.433 ( 30.419 -28.737 0.943) 41.857 4.672 ( 3.486 -17.886 24.410) 30.461 4.956 ( 4.174 -3.327 0.626) 5.374 5.507 ( 3.200 -15.646 -1.350) 16.027 5.878 ( 1.581 -12.941 4.815) 13.898 6.336 ( -6.010 12.617 -2.564) 14.208 6.613 ( -4.132 -14.914 -3.348) 15.834 6.732 ( 3.333 4.393 1.653) 5.757 7.412 ( -2.802 -1.381 0.398) 3.150 7.594 ( -1.490 -1.746 -1.458) 2.719 8.129 ( -3.873 -8.274 -22.381) 24.173 8.269 ( -1.920 -12.563 -15.415) 19.978 8.411 ( 7.293 -2.573 1.667) 7.911 8.760 ( -4.324 -6.661 8.827) 11.874 8.937 ( -3.893 -6.382 0.376) 7.485 9.226 ( -1.759 -23.470 -2.476) 23.666 10.374 ( -5.775 4.635 6.967) 10.168 11.252 ( -24.134 17.540 20.788) 36.363 11.853 ( 12.736 18.291 -5.638) 22.990 12.433 ( -5.048 10.487 5.154) 12.729 12.783 ( -1.546 17.822 -8.998) 20.024 13.241 ( 4.001 17.292 4.310) 18.265 13.836 ( 7.311 10.032 0.159) 12.414 14.247 ( 16.844 32.834 7.004) 37.561 16.274 ( -18.661 -45.437 -21.994) 53.820 17.304 ( -1.087 -47.191 14.141) 49.276 20.067 ( -3.976 -12.498 3.131) 13.484 20.785 ( 11.133 -39.469 -21.920) 46.500 22.526 ( -9.690 -5.556 -4.851) 12.178 24.584 ( 26.148 -0.192 -29.377) 39.329 26.835 ( -4.209 -1.412 10.072) 11.007 28.803 ( -18.123 17.943 19.122) 31.875 ======================= Grid point 434 (193/429) ======================= q-point: ( 0.36 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.729 ( 13.979 -21.014 11.241) 27.629 3.128 ( 7.256 -17.898 20.073) 27.855 3.885 ( -10.943 -4.405 -8.499) 14.539 4.115 ( 5.557 -10.491 -7.402) 13.990 4.795 ( 8.563 5.268 -7.105) 12.311 4.984 ( -11.107 -12.165 7.501) 18.101 5.236 ( 17.410 -18.124 8.723) 26.602 5.800 ( 4.375 -14.006 2.278) 14.849 5.880 ( -7.761 11.398 7.479) 15.687 6.231 ( 6.714 -7.373 2.442) 10.267 6.639 ( -9.978 -0.565 -6.736) 12.052 6.912 ( 0.656 -3.191 1.983) 3.814 7.615 ( 3.907 -15.186 -1.789) 15.782 7.709 ( -1.058 -18.402 1.516) 18.494 8.252 ( 0.201 -12.066 -19.687) 23.091 8.441 ( -1.651 -11.295 -10.200) 15.308 8.605 ( 7.776 -9.731 2.265) 12.660 8.869 ( -4.981 -5.480 6.153) 9.627 9.186 ( -2.999 -24.811 -3.602) 25.250 9.634 ( -4.036 -22.144 -0.837) 22.525 10.253 ( -7.144 5.261 6.542) 11.023 10.919 ( -5.803 13.389 16.012) 21.664 11.527 ( -4.411 18.210 -2.556) 18.910 12.138 ( 0.809 21.830 0.207) 21.846 12.357 ( 5.556 20.668 -4.595) 21.889 13.083 ( -0.801 3.416 3.710) 5.106 13.689 ( 3.767 10.210 0.604) 10.899 13.820 ( 9.543 20.444 5.030) 23.116 16.901 ( -20.037 -36.982 -13.618) 44.211 18.085 ( -0.344 -31.971 12.083) 34.180 20.249 ( 3.316 -7.973 3.393) 9.278 21.473 ( 11.426 -28.470 -25.049) 39.605 22.619 ( -11.533 -12.176 -1.981) 16.888 24.659 ( 19.410 0.762 -24.280) 31.094 26.881 ( -3.011 -3.709 10.938) 11.936 28.432 ( -13.008 15.604 17.904) 27.079 ======================= Grid point 435 (194/429) ======================= q-point: ( 0.43 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.180 ( 9.065 -17.432 9.835) 21.972 3.517 ( 6.020 -15.787 15.281) 22.781 3.882 ( -12.968 -4.445 -7.896) 15.820 4.289 ( 6.185 -4.114 -7.325) 10.432 4.647 ( 4.415 10.046 -6.240) 12.624 5.007 ( -21.508 -1.887 5.078) 22.180 5.354 ( 5.241 10.714 -3.066) 12.316 5.860 ( 0.401 -7.929 11.544) 14.010 6.118 ( 13.816 -9.983 7.751) 18.725 6.364 ( -2.864 -2.449 -2.655) 4.610 6.552 ( -9.192 0.923 0.077) 9.239 6.978 ( 5.668 -7.326 -0.767) 9.294 7.809 ( -0.253 -8.735 6.046) 10.626 8.107 ( -1.560 -15.770 -11.358) 19.497 8.446 ( 6.953 -6.371 -13.436) 16.415 8.720 ( 3.607 -6.471 0.433) 7.420 8.933 ( 1.337 -28.796 -2.409) 28.928 8.963 ( -5.887 -14.082 4.205) 15.832 9.698 ( 1.689 -24.805 -3.526) 25.111 9.950 ( -12.968 -9.948 1.077) 16.379 10.259 ( 1.846 -17.289 2.195) 17.525 10.697 ( 4.844 13.332 6.247) 15.500 11.176 ( -13.945 12.042 7.724) 19.978 11.691 ( -1.623 21.478 1.069) 21.566 12.126 ( 12.554 11.519 -4.110) 17.526 13.046 ( -4.932 0.705 2.399) 5.530 13.474 ( 4.020 12.968 3.906) 14.128 13.625 ( 2.591 7.306 0.705) 7.784 17.394 ( -15.100 -28.836 -7.892) 33.494 18.527 ( -2.706 -14.981 8.548) 17.459 20.411 ( 7.058 -4.909 2.996) 9.105 21.849 ( 10.466 -10.667 -22.830) 27.286 22.852 ( -9.589 -18.458 -0.305) 20.803 24.681 ( 13.293 2.801 -17.326) 22.017 26.977 ( -1.821 -5.578 10.872) 12.354 28.139 ( -9.086 12.251 14.284) 20.896 ======================= Grid point 436 (195/429) ======================= q-point: ( 0.50 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.498 ( 3.922 -9.923 8.109) 13.402 3.780 ( -8.382 -7.380 4.444) 12.019 3.916 ( -2.641 -7.556 -0.354) 8.012 4.279 ( -0.568 3.609 -6.904) 7.811 4.510 ( 3.123 5.831 -0.039) 6.615 4.940 ( -9.474 -1.450 -4.792) 10.715 5.166 ( -1.082 8.799 10.645) 13.853 5.998 ( 3.585 -3.196 5.903) 7.610 6.186 ( -2.101 7.790 4.710) 9.342 6.326 ( -5.790 -3.734 -10.816) 12.824 6.650 ( 6.885 -7.681 7.402) 12.696 7.221 ( 6.790 -11.977 1.330) 13.832 7.955 ( -1.405 -4.665 12.617) 13.525 8.285 ( -5.095 -8.633 -14.884) 17.945 8.520 ( 4.734 0.002 -7.913) 9.220 8.793 ( 2.193 -4.167 -3.887) 6.106 9.096 ( -1.925 -9.677 -1.059) 9.923 9.560 ( 1.380 -18.937 -0.331) 18.990 10.034 ( -4.101 -16.912 -2.434) 17.572 10.058 ( 5.273 -8.654 -5.396) 11.481 10.476 ( -2.252 9.746 0.890) 10.043 10.788 ( -2.310 -26.406 6.959) 27.405 11.005 ( -3.019 1.340 12.469) 12.899 11.415 ( -8.050 3.976 5.069) 10.310 11.991 ( 13.064 10.540 -4.590) 17.403 12.967 ( -6.419 4.961 2.138) 8.390 13.332 ( 2.078 4.356 2.890) 5.625 13.524 ( 0.432 4.756 0.161) 4.778 17.794 ( -9.310 -22.878 -4.042) 25.028 18.693 ( -2.809 -4.364 4.706) 7.006 20.505 ( 6.306 -0.286 2.500) 6.790 21.970 ( 7.666 -2.374 -19.402) 20.996 23.143 ( -5.100 -15.918 0.186) 16.716 24.639 ( 7.843 5.371 -10.732) 14.336 27.099 ( -1.151 -5.951 10.359) 12.002 27.915 ( -6.328 9.643 10.394) 15.526 ======================= Grid point 437 (196/429) ======================= q-point: ( 0.57 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.583 ( -5.022 1.385 3.442) 6.243 3.820 ( -8.743 -4.587 -3.674) 10.535 4.004 ( 1.780 1.506 9.005) 9.302 4.217 ( -2.259 -0.090 -0.886) 2.429 4.518 ( 1.284 -5.069 3.218) 6.140 4.891 ( 0.753 2.312 -4.020) 4.698 5.104 ( -2.040 0.330 12.769) 12.935 5.975 ( -13.581 1.755 -7.297) 15.517 6.128 ( 14.722 1.861 9.117) 17.416 6.351 ( -6.589 -3.666 -6.240) 9.787 6.809 ( 8.144 -2.287 5.279) 9.972 7.442 ( 2.485 -7.729 2.526) 8.502 7.974 ( -5.553 3.903 11.536) 13.385 8.347 ( -4.589 -5.949 -8.156) 11.089 8.527 ( 6.974 0.530 -2.913) 7.577 8.919 ( 4.554 -7.833 -12.452) 15.399 9.276 ( 0.067 -9.810 -2.905) 10.231 9.706 ( -2.301 -2.447 -6.066) 6.934 10.043 ( 1.370 9.910 -10.220) 14.302 10.245 ( 9.170 -4.024 6.252) 11.805 10.528 ( -9.431 -13.565 -2.058) 16.649 11.010 ( -7.921 -0.386 13.954) 16.050 11.116 ( 4.806 -6.910 13.108) 15.578 11.514 ( -7.032 -13.265 0.464) 15.020 11.866 ( 7.766 7.581 -0.803) 10.882 12.842 ( -4.043 4.210 2.381) 6.304 13.312 ( -0.001 -0.005 1.631) 1.631 13.451 ( 0.090 3.214 -0.014) 3.216 18.139 ( -4.306 -18.785 -1.524) 19.333 18.710 ( -0.913 1.464 1.194) 2.098 20.506 ( 2.929 3.123 2.334) 4.876 21.990 ( 6.181 0.175 -17.977) 19.011 23.374 ( -1.825 -10.795 0.985) 10.993 24.534 ( 3.393 7.416 -5.877) 10.052 27.217 ( -1.322 -5.363 9.887) 11.325 27.740 ( -4.486 7.558 7.655) 11.656 ======================= Grid point 438 (197/429) ======================= q-point: (-0.36 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.477 ( -7.205 5.679 2.712) 9.567 3.794 ( 2.825 5.632 0.107) 6.302 3.945 ( 0.665 5.805 8.517) 10.329 4.303 ( -5.151 -10.915 7.414) 14.165 4.615 ( 0.615 -1.981 2.911) 3.575 4.927 ( 0.619 -5.564 -3.608) 6.661 5.112 ( 0.703 -0.098 7.028) 7.064 5.880 ( -12.486 -1.214 -4.926) 13.478 6.209 ( 15.313 0.722 1.736) 15.428 6.353 ( -8.518 -1.637 0.859) 8.716 6.835 ( 6.794 4.621 2.707) 8.651 7.540 ( -0.985 -1.698 2.328) 3.045 7.821 ( -9.018 7.748 6.689) 13.642 8.452 ( -1.154 -5.120 -5.970) 7.950 8.593 ( 10.334 -5.009 2.731) 11.804 9.063 ( 4.424 -6.874 -14.790) 16.899 9.403 ( 4.062 -1.298 -6.244) 7.561 9.655 ( -4.258 2.166 -9.247) 10.409 9.886 ( 3.427 6.202 -2.883) 7.650 10.367 ( -0.365 -2.069 4.050) 4.562 10.604 ( -8.372 -1.735 5.887) 10.381 10.931 ( 2.023 4.695 -3.926) 6.446 11.258 ( 1.949 -0.676 20.358) 20.462 11.616 ( -8.027 -1.882 -1.311) 8.348 11.793 ( 1.040 5.520 4.844) 7.418 12.802 ( -0.616 -1.097 2.999) 3.252 13.314 ( -1.260 0.051 1.815) 2.211 13.404 ( 1.167 2.173 -0.130) 2.470 18.440 ( -1.306 -14.559 0.082) 14.618 18.650 ( 2.155 4.513 -1.919) 5.357 20.440 ( -1.178 4.692 2.661) 5.521 21.979 ( 5.769 0.875 -18.396) 19.299 23.538 ( 0.414 -7.126 1.075) 7.219 24.385 ( 0.502 8.717 -2.941) 9.213 27.310 ( -2.932 -3.220 8.687) 9.718 27.622 ( -2.493 3.615 7.878) 9.019 ======================= Grid point 439 (198/429) ======================= q-point: (-0.29 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.302 ( -2.941 11.047 7.776) 13.826 3.623 ( 1.500 14.496 8.081) 16.664 3.918 ( 5.006 -0.672 5.638) 7.570 4.525 ( 0.084 -6.802 10.861) 12.815 4.635 ( -5.204 -6.189 -1.951) 8.318 4.908 ( -0.294 7.415 -3.839) 8.355 5.265 ( 4.399 -13.090 -1.842) 13.931 5.844 ( -11.784 -1.678 3.634) 12.445 6.207 ( -3.271 3.900 -7.310) 8.908 6.366 ( 6.311 -0.595 6.894) 9.366 6.752 ( 6.742 7.764 0.388) 10.290 7.497 ( -3.203 5.093 0.554) 6.042 7.668 ( -7.682 3.921 7.095) 11.168 8.465 ( 0.897 0.925 -7.360) 7.472 8.831 ( 8.922 -9.717 5.051) 14.126 9.115 ( 3.622 3.493 -15.619) 16.410 9.345 ( 8.729 7.637 -6.977) 13.536 9.607 ( -5.029 -1.739 -4.247) 6.809 9.797 ( 1.178 5.962 -5.421) 8.144 10.202 ( -11.789 9.604 7.867) 17.120 10.753 ( 2.520 -12.188 5.606) 13.650 10.815 ( 3.139 10.460 -10.588) 15.211 11.241 ( -1.049 7.075 20.065) 21.302 11.462 ( -2.176 13.871 0.837) 14.066 11.702 ( -5.837 1.217 3.800) 7.071 12.879 ( 1.387 -5.630 4.672) 7.447 13.297 ( -2.384 0.973 1.583) 3.023 13.378 ( 2.422 1.843 1.197) 3.271 18.493 ( 2.901 8.418 -4.640) 10.041 18.723 ( 1.412 -10.025 1.311) 10.208 20.336 ( -4.395 5.086 3.157) 7.427 21.958 ( 6.043 1.210 -20.350) 21.263 23.652 ( 1.418 -4.246 -0.678) 4.528 24.206 ( 0.397 10.063 -1.580) 10.194 27.303 ( -5.793 2.507 4.869) 7.973 27.644 ( 0.004 -4.691 13.326) 14.128 ======================= Grid point 440 (199/429) ======================= q-point: (-0.21 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.057 ( 0.239 16.515 12.845) 20.924 3.330 ( 0.420 18.919 14.185) 23.650 4.028 ( 7.410 -5.512 5.284) 10.640 4.484 ( -0.610 6.193 0.312) 6.231 4.681 ( -5.211 10.989 -6.672) 13.872 4.883 ( -0.086 -12.710 3.663) 13.228 5.484 ( 4.754 -1.812 3.505) 6.178 5.822 ( -6.724 -1.548 6.866) 9.734 6.080 ( -9.103 0.568 -9.676) 13.297 6.415 ( 6.135 1.179 0.113) 6.248 6.642 ( 6.599 7.651 -2.216) 10.344 7.344 ( -2.941 8.852 1.435) 9.437 7.617 ( -4.684 -0.793 6.925) 8.398 8.414 ( 2.543 4.728 -3.822) 6.590 8.869 ( -0.259 11.779 -7.524) 13.980 8.939 ( 3.900 17.832 -5.083) 18.948 9.154 ( 4.171 10.291 -2.037) 11.289 9.600 ( -0.355 12.596 0.628) 12.617 9.778 ( -3.775 -18.664 -7.055) 20.307 10.079 ( -5.630 1.612 1.169) 5.972 10.505 ( 3.532 20.546 -5.782) 21.635 10.774 ( 3.730 23.351 1.259) 23.681 11.195 ( -7.254 -16.912 4.865) 19.035 11.357 ( 4.048 -1.335 12.349) 13.064 11.703 ( -4.294 -3.683 3.247) 6.523 13.020 ( 1.763 -6.560 6.621) 9.486 13.262 ( -3.852 0.614 -0.038) 3.900 13.373 ( 3.515 0.767 3.350) 4.915 18.282 ( 5.916 15.555 -8.142) 18.527 18.863 ( -3.000 -3.467 4.003) 6.087 20.224 ( -4.714 4.255 3.094) 7.064 21.920 ( 6.793 2.741 -24.262) 25.344 23.680 ( -4.484 1.604 -4.351) 6.451 24.026 ( 9.128 10.365 -1.866) 13.937 27.202 ( -6.862 4.528 3.439) 8.912 27.818 ( 0.222 -10.252 18.774) 21.392 ======================= Grid point 441 (200/429) ======================= q-point: (-0.14 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.718 ( 1.512 23.337 15.091) 27.833 3.002 ( 0.507 19.166 21.141) 28.539 4.187 ( 8.275 -3.420 6.582) 11.113 4.334 ( -0.289 9.951 -3.761) 10.642 4.421 ( -4.846 9.238 -9.559) 14.150 4.992 ( 3.030 8.594 7.374) 11.722 5.394 ( -4.302 7.381 16.966) 18.996 5.769 ( 3.056 5.963 -4.670) 8.167 6.165 ( -9.063 -13.448 -8.399) 18.263 6.353 ( -3.653 6.692 -5.510) 9.407 6.545 ( 9.855 6.124 -4.994) 12.632 7.172 ( 1.798 8.686 3.714) 9.616 7.665 ( -3.437 -4.889 5.428) 8.073 8.261 ( 9.821 21.219 0.916) 23.399 8.381 ( -6.918 27.292 6.990) 29.010 8.618 ( 0.880 11.885 -19.608) 22.945 8.996 ( -1.324 10.881 -1.804) 11.108 9.369 ( -7.018 8.436 -3.395) 11.487 9.752 ( -1.017 24.721 -7.061) 25.730 10.056 ( 1.791 9.411 -2.449) 9.888 10.279 ( 2.054 3.087 2.885) 4.698 10.546 ( -1.201 -15.751 -1.440) 15.862 11.491 ( -3.957 -11.152 0.263) 11.837 11.563 ( 3.239 -16.291 10.123) 19.452 11.857 ( 0.875 -15.451 6.701) 16.864 13.124 ( -1.263 -1.734 6.136) 6.500 13.272 ( -2.408 -5.233 0.877) 5.827 13.413 ( 4.989 -2.004 3.698) 6.525 17.931 ( 8.202 24.857 -11.836) 28.727 18.783 ( -12.976 9.405 7.537) 17.709 20.154 ( -1.289 1.528 1.767) 2.668 21.815 ( 7.504 8.508 -31.380) 33.368 23.476 ( -15.261 12.224 -4.366) 20.035 23.956 ( 24.676 7.410 -7.650) 26.876 27.082 ( -7.384 4.443 3.722) 9.387 28.099 ( -0.700 -15.827 23.736) 28.537 ======================= Grid point 442 (201/429) ======================= q-point: (-0.07 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.270 ( 2.956 28.017 16.638) 32.719 2.694 ( 0.737 19.582 26.456) 32.923 4.090 ( -3.273 11.493 -6.526) 13.616 4.116 ( 8.234 18.694 7.203) 21.660 4.317 ( 1.981 5.183 -5.322) 7.689 4.747 ( 5.073 13.432 14.774) 20.602 5.132 ( -1.281 23.130 7.730) 24.421 5.719 ( 2.401 4.380 -4.999) 7.067 6.119 ( -8.642 11.084 0.021) 14.055 6.330 ( -9.659 -11.765 -8.149) 17.266 6.513 ( 12.153 3.725 -3.059) 13.074 7.055 ( 3.052 7.635 0.730) 8.255 7.585 ( -0.569 24.163 -1.753) 24.233 7.812 ( -5.342 2.659 8.288) 10.213 8.110 ( 8.399 11.944 7.470) 16.401 8.415 ( 2.502 7.128 -22.185) 23.436 8.759 ( -3.724 10.638 -5.871) 12.708 9.134 ( -7.681 16.315 -2.906) 18.266 9.288 ( -2.475 13.365 -8.559) 16.063 9.732 ( -1.838 19.764 -2.745) 20.039 10.303 ( 1.779 -2.467 4.726) 5.620 11.047 ( -8.507 -30.899 7.802) 32.985 11.608 ( -1.565 -5.532 -6.378) 8.586 12.046 ( 10.498 -30.809 12.932) 35.024 12.239 ( -0.828 -19.837 4.722) 20.408 13.124 ( -7.179 -1.359 2.669) 7.778 13.441 ( 5.240 -11.386 3.427) 12.994 13.517 ( 5.705 -5.102 3.473) 8.405 17.378 ( 10.196 37.502 -16.501) 42.221 18.371 ( -25.090 24.883 9.527) 36.598 20.152 ( 0.945 -0.516 0.290) 1.115 21.500 ( 6.948 24.895 -40.855) 48.344 23.108 ( -16.576 14.766 -0.966) 22.220 23.964 ( 33.668 7.263 -15.073) 37.597 26.976 ( -7.463 2.998 4.717) 9.324 28.494 ( -3.267 -22.569 26.301) 34.810 ======================= Grid point 446 (202/429) ======================= q-point: ( 0.21 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.720 ( 14.193 -0.000 18.343) 23.192 2.325 ( 30.749 -0.000 25.179) 39.743 3.073 ( -0.543 0.000 -3.760) 3.799 3.881 ( -8.957 0.000 -13.133) 15.896 3.931 ( 24.772 -0.000 35.139) 42.993 4.452 ( -0.538 0.000 -3.027) 3.074 4.630 ( 24.515 -0.000 3.703) 24.793 5.244 ( 5.716 -0.000 2.763) 6.349 5.453 ( -0.661 0.000 1.869) 1.983 6.299 ( -5.233 0.000 1.880) 5.560 6.474 ( 2.370 -0.000 -8.148) 8.486 7.380 ( -2.046 0.000 -2.273) 3.058 7.449 ( -13.795 0.000 -10.020) 17.050 7.721 ( 0.792 -0.000 6.511) 6.559 7.770 ( -0.247 0.000 1.029) 1.058 7.939 ( -1.766 0.000 -22.600) 22.669 8.357 ( 0.785 -0.000 -11.607) 11.634 8.549 ( -13.103 0.000 3.236) 13.497 8.737 ( 13.911 -0.000 2.226) 14.088 8.859 ( -5.259 0.000 5.680) 7.741 10.469 ( -6.091 0.000 5.931) 8.501 11.717 ( -40.720 0.000 23.024) 46.778 12.448 ( 16.436 -0.000 -10.488) 19.497 12.607 ( -6.397 0.000 8.044) 10.278 13.234 ( -0.352 0.000 -2.517) 2.542 13.796 ( -2.356 0.000 -1.540) 2.815 14.080 ( 0.365 -0.000 -4.375) 4.390 14.522 ( 17.857 -0.000 0.659) 17.870 15.707 ( 20.653 -0.000 -5.296) 21.321 15.884 ( -1.154 0.000 2.673) 2.912 19.161 ( -0.717 0.000 2.261) 2.372 20.187 ( 0.598 -0.000 -1.828) 1.924 22.443 ( -6.604 0.000 -8.585) 10.831 24.582 ( 29.926 -0.000 -33.761) 45.115 26.821 ( -4.575 0.000 9.568) 10.605 29.228 ( -27.394 0.000 14.246) 30.876 ======================= Grid point 447 (203/429) ======================= q-point: ( 0.29 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( 15.773 -16.274 14.901) 27.123 2.533 ( 19.004 -6.007 24.052) 31.236 3.407 ( 0.107 -26.473 -0.833) 26.486 3.807 ( -14.828 -2.366 -12.558) 19.574 4.208 ( 29.725 -10.066 6.696) 32.090 4.540 ( 8.776 -8.538 16.594) 20.622 4.879 ( 15.454 -8.061 2.132) 17.560 5.321 ( 3.881 -5.771 2.877) 7.526 5.603 ( 0.552 -14.439 1.794) 14.560 6.321 ( -3.029 -4.856 2.263) 6.155 6.487 ( 1.464 -1.090 -7.911) 8.119 7.027 ( -7.530 23.075 1.339) 24.309 7.376 ( -3.198 -0.790 -1.565) 3.646 7.651 ( 0.768 7.209 -4.733) 8.658 7.890 ( -6.915 -9.632 -13.870) 18.248 8.013 ( -2.087 -10.218 -16.145) 19.220 8.395 ( 0.708 -2.491 1.099) 2.813 8.598 ( -12.476 -11.035 0.156) 16.656 8.863 ( -3.145 -1.664 6.653) 7.545 8.892 ( 12.770 -9.401 0.665) 15.871 10.420 ( -7.075 2.462 7.288) 10.452 11.399 ( -36.215 11.907 23.761) 44.921 12.329 ( 18.152 19.550 -8.931) 28.133 12.543 ( -3.158 4.647 6.025) 8.238 13.002 ( -1.923 13.198 -5.164) 14.302 13.603 ( 1.139 14.860 -1.480) 14.977 14.119 ( 11.515 11.842 0.490) 16.525 14.791 ( 4.267 -8.390 3.565) 10.065 15.549 ( 4.128 4.177 -15.626) 16.693 16.421 ( 2.226 -46.370 8.462) 47.188 19.575 ( -3.174 -34.335 0.661) 34.487 20.293 ( 5.267 -13.483 -6.531) 15.880 22.405 ( -6.363 -1.695 -9.148) 11.272 24.673 ( 25.006 0.292 -33.837) 42.075 26.818 ( -3.853 -0.288 11.122) 11.774 28.993 ( -24.442 10.834 16.433) 31.382 ======================= Grid point 448 (204/429) ======================= q-point: ( 0.36 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( 18.247 -18.703 11.103) 28.391 2.882 ( 9.265 -16.221 21.419) 28.421 3.711 ( -13.580 -5.550 -7.482) 16.468 3.872 ( -0.467 -16.368 -5.527) 17.283 4.667 ( 8.955 -19.306 -6.688) 22.308 4.824 ( 15.691 -8.368 -1.205) 17.824 5.079 ( 11.779 -7.643 21.222) 25.447 5.531 ( 1.193 -14.208 3.445) 14.668 5.920 ( 3.004 -14.138 1.077) 14.494 6.256 ( -7.810 13.027 1.863) 15.303 6.546 ( -2.429 -4.824 -3.796) 6.602 6.812 ( 6.253 -5.717 6.148) 10.468 7.387 ( -0.762 -4.757 -1.348) 5.002 7.562 ( -2.422 -0.267 -4.957) 5.524 7.964 ( -8.743 -9.511 -22.013) 25.524 8.232 ( 4.099 -13.055 -15.476) 20.658 8.482 ( 2.645 -7.570 5.814) 9.905 8.722 ( -7.529 -7.972 4.146) 11.723 8.903 ( -2.859 -4.037 3.655) 6.150 9.230 ( 3.848 -19.372 -1.007) 19.777 10.321 ( -8.638 4.957 9.291) 13.620 11.067 ( -21.461 8.620 20.990) 31.233 11.961 ( 9.084 25.716 -6.036) 27.933 12.425 ( 1.821 8.778 2.995) 9.452 12.728 ( -2.355 16.161 -9.526) 18.907 13.289 ( 2.351 16.892 2.123) 17.187 13.914 ( 6.465 12.991 -0.821) 14.534 14.446 ( 13.193 35.870 6.873) 38.832 15.977 ( -20.433 -43.983 -14.279) 50.556 17.383 ( 6.022 -46.281 10.389) 47.814 20.039 ( -3.785 -16.688 5.110) 17.859 20.836 ( 10.773 -37.716 -18.392) 43.322 22.406 ( -7.352 -4.515 -7.642) 11.526 24.732 ( 19.773 0.611 -31.075) 36.837 26.837 ( -2.892 -1.673 12.574) 13.011 28.657 ( -18.969 14.074 17.212) 29.226 ======================= Grid point 449 (205/429) ======================= q-point: ( 0.43 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( 15.026 -17.539 8.683) 24.674 3.275 ( 6.708 -16.720 16.405) 24.366 3.700 ( -16.214 -5.156 -6.359) 18.164 4.167 ( 7.815 -12.735 -7.590) 16.759 4.763 ( -9.880 2.208 -1.900) 10.300 4.929 ( 1.254 2.071 -4.911) 5.476 5.438 ( 12.842 -10.176 -1.169) 16.426 5.826 ( -4.812 3.355 7.191) 9.280 5.914 ( 7.995 -13.027 13.773) 20.575 6.238 ( -7.586 -7.273 0.481) 10.520 6.566 ( 2.926 -0.450 0.769) 3.059 6.948 ( 3.743 -0.209 1.598) 4.076 7.622 ( -2.298 -9.293 -2.308) 9.847 7.734 ( 6.077 -24.131 -2.235) 24.985 8.161 ( -4.156 -24.005 -16.120) 29.212 8.404 ( 3.120 -7.100 -12.132) 14.399 8.700 ( 6.853 -6.222 1.990) 9.468 8.848 ( -3.566 -6.138 8.372) 10.976 9.121 ( -5.894 -27.712 -3.790) 28.584 9.600 ( -1.358 -18.443 0.332) 18.496 10.190 ( -8.437 3.904 8.117) 12.342 10.914 ( -6.802 4.430 18.627) 20.319 11.460 ( -4.681 26.888 -3.384) 27.502 12.163 ( 4.532 24.335 -4.863) 25.226 12.396 ( 4.297 12.556 -3.791) 13.802 13.081 ( -1.390 6.506 2.504) 7.108 13.719 ( 1.671 10.528 -0.473) 10.670 13.937 ( 7.417 24.164 4.852) 25.738 16.647 ( -16.608 -39.559 -9.039) 43.846 18.137 ( 1.968 -28.718 10.434) 30.618 20.297 ( 2.376 -11.336 4.595) 12.461 21.518 ( 11.774 -28.398 -22.401) 38.038 22.491 ( -8.945 -11.882 -3.654) 15.315 24.760 ( 14.568 1.383 -25.482) 29.384 26.899 ( -1.691 -3.892 13.191) 13.857 28.339 ( -13.945 12.868 15.295) 24.372 ======================= Grid point 450 (206/429) ======================= q-point: ( 0.50 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.309 ( 7.564 -13.656 6.266) 16.822 3.601 ( -3.948 -9.821 7.026) 12.705 3.725 ( -5.978 -9.232 -0.411) 11.007 4.340 ( 7.395 0.547 -8.857) 11.552 4.655 ( -0.255 2.297 -6.013) 6.442 4.811 ( -13.086 3.008 4.432) 14.140 5.373 ( -0.195 10.963 -2.386) 11.221 5.913 ( 1.994 -7.834 7.235) 10.848 6.141 ( -20.465 -2.561 -8.671) 22.373 6.343 ( 15.116 -4.917 12.764) 20.386 6.602 ( 7.311 -1.124 8.764) 11.468 7.052 ( 7.456 -9.057 -1.943) 11.891 7.806 ( -4.122 -11.011 5.981) 13.191 8.049 ( -0.305 -11.593 -14.275) 18.392 8.482 ( 7.464 -4.218 -12.590) 15.231 8.734 ( -0.788 -9.075 -2.285) 9.391 8.936 ( -1.354 -25.499 6.476) 26.343 8.956 ( 3.234 -17.790 -1.194) 18.121 9.704 ( 1.419 -28.129 -3.504) 28.382 9.821 ( -10.039 -7.663 2.985) 12.977 10.274 ( -0.698 -19.540 2.390) 19.698 10.773 ( 4.655 17.260 3.908) 18.299 11.040 ( -15.950 6.284 12.900) 21.455 11.685 ( 0.964 23.944 -2.617) 24.106 12.247 ( 11.121 9.593 -4.111) 15.251 12.992 ( -5.634 2.489 1.048) 6.248 13.514 ( 0.734 11.815 2.973) 12.205 13.656 ( 2.483 10.235 0.632) 10.551 17.222 ( -10.456 -31.602 -5.200) 33.691 18.534 ( -1.390 -12.926 7.835) 15.179 20.493 ( 4.987 -5.846 3.685) 8.523 21.884 ( 9.983 -9.355 -21.932) 25.849 22.758 ( -6.412 -20.481 -0.822) 21.477 24.745 ( 9.400 3.378 -18.235) 20.791 27.007 ( -0.581 -5.461 12.808) 13.935 28.078 ( -10.081 10.440 11.926) 18.784 ======================= Grid point 451 (207/429) ======================= q-point: ( 0.57 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.530 ( -4.552 -4.403 3.932) 7.455 3.615 ( -13.409 -6.442 -4.325) 15.492 3.964 ( 4.200 -9.149 7.015) 12.270 4.262 ( 1.602 4.227 -5.283) 6.953 4.559 ( 4.536 7.243 4.697) 9.752 4.843 ( -4.013 -7.334 -5.212) 9.851 5.192 ( -1.107 7.451 8.058) 11.030 5.916 ( -15.485 2.649 -9.614) 18.418 6.139 ( -4.400 -7.005 8.588) 11.924 6.376 ( 12.596 6.408 -0.148) 14.133 6.791 ( 10.096 -6.828 10.428) 16.040 7.287 ( 3.959 -10.674 0.116) 11.385 7.961 ( -4.996 -4.985 9.988) 12.230 8.182 ( -3.646 -7.227 -11.227) 13.841 8.551 ( 6.214 -1.440 -9.834) 11.722 8.804 ( 2.187 -4.410 -5.303) 7.236 9.093 ( 1.318 -8.932 1.833) 9.213 9.570 ( 1.410 -15.294 -2.940) 15.638 9.962 ( -5.333 -20.229 -3.499) 21.211 10.090 ( 3.042 -10.362 -4.557) 11.722 10.452 ( -3.025 9.496 1.774) 10.123 10.796 ( -1.054 -24.082 8.046) 25.413 11.016 ( -4.769 -4.997 16.697) 18.069 11.354 ( -4.287 7.717 0.353) 8.835 12.111 ( 10.675 11.266 -4.102) 16.053 12.898 ( -6.443 4.027 0.851) 7.645 13.356 ( 0.119 5.263 2.819) 5.972 13.527 ( 0.141 5.219 -0.421) 5.238 17.700 ( -4.973 -25.124 -2.547) 25.737 18.683 ( -1.962 -3.891 4.403) 6.195 20.574 ( 4.004 0.543 2.885) 4.966 21.981 ( 6.864 -1.726 -19.138) 20.405 23.101 ( -2.294 -17.399 -0.153) 17.551 24.670 ( 4.777 5.956 -11.332) 13.664 27.132 ( -0.143 -5.429 11.933) 13.111 27.872 ( -7.299 8.412 8.555) 14.043 ======================= Grid point 452 (208/429) ======================= q-point: (-0.36 -0.79 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.454 ( -14.712 0.805 -2.366) 14.923 3.754 ( -4.349 -9.559 1.245) 10.575 4.054 ( 1.936 1.851 5.830) 6.416 4.223 ( 2.699 1.896 2.597) 4.198 4.563 ( 3.691 -3.506 6.163) 7.994 4.880 ( 0.620 0.193 -5.536) 5.574 5.145 ( 0.781 0.579 11.424) 11.465 5.772 ( -15.059 0.186 -10.101) 18.134 6.252 ( -6.241 -4.966 4.413) 9.115 6.344 ( 15.006 4.109 2.694) 15.790 6.927 ( 7.939 -0.375 5.823) 9.853 7.459 ( -0.715 -6.491 1.766) 6.765 7.916 ( -8.635 5.899 3.002) 10.880 8.303 ( -1.368 -8.404 1.224) 8.602 8.596 ( 7.467 -1.441 -5.101) 9.157 8.923 ( 3.594 -7.455 -12.348) 14.865 9.294 ( 4.499 -9.696 -0.642) 10.708 9.647 ( -2.967 0.731 -9.698) 10.168 10.015 ( 0.458 4.985 -9.053) 10.345 10.357 ( 5.162 -6.571 5.536) 10.024 10.421 ( -7.376 -7.299 0.120) 10.377 10.985 ( -6.279 -0.488 16.152) 17.336 11.212 ( 4.116 -9.270 10.846) 14.849 11.432 ( -7.090 -12.997 -1.075) 14.844 11.939 ( 5.457 10.146 -0.364) 11.526 12.805 ( -3.546 2.041 1.687) 4.426 13.312 ( -0.933 0.512 1.578) 1.903 13.452 ( 0.165 2.823 -0.305) 2.844 18.103 ( -1.111 -20.255 -0.846) 20.303 18.702 ( -1.057 0.901 1.017) 1.721 20.541 ( 1.514 4.762 2.562) 5.615 21.991 ( 5.689 0.370 -18.053) 18.932 23.365 ( -0.376 -11.636 0.784) 11.668 24.540 ( 1.602 7.845 -6.095) 10.063 27.245 ( -0.648 -4.351 11.002) 11.849 27.710 ( -5.216 6.374 6.437) 10.453 ======================= Grid point 453 (209/429) ======================= q-point: (-0.29 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.373 ( -10.092 0.501 0.508) 10.117 3.839 ( 2.184 3.373 3.774) 5.512 4.011 ( 4.638 4.146 8.389) 10.444 4.279 ( -3.310 -9.445 6.647) 12.014 4.637 ( 0.675 0.224 4.178) 4.238 4.922 ( 1.051 -4.682 -3.602) 6.000 5.153 ( 2.464 0.260 4.719) 5.330 5.712 ( -12.803 -3.483 -6.404) 14.733 6.237 ( -6.453 1.707 0.605) 6.702 6.415 ( 12.506 -0.337 5.768) 13.776 6.924 ( 6.232 5.325 2.835) 8.673 7.528 ( -2.316 -0.846 1.626) 2.953 7.732 ( -8.917 6.988 3.173) 11.765 8.425 ( -1.200 -4.077 -2.607) 4.986 8.715 ( 8.639 -7.327 2.777) 11.663 9.062 ( 4.922 -7.217 -14.262) 16.724 9.403 ( 0.100 1.883 -9.605) 9.788 9.601 ( 1.622 -2.292 -7.442) 7.954 9.913 ( 3.306 6.604 -3.343) 8.107 10.329 ( -8.602 7.215 5.467) 12.487 10.569 ( -1.242 -9.474 4.023) 10.368 10.950 ( 2.090 3.928 0.975) 4.555 11.352 ( 1.885 0.943 17.909) 18.032 11.516 ( -7.933 -1.981 -3.302) 8.818 11.820 ( 0.476 6.928 5.172) 8.659 12.805 ( -0.770 -2.889 2.878) 4.150 13.304 ( -1.507 0.376 1.769) 2.354 13.419 ( 1.223 1.306 0.008) 1.790 18.434 ( 0.224 -14.441 0.348) 14.446 18.658 ( 0.476 2.698 -2.174) 3.498 20.438 ( -0.886 6.507 2.721) 7.108 21.976 ( 5.633 0.959 -18.498) 19.360 23.542 ( -0.280 -7.465 0.961) 7.532 24.383 ( 1.032 8.607 -2.852) 9.126 27.309 ( -2.774 -0.692 8.770) 9.224 27.621 ( -2.628 1.029 7.798) 8.293 ======================= Grid point 454 (210/429) ======================= q-point: (-0.21 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.289 ( -3.201 6.059 6.951) 9.761 3.679 ( 2.303 14.363 9.986) 17.644 4.024 ( 8.653 -0.339 6.996) 11.133 4.534 ( -5.669 -16.413 4.831) 18.024 4.583 ( -1.781 4.970 2.044) 5.661 4.891 ( -0.255 7.318 -3.591) 8.156 5.313 ( 5.431 -14.199 -3.398) 15.578 5.706 ( -13.292 -3.566 1.279) 13.821 6.135 ( -5.262 5.853 2.203) 8.173 6.478 ( 8.050 1.148 1.378) 8.247 6.834 ( 6.807 8.013 0.665) 10.535 7.445 ( -5.943 5.718 -2.093) 8.509 7.630 ( -3.253 1.988 9.037) 9.808 8.446 ( 0.140 -0.239 -6.132) 6.138 8.893 ( 0.096 -4.712 -0.052) 4.713 9.126 ( 5.420 4.991 -10.600) 12.909 9.389 ( 5.040 -7.826 -11.719) 14.966 9.559 ( 0.296 10.464 -1.426) 10.565 9.807 ( 2.605 6.982 -3.433) 8.205 10.102 ( -9.550 6.885 6.095) 13.257 10.786 ( 0.147 -11.328 4.330) 12.129 10.827 ( 4.161 10.840 -6.402) 13.259 11.280 ( -4.501 11.366 16.946) 20.895 11.443 ( 0.602 5.134 -3.577) 6.287 11.675 ( -3.247 5.572 8.679) 10.813 12.905 ( 0.125 -6.745 4.699) 8.222 13.279 ( -1.716 1.775 1.527) 2.903 13.410 ( 2.108 0.799 1.531) 2.725 18.492 ( -0.078 6.776 -4.345) 8.050 18.736 ( 0.203 -9.006 0.860) 9.049 20.312 ( -1.734 6.365 2.949) 7.227 21.953 ( 6.285 1.359 -20.180) 21.180 23.636 ( -3.522 -2.901 -0.439) 4.584 24.235 ( 5.432 8.013 -1.731) 9.834 27.260 ( -5.055 4.166 5.301) 8.426 27.689 ( -0.658 -6.502 12.922) 14.480 ======================= Grid point 455 (211/429) ======================= q-point: (-0.14 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.115 ( 1.872 14.430 12.380) 19.105 3.402 ( 2.558 18.482 15.832) 24.470 4.147 ( 9.238 -5.563 5.539) 12.123 4.452 ( -4.345 6.322 -2.548) 8.083 4.591 ( -5.518 9.857 -7.011) 13.295 4.913 ( 2.495 -11.935 3.708) 12.744 5.551 ( 2.335 1.144 8.264) 8.664 5.740 ( -9.579 -12.759 -0.002) 15.955 5.984 ( -2.769 6.484 -2.703) 7.551 6.449 ( 1.083 5.156 -3.656) 6.413 6.718 ( 7.853 8.171 -1.791) 11.474 7.300 ( -5.890 5.372 -1.176) 8.058 7.620 ( 0.305 0.074 10.750) 10.755 8.423 ( 1.907 2.252 -5.091) 5.884 8.803 ( -3.224 10.503 -11.906) 16.200 8.942 ( -2.945 18.834 -0.706) 19.076 9.196 ( 4.748 16.237 -3.858) 17.351 9.578 ( -4.807 14.466 4.309) 15.842 9.754 ( 4.068 -18.909 -6.739) 20.482 10.041 ( -0.423 1.308 -2.173) 2.571 10.525 ( 2.376 17.374 -2.484) 17.711 10.810 ( 1.644 27.333 1.377) 27.417 11.123 ( -7.190 -16.741 2.460) 18.385 11.444 ( 5.146 -3.305 7.399) 9.600 11.685 ( -3.322 -5.892 8.079) 10.537 13.055 ( 0.022 -7.295 6.643) 9.866 13.229 ( -1.866 2.006 0.222) 2.748 13.424 ( 3.300 -0.445 3.095) 4.546 18.287 ( 0.197 13.789 -8.583) 16.243 18.829 ( -5.499 -0.291 4.455) 7.083 20.209 ( 0.260 4.287 2.561) 5.000 21.912 ( 7.421 3.319 -23.514) 24.880 23.568 ( -11.018 6.170 -1.958) 12.779 24.168 ( 15.678 4.679 -4.310) 16.920 27.145 ( -5.767 5.338 4.526) 9.068 27.881 ( -1.101 -11.241 17.581) 20.897 ======================= Grid point 456 (212/429) ======================= q-point: (-0.07 0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.805 ( 3.988 22.955 14.531) 27.459 3.104 ( 3.557 18.524 21.425) 28.545 4.264 ( -0.845 6.585 -1.602) 6.830 4.305 ( -3.299 5.976 -5.171) 8.563 4.385 ( 8.251 0.846 -3.112) 8.858 5.068 ( 6.284 4.949 4.610) 9.232 5.405 ( -7.261 9.251 21.847) 24.811 5.795 ( 4.457 6.173 -4.377) 8.782 6.036 ( -7.805 -13.504 -7.974) 17.517 6.271 ( -5.810 10.885 -4.032) 12.980 6.643 ( 10.271 4.079 -6.267) 12.705 7.180 ( -3.291 4.652 0.904) 5.769 7.663 ( -0.931 -1.980 8.620) 8.893 8.315 ( -7.787 28.951 3.699) 30.207 8.374 ( 9.510 14.040 -2.351) 17.120 8.563 ( 1.760 12.928 -15.730) 20.437 8.971 ( -1.457 13.002 -2.348) 13.292 9.263 ( -9.604 12.226 -1.885) 15.661 9.718 ( -0.274 22.149 -6.452) 23.071 10.093 ( 5.642 12.953 -2.263) 14.309 10.282 ( -3.605 2.475 2.385) 4.981 10.539 ( 0.558 -13.236 0.969) 13.283 11.424 ( -4.699 -14.059 -3.018) 15.128 11.661 ( 4.724 -16.663 10.405) 20.205 11.883 ( -0.681 -15.512 6.776) 16.940 13.116 ( -2.768 1.633 4.337) 5.398 13.281 ( 2.099 -8.493 2.942) 9.230 13.483 ( 4.891 -2.832 3.203) 6.496 17.932 ( -0.533 22.533 -13.499) 26.273 18.659 ( -13.263 14.764 9.235) 21.890 20.171 ( 3.033 1.463 1.461) 3.671 21.795 ( 8.635 10.229 -29.249) 32.167 23.291 ( -15.172 14.029 -1.279) 20.704 24.200 ( 23.852 3.205 -11.248) 26.565 27.022 ( -6.074 4.953 5.244) 9.430 28.160 ( -3.217 -16.118 21.699) 27.221 ======================= Grid point 461 (213/429) ======================= q-point: ( 0.29 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 12.450 -0.000 16.670) 20.806 2.735 ( 23.999 -0.000 27.435) 36.450 3.051 ( -0.656 0.000 -4.292) 4.342 3.667 ( -18.711 0.000 -12.615) 22.566 4.363 ( 33.194 -0.000 12.179) 35.358 4.438 ( -0.104 0.000 -2.685) 2.687 4.962 ( 27.917 -0.000 12.506) 30.590 5.299 ( 1.981 -0.000 2.361) 3.082 5.450 ( -1.120 0.000 1.551) 1.913 6.265 ( -2.346 0.000 4.517) 5.089 6.472 ( 2.496 -0.000 -8.130) 8.505 7.246 ( -14.643 0.000 -11.288) 18.489 7.349 ( -1.766 0.000 -2.323) 2.918 7.725 ( -2.832 0.000 5.009) 5.754 7.799 ( -7.332 0.000 -20.655) 21.918 7.799 ( 2.724 0.000 1.754) 3.240 8.306 ( -2.809 0.000 -17.709) 17.930 8.404 ( -12.768 0.000 9.021) 15.633 8.856 ( 0.263 -0.000 9.436) 9.439 8.919 ( 15.254 -0.000 1.425) 15.320 10.412 ( -8.005 0.000 7.631) 11.060 11.346 ( -38.208 0.000 25.638) 46.013 12.492 ( -3.859 0.000 -4.381) 5.838 12.692 ( 17.741 -0.000 -3.768) 18.137 13.216 ( -1.663 0.000 -0.748) 1.824 13.765 ( -1.743 0.000 -3.647) 4.042 14.067 ( 0.326 -0.000 -4.373) 4.385 14.736 ( 18.242 -0.000 2.666) 18.435 15.880 ( -1.160 0.000 2.603) 2.850 15.891 ( 15.607 -0.000 -5.891) 16.682 19.162 ( -0.719 0.000 2.269) 2.380 20.187 ( 0.610 -0.000 -1.812) 1.912 22.342 ( -4.494 0.000 -11.251) 12.115 24.747 ( 21.999 -0.000 -35.805) 42.023 26.817 ( -3.412 0.000 12.341) 12.804 28.977 ( -26.125 0.000 15.521) 30.388 ======================= Grid point 462 (214/429) ======================= q-point: ( 0.36 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 11.860 -18.173 14.169) 25.917 2.805 ( 14.687 -1.210 18.250) 23.457 3.414 ( -0.686 -23.209 3.290) 23.451 3.563 ( -18.661 -5.052 -10.137) 21.829 4.456 ( 12.294 -7.178 -5.962) 15.434 4.724 ( 19.684 -11.552 -2.738) 22.987 5.129 ( 18.837 0.077 18.534) 26.426 5.353 ( 0.012 -5.747 5.595) 8.021 5.624 ( 2.612 -15.846 0.865) 16.083 6.316 ( 0.337 -3.677 5.261) 6.427 6.482 ( 2.628 -0.991 -7.049) 7.588 6.942 ( -7.804 15.205 0.047) 17.091 7.339 ( -1.889 -0.436 -2.305) 3.012 7.606 ( -4.682 6.404 -9.715) 12.543 7.750 ( -6.728 -4.018 -14.883) 16.820 7.967 ( 0.392 -12.093 -7.061) 14.009 8.392 ( -7.896 -3.229 7.145) 11.128 8.446 ( -6.240 -15.507 -7.048) 18.141 8.883 ( 0.396 -0.329 10.906) 10.918 9.049 ( 14.463 -5.412 -1.122) 15.483 10.360 ( -8.741 2.365 9.571) 13.176 11.111 ( -29.528 6.895 23.804) 38.550 12.385 ( -1.505 10.327 -6.243) 12.161 12.640 ( 15.970 13.641 0.417) 21.007 12.956 ( -3.001 14.568 -5.127) 15.732 13.598 ( -0.383 12.856 -3.442) 13.314 14.253 ( 11.854 10.932 -0.084) 16.126 14.806 ( -1.801 -19.870 -0.756) 19.965 15.536 ( -0.833 28.800 -3.162) 28.985 16.521 ( 11.197 -49.319 2.976) 50.661 19.543 ( -3.811 -31.548 3.128) 31.931 20.328 ( 5.128 -16.691 -6.769) 18.727 22.308 ( -3.842 -1.184 -11.534) 12.214 24.790 ( 18.276 0.510 -35.321) 39.772 26.826 ( -2.775 -0.492 13.813) 14.098 28.781 ( -23.068 8.136 15.891) 29.169 ======================= Grid point 463 (215/429) ======================= q-point: ( 0.43 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.698 ( 12.471 -19.772 10.263) 25.530 3.059 ( 10.588 -13.058 15.297) 22.729 3.476 ( -21.699 -5.800 -6.185) 23.297 3.881 ( 3.055 -19.429 -1.376) 19.716 4.679 ( -1.635 -7.125 -0.978) 7.375 4.948 ( 13.733 -4.014 -22.301) 26.496 5.282 ( 5.706 -8.237 15.051) 18.081 5.596 ( 6.061 -15.965 10.385) 19.986 5.947 ( 2.488 -11.949 0.359) 12.211 6.191 ( -5.782 13.593 10.119) 17.906 6.550 ( 4.975 -3.145 -3.228) 6.712 6.902 ( 4.597 -8.956 7.686) 12.666 7.392 ( 3.149 -10.233 -2.706) 11.044 7.495 ( -6.145 -0.493 -6.146) 8.706 7.793 ( -6.521 -9.082 -21.392) 24.138 8.235 ( 5.458 -14.879 -13.120) 20.574 8.493 ( -7.393 -13.573 7.799) 17.312 8.647 ( -2.691 -8.578 -1.415) 9.101 8.908 ( -0.336 -0.676 7.990) 8.026 9.296 ( 8.119 -13.878 -1.653) 16.163 10.252 ( -10.138 5.423 11.889) 16.538 10.923 ( -17.341 2.290 20.523) 26.965 12.007 ( 3.352 28.153 -5.616) 28.902 12.496 ( 8.019 8.778 1.765) 12.020 12.658 ( -3.090 16.623 -10.984) 20.162 13.309 ( 0.303 15.750 0.265) 15.755 13.976 ( 5.218 16.816 -1.667) 17.685 14.589 ( 7.428 38.010 6.379) 39.251 15.723 ( -16.192 -44.927 -8.727) 48.546 17.506 ( 9.442 -43.689 8.023) 45.412 20.014 ( -4.571 -20.072 6.514) 21.592 20.892 ( 10.390 -37.175 -16.191) 41.858 22.306 ( -4.339 -3.567 -9.848) 11.337 24.808 ( 14.336 0.765 -32.144) 35.204 26.861 ( -1.805 -1.978 15.030) 15.266 28.504 ( -18.317 11.179 15.267) 26.336 ======================= Grid point 464 (216/429) ======================= q-point: ( 0.50 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.106 ( 8.381 -15.213 6.077) 18.401 3.396 ( 1.458 -11.975 8.606) 14.818 3.494 ( -11.878 -10.486 0.697) 15.860 4.227 ( 6.998 -15.379 -6.503) 18.104 4.633 ( -9.541 5.238 -3.113) 11.321 4.936 ( 2.802 6.036 -5.909) 8.900 5.491 ( -0.578 -1.666 -9.348) 9.513 5.806 ( -2.932 -2.269 5.982) 7.037 5.951 ( -9.223 -4.838 1.863) 10.580 6.274 ( 12.333 -10.838 20.654) 26.384 6.651 ( 8.516 -2.537 0.525) 8.902 7.003 ( 4.696 -0.494 1.926) 5.100 7.557 ( -7.771 -10.769 -0.522) 13.290 7.801 ( 7.632 -15.837 -8.668) 19.601 8.052 ( -5.620 -35.478 -10.129) 37.321 8.424 ( 7.964 -5.112 -11.733) 15.073 8.750 ( -0.324 -4.663 -0.280) 4.683 8.865 ( 1.960 -10.049 10.430) 14.616 9.042 ( -4.433 -28.078 -3.741) 28.671 9.608 ( 2.288 -14.540 0.660) 14.734 10.125 ( -8.548 2.216 9.151) 12.717 10.893 ( -9.609 -2.166 20.125) 22.406 11.410 ( -1.460 33.502 -4.028) 33.775 12.186 ( 3.095 26.864 -8.660) 28.394 12.432 ( 4.185 5.668 -2.394) 7.441 13.070 ( -1.849 9.229 1.321) 9.504 13.723 ( -0.401 11.659 -1.306) 11.739 14.018 ( 3.567 25.692 4.457) 26.319 16.468 ( -9.744 -41.607 -5.754) 43.118 18.206 ( 3.652 -25.070 9.437) 27.036 20.331 ( 0.150 -14.247 5.435) 15.250 21.573 ( 11.909 -28.040 -20.905) 36.947 22.392 ( -5.619 -11.795 -4.929) 13.964 24.804 ( 10.029 1.511 -26.252) 28.143 26.940 ( -0.493 -4.083 15.351) 15.892 28.231 ( -14.016 10.654 13.039) 21.908 ======================= Grid point 465 (217/429) ======================= q-point: (-0.43 -0.71 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.374 ( 0.235 -10.299 1.474) 10.407 3.446 ( -17.690 -3.929 -0.443) 18.127 3.791 ( 7.837 -13.523 9.327) 18.201 4.374 ( 3.967 7.188 -10.302) 13.173 4.592 ( -3.311 -13.216 -4.032) 14.209 4.788 ( 3.384 10.325 5.248) 12.066 5.323 ( -6.994 7.776 -5.309) 11.730 5.866 ( -14.486 2.802 -7.556) 16.577 5.974 ( -2.418 -9.222 8.962) 13.085 6.563 ( 15.490 0.607 6.299) 16.733 6.724 ( 6.939 -5.917 13.162) 16.013 7.121 ( 5.760 -8.396 -2.316) 10.442 7.763 ( -7.360 -13.415 7.190) 16.907 7.997 ( 0.682 -8.949 -14.337) 16.915 8.518 ( 7.231 -3.520 -12.881) 15.186 8.684 ( -5.836 -14.953 -3.458) 16.419 8.968 ( 2.177 -11.153 7.529) 13.631 9.008 ( 6.521 -27.021 -1.262) 27.826 9.690 ( -0.957 -31.857 -5.643) 32.367 9.770 ( -1.887 -3.582 6.846) 7.954 10.262 ( -2.432 -20.873 1.357) 21.058 10.806 ( -1.210 25.527 -2.172) 25.648 10.941 ( -10.265 -3.359 20.876) 23.505 11.687 ( 1.220 24.803 -4.257) 25.196 12.342 ( 8.155 7.714 -4.247) 12.002 12.931 ( -5.295 4.321 0.188) 6.837 13.513 ( -2.297 10.092 1.662) 10.483 13.683 ( 1.373 12.702 1.003) 12.816 17.123 ( -4.012 -33.402 -3.418) 33.815 18.554 ( 0.088 -10.752 7.406) 13.056 20.548 ( 1.839 -6.699 4.256) 8.146 21.913 ( 9.278 -7.569 -21.696) 24.781 22.703 ( -2.601 -22.443 -1.225) 22.627 24.761 ( 5.485 3.512 -18.741) 19.841 27.058 ( 0.602 -5.219 14.635) 15.549 28.000 ( -10.668 8.838 9.922) 17.040 ======================= Grid point 466 (218/429) ======================= q-point: (-0.36 -0.71 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.371 ( -17.558 0.247 -1.770) 17.649 3.533 ( -5.237 -9.303 0.466) 10.686 4.042 ( 5.022 -6.369 6.563) 10.433 4.267 ( 2.099 1.966 -5.338) 6.064 4.653 ( 7.202 7.498 9.216) 13.893 4.809 ( 1.839 -8.136 -6.878) 10.811 5.189 ( -3.638 2.450 3.918) 5.881 5.701 ( -13.631 3.315 -7.972) 16.135 6.121 ( -4.444 -6.602 6.322) 10.164 6.534 ( 12.669 6.511 3.009) 14.559 6.932 ( 7.961 -5.204 8.589) 12.815 7.310 ( 0.068 -8.990 1.057) 9.052 7.913 ( -7.442 -3.199 3.692) 8.903 8.134 ( -0.231 -8.908 -2.056) 9.145 8.586 ( 6.552 -2.168 -10.954) 12.947 8.790 ( -0.494 -5.774 -8.495) 10.283 9.142 ( 5.147 -9.316 3.854) 11.319 9.569 ( 1.067 -12.064 -5.285) 13.214 9.902 ( -2.821 -17.157 -2.276) 17.536 10.098 ( 1.748 -9.470 -4.974) 10.839 10.422 ( -3.798 1.733 3.512) 5.456 10.823 ( 0.464 -22.561 8.405) 24.081 11.015 ( -6.865 -8.137 18.522) 21.364 11.317 ( -1.774 11.395 -2.385) 11.776 12.199 ( 7.251 11.817 -3.912) 14.406 12.831 ( -5.457 3.035 0.216) 6.248 13.355 ( -1.846 5.128 2.467) 5.982 13.524 ( -0.311 5.557 -0.656) 5.604 17.665 ( 0.187 -26.279 -1.755) 26.338 18.682 ( -0.963 -2.950 4.240) 5.254 20.615 ( 1.096 0.857 3.314) 3.594 21.985 ( 6.315 -1.154 -19.263) 20.305 23.089 ( 0.449 -18.154 -0.436) 18.165 24.664 ( 1.674 5.898 -11.559) 13.085 27.183 ( 0.815 -4.689 13.430) 14.248 27.813 ( -8.101 7.142 6.952) 12.844 ======================= Grid point 467 (219/429) ======================= q-point: (-0.29 -0.71 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.281 ( -13.504 -1.518 -1.204) 13.643 3.707 ( -5.098 -12.296 2.760) 13.594 4.096 ( 2.469 2.067 4.018) 5.149 4.270 ( 2.738 1.228 2.158) 3.696 4.644 ( 5.407 -0.062 7.284) 9.071 4.872 ( 1.653 -0.972 -4.450) 4.846 5.195 ( 1.808 -0.330 6.959) 7.198 5.584 ( -10.870 -0.312 -8.697) 13.925 6.188 ( -7.376 -2.903 5.639) 9.728 6.525 ( 12.943 2.889 3.385) 13.687 7.017 ( 4.575 0.852 3.209) 5.653 7.447 ( -2.581 -6.089 3.434) 7.452 7.822 ( -8.073 6.360 0.181) 10.279 8.308 ( -0.356 -7.694 5.094) 9.235 8.658 ( 6.968 -3.929 -5.875) 9.925 8.904 ( 1.549 -8.201 -13.299) 15.701 9.373 ( 8.815 -8.721 1.248) 12.463 9.569 ( -3.154 3.927 -12.979) 13.922 9.993 ( 1.135 0.793 -7.088) 7.222 10.315 ( -6.606 -12.124 -1.360) 13.873 10.452 ( 3.043 1.799 8.744) 9.431 10.983 ( -5.463 -0.806 17.772) 18.610 11.287 ( 3.294 -10.679 4.782) 12.156 11.349 ( -6.656 -13.075 1.174) 14.719 11.987 ( 3.038 11.776 -0.209) 12.164 12.775 ( -2.732 0.142 1.423) 3.084 13.303 ( -1.515 0.559 1.548) 2.237 13.451 ( -0.217 2.202 -0.496) 2.268 18.108 ( 2.355 -20.582 -0.620) 20.726 18.693 ( -1.161 1.183 0.942) 1.907 20.559 ( -0.173 5.441 2.834) 6.137 21.987 ( 5.485 0.444 -18.287) 19.097 23.370 ( 0.845 -11.549 0.663) 11.599 24.526 ( -0.134 7.215 -6.094) 9.445 27.284 ( -0.051 -2.963 12.072) 12.430 27.669 ( -5.829 4.818 5.339) 9.257 ======================= Grid point 468 (220/429) ======================= q-point: (-0.21 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.278 ( -7.006 -3.515 2.457) 8.215 3.868 ( 0.155 -0.563 5.687) 5.717 4.087 ( 3.340 -0.791 6.215) 7.100 4.279 ( -0.707 -4.039 4.767) 6.288 4.655 ( -0.507 2.711 4.143) 4.977 4.928 ( 1.814 -3.105 -1.818) 4.029 5.197 ( 3.297 0.551 0.375) 3.363 5.561 ( -9.350 -4.052 -4.304) 11.062 6.177 ( -6.438 0.882 7.628) 10.021 6.557 ( 9.186 1.775 0.707) 9.382 6.985 ( 3.399 4.592 -0.174) 5.716 7.498 ( -4.004 1.592 0.594) 4.349 7.668 ( -4.258 3.806 6.685) 8.792 8.402 ( -1.657 -2.961 -1.160) 3.586 8.790 ( 3.220 -6.160 -1.933) 7.215 9.079 ( 6.793 -10.950 -10.154) 16.406 9.336 ( -3.567 7.803 -12.862) 15.462 9.639 ( 8.103 -6.795 -6.096) 12.206 9.933 ( 2.664 6.469 -4.423) 8.277 10.244 ( -9.097 10.246 6.498) 15.165 10.587 ( 1.061 -10.765 4.913) 11.881 10.978 ( 0.403 2.831 4.792) 5.581 11.393 ( -9.070 2.586 7.812) 12.247 11.455 ( 3.815 -2.284 2.779) 5.244 11.840 ( -0.271 7.013 4.842) 8.526 12.806 ( -1.053 -4.049 2.882) 5.080 13.295 ( -1.241 0.381 1.847) 2.258 13.429 ( 0.548 0.402 -0.027) 0.680 18.447 ( 1.661 -12.919 0.517) 13.036 18.645 ( -1.188 1.828 -2.342) 3.200 20.440 ( -0.581 7.007 2.747) 7.549 21.972 ( 5.742 0.863 -18.503) 19.393 23.538 ( -1.049 -6.203 1.018) 6.373 24.387 ( 1.528 6.666 -2.915) 7.434 27.311 ( -2.657 1.991 8.816) 9.420 27.620 ( -2.703 -1.780 7.754) 8.403 ======================= Grid point 469 (221/429) ======================= q-point: (-0.14 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.295 ( -0.315 1.904 8.109) 8.335 3.747 ( 2.601 13.003 11.363) 17.463 4.144 ( 7.838 -0.909 5.079) 9.384 4.455 ( -7.775 -9.173 -2.869) 12.362 4.584 ( -2.034 1.378 5.848) 6.343 4.876 ( -0.181 5.984 -2.594) 6.525 5.350 ( 2.296 -14.845 -4.752) 15.755 5.579 ( -8.512 -2.531 3.090) 9.402 6.113 ( -2.203 4.995 8.864) 10.410 6.540 ( 3.131 3.953 -3.382) 6.072 6.902 ( 5.080 6.418 -1.893) 8.401 7.353 ( -7.750 6.792 -2.660) 10.643 7.669 ( 2.534 0.299 12.828) 13.079 8.425 ( -0.295 -1.078 -4.214) 4.360 8.852 ( -4.054 -0.613 -7.576) 8.614 9.105 ( -2.397 8.361 -10.886) 13.934 9.403 ( 2.767 -15.338 -3.926) 16.073 9.605 ( 9.406 15.206 -6.076) 18.884 9.818 ( 0.115 8.330 0.300) 8.336 10.049 ( -2.095 2.219 2.674) 4.058 10.800 ( -0.525 -6.283 5.332) 8.257 10.844 ( 1.500 9.054 -3.414) 9.792 11.258 ( -8.175 10.982 11.900) 18.140 11.469 ( 6.006 0.772 -2.566) 6.577 11.678 ( -2.799 8.252 9.634) 12.990 12.917 ( -0.971 -7.402 4.626) 8.783 13.270 ( -0.828 2.093 1.761) 2.858 13.435 ( 1.250 -0.353 1.360) 1.881 18.458 ( -3.160 7.388 -4.274) 9.101 18.735 ( -0.937 -7.710 1.014) 7.832 20.319 ( 1.116 6.147 2.669) 6.794 21.953 ( 6.704 1.279 -19.713) 20.861 23.579 ( -6.092 0.537 0.261) 6.121 24.306 ( 7.916 3.777 -2.658) 9.165 27.228 ( -4.259 5.336 5.963) 9.065 27.724 ( -1.384 -7.771 12.208) 14.537 ======================= Grid point 470 (222/429) ======================= q-point: (-0.07 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.193 ( 3.995 12.642 12.207) 18.022 3.502 ( 4.078 17.196 16.948) 24.486 4.262 ( 7.548 -5.653 2.667) 9.800 4.365 ( -8.185 5.996 -5.480) 11.532 4.515 ( -3.173 8.411 -6.812) 11.279 4.963 ( 3.939 -12.293 3.106) 13.277 5.525 ( -15.979 0.994 11.389) 19.648 5.686 ( 5.298 -15.900 -4.745) 17.418 5.992 ( 2.473 9.539 5.500) 11.285 6.427 ( -1.096 7.844 -5.087) 9.413 6.798 ( 7.148 7.487 -3.406) 10.898 7.197 ( -10.296 3.528 -2.388) 11.143 7.699 ( 4.813 1.442 13.237) 14.158 8.422 ( 1.505 1.269 -5.664) 5.996 8.712 ( -5.028 10.626 -12.389) 17.078 8.883 ( -5.155 14.109 -2.406) 15.213 9.218 ( 1.622 16.687 -5.768) 17.730 9.540 ( -4.613 18.457 6.930) 20.248 9.808 ( 8.556 -14.934 -4.855) 17.883 10.050 ( 3.487 3.258 -4.223) 6.373 10.535 ( -0.018 12.898 0.158) 12.899 10.820 ( -0.942 30.439 1.850) 30.510 11.058 ( -5.563 -16.308 2.295) 17.383 11.531 ( 4.341 -3.439 8.402) 10.063 11.678 ( -1.622 -7.884 4.571) 9.257 13.070 ( -1.709 -7.513 6.280) 9.940 13.223 ( 0.599 1.888 0.956) 2.199 13.467 ( 2.435 -1.810 2.432) 3.888 18.221 ( -6.277 13.977 -8.602) 17.572 18.780 ( -5.793 2.555 5.118) 8.142 20.247 ( 4.660 3.690 2.190) 6.335 21.916 ( 8.115 3.559 -22.336) 24.029 23.435 ( -11.257 9.316 -0.412) 14.618 24.327 ( 15.485 0.639 -6.528) 16.817 27.105 ( -4.562 5.927 5.813) 9.473 27.922 ( -2.523 -11.623 16.044) 19.972 ======================= Grid point 476 (223/429) ======================= q-point: ( 0.36 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( 6.965 -0.000 15.624) 17.106 3.031 ( 0.539 -0.000 -4.764) 4.795 3.063 ( 14.325 -0.000 26.327) 29.972 3.384 ( -21.515 0.000 -9.100) 23.360 4.430 ( 0.428 -0.000 -2.455) 2.492 4.727 ( 28.919 -0.000 -12.165) 31.374 5.283 ( -1.614 0.000 2.704) 3.149 5.363 ( 25.560 -0.000 22.829) 34.271 5.440 ( -1.464 0.000 1.324) 1.974 6.295 ( 4.394 -0.000 7.821) 8.971 6.471 ( 2.660 -0.000 -8.142) 8.566 7.043 ( -12.667 0.000 -13.733) 18.683 7.324 ( -1.253 0.000 -2.297) 2.616 7.602 ( -15.155 0.000 -16.226) 22.203 7.708 ( -2.975 0.000 4.333) 5.255 7.845 ( 2.732 -0.000 3.422) 4.379 8.152 ( -10.707 0.000 -11.810) 15.941 8.367 ( -0.067 0.000 3.168) 3.169 8.911 ( 1.988 -0.000 12.157) 12.319 9.096 ( 15.933 -0.000 -2.243) 16.090 10.349 ( -8.563 0.000 9.990) 13.158 11.054 ( -29.448 0.000 25.138) 38.719 12.419 ( -5.785 0.000 -3.111) 6.569 12.868 ( 15.729 -0.000 -8.234) 17.754 13.198 ( -1.165 0.000 1.516) 1.911 13.724 ( -2.484 0.000 -5.957) 6.454 14.056 ( 0.506 -0.000 -4.372) 4.402 14.940 ( 14.536 -0.000 4.548) 15.231 15.877 ( -1.106 0.000 2.540) 2.771 16.026 ( 12.716 -0.000 -6.624) 14.338 19.162 ( -0.724 0.000 2.275) 2.387 20.188 ( 0.618 -0.000 -1.797) 1.900 22.261 ( -1.842 0.000 -13.107) 13.236 24.825 ( 15.673 -0.000 -37.081) 40.257 26.834 ( -2.538 0.000 15.060) 15.272 28.752 ( -23.299 0.000 15.245) 27.843 ======================= Grid point 477 (224/429) ======================= q-point: ( 0.43 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 3.209 -19.210 13.680) 23.800 2.997 ( 10.185 -3.091 8.362) 13.536 3.229 ( -24.985 -4.984 -5.808) 26.131 3.515 ( 5.338 -20.044 9.240) 22.708 4.512 ( 2.861 -8.529 -3.061) 9.502 4.897 ( 17.109 -4.619 -23.343) 29.308 5.247 ( -7.434 -0.129 7.237) 10.376 5.452 ( 6.064 -5.097 11.288) 13.791 5.729 ( 16.841 -13.509 12.132) 24.765 6.371 ( 4.290 1.480 8.923) 10.011 6.502 ( 5.514 -3.646 -6.069) 8.973 6.852 ( -6.500 5.234 -4.439) 9.452 7.315 ( -0.659 -0.705 -3.375) 3.510 7.461 ( -14.342 1.747 -9.130) 17.091 7.654 ( -1.462 0.320 -11.267) 11.366 7.953 ( -0.552 -10.255 -1.470) 10.375 8.258 ( -10.203 -11.710 -2.639) 15.754 8.451 ( 3.393 -8.574 1.511) 9.343 8.940 ( 1.788 0.696 11.777) 11.932 9.206 ( 14.690 -3.326 -3.841) 15.544 10.298 ( -8.820 2.651 12.509) 15.534 10.907 ( -21.699 3.232 22.794) 31.637 12.327 ( -4.085 6.923 -4.447) 9.187 12.829 ( 16.799 15.920 -2.541) 23.283 12.895 ( -4.360 16.019 -5.232) 17.406 13.566 ( -2.585 11.275 -5.603) 12.853 14.386 ( 11.595 7.140 -0.684) 13.634 14.759 ( -4.736 -17.951 -2.956) 18.799 15.498 ( -6.303 37.537 4.177) 38.291 16.687 ( 16.744 -49.722 -0.379) 52.467 19.509 ( -4.645 -29.131 4.623) 29.859 20.360 ( 5.028 -19.536 -6.848) 21.303 22.235 ( -0.938 -0.758 -13.133) 13.188 24.833 ( 12.664 0.410 -36.400) 38.542 26.855 ( -1.968 -0.737 16.376) 16.510 28.590 ( -20.392 6.443 14.875) 26.050 ======================= Grid point 478 (225/429) ======================= q-point: (-0.50 -0.64 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.800 ( -1.405 -21.206 9.438) 23.253 3.190 ( -25.338 -8.358 -2.045) 26.759 3.252 ( 15.883 -11.996 8.573) 21.672 3.923 ( 4.190 -18.690 1.858) 19.244 4.646 ( -2.471 -1.949 -3.027) 4.367 4.972 ( 4.075 -1.295 -19.965) 20.417 5.309 ( -4.155 -9.889 2.452) 11.003 5.645 ( -3.077 -10.376 2.703) 11.155 6.017 ( 6.930 1.271 0.640) 7.074 6.252 ( 6.657 2.779 25.052) 26.070 6.612 ( 7.476 -5.088 -4.436) 10.073 6.968 ( 2.786 -9.566 5.600) 11.429 7.362 ( -12.679 -4.479 -7.741) 15.516 7.431 ( 3.465 -14.675 -1.454) 15.149 7.683 ( 0.844 -5.986 -16.662) 17.725 8.249 ( 2.547 -21.455 -8.031) 23.049 8.393 ( -7.731 -10.506 -0.963) 13.080 8.671 ( 4.585 -10.346 1.792) 11.457 8.947 ( 1.273 1.394 9.745) 9.926 9.390 ( 9.821 -9.812 -3.832) 14.402 10.187 ( -9.367 5.989 14.621) 18.368 10.824 ( -13.349 -1.172 19.880) 23.975 12.011 ( 1.250 26.675 -4.623) 27.101 12.530 ( -5.884 11.234 -4.125) 13.336 12.646 ( 11.040 17.428 -7.397) 21.916 13.295 ( -2.490 13.918 -1.535) 14.222 14.017 ( 2.974 20.962 -2.195) 21.286 14.655 ( -0.145 39.194 6.023) 39.655 15.557 ( -8.064 -47.736 -5.286) 48.700 17.656 ( 12.124 -40.168 6.737) 42.495 19.980 ( -6.010 -22.655 7.175) 24.512 20.952 ( 10.270 -37.340 -14.865) 41.481 22.236 ( -1.033 -2.785 -11.354) 11.736 24.822 ( 9.331 0.532 -32.993) 34.291 26.906 ( -0.831 -2.379 17.324) 17.506 28.358 ( -16.655 9.326 13.704) 23.499 ======================= Grid point 479 (226/429) ======================= q-point: (-0.43 -0.64 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.139 ( -5.882 -15.100 3.201) 16.518 3.217 ( -21.215 -8.833 1.780) 23.050 3.612 ( 14.459 -13.586 9.383) 21.947 4.278 ( 5.562 -16.807 -3.770) 18.101 4.541 ( -2.890 8.223 -8.144) 11.929 4.946 ( 1.526 2.640 -2.654) 4.043 5.360 ( -13.701 3.033 -11.803) 18.336 5.799 ( -0.393 -8.628 -0.069) 8.637 5.875 ( -5.333 5.243 7.843) 10.837 6.528 ( 15.466 -11.934 20.117) 28.041 6.729 ( 5.122 -1.998 -2.415) 6.005 7.066 ( 4.842 -1.542 1.567) 5.318 7.450 ( -11.096 -13.771 2.653) 17.883 7.806 ( 0.190 -9.717 -15.821) 18.568 7.994 ( 0.292 -37.685 -1.133) 37.703 8.484 ( 7.610 -4.846 -8.900) 12.673 8.718 ( -0.572 -16.518 -3.640) 16.924 8.953 ( 3.747 -0.508 9.244) 9.988 9.010 ( 2.617 -29.925 -2.367) 30.133 9.649 ( 4.506 -12.197 -0.381) 13.008 10.070 ( -7.142 1.526 10.745) 12.992 10.849 ( -10.691 -3.792 19.840) 22.855 11.395 ( 0.858 35.639 -3.116) 35.786 12.162 ( -1.000 23.962 -10.575) 26.211 12.475 ( 4.555 5.622 -1.925) 7.487 13.049 ( -2.441 10.451 0.328) 10.737 13.701 ( -2.608 12.923 -1.697) 13.292 14.050 ( -0.705 25.436 4.215) 25.792 16.385 ( -1.641 -42.879 -4.062) 43.103 18.292 ( 5.628 -21.215 8.978) 23.714 20.338 ( -2.714 -16.591 5.840) 17.797 21.633 ( 12.137 -27.152 -20.571) 36.162 22.330 ( -1.851 -12.127 -5.535) 13.459 24.794 ( 5.451 1.271 -26.778) 27.357 27.001 ( 0.703 -4.301 17.273) 17.814 28.119 ( -13.458 9.181 11.445) 19.910 ======================= Grid point 480 (227/429) ======================= q-point: (-0.36 -0.64 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.225 ( -19.061 -5.110 0.521) 19.741 3.344 ( -7.845 -9.156 2.249) 12.265 3.925 ( 9.093 -10.554 8.727) 16.439 4.351 ( -0.247 7.464 -10.445) 12.840 4.604 ( 8.194 -14.042 -6.529) 17.520 4.880 ( 7.000 8.237 9.725) 14.541 5.170 ( -13.700 1.929 -10.686) 17.482 5.720 ( -7.782 5.735 -0.100) 9.667 5.982 ( -2.073 -7.443 5.565) 9.522 6.703 ( 6.857 4.256 -1.875) 8.286 6.860 ( 7.756 -9.291 13.557) 18.174 7.161 ( 1.961 -6.465 0.315) 6.763 7.702 ( -7.780 -14.922 7.427) 18.395 7.966 ( 2.334 -9.058 -10.302) 13.915 8.550 ( 5.265 -9.599 -11.994) 16.239 8.589 ( -6.684 -12.046 -3.617) 14.243 9.028 ( 3.486 -5.655 5.225) 8.451 9.088 ( 8.525 -27.463 -2.092) 28.832 9.671 ( 2.037 -29.435 -5.857) 30.081 9.803 ( 1.929 -5.099 8.541) 10.133 10.234 ( -2.698 -20.290 0.819) 20.485 10.744 ( -7.049 18.979 1.744) 20.321 10.949 ( -3.445 1.310 17.946) 18.320 11.678 ( 0.231 24.458 -4.777) 24.921 12.394 ( 3.645 6.048 -4.644) 8.452 12.879 ( -3.583 5.973 0.006) 6.966 13.479 ( -4.392 8.811 0.868) 9.883 13.692 ( -0.557 13.594 1.300) 13.667 17.105 ( 2.718 -34.216 -2.846) 34.442 18.592 ( 1.841 -8.358 7.269) 11.228 20.565 ( -1.667 -7.545 4.706) 9.047 21.934 ( 8.676 -5.685 -22.090) 24.404 22.692 ( 1.544 -23.869 -1.426) 23.961 24.731 ( 1.441 3.185 -18.896) 19.217 27.128 ( 1.740 -4.852 16.171) 16.973 27.911 ( -10.908 7.642 8.535) 15.818 ======================= Grid point 481 (228/429) ======================= q-point: (-0.29 -0.64 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.177 ( -15.726 -1.312 0.974) 15.811 3.468 ( -6.685 -9.599 1.687) 11.818 4.124 ( 5.215 -3.546 6.084) 8.763 4.259 ( 0.257 0.020 -7.280) 7.285 4.765 ( 5.208 6.333 5.825) 10.057 4.833 ( 6.009 -4.533 -4.311) 8.674 5.150 ( -2.491 -4.884 1.287) 5.631 5.576 ( -4.873 5.046 -3.391) 7.791 6.083 ( -6.292 -4.953 6.492) 10.309 6.655 ( 6.551 3.858 -0.087) 7.603 7.025 ( 4.352 -3.151 3.110) 6.208 7.308 ( -2.063 -7.759 6.088) 10.076 7.835 ( -7.484 -1.898 1.874) 7.945 8.157 ( 3.271 -9.995 3.819) 11.189 8.617 ( 5.559 -2.442 -10.427) 12.066 8.737 ( -1.759 -7.484 -10.933) 13.366 9.223 ( 6.527 -10.943 1.717) 12.857 9.555 ( 0.576 -10.245 -7.609) 12.774 9.891 ( 1.771 -9.815 0.755) 10.002 10.098 ( 1.364 -6.514 -4.212) 7.876 10.397 ( -3.022 -8.393 4.611) 10.042 10.862 ( 0.855 -22.628 7.206) 23.763 10.999 ( -8.044 -7.230 18.945) 21.815 11.291 ( -1.202 13.119 -2.837) 13.476 12.242 ( 2.616 11.585 -4.115) 12.569 12.781 ( -3.239 2.425 0.337) 4.060 13.335 ( -3.102 4.140 2.109) 5.586 13.514 ( -1.068 5.722 -0.542) 5.846 17.689 ( 5.170 -26.410 -1.853) 26.975 18.693 ( 0.177 -1.469 4.265) 4.514 20.623 ( -1.972 0.621 3.745) 4.278 21.984 ( 6.145 -0.708 -19.758) 20.703 23.108 ( 3.137 -18.045 -0.575) 18.325 24.623 ( -1.453 5.159 -11.412) 12.607 27.249 ( 1.680 -3.766 14.718) 15.285 27.741 ( -8.713 5.971 5.749) 12.026 ======================= Grid point 482 (229/429) ======================= q-point: (-0.21 -0.64 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.153 ( -8.983 -4.247 2.196) 10.177 3.664 ( -4.618 -14.133 4.279) 15.472 4.137 ( 2.383 2.857 1.690) 4.086 4.289 ( -0.304 -1.057 0.909) 1.427 4.710 ( 1.563 2.808 3.822) 4.994 4.895 ( 3.937 -1.324 -0.817) 4.233 5.245 ( 4.812 -1.160 2.955) 5.765 5.476 ( -3.764 1.367 -4.434) 5.975 6.129 ( -7.402 -2.941 8.768) 11.845 6.637 ( 5.143 1.947 -1.147) 5.618 7.053 ( 1.256 1.611 -1.892) 2.784 7.436 ( -2.509 -5.670 7.304) 9.581 7.752 ( -4.881 5.323 3.924) 8.219 8.323 ( 0.014 -4.983 3.695) 6.203 8.699 ( 3.626 -4.791 -7.776) 9.827 8.880 ( 3.595 -10.637 -10.447) 15.337 9.481 ( -1.705 -0.271 -14.373) 14.476 9.488 ( 8.979 -1.532 -1.448) 9.223 9.992 ( 2.180 -0.974 -4.190) 4.822 10.249 ( -4.247 -9.432 -0.299) 10.349 10.511 ( 1.480 2.094 9.739) 10.071 10.985 ( -6.265 -1.225 18.805) 19.859 11.244 ( -5.743 -10.356 -7.589) 14.065 11.370 ( 2.314 -14.714 10.183) 18.043 12.006 ( 0.436 12.120 -0.480) 12.137 12.755 ( -1.693 -0.968 1.594) 2.519 13.291 ( -1.508 0.130 1.599) 2.202 13.442 ( -0.916 1.589 -0.553) 1.915 18.150 ( 5.490 -19.911 -0.949) 20.676 18.684 ( -1.124 2.370 1.038) 2.821 20.557 ( -1.992 5.132 3.085) 6.311 21.982 ( 5.574 0.399 -18.617) 19.438 23.389 ( 2.095 -10.512 0.654) 10.739 24.493 ( -1.836 5.558 -5.873) 8.292 27.332 ( 0.355 -1.103 13.030) 13.081 27.618 ( -6.226 2.832 4.435) 8.152 ======================= Grid point 483 (230/429) ======================= q-point: (-0.14 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.240 ( -2.040 -6.718 5.524) 8.934 3.886 ( -0.829 -5.051 6.403) 8.198 4.124 ( -0.400 -3.777 3.415) 5.108 4.288 ( -0.242 -0.013 2.369) 2.381 4.653 ( -2.379 4.214 3.749) 6.122 4.944 ( 1.451 -0.172 -0.823) 1.677 5.221 ( 0.923 1.703 -3.538) 4.033 5.496 ( 0.150 -3.516 2.157) 4.128 6.149 ( -4.534 -0.853 10.634) 11.592 6.612 ( 1.383 2.734 -3.782) 4.867 6.996 ( 0.163 3.552 -5.641) 6.668 7.451 ( -3.720 4.922 1.938) 6.466 7.695 ( 1.746 -0.370 13.383) 13.501 8.379 ( -1.659 -2.329 -0.451) 2.895 8.769 ( -2.092 -3.444 -10.809) 11.535 9.146 ( 8.079 -14.369 -1.870) 16.590 9.247 ( -2.538 10.335 -14.998) 18.390 9.714 ( 8.920 -7.221 -8.323) 14.176 9.935 ( 0.142 6.843 -4.539) 8.213 10.190 ( -4.207 10.636 6.955) 13.386 10.630 ( 2.752 -11.121 7.188) 13.524 10.984 ( -3.212 2.375 6.899) 7.972 11.295 ( -9.325 0.663 1.359) 9.447 11.536 ( 5.539 0.103 6.974) 8.907 11.846 ( -1.650 6.491 3.775) 7.688 12.803 ( -1.287 -4.551 3.013) 5.608 13.291 ( -0.664 0.187 1.945) 2.064 13.430 ( -0.338 -0.427 -0.160) 0.567 18.474 ( 2.497 -9.284 0.582) 9.631 18.616 ( -2.155 1.062 -2.417) 3.408 20.445 ( -0.493 6.108 2.719) 6.704 21.970 ( 6.018 0.589 -18.406) 19.374 23.528 ( -1.303 -3.736 1.198) 4.135 24.394 ( 1.605 3.424 -3.077) 4.875 27.313 ( -2.669 4.351 8.789) 10.164 27.618 ( -2.663 -4.307 7.780) 9.283 ======================= Grid point 484 (231/429) ======================= q-point: (-0.07 0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.345 ( 3.342 -0.845 9.579) 10.180 3.819 ( 2.347 10.746 12.161) 16.398 4.228 ( 4.210 -2.498 2.146) 5.345 4.338 ( -9.752 -4.476 -5.971) 12.280 4.573 ( -2.826 2.264 2.940) 4.665 4.870 ( 0.258 2.702 -0.872) 2.851 5.294 ( -9.066 -9.670 -1.363) 13.325 5.587 ( 6.544 -4.019 5.675) 9.549 6.142 ( 0.400 2.820 10.150) 10.542 6.530 ( -1.236 5.028 -5.646) 7.661 6.912 ( -1.450 3.678 -8.086) 9.001 7.284 ( -2.468 9.676 1.867) 10.159 7.767 ( 4.841 -0.712 15.463) 16.219 8.413 ( 0.244 -1.878 -1.833) 2.636 8.752 ( -6.819 0.682 -12.526) 14.279 9.023 ( -3.017 9.103 -12.813) 16.005 9.399 ( -1.978 -2.996 -1.977) 4.099 9.710 ( 10.902 4.214 -4.608) 12.564 9.822 ( 1.537 8.864 1.711) 9.158 10.064 ( 3.352 -1.266 -1.605) 3.927 10.801 ( -3.230 10.782 1.731) 11.388 10.851 ( 1.388 -3.194 4.225) 5.475 11.197 ( -9.373 7.131 10.390) 15.705 11.551 ( 9.271 -0.092 -1.461) 9.386 11.673 ( -3.936 10.000 7.544) 13.130 12.917 ( -2.019 -7.646 4.492) 9.095 13.273 ( 0.075 1.941 1.903) 2.719 13.448 ( 0.360 -1.463 0.983) 1.799 18.390 ( -5.925 9.775 -4.044) 12.125 18.726 ( -1.159 -6.095 1.344) 6.348 20.354 ( 3.187 4.502 2.397) 6.015 21.960 ( 7.070 0.986 -19.090) 20.381 23.508 ( -6.315 3.933 0.859) 7.489 24.386 ( 8.026 -0.297 -3.750) 8.864 27.207 ( -3.477 6.025 6.788) 9.720 27.747 ( -2.140 -8.494 11.262) 14.267 ======================= Grid point 491 (232/429) ======================= q-point: (-0.57 -0.57 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( -2.110 0.000 14.679) 14.830 2.990 ( -28.581 0.000 -0.738) 28.590 3.037 ( 3.745 -0.000 -4.674) 5.989 3.387 ( 12.334 -0.000 19.826) 23.349 4.429 ( 0.890 -0.000 -2.360) 2.522 4.904 ( 13.350 -0.000 -24.770) 28.138 5.191 ( -13.546 0.000 5.101) 14.474 5.427 ( -1.621 0.000 1.219) 2.028 5.782 ( 29.585 -0.000 22.427) 37.125 6.430 ( 13.220 -0.000 10.576) 16.930 6.472 ( 2.828 -0.000 -8.182) 8.657 6.859 ( -10.301 0.000 -16.805) 19.711 7.305 ( -0.543 0.000 -2.160) 2.227 7.338 ( -22.289 0.000 -7.920) 23.654 7.690 ( -2.966 0.000 4.149) 5.100 7.885 ( 1.930 -0.000 3.586) 4.073 8.017 ( -4.547 0.000 -13.084) 13.851 8.406 ( 4.510 -0.000 4.214) 6.172 8.982 ( 2.493 -0.000 11.211) 11.485 9.263 ( 15.783 -0.000 -5.359) 16.668 10.301 ( -7.014 0.000 13.386) 15.112 10.861 ( -20.665 0.000 23.723) 31.461 12.344 ( -5.233 0.000 -3.021) 6.042 12.964 ( 6.287 -0.000 -9.457) 11.356 13.221 ( 4.312 -0.000 2.945) 5.222 13.662 ( -3.769 0.000 -8.379) 9.188 14.047 ( 0.870 -0.000 -4.374) 4.460 15.079 ( 5.742 -0.000 5.652) 8.057 15.874 ( -1.003 0.000 2.498) 2.692 16.144 ( 12.984 -0.000 -7.200) 14.846 19.162 ( -0.731 0.000 2.278) 2.393 20.188 ( 0.619 -0.000 -1.786) 1.891 22.205 ( 0.922 -0.000 -14.265) 14.295 24.833 ( 10.137 -0.000 -38.213) 39.535 26.869 ( -1.883 0.000 17.579) 17.679 28.564 ( -19.463 0.000 14.645) 24.357 ======================= Grid point 492 (233/429) ======================= q-point: (-0.50 -0.57 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( -7.580 -18.652 12.364) 23.627 2.882 ( -29.105 -6.614 0.793) 29.857 3.152 ( 10.606 -9.026 -0.324) 13.930 3.636 ( 7.227 -14.255 13.607) 20.990 4.520 ( 0.713 -8.075 -2.524) 8.490 4.912 ( -1.108 -1.381 -21.789) 21.861 5.151 ( -9.701 -3.475 1.864) 10.472 5.480 ( -1.936 -6.104 2.567) 6.899 6.036 ( 23.049 -4.929 12.053) 26.473 6.456 ( 3.616 4.979 9.466) 11.290 6.568 ( 7.019 -1.104 -0.659) 7.136 6.771 ( -1.589 -7.169 -10.714) 12.989 7.213 ( -18.458 -0.970 -4.432) 19.008 7.324 ( -0.749 -2.614 -0.987) 2.893 7.627 ( 2.482 1.206 -7.588) 8.075 7.933 ( -2.268 -7.288 -1.089) 7.710 8.176 ( -1.511 -13.138 -5.553) 14.343 8.515 ( 5.668 -7.507 4.538) 10.444 9.005 ( 2.401 1.161 10.159) 10.503 9.353 ( 14.463 -1.809 -6.709) 16.045 10.263 ( -6.230 3.384 16.528) 17.985 10.782 ( -14.848 0.962 21.323) 26.001 12.266 ( -3.839 5.299 -3.841) 7.588 12.821 ( -5.208 17.959 -5.082) 19.377 12.996 ( 14.570 15.668 -3.277) 21.645 13.496 ( -5.262 10.262 -7.992) 14.032 14.508 ( 10.378 -0.361 -1.207) 10.454 14.683 ( -6.352 -8.730 -3.528) 11.359 15.423 ( -10.507 38.502 6.977) 40.515 16.892 ( 19.743 -49.569 -1.593) 53.380 19.471 ( -5.374 -26.569 5.339) 27.628 20.392 ( 4.995 -22.208 -6.884) 23.781 22.191 ( 1.857 -0.467 -14.142) 14.271 24.810 ( 7.234 0.100 -37.493) 38.185 26.902 ( -1.207 -1.062 18.693) 18.762 28.431 ( -16.827 5.629 14.239) 22.750 ======================= Grid point 493 (234/429) ======================= q-point: (-0.43 -0.57 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.747 ( -12.507 -21.011 7.495) 25.574 2.895 ( -26.679 -10.891 3.663) 29.048 3.467 ( 16.612 -13.972 4.886) 22.250 3.986 ( 4.927 -17.065 3.693) 18.142 4.603 ( -2.315 0.206 -5.778) 6.228 4.892 ( -7.558 -3.504 -12.022) 14.626 5.226 ( -9.453 -7.194 -3.964) 12.523 5.620 ( -0.528 -9.373 1.450) 9.499 6.073 ( 4.044 12.368 -0.548) 13.023 6.454 ( 8.559 -6.213 20.835) 23.365 6.674 ( 6.361 -5.833 -5.956) 10.486 7.022 ( 5.326 -10.748 3.202) 12.415 7.152 ( -20.015 -7.089 -1.583) 21.293 7.444 ( 0.624 -12.218 -4.588) 13.066 7.700 ( 9.171 -7.358 -8.841) 14.711 8.194 ( -6.564 -23.579 -3.364) 24.706 8.391 ( 8.580 -10.175 -7.026) 15.051 8.732 ( 3.996 -10.830 1.664) 11.663 9.011 ( 3.991 1.480 9.665) 10.561 9.486 ( 10.314 -6.712 -6.503) 13.918 10.158 ( -5.857 6.957 18.384) 20.510 10.764 ( -9.935 -2.502 19.050) 21.630 12.009 ( 1.092 24.441 -3.503) 24.715 12.416 ( -9.025 14.388 -7.630) 18.619 12.761 ( 11.757 18.148 -5.625) 22.343 13.240 ( -5.601 11.307 -3.007) 12.971 14.023 ( -0.611 24.171 -2.295) 24.288 14.630 ( -7.809 37.236 6.279) 38.561 15.505 ( 1.806 -49.178 -4.093) 49.381 17.832 ( 14.807 -36.206 6.269) 39.616 19.930 ( -7.297 -24.344 7.088) 26.384 21.017 ( 10.681 -38.025 -14.407) 42.042 22.199 ( 1.957 -2.312 -12.267) 12.635 24.776 ( 4.013 -0.037 -33.817) 34.054 26.970 ( 0.229 -2.891 19.227) 19.444 28.231 ( -14.268 8.568 13.087) 21.172 ======================= Grid point 494 (235/429) ======================= q-point: (-0.36 -0.57 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.962 ( -22.269 -10.800 4.405) 25.139 3.048 ( -14.528 -16.551 4.982) 22.579 3.806 ( 12.953 -10.825 7.443) 18.449 4.330 ( 4.755 -14.280 -0.543) 15.061 4.504 ( 3.819 4.734 -14.943) 16.133 4.932 ( -4.001 -5.566 -1.728) 7.069 5.157 ( -13.524 5.796 -5.050) 15.556 5.795 ( -0.721 -1.823 0.865) 2.143 5.877 ( 1.249 2.928 4.761) 5.727 6.731 ( 3.324 -9.958 12.689) 16.469 6.740 ( 4.373 -2.715 -6.717) 8.462 7.099 ( -2.076 -2.294 1.465) 3.424 7.367 ( -3.610 -16.697 7.479) 18.648 7.720 ( -4.547 -17.182 -11.135) 20.973 8.024 ( 3.594 -24.274 0.154) 24.539 8.493 ( 0.223 -9.257 -7.480) 11.903 8.771 ( 12.235 -20.001 -5.837) 24.162 8.960 ( -1.307 -10.071 -1.868) 10.326 9.112 ( 9.727 -15.419 5.810) 19.134 9.701 ( 5.429 -11.411 -3.036) 12.997 10.054 ( -3.261 2.322 14.964) 15.490 10.804 ( -9.449 -2.650 18.754) 21.166 11.398 ( 0.966 35.561 -1.905) 35.625 12.094 ( -3.621 18.302 -10.532) 21.424 12.511 ( 2.665 9.748 -2.798) 10.486 13.019 ( -2.612 9.556 -0.216) 9.909 13.653 ( -4.738 13.901 -1.448) 14.758 14.035 ( -4.466 23.778 4.190) 24.554 16.397 ( 5.986 -43.363 -4.015) 43.958 18.401 ( 7.783 -17.145 8.967) 20.855 20.314 ( -5.243 -18.235 5.869) 19.860 21.696 ( 12.666 -25.250 -21.750) 35.652 22.310 ( 1.995 -13.425 -5.239) 14.549 24.729 ( 0.462 0.570 -27.087) 27.097 27.082 ( 1.868 -4.508 18.548) 19.179 28.013 ( -12.339 8.611 11.024) 18.653 ======================= Grid point 495 (236/429) ======================= q-point: (-0.29 -0.57 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.018 ( -18.578 -6.565 4.842) 20.290 3.240 ( -11.532 -11.444 3.655) 16.653 4.044 ( 6.094 -7.891 7.139) 12.262 4.310 ( 0.582 5.778 -11.859) 13.204 4.705 ( 13.044 -11.718 -8.310) 19.403 4.937 ( -9.584 7.404 -5.099) 13.140 5.041 ( 4.471 -5.148 8.799) 11.132 5.668 ( -2.800 6.832 1.390) 7.513 5.969 ( -2.682 -4.862 3.578) 6.606 6.709 ( -3.082 0.767 -4.811) 5.765 6.965 ( 3.915 -6.358 2.591) 7.903 7.176 ( -1.168 -6.551 7.049) 9.694 7.652 ( -4.678 -12.966 5.204) 14.734 7.982 ( 4.794 -12.665 -2.718) 13.812 8.463 ( -9.403 -18.650 -2.526) 21.039 8.607 ( 8.490 -3.207 -10.695) 14.027 9.068 ( 1.578 -8.632 -1.070) 8.840 9.183 ( 9.323 -19.792 -1.996) 21.969 9.692 ( 5.213 -30.386 -6.155) 31.438 9.870 ( 3.919 -4.177 8.920) 10.600 10.221 ( -0.380 -17.150 3.630) 17.535 10.678 ( -6.215 13.614 3.082) 15.279 10.972 ( -3.588 4.464 15.704) 16.716 11.659 ( -0.451 23.560 -4.247) 23.944 12.385 ( -2.283 5.086 -5.400) 7.761 12.855 ( -0.571 6.797 0.442) 6.835 13.424 ( -5.593 7.640 0.858) 9.507 13.679 ( -2.551 13.304 1.456) 13.624 17.159 ( 8.597 -34.211 -3.477) 35.445 18.650 ( 3.585 -5.703 7.358) 9.976 20.546 ( -4.834 -8.276 5.053) 10.835 21.947 ( 8.291 -4.070 -23.133) 24.909 22.728 ( 5.855 -24.401 -1.451) 25.136 24.654 ( -2.795 2.262 -18.656) 18.999 27.215 ( 2.621 -4.402 16.922) 17.680 27.818 ( -10.694 7.063 8.271) 15.253 ======================= Grid point 496 (237/429) ======================= q-point: (-0.21 -0.57 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.030 ( -11.715 -4.077 5.043) 13.390 3.400 ( -6.834 -11.639 3.982) 14.073 4.204 ( 5.208 -0.585 3.954) 6.565 4.213 ( -3.080 -1.824 -8.054) 8.813 4.785 ( -2.264 4.332 -1.299) 5.058 4.885 ( 5.223 -3.178 -3.531) 7.060 5.217 ( 11.216 -6.008 8.609) 15.362 5.542 ( -0.297 5.773 -2.604) 6.341 6.032 ( -6.666 -4.171 6.916) 10.472 6.670 ( -2.437 0.827 -3.483) 4.331 7.042 ( -1.159 -2.184 -5.841) 6.343 7.325 ( -0.871 -6.911 12.605) 14.402 7.769 ( -5.715 -2.180 3.986) 7.301 8.230 ( 6.266 -8.380 6.038) 12.081 8.608 ( -1.765 -5.405 -9.358) 10.950 8.709 ( 5.714 -6.705 -11.401) 14.408 9.283 ( 4.103 -12.099 -4.311) 13.484 9.532 ( 1.207 -9.077 -8.588) 12.554 9.950 ( 6.229 -3.256 5.616) 8.997 10.097 ( 0.809 -1.999 -3.528) 4.135 10.390 ( -1.131 -17.534 4.637) 18.173 10.883 ( -1.037 -23.402 2.938) 23.609 10.979 ( -7.913 -3.448 20.457) 22.204 11.272 ( -0.620 12.678 -1.300) 12.760 12.224 ( -2.916 9.897 -4.670) 11.326 12.765 ( -0.049 2.815 1.067) 3.011 13.305 ( -3.327 2.636 2.114) 4.742 13.495 ( -2.028 5.608 -0.313) 5.972 17.764 ( 9.222 -25.731 -2.785) 27.475 18.718 ( 1.302 0.505 4.443) 4.657 20.598 ( -4.847 -0.034 4.118) 6.360 21.979 ( 6.221 -0.438 -20.576) 21.501 23.157 ( 5.970 -17.044 -0.599) 18.070 24.548 ( -4.555 3.688 -10.849) 12.331 27.328 ( 2.302 -2.832 15.452) 15.877 27.659 ( -9.041 5.135 5.279) 11.660 ======================= Grid point 497 (238/429) ======================= q-point: (-0.14 -0.57 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.098 ( -3.345 -7.160 6.162) 10.021 3.634 ( -3.967 -15.437 5.690) 16.924 4.137 ( -2.170 2.467 -5.867) 6.724 4.294 ( 0.354 -1.583 5.711) 5.936 4.717 ( -1.159 3.171 2.108) 3.980 4.932 ( 2.434 -1.308 -0.854) 2.892 5.317 ( 4.227 5.011 -2.795) 7.126 5.480 ( 6.914 -0.635 4.768) 8.422 6.087 ( -6.034 -3.990 9.620) 12.037 6.634 ( -3.030 0.886 -3.897) 5.015 7.023 ( -3.470 1.104 -9.145) 9.843 7.450 ( -0.955 -3.811 10.674) 11.374 7.745 ( -1.445 1.868 9.987) 10.262 8.340 ( 1.860 -1.291 1.283) 2.603 8.672 ( -0.845 -3.889 -12.696) 13.305 8.927 ( 8.447 -13.387 -3.426) 16.195 9.391 ( -2.446 6.101 -17.058) 18.281 9.587 ( 8.536 -6.745 -4.488) 11.768 10.002 ( 0.852 1.133 -2.352) 2.747 10.226 ( 0.110 -9.593 2.307) 9.868 10.560 ( 0.708 2.984 10.356) 10.800 10.979 ( -6.636 -1.006 18.652) 19.823 11.146 ( -6.137 -10.734 -7.623) 14.525 11.430 ( 1.954 -16.155 8.473) 18.347 11.992 ( -2.438 11.011 -1.062) 11.328 12.750 ( -0.305 -0.914 2.100) 2.311 13.284 ( -0.901 -0.559 1.828) 2.113 13.426 ( -1.682 1.044 -0.545) 2.053 18.222 ( 7.798 -18.520 -1.810) 20.176 18.676 ( -0.888 4.364 1.328) 4.648 20.536 ( -3.790 3.952 3.265) 6.375 21.977 ( 5.811 0.221 -19.004) 19.874 23.424 ( 3.581 -8.559 0.693) 9.304 24.442 ( -3.466 2.990 -5.405) 7.083 27.386 ( 0.278 1.609 13.715) 13.812 27.562 ( -6.137 0.068 3.874) 7.258 ======================= Grid point 498 (239/429) ======================= q-point: (-0.07 -0.57 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.272 ( 3.014 -9.018 8.383) 12.676 3.895 ( -1.887 -8.900 6.462) 11.160 4.093 ( -5.392 -3.387 -2.996) 7.037 4.298 ( 0.063 1.918 4.845) 5.211 4.635 ( -2.852 4.661 3.948) 6.742 4.950 ( 0.499 2.537 -1.928) 3.225 5.180 ( -5.044 3.202 -2.550) 6.496 5.591 ( 12.158 -2.247 7.161) 14.288 6.143 ( -3.470 -2.822 8.744) 9.822 6.577 ( -3.481 2.457 -4.518) 6.210 6.939 ( -4.609 3.146 -11.086) 12.411 7.447 ( 0.392 5.474 5.804) 7.988 7.783 ( 2.908 -2.548 16.836) 17.274 8.367 ( -0.106 -1.866 0.213) 1.881 8.683 ( -3.763 -1.211 -15.197) 15.703 9.166 ( -1.070 9.157 -14.405) 17.102 9.239 ( 7.637 -11.795 -0.661) 14.067 9.771 ( 7.212 -7.408 -10.862) 14.996 9.902 ( -3.005 7.196 -3.226) 8.439 10.201 ( 1.571 10.367 5.848) 12.005 10.700 ( 3.664 -12.837 8.977) 16.087 10.956 ( -5.532 3.507 5.934) 8.838 11.202 ( -8.348 0.552 3.998) 9.272 11.623 ( 5.315 -0.717 5.994) 8.043 11.828 ( -3.454 5.917 2.216) 7.201 12.799 ( -1.331 -4.280 3.166) 5.488 13.295 ( 0.059 0.007 2.028) 2.029 13.421 ( -1.021 -1.187 -0.325) 1.599 18.500 ( 1.200 -0.261 0.541) 1.342 18.587 ( -0.799 -3.474 -2.389) 4.291 20.448 ( -0.688 4.020 2.658) 4.869 21.973 ( 6.255 0.187 -18.281) 19.322 23.520 ( -0.876 -0.654 1.363) 1.748 24.399 ( 1.227 -0.368 -3.215) 3.461 27.315 ( -2.805 5.862 8.709) 10.866 27.617 ( -2.533 -5.993 7.859) 10.203 ======================= Grid point 506 (240/429) ======================= q-point: (-0.50 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( -11.574 0.000 13.586) 17.847 2.646 ( -31.369 0.000 3.947) 31.616 3.081 ( 6.466 -0.000 -3.787) 7.494 3.586 ( 9.231 -0.000 18.045) 20.269 4.433 ( 1.302 -0.000 -2.408) 2.737 4.815 ( -17.745 0.000 -9.077) 19.932 5.075 ( -4.235 0.000 -9.823) 10.697 5.413 ( -1.577 0.000 1.253) 2.014 6.160 ( 23.858 -0.000 10.408) 26.029 6.475 ( 2.968 -0.000 -8.238) 8.757 6.648 ( -2.838 0.000 -11.176) 11.530 6.663 ( 3.615 -0.000 11.733) 12.278 7.093 ( -13.538 0.000 -5.294) 14.537 7.296 ( 0.312 -0.000 -1.925) 1.950 7.671 ( -3.017 0.000 4.061) 5.059 7.915 ( 1.004 -0.000 3.543) 3.682 7.950 ( 1.245 -0.000 -13.591) 13.648 8.495 ( 7.055 -0.000 6.383) 9.513 9.048 ( 3.141 -0.000 8.157) 8.741 9.412 ( 14.686 -0.000 -8.449) 16.943 10.303 ( -2.116 0.000 18.483) 18.604 10.752 ( -13.697 0.000 21.699) 25.661 12.277 ( -4.822 0.000 -2.620) 5.488 12.960 ( -0.111 0.000 -7.389) 7.390 13.298 ( 6.082 -0.000 1.184) 6.197 13.582 ( -3.470 0.000 -10.440) 11.001 14.044 ( 1.345 -0.000 -4.378) 4.580 15.102 ( -5.342 0.000 5.544) 7.699 15.873 ( -0.870 0.000 2.484) 2.632 16.274 ( 14.719 -0.000 -7.311) 16.435 19.162 ( -0.738 0.000 2.279) 2.395 20.189 ( 0.616 -0.000 -1.782) 1.885 22.176 ( 3.349 -0.000 -15.043) 15.411 24.772 ( 4.231 -0.000 -39.470) 39.696 26.921 ( -1.133 0.000 19.740) 19.773 28.422 ( -14.819 0.000 14.729) 20.894 ======================= Grid point 507 (241/429) ======================= q-point: (-0.43 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.303 ( -15.606 -17.500 11.230) 25.999 2.557 ( -29.870 -7.970 7.829) 31.891 3.267 ( 9.575 -14.563 -1.774) 17.519 3.763 ( 6.050 -10.312 12.662) 17.415 4.512 ( -0.591 -6.173 -2.549) 6.705 4.719 ( -22.616 -4.374 -2.495) 23.170 5.058 ( -3.508 -3.399 -14.071) 14.895 5.467 ( -1.306 -6.198 1.524) 6.515 6.261 ( 11.653 1.787 -4.259) 12.535 6.470 ( -10.467 2.919 -1.609) 10.985 6.590 ( 4.238 -5.139 -2.616) 7.156 6.806 ( 4.385 -5.836 12.011) 14.056 7.044 ( -3.392 -1.254 -2.430) 4.357 7.331 ( 2.132 -3.587 -1.962) 4.611 7.650 ( 5.113 -0.848 -3.782) 6.416 7.898 ( -2.179 -5.325 -3.769) 6.878 8.173 ( 3.389 -14.790 -3.815) 15.646 8.601 ( 5.507 -5.789 5.156) 9.509 9.074 ( 4.647 0.892 7.036) 8.479 9.481 ( 13.029 -0.888 -9.371) 16.073 10.294 ( -0.176 4.837 22.259) 22.780 10.718 ( -9.907 -0.273 19.199) 21.607 12.209 ( -4.034 4.010 -3.434) 6.644 12.745 ( -4.806 20.227 -4.397) 21.250 13.136 ( 11.954 14.367 -2.998) 18.929 13.387 ( -7.675 10.498 -10.685) 16.831 14.590 ( -7.863 3.124 -3.477) 9.148 14.607 ( 7.455 -11.153 -1.083) 13.459 15.318 ( -11.819 37.273 6.842) 39.697 17.120 ( 21.393 -50.604 -1.816) 54.970 19.427 ( -5.594 -23.762 5.340) 24.989 20.423 ( 5.071 -24.886 -7.031) 26.353 22.171 ( 4.082 -0.317 -14.882) 15.435 24.717 ( 0.932 -0.451 -38.613) 38.626 26.966 ( -0.268 -1.465 20.404) 20.458 28.317 ( -12.430 5.674 14.852) 20.181 ======================= Grid point 508 (242/429) ======================= q-point: (-0.36 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.593 ( -19.482 -18.519 9.283) 28.438 2.621 ( -24.967 -15.013 8.374) 30.312 3.646 ( 11.722 -16.525 2.514) 20.416 4.058 ( 4.800 -15.850 4.493) 17.160 4.551 ( -2.029 0.727 -8.841) 9.100 4.726 ( -16.522 -8.863 -1.386) 18.801 5.089 ( -10.183 -3.731 -6.686) 12.740 5.644 ( 3.271 -11.337 0.307) 11.803 6.124 ( 5.926 15.180 -1.518) 16.367 6.517 ( -7.015 -13.866 2.155) 15.688 6.690 ( 1.219 -2.404 -8.592) 9.005 6.938 ( -16.581 -9.310 7.794) 20.551 7.155 ( 13.349 -8.244 10.091) 18.654 7.425 ( -0.410 -6.541 -4.854) 8.155 7.780 ( 8.254 -9.593 -7.212) 14.565 8.129 ( -1.320 -20.265 -3.646) 20.633 8.488 ( 11.416 -16.282 -5.129) 20.536 8.760 ( 0.265 -8.098 -0.269) 8.107 9.112 ( 8.286 -0.258 7.094) 10.911 9.573 ( 9.723 -4.413 -8.823) 13.852 10.202 ( 0.110 8.669 23.617) 25.158 10.735 ( -7.202 -2.767 17.799) 19.400 12.011 ( 1.165 21.621 -2.624) 21.811 12.281 ( -9.410 16.733 -7.484) 20.605 12.856 ( 8.294 21.394 -7.731) 24.213 13.154 ( -6.834 7.383 -2.667) 10.408 13.985 ( -4.640 25.332 -1.973) 25.828 14.534 ( -12.989 32.619 6.996) 35.800 15.558 ( 9.771 -48.536 -4.885) 49.750 18.038 ( 17.173 -32.044 6.395) 36.914 19.870 ( -7.477 -25.168 6.256) 26.991 21.090 ( 11.954 -39.221 -15.285) 43.758 22.188 ( 4.209 -2.319 -12.648) 13.530 24.661 ( -2.266 -1.113 -34.412) 34.504 27.052 ( 1.224 -3.435 20.013) 20.343 28.136 ( -10.998 8.991 14.270) 20.135 ======================= Grid point 509 (243/429) ======================= q-point: (-0.29 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( -22.148 -12.447 9.711) 27.199 2.886 ( -17.026 -18.465 6.721) 26.000 3.945 ( 7.097 -8.737 5.124) 12.368 4.361 ( 0.694 -4.608 -1.198) 4.811 4.512 ( 6.274 -7.744 -16.910) 19.629 4.841 ( -7.201 -8.604 -3.910) 11.881 5.051 ( -6.606 -0.375 6.334) 9.160 5.787 ( -1.959 2.979 2.672) 4.456 5.937 ( 8.040 3.547 -0.770) 8.821 6.639 ( -11.479 -2.661 -5.669) 13.076 6.824 ( 2.308 -11.754 2.140) 12.168 7.032 ( -7.879 -8.411 1.164) 11.583 7.429 ( 6.099 -9.943 6.072) 13.150 7.652 ( -2.212 -21.043 -0.025) 21.158 8.049 ( 0.250 -16.564 -1.241) 16.612 8.483 ( 3.929 -14.723 -6.421) 16.536 8.872 ( 2.506 -10.702 -4.494) 11.874 8.962 ( 9.335 -19.546 -7.393) 22.888 9.240 ( 9.348 -10.312 3.955) 14.470 9.747 ( 5.671 -11.001 -5.985) 13.748 10.114 ( 2.056 3.605 20.525) 20.941 10.775 ( -7.380 -0.984 17.873) 19.361 11.399 ( 0.325 35.503 -1.501) 35.536 12.014 ( -3.524 13.033 -9.052) 16.255 12.501 ( -2.357 14.100 -4.560) 15.005 12.997 ( -0.900 7.395 0.293) 7.455 13.585 ( -6.272 14.241 -0.615) 15.573 13.982 ( -7.467 21.263 4.172) 22.919 16.484 ( 12.023 -43.298 -5.263) 45.243 18.533 ( 9.289 -12.942 9.226) 18.409 20.266 ( -6.616 -18.946 5.578) 20.829 21.758 ( 13.281 -21.716 -25.062) 35.722 22.339 ( 6.190 -16.390 -3.826) 17.933 24.603 ( -5.107 -0.852 -26.920) 27.414 27.176 ( 2.353 -4.669 18.070) 18.811 27.927 ( -10.196 9.142 12.819) 18.758 ======================= Grid point 510 (244/429) ======================= q-point: (-0.21 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.846 ( -16.106 -9.310 9.145) 20.730 3.122 ( -12.094 -14.586 6.574) 20.056 4.105 ( 0.884 -5.481 2.945) 6.284 4.283 ( 2.470 4.655 -10.663) 11.894 4.728 ( -7.353 -7.710 -5.023) 11.779 4.888 ( 10.789 -0.375 -10.450) 15.025 5.177 ( 8.012 -8.632 17.180) 20.829 5.651 ( -1.637 6.772 1.084) 7.051 5.961 ( 0.725 -0.791 0.681) 1.271 6.614 ( -9.914 -2.391 -3.886) 10.914 6.958 ( -3.317 -3.793 -6.286) 8.056 7.191 ( -1.515 -9.673 8.624) 13.047 7.635 ( -0.950 -8.991 2.047) 9.270 8.051 ( 6.145 -17.158 5.035) 18.908 8.353 ( -8.253 -16.777 -1.920) 18.796 8.675 ( 9.744 -3.143 -8.786) 13.491 9.054 ( -1.580 -12.475 -5.771) 13.835 9.279 ( 9.194 -12.219 -3.807) 15.759 9.737 ( 6.160 -31.774 -5.499) 32.829 9.946 ( 4.366 -5.080 5.263) 8.519 10.264 ( 3.594 -11.814 9.843) 15.792 10.619 ( -6.118 12.181 1.651) 13.731 10.985 ( -3.605 5.245 14.722) 16.039 11.644 ( 0.306 22.739 -2.439) 22.872 12.304 ( -7.849 4.768 -6.429) 11.210 12.868 ( 2.170 6.607 1.304) 7.076 13.363 ( -5.661 6.291 1.588) 8.610 13.645 ( -4.392 12.255 1.428) 13.097 17.268 ( 12.954 -33.618 -4.964) 36.368 18.726 ( 4.732 -2.970 7.503) 9.354 20.495 ( -7.241 -8.626 5.257) 12.429 21.951 ( 8.014 -2.962 -24.834) 26.262 22.815 ( 10.436 -23.881 -1.458) 26.102 24.530 ( -7.133 0.568 -17.843) 19.224 27.306 ( 2.281 -4.165 15.397) 16.113 27.736 ( -9.251 7.500 10.534) 15.900 ======================= Grid point 511 (245/429) ======================= q-point: (-0.14 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.951 ( -6.987 -7.893 9.197) 13.989 3.344 ( -6.426 -14.149 6.441) 16.822 4.125 ( -5.523 0.644 -10.770) 12.120 4.279 ( 4.722 -1.922 5.506) 7.504 4.745 ( -2.596 -0.641 -1.045) 2.871 4.933 ( 5.001 0.492 -3.218) 5.967 5.399 ( 12.062 -1.991 3.631) 12.753 5.550 ( 3.271 2.746 5.298) 6.805 5.993 ( -3.457 -3.325 4.544) 6.607 6.596 ( -7.482 -1.409 -2.646) 8.060 6.958 ( -7.247 -1.825 -11.427) 13.653 7.367 ( -0.439 -7.213 12.008) 14.015 7.735 ( -3.803 -2.928 6.141) 7.794 8.337 ( 7.889 -5.812 6.855) 11.958 8.540 ( -2.457 -8.181 -9.679) 12.909 8.762 ( 9.433 -6.299 -9.067) 14.521 9.277 ( -0.329 -11.032 -9.850) 14.793 9.528 ( 3.336 -8.904 -7.740) 12.260 10.058 ( 6.294 -3.267 8.795) 11.297 10.087 ( 0.343 6.801 -3.240) 7.541 10.404 ( 0.960 -24.829 3.147) 25.046 10.852 ( -4.604 -20.717 -1.804) 21.299 10.978 ( -5.674 -0.922 22.066) 22.802 11.272 ( 0.601 10.471 1.471) 10.591 12.144 ( -7.579 7.191 -5.262) 11.698 12.786 ( 2.672 3.817 2.118) 5.118 13.279 ( -2.509 0.978 2.596) 3.741 13.465 ( -3.048 5.149 -0.186) 5.986 17.872 ( 11.885 -24.470 -4.239) 27.532 18.754 ( 2.140 2.719 4.640) 5.788 20.544 ( -7.279 -0.903 4.345) 8.525 21.973 ( 6.352 -0.412 -21.629) 22.546 23.240 ( 9.060 -15.145 -0.665) 17.661 24.441 ( -7.488 1.461 -9.793) 12.414 27.409 ( 1.774 -2.813 13.820) 14.214 27.580 ( -8.257 5.571 7.298) 12.348 ======================= Grid point 512 (246/429) ======================= q-point: (-0.07 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.119 ( 1.679 -10.068 9.607) 14.017 3.614 ( -3.645 -16.148 6.598) 17.821 4.052 ( -6.775 0.913 -8.810) 11.151 4.341 ( 2.570 0.030 8.892) 9.256 4.714 ( -0.730 3.886 2.598) 4.731 4.946 ( 1.113 -1.482 -2.058) 2.770 5.298 ( -2.462 9.753 -6.115) 11.772 5.661 ( 16.561 -1.460 11.128) 20.006 6.059 ( -4.600 -4.532 6.585) 9.222 6.569 ( -5.453 -0.020 -2.105) 5.845 6.909 ( -8.353 -0.296 -13.416) 15.806 7.485 ( 0.038 -2.695 9.904) 10.264 7.772 ( -2.192 -2.312 12.713) 13.106 8.387 ( 6.004 2.450 0.732) 6.526 8.610 ( -0.693 -2.603 -13.609) 13.873 9.027 ( 10.009 -14.418 -0.830) 17.571 9.303 ( -1.775 5.519 -17.285) 18.231 9.646 ( 5.851 -6.088 -7.732) 11.449 9.978 ( -3.130 3.536 -3.462) 5.855 10.267 ( 3.341 -10.405 5.894) 12.416 10.603 ( 0.126 4.491 10.234) 11.177 10.966 ( -5.563 -0.810 7.730) 9.558 11.066 ( -4.475 -11.113 2.885) 12.323 11.472 ( 0.111 -17.331 7.408) 18.848 11.943 ( -5.250 8.619 -1.589) 10.217 12.765 ( 1.266 0.287 2.830) 3.113 13.286 ( 0.058 -1.193 2.255) 2.552 13.401 ( -2.258 0.478 -0.577) 2.379 18.309 ( 8.860 -16.690 -3.027) 19.137 18.675 ( -0.406 6.864 1.759) 7.098 20.496 ( -5.317 2.082 3.348) 6.619 21.973 ( 6.009 -0.088 -19.429) 20.337 23.476 ( 5.173 -5.736 0.637) 7.750 24.376 ( -4.801 -0.331 -4.654) 6.694 27.429 ( -2.172 5.972 12.171) 13.730 27.518 ( -3.687 -4.257 5.588) 7.933 ======================= Grid point 521 (247/429) ======================= q-point: (-0.43 -0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.047 ( -18.319 0.000 13.141) 22.545 2.325 ( -30.035 0.000 13.255) 32.830 3.144 ( 6.252 -0.000 -2.877) 6.882 3.720 ( 3.192 -0.000 14.493) 14.841 4.441 ( 1.796 -0.000 -2.602) 3.162 4.509 ( -32.637 0.000 8.132) 33.635 4.988 ( -1.277 0.000 -22.565) 22.601 5.401 ( -1.371 0.000 1.432) 1.983 6.195 ( -22.841 0.000 -17.160) 28.568 6.479 ( 3.051 -0.000 -8.296) 8.839 6.557 ( 8.898 -0.000 11.152) 14.267 6.882 ( 7.160 -0.000 15.418) 16.999 7.043 ( 12.929 -0.000 -10.887) 16.903 7.298 ( 1.249 -0.000 -1.636) 2.059 7.651 ( -3.117 0.000 3.994) 5.067 7.933 ( 0.033 -0.000 3.384) 3.384 7.945 ( 5.665 -0.000 -10.320) 11.773 8.592 ( 4.777 -0.000 5.840) 7.545 9.125 ( 6.799 -0.000 4.887) 8.373 9.528 ( 11.772 -0.000 -11.032) 16.133 10.405 ( 6.307 -0.000 25.263) 26.038 10.699 ( -9.224 0.000 18.559) 20.725 12.212 ( -5.120 0.000 -2.191) 5.569 12.929 ( -0.623 0.000 -5.319) 5.355 13.313 ( -4.537 0.000 -4.174) 6.165 13.547 ( 5.128 -0.000 -8.061) 9.554 14.045 ( 1.835 -0.000 -4.384) 4.752 15.006 ( -14.375 0.000 4.846) 15.170 15.873 ( -0.734 0.000 2.503) 2.608 16.417 ( 14.863 -0.000 -7.948) 16.854 19.162 ( -0.745 0.000 2.276) 2.395 20.189 ( 0.607 -0.000 -1.784) 1.885 22.167 ( 5.078 -0.000 -15.776) 16.573 24.632 ( -3.117 0.000 -40.470) 40.590 26.988 ( -0.216 0.000 20.919) 20.920 28.342 ( -9.024 0.000 16.517) 18.822 ======================= Grid point 522 (248/429) ======================= q-point: (-0.36 -0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -20.205 -16.931 11.541) 28.777 2.273 ( -27.665 -8.650 17.073) 33.640 3.345 ( 4.854 -17.024 -1.526) 17.768 3.856 ( 2.009 -10.299 10.398) 14.773 4.408 ( -28.854 -7.112 12.721) 32.325 4.507 ( -1.848 -4.638 -6.014) 7.816 4.960 ( -2.419 -2.639 -20.242) 20.556 5.461 ( -0.669 -7.426 0.649) 7.484 6.124 ( -25.845 -12.439 -13.334) 31.630 6.415 ( 4.613 8.056 -2.773) 9.689 6.660 ( 7.517 -1.837 -4.387) 8.895 6.834 ( -4.948 4.540 12.474) 14.166 7.160 ( 17.621 -3.251 2.742) 18.127 7.354 ( 3.485 -3.594 -2.449) 5.573 7.706 ( 5.679 -2.718 -0.935) 6.365 7.861 ( -1.195 -6.053 -5.184) 8.059 8.218 ( 6.017 -16.196 -1.028) 17.308 8.655 ( 0.858 -3.721 2.476) 4.551 9.176 ( 9.943 0.301 4.371) 10.865 9.574 ( 9.899 -0.726 -11.382) 15.101 10.431 ( 6.999 7.468 28.848) 30.610 10.692 ( -5.791 -1.189 16.122) 17.172 12.146 ( -5.047 3.219 -3.330) 6.850 12.686 ( -2.877 22.472 -2.978) 22.850 13.204 ( -6.610 4.211 -3.090) 8.424 13.288 ( 6.519 20.006 -12.024) 24.235 14.477 ( -9.750 12.938 -3.306) 16.535 14.658 ( 0.727 -18.580 1.218) 18.634 15.221 ( -7.751 32.702 3.537) 33.794 17.362 ( 22.357 -53.565 -2.245) 58.087 19.386 ( -4.769 -21.043 4.536) 22.048 20.455 ( 5.288 -27.785 -7.612) 29.290 22.170 ( 5.462 -0.317 -15.536) 16.472 24.541 ( -6.971 -1.387 -38.970) 39.613 27.044 ( 0.459 -1.851 20.444) 20.532 28.267 ( -6.503 6.664 17.804) 20.092 ======================= Grid point 523 (249/429) ======================= q-point: (-0.29 -0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( -25.305 -14.303 13.644) 32.110 2.419 ( -19.088 -20.466 13.165) 30.928 3.739 ( 2.960 -19.339 1.011) 19.591 4.125 ( 3.664 -14.114 5.291) 15.512 4.491 ( -3.183 -1.592 -8.736) 9.433 4.522 ( -20.242 -13.208 6.779) 25.103 4.968 ( -4.873 -3.346 -9.843) 11.482 5.679 ( 2.436 -12.433 -0.560) 12.681 6.190 ( 5.826 11.056 -8.621) 15.182 6.336 ( -18.197 -16.930 0.364) 24.857 6.676 ( -0.203 -1.324 -1.392) 1.932 6.831 ( -7.059 -5.813 1.440) 9.257 7.355 ( 9.748 -5.538 6.197) 12.810 7.414 ( 3.638 -4.345 5.001) 7.558 7.810 ( 3.104 -9.179 -11.342) 14.918 8.147 ( 5.576 -19.306 -1.214) 20.131 8.597 ( 10.031 -20.016 -3.229) 22.621 8.735 ( -3.259 -5.591 -3.490) 7.353 9.249 ( 12.250 -0.640 3.671) 12.804 9.637 ( 7.533 -3.465 -10.408) 13.307 10.326 ( 3.664 10.900 26.775) 29.140 10.738 ( -2.704 -2.252 17.892) 18.235 12.012 ( 0.274 14.989 -2.807) 15.252 12.159 ( -6.987 22.725 -5.578) 24.420 12.853 ( -3.881 22.354 -11.202) 25.303 13.108 ( 1.273 5.808 0.193) 5.949 13.907 ( -7.600 24.487 -1.386) 25.677 14.394 ( -16.178 27.896 7.525) 33.114 15.679 ( 14.914 -47.926 -6.790) 50.650 18.263 ( 17.687 -27.625 6.835) 33.506 19.814 ( -5.434 -25.162 4.497) 26.132 21.177 ( 14.342 -40.846 -18.830) 47.209 22.200 ( 5.880 -3.203 -12.068) 13.801 24.467 ( -9.676 -2.989 -33.880) 35.361 27.138 ( 1.057 -3.819 18.156) 18.583 28.097 ( -5.886 10.740 18.509) 22.194 ======================= Grid point 524 (250/429) ======================= q-point: (-0.21 -0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.534 ( -20.277 -14.578 13.297) 28.293 2.727 ( -16.250 -20.139 11.502) 28.318 4.008 ( 1.908 -7.890 2.068) 8.377 4.347 ( -0.582 0.730 -5.186) 5.270 4.478 ( -2.624 -11.353 -10.507) 15.690 4.770 ( -9.041 -15.579 8.152) 19.771 5.053 ( 6.444 -8.528 -1.980) 10.871 5.768 ( -3.256 4.565 3.241) 6.477 6.049 ( 12.547 6.119 -4.050) 14.535 6.459 ( -16.537 -6.054 -0.774) 17.627 6.815 ( -3.050 -9.746 -2.613) 10.541 6.965 ( -3.793 -12.453 -1.275) 13.080 7.467 ( 0.654 -9.065 -5.875) 10.822 7.709 ( 5.394 -17.897 16.957) 25.237 8.019 ( -2.855 -13.851 -5.101) 15.034 8.538 ( 8.124 -16.647 -2.922) 18.753 8.816 ( -5.070 -7.785 -8.126) 12.343 9.074 ( 11.747 -23.086 -8.313) 27.205 9.356 ( 9.649 -5.385 1.242) 11.119 9.788 ( 5.741 -10.973 -6.954) 14.203 10.227 ( 2.329 4.411 20.810) 21.400 10.780 ( -3.041 1.478 19.697) 19.985 11.396 ( 0.370 35.678 -2.050) 35.739 11.956 ( -1.286 8.402 -6.754) 10.857 12.420 ( -8.161 16.791 -5.923) 19.587 13.006 ( 1.997 6.212 1.586) 6.715 13.510 ( -6.677 13.737 0.530) 15.283 13.898 ( -9.913 18.301 3.928) 21.181 16.623 ( 16.088 -42.948 -7.174) 46.420 18.673 ( 8.725 -9.093 9.504) 15.784 20.210 ( -6.387 -18.289 4.930) 19.990 21.807 ( 13.037 -16.708 -30.653) 37.266 22.429 ( 11.938 -20.832 -1.776) 24.075 24.414 ( -11.010 -3.263 -25.635) 28.090 27.255 ( 0.416 -4.730 13.950) 14.736 27.890 ( -5.673 10.924 18.427) 22.160 ======================= Grid point 525 (251/429) ======================= q-point: (-0.14 -0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( -12.463 -13.019 12.788) 22.099 3.021 ( -10.957 -17.393 10.007) 22.863 4.089 ( -2.639 -0.609 -3.200) 4.192 4.292 ( 3.632 0.450 -5.065) 6.249 4.634 ( -5.085 -7.759 -3.284) 9.841 4.959 ( 3.182 -4.380 -0.230) 5.419 5.343 ( 13.357 -12.655 5.603) 19.234 5.627 ( -5.042 5.849 5.989) 9.772 6.007 ( 8.400 4.069 -3.118) 9.841 6.478 ( -11.842 -4.944 -0.121) 12.833 6.863 ( -7.486 -1.688 -9.472) 12.191 7.198 ( -1.941 -12.026 5.305) 13.286 7.640 ( 1.374 -6.809 -1.030) 7.022 8.137 ( 2.061 -20.021 10.511) 22.706 8.275 ( -2.653 -15.858 -1.955) 16.197 8.754 ( 9.054 -2.367 -8.497) 12.640 9.001 ( -2.821 -15.446 -6.781) 17.103 9.361 ( 8.370 -6.687 -6.315) 12.436 9.783 ( 4.822 -32.929 -4.461) 33.578 10.007 ( 4.268 -5.895 2.159) 7.591 10.352 ( 3.030 -11.894 10.369) 16.068 10.552 ( -5.681 18.538 1.083) 19.420 11.010 ( -1.065 4.840 15.429) 16.205 11.653 ( 2.025 22.603 0.127) 22.694 12.166 ( -11.468 4.200 -7.479) 14.321 12.910 ( 3.681 6.060 2.482) 7.512 13.313 ( -4.437 4.706 2.775) 7.039 13.590 ( -6.072 10.680 1.150) 12.339 17.410 ( 15.571 -32.622 -6.750) 36.773 18.808 ( 4.539 -0.669 7.504) 8.795 20.423 ( -8.736 -8.297 5.197) 13.121 21.945 ( 7.683 -2.529 -27.071) 28.253 22.956 ( 15.349 -22.189 -1.780) 27.039 24.362 ( -11.254 -1.979 -16.155) 19.788 27.359 ( -1.780 -4.344 9.001) 10.152 27.705 ( -4.330 9.132 17.745) 20.422 ======================= Grid point 526 (252/429) ======================= q-point: (-0.07 -0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( -3.005 -12.153 12.420) 17.635 3.303 ( -5.585 -16.312 8.622) 19.277 4.023 ( -5.505 2.217 -8.286) 10.192 4.352 ( 4.552 -2.512 5.013) 7.222 4.729 ( 0.096 -4.054 -0.576) 4.096 4.964 ( 1.583 3.779 -1.256) 4.285 5.438 ( 0.730 6.383 -9.104) 11.143 5.701 ( 9.467 -7.811 20.953) 24.283 5.999 ( 4.528 0.242 -1.865) 4.903 6.499 ( -8.292 -3.284 0.453) 8.930 6.809 ( -9.998 -0.980 -13.612) 16.918 7.394 ( -1.462 -8.420 8.191) 11.838 7.718 ( -3.622 -2.868 6.349) 7.852 8.418 ( 0.314 -6.952 1.355) 7.090 8.532 ( 8.594 -7.285 -3.285) 11.735 8.846 ( 10.359 -7.551 -7.814) 15.013 9.218 ( -2.581 -9.107 -11.062) 14.559 9.544 ( 3.965 -9.198 -6.938) 12.184 10.046 ( -3.490 5.725 -3.546) 7.585 10.164 ( 3.174 3.970 10.018) 11.234 10.434 ( 3.541 -29.599 -1.048) 29.829 10.778 ( -5.863 -16.885 -3.669) 18.247 11.020 ( -1.601 0.124 23.489) 23.544 11.289 ( 0.350 9.326 3.149) 9.850 12.022 ( -10.074 4.523 -5.554) 12.360 12.836 ( 4.146 4.624 3.395) 7.078 13.270 ( -0.946 -0.452 3.351) 3.511 13.424 ( -3.981 4.280 -0.281) 5.852 17.997 ( 12.947 -22.761 -5.758) 26.811 18.798 ( 2.380 4.695 4.681) 7.044 20.467 ( -8.995 -1.834 4.349) 10.159 21.964 ( 6.409 -0.679 -22.767) 23.662 23.358 ( 12.147 -12.292 -1.037) 17.313 24.308 ( -9.923 -1.515 -8.152) 12.931 27.428 ( -5.486 -3.683 3.860) 7.653 27.568 ( -0.849 7.181 17.682) 19.103 ======================= Grid point 536 (253/429) ======================= q-point: (-0.36 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -22.390 0.000 13.840) 26.322 2.073 ( -26.309 0.000 24.230) 35.767 3.194 ( 3.973 -0.000 -2.365) 4.623 3.718 ( -17.511 0.000 16.141) 23.815 4.212 ( -22.003 0.000 14.310) 26.247 4.454 ( 2.379 -0.000 -2.936) 3.779 4.882 ( -1.111 0.000 -26.061) 26.085 5.393 ( -1.062 0.000 1.739) 2.038 5.777 ( -36.437 0.000 -12.397) 38.488 6.483 ( 3.059 -0.000 -8.342) 8.885 6.695 ( 7.504 -0.000 1.456) 7.644 6.958 ( 5.334 -0.000 1.881) 5.656 7.245 ( 20.853 -0.000 -1.154) 20.885 7.312 ( 2.198 -0.000 -1.355) 2.582 7.630 ( -3.241 0.000 3.950) 5.110 7.940 ( -0.916 0.000 3.154) 3.284 8.003 ( 9.034 -0.000 -4.606) 10.141 8.629 ( -0.743 0.000 1.894) 2.035 9.248 ( 12.117 -0.000 3.046) 12.494 9.597 ( 8.171 -0.000 -12.486) 14.922 10.607 ( 1.586 -0.000 28.038) 28.083 10.698 ( 6.889 -0.000 18.086) 19.353 12.143 ( -5.726 0.000 -1.885) 6.028 12.915 ( 1.277 -0.000 -3.357) 3.592 13.186 ( -11.661 0.000 -8.568) 14.470 13.617 ( 9.715 -0.000 -4.943) 10.900 14.053 ( 2.240 -0.000 -4.390) 4.928 14.825 ( -19.865 0.000 4.333) 20.332 15.874 ( -0.622 0.000 2.549) 2.623 16.541 ( 12.346 -0.000 -10.834) 16.425 19.162 ( -0.750 0.000 2.271) 2.391 20.189 ( 0.595 -0.000 -1.794) 1.890 22.171 ( 5.900 -0.000 -16.542) 17.563 24.397 ( -12.301 0.000 -39.616) 41.482 27.065 ( 0.048 -0.000 19.721) 19.722 28.352 ( -0.704 0.000 21.036) 21.048 ======================= Grid point 537 (254/429) ======================= q-point: (-0.29 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( -23.546 -16.140 12.095) 31.003 2.069 ( -22.614 -9.450 27.571) 36.890 3.352 ( -4.595 -16.093 1.825) 16.835 3.838 ( -15.279 -20.211 12.922) 28.441 4.182 ( -14.201 -4.520 14.138) 20.542 4.477 ( -0.291 -0.609 -7.422) 7.453 4.863 ( -1.359 -2.876 -19.956) 20.208 5.443 ( -3.787 -9.136 -1.603) 10.018 5.759 ( -27.898 -18.797 -7.358) 34.435 6.458 ( 5.265 4.490 -5.632) 8.922 6.704 ( 3.319 1.690 -7.266) 8.165 6.834 ( -0.331 10.077 5.840) 11.652 7.340 ( 7.001 -1.566 2.469) 7.586 7.423 ( 12.707 -3.877 1.245) 13.343 7.755 ( 3.122 1.218 -1.628) 3.725 7.841 ( 1.246 -12.671 -3.853) 13.302 8.298 ( 7.542 -16.833 1.047) 18.475 8.640 ( -3.174 -2.170 -1.627) 4.175 9.326 ( 13.486 -0.034 2.312) 13.683 9.622 ( 6.465 -0.738 -12.544) 14.131 10.561 ( -7.036 6.036 20.481) 22.481 10.798 ( 16.761 3.097 26.137) 31.204 12.071 ( -5.779 3.112 -3.213) 7.307 12.660 ( -0.303 24.193 -1.482) 24.240 13.042 ( -14.013 6.240 -7.575) 17.108 13.376 ( 10.977 17.686 -6.935) 21.941 14.343 ( -11.726 19.303 -2.942) 22.777 14.619 ( -9.975 -12.821 6.017) 17.323 15.185 ( 1.486 16.926 -2.996) 17.253 17.604 ( 21.801 -58.280 -4.187) 62.365 19.359 ( -1.792 -19.378 2.528) 19.624 20.486 ( 5.495 -31.083 -9.367) 32.926 22.179 ( 6.081 -0.619 -15.716) 16.863 24.270 ( -16.177 -2.833 -36.481) 40.007 27.117 ( -0.354 -2.020 17.333) 17.454 28.316 ( 2.422 8.834 23.777) 25.481 ======================= Grid point 538 (255/429) ======================= q-point: (-0.21 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( -23.990 -17.149 12.777) 32.139 2.283 ( -16.680 -18.856 23.888) 34.704 3.717 ( -8.027 -23.379 3.345) 24.944 4.181 ( 2.781 -11.970 4.834) 13.205 4.317 ( -21.682 -19.913 17.474) 34.234 4.431 ( -0.361 1.536 -14.800) 14.884 4.906 ( -0.030 -7.387 -11.526) 13.690 5.684 ( -1.061 -13.091 -2.415) 13.354 6.023 ( -18.717 -20.694 -5.718) 28.482 6.348 ( 9.739 8.537 1.210) 13.007 6.674 ( -0.086 0.770 2.307) 2.434 6.765 ( -3.835 -5.240 -4.786) 8.067 7.346 ( -2.949 -0.226 -4.291) 5.212 7.596 ( 11.628 -6.211 16.817) 21.369 7.787 ( 1.952 -7.173 -13.883) 15.748 8.224 ( 7.801 -20.233 -0.889) 21.703 8.661 ( -2.269 -7.642 -8.741) 11.830 8.695 ( 5.091 -16.975 -0.435) 17.728 9.409 ( 13.802 0.115 0.918) 13.833 9.664 ( 4.268 -3.869 -11.546) 12.904 10.409 ( -6.395 8.842 18.666) 21.622 10.862 ( 11.731 3.703 26.964) 29.638 11.983 ( -2.944 2.997 -4.773) 6.359 12.100 ( -0.662 33.739 -2.316) 33.825 12.717 ( -11.337 17.755 -9.150) 22.967 13.163 ( 6.811 9.802 -0.111) 11.937 13.809 ( -8.691 22.385 -0.709) 24.023 14.224 ( -18.646 23.580 7.545) 30.994 15.838 ( 17.867 -48.004 -9.079) 52.020 18.471 ( 13.062 -23.194 7.328) 27.610 19.792 ( 0.287 -23.780 1.511) 23.829 21.272 ( 17.058 -42.149 -27.916) 53.356 22.239 ( 8.463 -6.098 -9.039) 13.802 24.193 ( -17.386 -5.776 -30.447) 35.534 27.195 ( -1.653 -3.695 12.872) 13.494 28.153 ( 1.856 13.905 25.784) 29.353 ======================= Grid point 539 (256/429) ======================= q-point: (-0.14 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.372 ( -17.176 -17.983 14.596) 28.835 2.612 ( -13.486 -20.544 18.270) 30.622 4.009 ( -1.947 -9.170 0.074) 9.374 4.316 ( -0.688 2.037 -7.323) 7.632 4.419 ( -2.430 -10.873 -2.764) 11.479 4.671 ( -14.815 -21.606 15.346) 30.361 5.153 ( 12.622 -15.949 -10.862) 23.058 5.737 ( -4.263 5.284 3.491) 7.634 6.161 ( 7.035 0.811 -5.295) 8.843 6.311 ( -6.907 -2.326 4.569) 8.602 6.753 ( -4.758 -5.408 -5.001) 8.769 6.926 ( -2.360 -14.500 -2.058) 14.834 7.447 ( 1.086 -13.458 -5.824) 14.705 7.832 ( 2.345 -10.750 16.793) 20.077 7.969 ( -0.706 -14.689 -5.099) 15.565 8.627 ( 7.021 -17.732 0.243) 19.073 8.722 ( -3.585 -6.044 -12.848) 14.644 9.149 ( 7.121 -25.164 -8.139) 27.390 9.461 ( 8.352 0.010 -2.384) 8.686 9.829 ( 5.914 -12.776 -6.277) 15.414 10.274 ( -5.934 3.751 13.522) 15.235 10.876 ( 5.232 7.445 25.833) 27.389 11.399 ( 2.165 35.075 -2.527) 35.232 11.932 ( 0.294 3.746 -5.648) 6.784 12.290 ( -10.182 18.896 -4.761) 21.987 13.049 ( 3.870 6.442 2.813) 8.024 13.443 ( -5.664 12.367 1.773) 13.718 13.787 ( -11.931 15.071 3.334) 19.509 16.790 ( 18.288 -42.462 -9.124) 47.125 18.787 ( 4.604 -6.813 9.596) 12.637 20.163 ( -4.537 -15.588 3.852) 16.686 21.821 ( 11.177 -12.584 -37.206) 40.836 22.604 ( 19.885 -24.234 -1.058) 31.366 24.168 ( -16.429 -6.632 -22.284) 28.469 27.274 ( -4.204 -4.246 7.407) 9.516 27.945 ( 0.869 13.509 26.151) 29.447 ======================= Grid point 540 (257/429) ======================= q-point: (-0.07 -0.36 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.656 ( -8.506 -17.025 15.052) 24.264 2.951 ( -8.850 -19.214 13.622) 25.161 4.047 ( -1.904 2.664 -3.072) 4.490 4.317 ( 3.020 -3.503 -2.577) 5.295 4.586 ( -1.820 -9.034 -2.893) 9.659 4.963 ( -3.838 -9.631 7.469) 12.777 5.470 ( 6.441 -6.045 -11.065) 14.158 5.616 ( 0.157 -1.039 14.298) 14.337 6.120 ( 12.694 6.006 -3.581) 14.493 6.365 ( -8.235 -5.532 3.471) 10.510 6.728 ( -9.392 0.282 -11.093) 14.538 7.186 ( -2.835 -13.392 3.122) 14.041 7.658 ( 2.978 -4.490 -2.600) 5.983 8.138 ( -5.317 -19.957 6.602) 21.683 8.310 ( 5.426 -18.781 4.796) 20.129 8.792 ( 3.648 -5.070 -13.681) 15.039 8.966 ( 0.756 -14.833 -2.480) 15.058 9.422 ( 6.872 -2.806 -7.601) 10.624 9.807 ( 2.133 -33.902 -4.156) 34.222 10.064 ( 4.325 -3.419 2.297) 5.973 10.344 ( -7.489 -17.346 -0.927) 18.917 10.538 ( 0.904 27.429 5.266) 27.945 11.089 ( 4.017 4.544 18.966) 19.912 11.686 ( 2.625 24.019 2.390) 24.280 11.998 ( -12.457 2.682 -8.323) 15.220 12.967 ( 4.288 5.520 3.961) 8.034 13.287 ( -2.136 3.068 3.975) 5.457 13.516 ( -7.446 8.716 0.592) 11.479 17.566 ( 16.495 -31.301 -8.339) 36.351 18.876 ( 2.389 0.393 7.289) 7.681 20.338 ( -9.184 -7.105 4.720) 12.534 21.926 ( 7.239 -2.941 -29.495) 30.512 23.150 ( 20.184 -19.201 -2.866) 28.005 24.159 ( -14.606 -5.240 -13.280) 20.425 27.328 ( -6.833 -3.858 3.281) 8.506 27.770 ( 1.092 10.648 24.141) 26.408 ======================= Grid point 551 (258/429) ======================= q-point: (-0.29 -0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( -24.280 0.000 15.668) 28.896 1.905 ( -22.470 0.000 33.004) 39.927 3.215 ( 1.249 -0.000 -2.156) 2.491 3.430 ( -42.728 0.000 28.925) 51.598 4.149 ( -0.613 0.000 9.577) 9.596 4.473 ( 2.806 -0.000 -3.366) 4.382 4.782 ( 0.496 -0.000 -24.718) 24.723 5.310 ( -37.730 0.000 -9.770) 38.975 5.390 ( -0.695 0.000 2.128) 2.239 6.487 ( 2.992 -0.000 -8.369) 8.888 6.733 ( 2.443 -0.000 -8.767) 9.102 7.025 ( 4.258 -0.000 2.079) 4.739 7.338 ( 3.093 -0.000 -1.160) 3.303 7.473 ( 19.493 -0.000 0.401) 19.497 7.607 ( -3.366 0.000 3.970) 5.205 7.936 ( -1.776 0.000 2.889) 3.391 8.101 ( 9.353 -0.000 -1.783) 9.522 8.603 ( -3.038 0.000 -1.373) 3.334 9.400 ( 11.979 -0.000 -0.491) 11.989 9.631 ( 6.487 -0.000 -11.905) 13.558 10.568 ( -13.164 0.000 12.207) 17.953 11.051 ( 29.471 -0.000 33.594) 44.689 12.072 ( -5.567 0.000 -1.412) 5.743 12.935 ( 3.458 -0.000 -0.951) 3.586 13.010 ( -12.938 0.000 -8.454) 15.455 13.714 ( 10.165 -0.000 -4.346) 11.055 14.063 ( 2.482 -0.000 -4.394) 5.047 14.600 ( -22.014 0.000 4.222) 22.416 15.877 ( -0.558 0.000 2.613) 2.672 16.598 ( 5.800 -0.000 -17.662) 18.590 19.162 ( -0.752 0.000 2.264) 2.385 20.189 ( 0.582 -0.000 -1.808) 1.899 22.178 ( 6.066 -0.000 -16.548) 17.625 24.065 ( -21.810 0.000 -33.753) 40.186 27.123 ( -1.594 0.000 15.310) 15.392 28.499 ( 11.650 -0.000 27.429) 29.800 ======================= Grid point 552 (259/429) ======================= q-point: (-0.21 -0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.706 ( -24.382 -14.775 14.200) 31.850 1.952 ( -18.788 -11.539 33.844) 40.392 3.231 ( -22.592 -14.757 16.043) 31.394 3.674 ( -16.259 -29.809 12.356) 36.133 4.173 ( 1.562 -0.731 7.401) 7.599 4.441 ( -1.261 2.527 -7.946) 8.433 4.776 ( -2.900 -2.393 -16.002) 16.438 5.282 ( -19.767 -20.084 -9.151) 29.629 5.553 ( -6.010 -15.617 2.018) 16.854 6.492 ( 4.718 0.783 -6.744) 8.268 6.683 ( -1.165 1.905 -9.139) 9.408 6.872 ( 3.098 13.169 5.369) 14.555 7.380 ( 1.842 2.392 -0.359) 3.040 7.576 ( 8.936 -4.951 1.497) 10.325 7.770 ( 1.077 4.327 -0.587) 4.497 7.876 ( 7.861 -18.053 -2.482) 19.846 8.380 ( 5.971 -16.573 -1.263) 17.661 8.592 ( -3.009 -1.211 -2.184) 3.910 9.469 ( 9.737 -1.535 -2.696) 10.219 9.639 ( 5.402 0.729 -11.291) 12.538 10.478 ( -15.266 3.058 10.805) 18.951 11.194 ( 30.335 10.051 35.357) 47.658 11.995 ( -5.444 3.348 -2.907) 7.021 12.664 ( 1.478 25.352 -1.194) 25.423 12.858 ( -13.835 7.254 -3.732) 16.061 13.475 ( 10.879 16.814 -6.486) 21.051 14.194 ( -12.655 20.914 -2.211) 24.544 14.483 ( -18.651 2.343 9.421) 21.026 15.224 ( 8.480 -4.773 -8.883) 13.176 17.803 ( 15.797 -63.111 -8.857) 65.658 19.377 ( 5.510 -20.986 -1.819) 21.773 20.504 ( 4.642 -34.405 -13.643) 37.301 22.197 ( 7.286 -1.770 -13.517) 15.458 23.916 ( -24.058 -4.497 -28.072) 37.243 27.152 ( -3.171 -1.763 11.791) 12.336 28.509 ( 14.050 12.671 30.045) 35.506 ======================= Grid point 553 (260/429) ======================= q-point: (-0.14 -0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.923 ( -21.331 -19.983 13.653) 32.260 2.214 ( -13.415 -18.131 30.839) 38.206 3.597 ( -16.698 -29.185 11.550) 35.553 4.150 ( -13.174 -22.805 10.519) 28.360 4.244 ( 1.602 -5.534 5.077) 7.679 4.382 ( 0.513 0.304 -11.455) 11.470 4.855 ( -2.972 -13.795 -9.482) 17.002 5.623 ( -5.996 -18.018 -7.615) 20.460 5.862 ( -7.776 -20.042 3.333) 21.754 6.450 ( 6.710 6.284 -1.875) 9.383 6.706 ( -0.136 1.095 -0.186) 1.119 6.712 ( 2.908 -2.833 -1.048) 4.193 7.285 ( -5.142 0.857 -3.641) 6.358 7.746 ( 4.745 -8.701 -0.872) 9.949 7.780 ( 5.086 -2.272 2.535) 6.120 8.309 ( 7.964 -20.358 -2.467) 21.999 8.585 ( -2.063 -4.959 -12.364) 13.480 8.755 ( 4.034 -17.660 0.766) 18.131 9.549 ( 9.967 1.288 -2.118) 10.271 9.648 ( 0.756 -5.850 -12.238) 13.585 10.340 ( -12.801 4.627 10.933) 17.458 11.171 ( 20.211 13.317 34.553) 42.187 11.923 ( -3.789 0.407 -6.051) 7.150 12.109 ( 2.925 35.379 -1.798) 35.545 12.563 ( -10.222 14.702 -4.048) 18.358 13.247 ( 7.889 12.009 -0.433) 14.375 13.712 ( -7.893 19.597 0.003) 21.127 14.027 ( -20.705 19.322 7.069) 29.190 16.012 ( 19.217 -48.599 -11.324) 53.473 18.584 ( 0.958 -20.739 7.319) 22.013 19.843 ( 8.883 -19.319 -2.116) 21.369 21.334 ( 15.740 -41.473 -44.705) 62.978 22.350 ( 16.273 -12.673 -2.762) 20.810 23.861 ( -22.977 -8.744 -22.168) 33.103 27.191 ( -5.421 -2.926 7.314) 9.563 28.327 ( 9.332 18.513 31.721) 37.895 ======================= Grid point 554 (261/429) ======================= q-point: (-0.07 -0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -12.830 -22.257 14.976) 29.737 2.557 ( -10.028 -19.801 24.222) 32.853 3.978 ( -3.387 -12.948 1.659) 13.486 4.276 ( -2.392 -0.473 -5.117) 5.669 4.400 ( -0.106 -8.727 -2.095) 8.975 4.579 ( -10.096 -22.824 15.141) 29.191 5.211 ( 3.498 -21.367 -10.136) 23.907 5.711 ( -1.438 3.726 1.859) 4.406 6.157 ( -1.027 -11.712 1.602) 11.865 6.347 ( 5.894 6.691 -0.990) 8.972 6.676 ( -5.080 1.961 -6.266) 8.302 6.898 ( -1.061 -14.192 -0.484) 14.240 7.465 ( 5.030 -19.525 -2.932) 20.375 7.836 ( -3.897 -5.447 -1.670) 6.903 8.005 ( 2.116 -15.119 11.773) 19.279 8.606 ( -3.800 -10.485 -11.836) 16.262 8.732 ( 7.642 -11.725 -3.856) 14.517 9.183 ( 4.231 -26.925 -7.408) 28.244 9.509 ( 2.629 3.114 -6.690) 7.833 9.871 ( 4.261 -15.878 -5.385) 17.300 10.219 ( -8.507 3.459 8.615) 12.592 11.046 ( 5.184 18.368 24.940) 31.404 11.446 ( 7.768 30.836 1.388) 31.830 11.893 ( -3.882 -0.081 -8.078) 8.962 12.190 ( -4.420 21.295 0.092) 21.749 13.110 ( 4.462 7.086 3.935) 9.252 13.400 ( -3.318 10.323 2.974) 11.243 13.654 ( -13.099 11.641 2.358) 17.682 16.966 ( 18.898 -41.864 -10.738) 47.171 18.833 ( -3.237 -7.600 9.336) 12.466 20.138 ( -1.884 -10.561 2.473) 11.009 21.784 ( 8.395 -11.998 -43.040) 45.463 22.871 ( 28.211 -23.980 -3.350) 37.177 23.887 ( -20.005 -10.229 -16.134) 27.661 27.224 ( -7.606 -3.410 3.616) 9.086 28.087 ( 4.787 16.625 30.346) 34.931 ======================= Grid point 566 (262/429) ======================= q-point: (-0.21 -0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( -23.749 0.000 18.494) 30.100 1.775 ( -23.949 0.000 33.777) 41.406 3.061 ( -42.588 0.000 44.021) 61.250 3.209 ( -0.826 0.000 -2.118) 2.274 4.203 ( 3.838 -0.000 5.671) 6.847 4.492 ( 2.780 -0.000 -3.797) 4.706 4.716 ( 0.540 -0.000 -17.235) 17.243 4.868 ( -31.368 0.000 -11.256) 33.326 5.393 ( -0.306 0.000 2.517) 2.535 6.489 ( 2.864 -0.000 -8.377) 8.853 6.698 ( -1.216 0.000 -13.175) 13.231 7.067 ( 1.362 -0.000 5.091) 5.271 7.373 ( 3.874 -0.000 -1.189) 4.052 7.583 ( -3.473 0.000 4.169) 5.426 7.689 ( 17.400 -0.000 1.866) 17.500 7.922 ( -2.490 0.000 2.626) 3.619 8.182 ( 7.022 -0.000 -6.229) 9.387 8.568 ( -2.066 0.000 -0.282) 2.085 9.466 ( 1.895 -0.000 -10.062) 10.239 9.682 ( 8.225 -0.000 -6.932) 10.756 10.426 ( -17.344 0.000 7.614) 18.942 11.570 ( 38.062 -0.000 32.365) 49.963 12.016 ( -2.597 0.000 1.076) 2.811 12.847 ( -11.207 0.000 -0.931) 11.246 12.989 ( 6.636 -0.000 -1.951) 6.917 13.814 ( 10.337 -0.000 -4.163) 11.144 14.076 ( 2.514 -0.000 -4.397) 5.064 14.367 ( -21.210 0.000 4.518) 21.686 15.881 ( -0.555 0.000 2.684) 2.740 16.505 ( -9.283 0.000 -28.332) 29.814 19.162 ( -0.750 0.000 2.257) 2.378 20.189 ( 0.571 -0.000 -1.824) 1.911 22.197 ( 8.025 -0.000 -12.947) 15.232 23.680 ( -26.618 0.000 -20.503) 33.598 27.135 ( -4.463 0.000 9.872) 10.834 28.822 ( 25.865 -0.000 29.779) 39.443 ======================= Grid point 567 (263/429) ======================= q-point: (-0.14 -0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.495 ( -22.373 -13.985 17.229) 31.511 1.864 ( -19.465 -16.635 32.354) 41.260 3.014 ( -28.484 -16.788 35.118) 48.234 3.588 ( -5.883 -30.712 6.268) 31.892 4.225 ( 3.764 0.538 1.888) 4.245 4.370 ( -8.387 3.437 -6.903) 11.393 4.675 ( -5.385 -1.592 -7.780) 9.595 5.070 ( -8.301 -27.396 -11.642) 30.903 5.535 ( -0.850 -13.448 3.525) 13.928 6.515 ( 3.866 -1.568 -7.284) 8.394 6.623 ( -3.386 1.526 -7.822) 8.659 6.942 ( 5.301 11.567 7.002) 14.523 7.389 ( -0.346 8.508 0.185) 8.517 7.620 ( 1.311 -7.567 -3.692) 8.521 7.776 ( -0.266 -0.793 0.638) 1.052 8.009 ( 15.150 -14.061 -0.377) 20.673 8.403 ( 2.169 -13.493 -11.275) 17.716 8.577 ( -0.413 -3.272 4.557) 5.625 9.482 ( -2.213 -4.629 -11.423) 12.522 9.671 ( 3.525 3.521 -7.597) 9.085 10.332 ( -14.160 1.376 8.338) 16.489 11.714 ( 35.801 14.790 33.561) 51.252 11.928 ( -3.955 6.083 -0.515) 7.274 12.668 ( -0.987 20.467 -3.303) 20.755 12.732 ( -6.368 14.163 5.504) 16.475 13.578 ( 11.560 16.324 -6.333) 20.981 14.048 ( -11.558 19.276 -1.257) 22.511 14.271 ( -25.170 15.209 10.878) 31.356 15.300 ( 11.791 -22.634 -13.268) 28.764 17.855 ( -0.319 -66.046 -15.434) 67.826 19.481 ( 16.455 -28.494 -10.437) 34.520 20.472 ( -0.304 -34.805 -19.809) 40.049 22.272 ( 14.144 -4.833 -6.154) 16.165 23.549 ( -25.177 -5.218 -13.678) 29.124 27.133 ( -6.037 -1.196 7.098) 9.394 28.841 ( 23.241 18.671 30.342) 42.537 ======================= Grid point 568 (264/429) ======================= q-point: (-0.07 -0.21 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( -16.250 -23.121 15.970) 32.461 2.195 ( -10.883 -19.237 32.338) 39.169 3.458 ( -16.618 -34.113 20.668) 43.210 4.065 ( -7.261 -17.176 6.390) 19.712 4.269 ( 2.522 -5.431 -6.652) 8.950 4.362 ( -0.001 -5.352 -2.067) 5.738 4.771 ( -6.559 -16.768 -2.155) 18.134 5.534 ( -2.572 -22.841 -10.838) 25.412 5.838 ( -1.222 -17.657 6.507) 18.858 6.473 ( -0.682 5.642 -1.867) 5.981 6.667 ( -0.489 -5.913 -7.423) 9.503 6.833 ( 11.467 6.191 7.201) 14.889 7.207 ( -5.932 -0.848 -3.290) 6.836 7.762 ( 5.659 -4.786 -10.836) 13.128 7.854 ( -0.507 -5.643 11.934) 13.210 8.370 ( 5.077 -13.589 -8.487) 16.807 8.550 ( 4.602 -9.244 -10.815) 14.953 8.789 ( 1.230 -15.632 1.217) 15.727 9.577 ( -2.104 3.750 -10.965) 11.778 9.600 ( -3.061 -11.263 -6.649) 13.433 10.255 ( -6.335 2.411 8.663) 11.000 11.520 ( 15.397 24.021 35.180) 45.296 11.849 ( -4.580 0.727 -7.542) 8.854 12.160 ( 8.404 34.527 -1.168) 35.555 12.475 ( -4.282 11.697 1.933) 12.606 13.336 ( 7.712 13.735 -0.270) 15.755 13.635 ( -5.791 16.134 0.565) 17.151 13.811 ( -21.043 14.854 6.312) 26.519 16.187 ( 19.381 -49.453 -13.373) 54.773 18.535 ( -13.791 -22.461 5.663) 26.959 19.964 ( 13.324 -11.682 -4.077) 18.182 21.272 ( 7.101 -41.165 -59.969) 73.084 22.608 ( 29.777 -19.663 -0.799) 35.693 23.535 ( -22.509 -9.849 -9.857) 26.473 27.135 ( -7.758 -2.039 4.345) 9.123 28.573 ( 11.864 24.175 32.553) 42.248 ======================= Grid point 581 (265/429) ======================= q-point: (-0.14 -0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( -19.912 0.000 21.891) 29.592 1.569 ( -32.546 0.000 27.413) 42.553 2.846 ( -28.041 0.000 60.255) 66.460 3.185 ( -1.817 0.000 -2.192) 2.847 4.248 ( -0.726 0.000 0.711) 1.016 4.477 ( -22.955 0.000 -5.989) 23.723 4.506 ( 2.229 -0.000 -4.113) 4.678 4.739 ( 7.850 -0.000 -14.044) 16.089 5.402 ( 0.052 -0.000 2.805) 2.806 6.490 ( 2.701 -0.000 -8.366) 8.791 6.620 ( -4.203 0.000 -10.192) 11.025 7.116 ( 4.139 -0.000 8.580) 9.526 7.416 ( 4.416 -0.000 -1.783) 4.762 7.559 ( -3.473 0.000 4.873) 5.984 7.867 ( 11.559 -0.000 2.246) 11.775 7.900 ( -3.010 0.000 2.400) 3.850 8.218 ( 7.091 -0.000 -15.125) 16.705 8.558 ( -1.100 0.000 4.344) 4.481 9.384 ( -7.949 0.000 -13.420) 15.598 9.693 ( -4.495 0.000 -9.042) 10.098 10.289 ( -8.309 0.000 8.500) 11.887 11.869 ( -0.584 0.000 -1.964) 2.049 12.247 ( 34.949 -0.000 22.013) 41.304 12.788 ( 0.867 -0.000 10.615) 10.650 13.077 ( 10.434 -0.000 -0.753) 10.461 13.921 ( 11.158 -0.000 -4.045) 11.869 14.087 ( 2.331 -0.000 -4.396) 4.976 14.161 ( -17.899 0.000 5.431) 18.705 15.884 ( -0.611 0.000 2.746) 2.813 16.139 ( -35.431 0.000 -34.053) 49.142 19.161 ( -0.746 0.000 2.251) 2.371 20.189 ( 0.563 -0.000 -1.839) 1.924 22.303 ( 18.068 -0.000 -4.152) 18.539 23.351 ( -21.152 0.000 -5.439) 21.840 27.100 ( -6.646 0.000 6.090) 9.014 29.269 ( 33.495 -0.000 21.229) 39.656 ======================= Grid point 582 (266/429) ======================= q-point: (-0.07 -0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( -17.061 -13.793 20.932) 30.323 1.738 ( -20.643 -26.996 25.908) 42.733 2.899 ( -18.022 -15.000 47.948) 53.374 3.571 ( -1.267 -32.188 5.429) 32.667 4.181 ( -17.027 1.799 -8.297) 19.026 4.263 ( 2.340 0.532 -2.695) 3.608 4.649 ( 2.419 -1.653 1.922) 3.504 4.995 ( 1.603 -25.383 -12.581) 28.375 5.546 ( 0.086 -13.480 3.994) 14.059 6.525 ( 2.207 -1.394 -6.970) 7.443 6.559 ( -2.935 -0.579 -5.322) 6.105 7.052 ( 8.950 8.672 9.749) 15.823 7.370 ( -3.084 15.951 0.550) 16.255 7.610 ( -0.224 -11.182 -3.304) 11.662 7.776 ( 1.537 -3.384 -2.258) 4.349 8.180 ( 14.264 -10.943 -1.874) 18.076 8.369 ( 1.724 -11.767 -16.380) 20.242 8.597 ( -0.571 -5.290 7.890) 9.517 9.362 ( -11.004 -6.689 -11.404) 17.201 9.596 ( -10.827 2.760 -10.148) 15.094 10.277 ( -0.500 0.770 8.519) 8.568 11.829 ( -5.016 1.782 -5.507) 7.659 12.269 ( 29.887 26.435 29.042) 49.351 12.652 ( 0.521 19.890 6.853) 21.044 12.748 ( 4.884 19.198 6.531) 20.859 13.691 ( 11.872 15.242 -6.268) 20.312 13.927 ( -9.606 18.863 -1.398) 21.214 14.000 ( -28.184 20.594 13.176) 37.311 15.387 ( 13.280 -36.329 -17.372) 42.402 17.668 ( -20.833 -69.220 -19.130) 74.776 19.644 ( 20.625 -40.756 -21.891) 50.653 20.348 ( -8.079 -25.251 -17.525) 31.781 22.502 ( 27.393 -9.037 -0.174) 28.846 23.283 ( -14.815 -4.204 -1.497) 15.472 27.076 ( -7.584 -0.631 4.651) 8.919 29.212 ( 22.406 25.385 22.633) 40.727 ======================= Grid point 596 (267/429) ======================= q-point: (-0.07 -0.07 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.161 ( -12.090 0.000 24.647) 27.453 1.288 ( -29.836 0.000 25.544) 39.276 2.855 ( -13.757 0.000 68.662) 70.027 3.155 ( -1.821 0.000 -2.356) 2.977 4.109 ( -16.139 0.000 -5.310) 16.990 4.362 ( 1.657 -0.000 -7.297) 7.483 4.511 ( 1.335 -0.000 -4.226) 4.432 4.815 ( 10.518 -0.000 -4.558) 11.463 5.414 ( 0.294 -0.000 2.916) 2.930 6.489 ( 2.535 -0.000 -8.338) 8.715 6.544 ( -4.206 0.000 -4.153) 5.911 7.252 ( 14.676 -0.000 9.434) 17.447 7.455 ( 3.810 -0.000 -3.633) 5.265 7.544 ( -2.489 0.000 6.772) 7.215 7.872 ( -3.309 0.000 2.237) 3.994 7.944 ( 1.304 -0.000 -1.777) 2.204 8.253 ( 10.559 -0.000 -19.380) 22.070 8.571 ( -0.785 0.000 8.407) 8.444 9.197 ( -16.538 0.000 -9.650) 19.147 9.521 ( -15.903 0.000 -11.184) 19.442 10.316 ( 5.161 -0.000 8.005) 9.524 11.818 ( -3.119 0.000 -4.436) 5.423 12.532 ( 6.926 -0.000 5.633) 8.928 12.974 ( 14.103 -0.000 11.214) 18.018 13.272 ( 23.449 -0.000 5.046) 23.986 13.991 ( -5.951 0.000 -1.331) 6.098 14.064 ( 7.558 -0.000 3.896) 8.503 14.096 ( 1.971 -0.000 -4.393) 4.815 15.505 ( -52.149 0.000 -20.957) 56.203 15.887 ( -0.716 0.000 2.788) 2.878 19.161 ( -0.739 0.000 2.247) 2.365 20.188 ( 0.561 -0.000 -1.850) 1.933 22.570 ( 25.658 -0.000 -0.388) 25.661 23.200 ( -0.523 0.000 0.790) 0.947 27.037 ( -7.574 0.000 4.348) 8.733 29.663 ( 23.883 -0.000 5.827) 24.584 ======================= Grid point 597 (268/429) ======================= 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( -0.859 0.000 15.209) 15.234 1.620 ( -1.640 0.000 16.709) 16.789 3.074 ( -1.075 0.000 -2.504) 2.725 3.822 ( -3.649 0.000 -5.260) 6.402 3.999 ( -1.316 0.000 2.848) 3.137 4.373 ( -1.138 0.000 39.140) 39.157 4.434 ( 0.434 -0.000 -2.726) 2.761 5.028 ( 7.954 -0.000 5.465) 9.651 5.476 ( 0.142 -0.000 1.738) 1.744 6.347 ( 1.531 -0.000 -5.241) 5.460 6.480 ( -2.726 0.000 1.585) 3.153 7.397 ( 0.585 -0.000 -2.478) 2.546 7.481 ( 3.072 -0.000 -22.646) 22.853 7.653 ( 9.253 -0.000 -1.499) 9.373 7.689 ( 0.764 -0.000 5.040) 5.098 7.866 ( -2.462 0.000 0.359) 2.488 8.049 ( 5.477 -0.000 -6.490) 8.492 8.678 ( -4.312 0.000 -2.988) 5.246 8.883 ( -5.280 0.000 -0.303) 5.289 9.202 ( -12.649 0.000 -0.395) 12.656 10.505 ( 3.938 -0.000 3.011) 4.957 11.734 ( 2.121 -0.000 -1.947) 2.879 12.725 ( 0.093 -0.000 7.055) 7.056 13.131 ( 1.763 -0.000 1.175) 2.119 13.500 ( -6.191 0.000 3.906) 7.321 13.962 ( 1.419 -0.000 0.056) 1.421 14.023 ( 1.014 -0.000 -2.934) 3.104 14.113 ( -2.048 0.000 -2.270) 3.058 14.993 ( -1.919 0.000 -2.241) 2.951 15.936 ( -0.546 0.000 1.807) 1.888 19.203 ( -0.554 0.000 1.708) 1.796 20.153 ( 0.436 -0.000 -1.427) 1.492 22.693 ( 0.483 -0.000 -1.669) 1.738 23.288 ( 18.886 -0.000 -5.242) 19.600 27.039 ( -4.853 0.000 2.940) 5.674 29.790 ( 0.819 -0.000 -1.089) 1.363 ======================= Grid point 598 (269/429) ======================= q-point: ( 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( 2.459 -11.868 14.751) 19.092 2.038 ( 8.731 -35.500 14.358) 39.277 3.341 ( 0.950 -25.457 -1.365) 25.511 3.731 ( -0.122 4.999 -4.949) 7.036 3.968 ( -0.552 -0.764 -1.742) 1.981 4.512 ( 5.239 -9.108 24.083) 26.276 4.711 ( -4.677 -20.422 8.727) 22.696 5.115 ( 7.607 -5.391 5.521) 10.836 5.643 ( -0.129 -16.461 2.275) 16.618 6.378 ( 1.314 -3.531 -5.623) 6.769 6.465 ( -2.894 -0.045 3.253) 4.354 7.231 ( -5.166 24.279 -3.522) 25.071 7.486 ( 4.323 7.119 -7.386) 11.132 7.514 ( -3.077 -11.727 -2.729) 12.427 7.703 ( 4.387 -1.606 -9.911) 10.957 7.884 ( 10.920 -3.929 -9.114) 14.757 8.338 ( -2.859 -11.437 0.189) 11.790 8.756 ( -1.911 -10.418 1.936) 10.768 8.899 ( -3.543 -7.520 -2.769) 8.762 9.141 ( -10.366 -0.737 2.862) 10.779 10.503 ( 3.118 2.764 2.013) 4.628 11.692 ( 4.865 5.883 -2.417) 8.008 12.634 ( -11.592 19.100 7.624) 23.607 12.800 ( 2.570 21.615 4.319) 22.191 13.332 ( -22.144 8.330 2.636) 23.805 13.547 ( -1.672 22.859 5.024) 23.464 13.803 ( 6.701 14.463 -1.075) 15.976 14.265 ( 23.307 33.711 3.606) 41.142 15.102 ( 3.706 -56.033 -15.553) 58.270 16.878 ( -14.836 -62.852 2.101) 64.613 19.497 ( 4.492 -29.440 -5.995) 30.378 20.154 ( 0.384 -0.054 -1.077) 1.145 22.719 ( -9.853 -5.853 -1.220) 11.525 23.441 ( 27.204 -3.470 -10.563) 29.389 27.021 ( -4.089 -0.157 4.023) 5.738 29.631 ( -4.310 14.709 2.369) 15.509 ======================= Grid point 599 (270/429) ======================= q-point: ( 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( 4.131 -23.398 12.199) 26.708 2.777 ( 7.107 -30.353 18.425) 36.212 3.715 ( -0.557 -6.709 -6.813) 9.578 3.877 ( 10.295 -21.987 -1.334) 24.314 4.013 ( -2.263 -7.416 -6.862) 10.354 4.807 ( 8.010 -11.336 4.391) 14.558 5.020 ( -3.235 -15.542 14.763) 21.679 5.414 ( 3.445 -20.155 8.289) 22.063 5.996 ( -2.901 -16.424 4.261) 17.214 6.412 ( -2.398 2.403 3.472) 4.856 6.563 ( 4.707 -10.893 1.568) 11.970 6.749 ( -4.965 15.829 -4.891) 17.296 7.411 ( 2.607 0.882 -7.372) 7.869 7.670 ( -6.331 -6.596 -10.791) 14.144 7.821 ( -2.443 -11.477 -11.714) 16.581 8.065 ( 15.888 -9.748 -0.952) 18.664 8.419 ( -8.145 -5.518 -1.774) 9.996 8.894 ( 1.050 -7.387 3.706) 8.331 9.067 ( -5.687 -2.436 -0.336) 6.196 9.277 ( -3.415 -22.116 1.084) 22.405 10.452 ( 2.078 4.323 1.520) 5.032 11.577 ( 4.600 9.319 -2.289) 10.642 11.922 ( -13.447 36.402 10.971) 40.328 12.580 ( 2.863 15.934 -1.130) 16.229 12.876 ( -16.076 26.078 2.182) 30.713 13.222 ( 2.730 9.804 4.990) 11.334 13.658 ( 8.119 7.108 -1.270) 10.865 13.890 ( 15.055 20.812 1.702) 25.742 16.178 ( 0.568 -55.209 -14.655) 57.124 17.807 ( -18.934 -45.823 11.824) 50.971 20.148 ( -2.723 -9.410 -2.328) 10.069 20.210 ( 14.398 -29.755 -16.897) 37.124 22.799 ( -15.462 -10.677 0.057) 18.790 23.670 ( 27.188 -6.532 -14.285) 31.400 27.019 ( -3.174 -1.135 5.221) 6.215 29.261 ( -6.921 20.839 7.394) 23.170 ======================= Grid point 600 (271/429) ======================= q-point: ( 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.656 ( 4.355 -25.593 9.695) 27.712 3.271 ( 4.221 -16.941 20.233) 26.725 3.886 ( -0.937 -10.842 -5.649) 12.261 4.051 ( -2.357 -6.215 -4.410) 7.977 4.325 ( 11.443 -10.533 -11.212) 19.172 5.008 ( 4.657 -9.234 -1.510) 10.452 5.339 ( -1.010 -12.855 2.892) 13.214 5.833 ( -1.497 -20.508 13.827) 24.779 6.151 ( -2.173 -1.998 2.621) 3.948 6.190 ( -4.299 14.351 12.298) 19.383 6.525 ( 6.649 1.093 -3.399) 7.547 7.039 ( -2.229 -17.650 1.024) 17.820 7.563 ( 3.064 -20.650 -1.778) 20.951 7.705 ( -3.823 -6.080 -19.760) 21.025 7.969 ( -6.782 -10.064 -10.904) 16.315 8.335 ( 12.258 -6.322 4.288) 14.444 8.631 ( -7.012 -23.749 2.770) 24.916 9.068 ( -5.600 -2.371 2.030) 6.411 9.154 ( 2.327 -20.172 -1.534) 20.364 9.685 ( -1.020 -21.898 -0.322) 21.925 10.375 ( 0.042 5.210 1.084) 5.321 11.125 ( -2.437 35.055 4.656) 35.447 11.527 ( 1.761 7.577 -0.755) 7.816 12.159 ( 4.723 26.209 -3.854) 26.908 12.392 ( -13.698 18.591 6.436) 23.973 13.151 ( -0.280 0.649 4.186) 4.246 13.558 ( 7.436 9.785 -0.475) 12.299 13.654 ( 6.626 10.079 1.295) 12.131 17.034 ( -6.721 -40.397 -12.314) 42.764 18.444 ( -12.233 -28.616 15.398) 34.722 20.199 ( 3.203 -2.375 2.424) 4.666 20.867 ( 12.467 -28.472 -23.957) 39.243 22.947 ( -16.867 -14.677 1.591) 22.415 23.923 ( 22.523 -7.738 -14.667) 27.969 27.052 ( -2.124 -2.921 6.245) 7.214 28.842 ( -7.167 20.479 9.229) 23.578 ======================= Grid point 601 (272/429) ======================= q-point: ( 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.142 ( 4.154 -21.111 7.545) 22.801 3.608 ( 4.424 -13.882 15.607) 21.351 4.019 ( -6.419 -6.833 -5.372) 10.806 4.173 ( -1.866 -8.086 -4.311) 9.351 4.404 ( 6.925 2.612 -7.612) 10.617 5.145 ( 5.958 2.385 -1.985) 6.717 5.420 ( -14.045 -3.835 -9.736) 17.514 5.939 ( 6.289 7.912 4.159) 10.929 6.187 ( -4.023 -2.935 18.256) 18.923 6.245 ( 5.368 -11.701 6.402) 14.377 6.627 ( 4.679 -8.831 2.853) 10.393 7.106 ( -10.883 1.247 0.891) 10.991 7.774 ( 2.260 -9.032 -8.922) 12.895 8.082 ( 6.449 -11.246 -11.062) 17.042 8.135 ( -9.569 -20.477 -6.997) 23.660 8.588 ( 7.339 -16.663 1.751) 18.292 8.982 ( -2.418 -8.394 4.061) 9.633 9.213 ( -8.339 -22.764 5.802) 24.928 9.608 ( 1.858 -22.409 -3.451) 22.750 10.135 ( 8.406 -14.909 -0.914) 17.140 10.210 ( -8.988 -0.309 -0.852) 9.034 10.616 ( 6.085 16.045 0.537) 17.168 11.358 ( -1.496 12.926 1.101) 13.059 11.779 ( 9.640 16.166 -1.907) 18.919 12.029 ( -14.094 12.039 6.982) 19.807 13.172 ( -2.563 -1.979 2.729) 4.235 13.385 ( 5.534 11.133 1.531) 12.526 13.566 ( 2.738 4.009 -0.478) 4.878 17.595 ( -10.399 -27.932 -8.103) 30.887 18.780 ( -7.369 -10.980 10.555) 16.920 20.291 ( 6.324 -3.478 4.833) 8.686 21.302 ( 11.081 -15.677 -21.858) 29.092 23.150 ( -14.833 -15.630 2.476) 21.690 24.145 ( 16.910 -6.212 -12.082) 21.691 27.127 ( -1.143 -4.644 6.837) 8.344 28.464 ( -6.082 17.481 8.327) 20.295 ======================= Grid point 602 (273/429) ======================= q-point: ( 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.492 ( 4.076 -11.772 6.746) 14.167 3.878 ( 4.726 -8.126 3.932) 10.189 4.082 ( -10.972 -6.334 -1.484) 12.756 4.252 ( -3.677 -2.383 -5.277) 6.858 4.413 ( 4.238 -3.417 1.374) 5.615 4.980 ( -1.607 10.860 -3.878) 11.643 5.377 ( -10.085 0.119 -5.205) 11.350 5.873 ( 12.790 6.453 6.639) 15.789 6.248 ( -4.039 -2.775 6.007) 7.752 6.410 ( 1.252 -2.693 2.155) 3.670 6.796 ( -5.968 -3.566 13.138) 14.864 7.112 ( 0.965 -10.357 -2.356) 10.666 7.969 ( 6.913 -8.972 -4.872) 12.330 8.231 ( -2.402 -8.299 -8.635) 12.215 8.338 ( -2.636 -6.078 -4.094) 7.788 8.840 ( -4.684 -3.522 1.559) 6.064 9.114 ( -0.956 -10.562 -1.983) 10.789 9.620 ( -4.927 -13.492 0.733) 14.383 9.903 ( 8.931 -6.626 4.403) 11.961 9.947 ( 2.922 2.047 -5.973) 6.957 10.532 ( -0.291 -3.040 -0.808) 3.159 10.824 ( 0.739 -33.899 -1.299) 33.932 11.115 ( -1.046 7.311 5.984) 9.506 11.617 ( 13.009 9.851 -4.478) 16.921 11.834 ( -13.223 1.907 10.553) 17.025 13.120 ( -5.037 6.882 0.428) 8.539 13.290 ( 3.825 0.955 2.312) 4.571 13.510 ( 0.676 3.054 -0.579) 3.181 17.970 ( -9.599 -20.224 -4.128) 22.764 18.843 ( -4.194 1.194 4.675) 6.393 20.400 ( 6.229 -2.868 5.723) 8.932 21.524 ( 8.882 -6.687 -18.511) 21.593 23.348 ( -10.707 -12.273 2.763) 16.520 24.293 ( 11.446 -2.930 -8.415) 14.505 27.232 ( -0.546 -5.566 7.010) 8.968 28.152 ( -4.595 13.970 6.347) 16.018 ======================= Grid point 603 (274/429) ======================= q-point: ( 0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.639 ( 4.200 0.231 8.772) 9.728 3.937 ( 0.394 1.393 -7.541) 7.679 4.059 ( -9.371 2.613 -1.959) 9.924 4.333 ( -3.295 -9.240 3.350) 10.366 4.553 ( 0.954 -6.828 5.938) 9.099 4.843 ( -2.033 0.519 -3.522) 4.099 5.284 ( -3.973 4.782 1.416) 6.376 5.855 ( 14.343 5.163 5.800) 16.310 6.196 ( -11.467 2.432 -4.641) 12.608 6.459 ( -1.321 -3.770 2.446) 4.684 6.839 ( -3.091 -2.053 12.984) 13.504 7.366 ( 5.660 -11.208 -0.909) 12.589 8.127 ( 4.467 -4.056 -2.942) 6.713 8.320 ( -4.556 -3.482 -12.963) 14.175 8.360 ( -0.411 0.477 6.574) 6.604 8.817 ( -2.339 -0.861 -0.917) 2.656 9.273 ( -2.534 -6.878 -5.062) 8.908 9.696 ( -4.395 -0.533 -8.432) 9.524 9.822 ( 10.883 9.708 -2.906) 14.870 10.148 ( 3.997 -9.623 7.976) 13.122 10.673 ( -5.699 -11.063 -4.489) 13.229 11.117 ( 4.116 4.503 9.662) 11.426 11.214 ( 0.369 -9.655 -2.111) 9.890 11.652 ( 4.585 -11.212 -0.498) 12.124 11.814 ( -6.642 -2.353 10.841) 12.930 12.946 ( -3.355 7.600 0.040) 8.308 13.321 ( 0.536 -1.455 1.581) 2.215 13.453 ( -0.344 2.988 -0.528) 3.054 18.253 ( -6.525 -15.852 -1.229) 17.187 18.741 ( -0.634 7.995 0.631) 8.044 20.482 ( 3.017 -1.958 5.375) 6.468 21.611 ( 6.849 -1.820 -16.310) 17.783 23.487 ( -5.776 -6.992 2.632) 9.443 24.354 ( 6.022 0.288 -5.086) 7.888 27.350 ( -0.602 -5.936 6.944) 9.155 27.912 ( -3.289 10.365 4.685) 11.841 ======================= Grid point 604 (275/429) ======================= 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.594 ( 5.133 7.972 11.844) 15.171 3.840 ( -9.996 3.842 -4.771) 11.723 3.966 ( 3.073 5.041 0.291) 5.910 4.510 ( -2.666 -9.843 6.708) 12.206 4.624 ( -0.049 -0.333 -0.493) 0.597 4.899 ( -1.416 -4.641 -0.398) 4.868 5.175 ( -0.997 4.669 0.738) 4.831 5.875 ( 15.374 1.917 3.538) 15.892 6.111 ( -12.429 -2.836 -6.168) 14.162 6.523 ( -2.403 -2.902 3.221) 4.957 6.842 ( -2.209 3.566 11.752) 12.478 7.538 ( 2.763 -4.346 -2.280) 5.632 8.096 ( -9.717 4.856 -0.820) 10.894 8.294 ( 5.665 0.634 -10.638) 12.069 8.431 ( 4.646 -3.753 8.356) 10.271 8.883 ( 0.788 -5.922 -5.965) 8.442 9.303 ( 0.683 4.182 -1.152) 4.391 9.537 ( 3.387 6.280 -13.101) 14.918 9.830 ( -0.310 -1.902 -0.426) 1.973 10.354 ( 2.596 -8.773 5.267) 10.557 10.766 ( -2.566 0.620 -9.142) 9.516 10.944 ( -3.660 8.043 8.776) 12.454 11.370 ( 3.223 -2.760 4.515) 6.196 11.796 ( -2.460 1.410 2.169) 3.570 11.861 ( -2.807 -3.034 8.925) 9.836 12.835 ( -0.324 2.502 0.548) 2.582 13.349 ( 0.122 -0.950 2.043) 2.257 13.396 ( -0.725 2.459 -0.609) 2.635 18.496 ( -3.036 -13.091 0.480) 13.447 18.556 ( 3.497 12.133 -1.886) 12.767 20.527 ( -1.757 -1.409 4.886) 5.381 21.623 ( 5.356 0.833 -15.665) 16.576 23.554 ( -0.359 -1.647 1.763) 2.439 24.337 ( 0.617 2.608 -2.532) 3.687 27.463 ( -2.037 -4.867 5.748) 7.802 27.755 ( -1.545 5.058 5.285) 7.477 ======================= Grid point 605 (276/429) ======================= q-point: (-0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.471 ( 1.890 10.214 14.895) 18.159 3.687 ( -4.272 8.346 2.938) 9.825 3.910 ( 3.399 1.828 2.221) 4.453 4.559 ( 2.784 4.988 -0.005) 5.712 4.724 ( -1.545 -9.995 1.425) 10.214 4.886 ( -2.312 4.142 -2.018) 5.155 5.147 ( 2.060 -1.634 -4.801) 5.474 5.974 ( 14.912 -1.728 2.870) 15.284 6.137 ( -11.478 -7.701 -2.053) 13.973 6.538 ( -4.535 0.412 4.908) 6.695 6.709 ( -2.796 10.815 9.440) 14.626 7.546 ( -0.816 3.041 -4.225) 5.269 7.927 ( -9.050 6.722 2.888) 11.637 8.287 ( 2.940 0.997 -12.367) 12.751 8.585 ( 12.457 -5.502 6.815) 15.228 8.934 ( 0.243 2.689 -10.723) 11.057 9.156 ( 4.843 8.476 0.196) 9.764 9.523 ( 5.296 -0.985 -4.906) 7.286 9.834 ( -6.299 -1.566 -2.834) 7.083 10.444 ( 0.784 4.106 5.539) 6.940 10.626 ( -2.302 5.857 -12.712) 14.185 10.872 ( -4.698 2.467 10.558) 11.816 11.382 ( 2.202 1.374 5.685) 6.250 11.573 ( -3.713 18.699 2.480) 19.224 11.889 ( -4.792 -0.560 4.855) 6.844 12.862 ( 3.887 -3.722 2.805) 6.069 13.351 ( 0.228 1.161 0.609) 1.331 13.374 ( -1.426 -0.781 2.260) 2.784 18.312 ( 7.119 16.431 -3.811) 18.308 18.719 ( 0.421 -10.893 1.612) 11.019 20.530 ( -6.817 -0.469 4.815) 8.359 21.585 ( 4.608 3.160 -16.756) 17.664 23.549 ( 5.739 4.120 -0.001) 7.065 24.256 ( -4.656 4.607 -0.856) 6.606 27.475 ( -5.346 2.060 1.189) 5.851 27.781 ( 1.667 -6.156 10.736) 12.487 ======================= Grid point 606 (277/429) ======================= q-point: (-0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.270 ( -2.535 14.469 15.309) 21.217 3.486 ( -1.610 11.930 10.455) 15.944 3.965 ( 4.623 -3.836 4.534) 7.526 4.455 ( 2.271 7.074 -3.368) 8.158 4.676 ( -1.047 10.779 -4.851) 11.867 4.959 ( -2.525 -9.687 2.042) 10.217 5.204 ( 8.431 -2.429 -10.927) 14.014 6.079 ( 7.514 -1.598 0.180) 7.684 6.239 ( -8.998 -6.605 11.855) 16.283 6.413 ( -6.180 11.749 10.791) 17.108 6.531 ( -1.019 4.989 -2.625) 5.729 7.427 ( -2.007 7.508 -2.836) 8.273 7.759 ( -3.434 7.635 2.305) 8.683 8.232 ( 1.345 4.178 -13.895) 14.572 8.692 ( 5.953 9.535 -6.537) 13.004 8.752 ( 6.763 9.509 0.649) 11.686 9.079 ( 3.275 3.854 0.217) 5.062 9.510 ( 5.610 6.839 0.161) 8.847 9.894 ( -7.630 -12.441 -3.033) 14.906 10.290 ( -0.942 26.432 -10.839) 28.584 10.370 ( -5.686 0.814 7.744) 9.641 10.719 ( 0.741 21.166 1.679) 21.245 11.324 ( 0.788 -1.331 -0.249) 1.567 11.465 ( -4.134 -10.887 7.891) 14.067 11.850 ( -2.777 2.559 3.824) 5.374 12.998 ( 6.225 -5.862 4.739) 9.776 13.353 ( -3.044 -2.630 0.156) 4.025 13.384 ( -1.179 -0.509 4.083) 4.280 17.996 ( 10.673 22.262 -4.980) 25.186 18.904 ( 1.951 -7.298 1.904) 7.791 20.478 ( -10.895 1.767 5.388) 12.282 21.486 ( 4.693 6.999 -20.238) 21.922 23.461 ( 12.475 10.611 -2.285) 16.536 24.104 ( -9.502 7.407 -0.046) 12.048 27.381 ( -6.360 3.765 -0.053) 7.392 27.993 ( 2.917 -11.968 14.000) 18.648 ======================= Grid point 607 (278/429) ======================= q-point: (-0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.942 ( -4.315 21.224 13.929) 25.751 3.286 ( -3.743 10.716 19.075) 22.197 4.075 ( 5.794 -2.282 2.678) 6.779 4.294 ( 0.562 10.828 -3.182) 11.300 4.444 ( -4.467 9.576 -7.703) 13.077 5.049 ( 0.938 1.580 1.320) 2.263 5.263 ( 8.105 1.845 -8.398) 11.816 6.022 ( -7.849 10.727 19.329) 23.458 6.217 ( 8.355 2.255 -0.096) 8.655 6.352 ( -4.345 -1.599 2.215) 5.133 6.449 ( -8.820 -0.953 -1.423) 8.984 7.232 ( -1.612 11.998 3.238) 12.532 7.646 ( 7.852 5.306 -0.979) 9.527 8.045 ( 0.405 16.418 -12.093) 20.395 8.357 ( 0.168 19.885 -15.673) 25.320 8.571 ( -0.258 12.814 6.363) 14.309 9.009 ( 1.133 7.878 2.129) 8.238 9.361 ( 4.711 10.448 -2.542) 11.739 9.686 ( -0.730 32.254 -6.318) 32.875 10.154 ( -11.283 0.662 -1.896) 11.460 10.169 ( 7.804 8.790 0.666) 11.773 10.591 ( -4.597 -22.016 0.927) 22.510 11.489 ( 3.477 -10.026 0.548) 10.626 11.712 ( -11.134 -10.693 -0.556) 15.447 11.880 ( 9.783 -10.876 11.287) 18.476 13.136 ( 6.114 -3.863 4.384) 8.457 13.404 ( -2.037 -2.066 4.622) 5.458 13.424 ( -6.969 -7.825 0.894) 10.517 17.561 ( 13.336 31.035 -5.792) 34.272 18.995 ( -0.014 -0.415 1.502) 1.559 20.357 ( -11.606 5.327 6.015) 14.116 21.278 ( 5.060 14.362 -26.578) 30.631 23.290 ( 19.103 16.282 -4.278) 25.463 23.869 ( -13.258 10.656 0.689) 17.023 27.273 ( -6.830 3.581 -0.074) 7.712 28.307 ( 4.452 -16.446 16.118) 23.453 ======================= Grid point 608 (279/429) ======================= q-point: (-0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.500 ( -5.071 25.132 14.190) 29.304 3.087 ( -7.279 13.085 24.941) 29.091 3.961 ( 0.678 15.908 -4.188) 16.464 4.158 ( 4.254 4.725 -4.311) 7.682 4.249 ( -7.282 7.669 -6.704) 12.521 4.892 ( -2.486 14.379 9.020) 17.155 5.127 ( 6.443 14.298 2.323) 15.854 5.794 ( -3.503 16.147 10.900) 19.794 6.204 ( 3.113 7.111 0.087) 7.763 6.349 ( -1.865 -5.972 0.776) 6.304 6.493 ( -10.266 -7.303 -0.182) 12.600 7.017 ( 1.696 11.088 4.921) 12.249 7.501 ( 8.459 26.502 -2.942) 27.974 7.682 ( 5.774 4.486 -2.885) 7.860 8.024 ( 2.314 12.152 -24.872) 27.779 8.361 ( -8.058 10.439 7.722) 15.281 8.769 ( 1.597 17.340 -0.564) 17.423 9.062 ( 4.218 19.637 -5.747) 20.891 9.337 ( -5.668 2.174 -5.226) 8.010 9.764 ( -1.238 18.934 -4.212) 19.436 10.306 ( -1.170 -4.804 4.249) 6.520 11.230 ( -3.827 -41.954 -0.261) 42.129 11.617 ( -4.943 -5.167 -5.779) 9.194 11.914 ( 11.079 -15.925 12.219) 22.927 12.288 ( 6.306 -19.654 7.235) 21.872 13.239 ( 3.781 -4.278 1.464) 5.894 13.469 ( -3.598 -5.882 3.285) 7.638 13.562 ( -9.761 -11.602 3.685) 15.603 16.942 ( 14.357 42.713 -6.784) 45.569 18.863 ( -8.501 14.246 -0.658) 16.603 20.189 ( -4.374 8.135 4.391) 10.227 20.877 ( 3.617 25.757 -31.915) 41.171 23.069 ( 23.479 18.824 -4.813) 30.476 23.582 ( -14.000 10.850 2.269) 17.856 27.176 ( -6.807 2.510 0.442) 7.269 28.717 ( 6.236 -20.692 15.950) 26.860 ======================= Grid point 609 (280/429) ======================= q-point: (-0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( -5.071 23.100 15.615) 28.340 2.706 ( -12.556 28.567 21.085) 37.660 3.663 ( 2.273 15.054 1.081) 15.263 3.968 ( -8.796 12.720 -7.544) 17.207 4.062 ( 0.000 6.373 -6.333) 8.984 4.607 ( 0.199 17.112 16.365) 23.679 4.939 ( 3.422 7.908 11.864) 14.663 5.359 ( -3.499 27.383 4.126) 27.912 5.979 ( 1.380 18.397 4.446) 18.977 6.450 ( -2.970 -2.215 2.944) 4.732 6.522 ( -0.098 4.930 -3.215) 5.887 6.931 ( -5.759 -12.648 -7.361) 15.726 7.279 ( 9.466 1.489 8.898) 13.077 7.682 ( 13.973 4.773 -4.835) 15.537 7.816 ( 2.705 6.967 -23.431) 24.594 8.035 ( -10.072 17.051 -0.581) 19.812 8.527 ( 3.963 9.020 -2.908) 10.272 8.849 ( -0.447 6.259 3.319) 7.099 9.256 ( -6.029 5.988 -8.880) 12.291 9.412 ( -7.127 12.439 -3.863) 14.847 10.384 ( 0.313 -3.315 4.490) 5.590 11.613 ( -4.876 -5.716 -4.478) 8.747 12.065 ( -5.363 -41.040 6.798) 41.944 12.412 ( 15.550 -20.631 3.740) 26.104 12.694 ( 13.074 -21.536 12.888) 28.299 13.377 ( 1.235 -10.401 -2.222) 10.707 13.574 ( -7.482 -7.584 1.037) 10.704 13.777 ( -10.286 -16.410 6.339) 20.378 16.096 ( 12.480 53.668 -9.256) 55.872 18.274 ( -18.424 41.702 -7.642) 46.226 19.981 ( 11.870 22.156 -7.075) 26.112 20.324 ( -5.787 19.282 -16.317) 25.913 22.859 ( 21.257 15.731 -3.206) 26.638 23.353 ( -7.625 6.877 2.388) 10.542 27.106 ( -6.317 1.081 1.220) 6.524 29.191 ( 7.264 -22.171 11.521) 26.020 ======================= Grid point 610 (281/429) ======================= q-point: (-0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -3.496 12.047 16.824) 20.986 2.011 ( -13.125 35.611 15.307) 40.923 3.331 ( 0.883 21.755 0.459) 21.778 3.809 ( -8.918 -4.088 -8.365) 12.892 3.965 ( 0.583 2.384 2.705) 3.653 4.386 ( -0.260 8.918 27.264) 28.687 4.742 ( -4.622 21.913 4.252) 22.795 4.998 ( 8.516 5.573 8.116) 13.017 5.633 ( 0.333 16.221 2.679) 16.444 6.383 ( 1.532 3.904 -5.793) 7.152 6.486 ( -2.153 -0.530 1.276) 2.559 7.302 ( -5.046 -25.091 -2.957) 25.764 7.409 ( 9.893 -5.154 5.601) 12.482 7.538 ( 1.188 12.025 -3.786) 12.663 7.707 ( 3.107 3.099 -15.147) 15.770 7.816 ( 5.679 2.889 -10.807) 12.545 8.349 ( 1.342 14.764 0.762) 14.844 8.760 ( -0.519 5.490 4.380) 7.042 8.984 ( -7.410 8.811 -9.000) 14.613 9.277 ( -12.936 -0.064 -3.062) 13.294 10.454 ( 2.999 -2.233 4.129) 5.571 11.686 ( -2.011 -4.751 -2.381) 5.682 12.664 ( 2.911 -4.893 6.367) 8.541 12.773 ( -2.100 -32.990 3.746) 33.268 13.299 ( 18.430 -17.591 8.474) 26.850 13.671 ( -0.406 -8.685 -0.783) 8.729 13.760 ( -8.655 -29.400 -1.170) 30.670 14.104 ( -3.778 -27.386 9.467) 29.222 15.107 ( 5.080 50.708 -13.875) 52.817 17.067 ( -15.779 71.219 -8.170) 73.402 19.464 ( 4.944 26.724 -5.326) 27.694 20.163 ( -1.206 1.160 -1.573) 2.296 22.729 ( 12.496 7.812 -1.877) 14.856 23.254 ( 4.995 3.128 -0.501) 5.914 27.065 ( -5.593 0.171 2.045) 5.957 29.614 ( 5.691 -15.665 3.442) 17.018 ======================= Grid point 612 (282/429) ======================= q-point: ( 0.07 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 6.435 -0.000 13.041) 14.542 1.819 ( 24.810 -0.000 14.668) 28.821 3.055 ( -0.818 0.000 -1.891) 2.061 3.799 ( 2.098 -0.000 -3.684) 4.239 3.994 ( 0.214 -0.000 -1.656) 1.669 4.426 ( -0.185 0.000 -2.428) 2.435 4.536 ( 4.278 -0.000 38.625) 38.861 5.124 ( 6.636 -0.000 1.759) 6.866 5.482 ( -0.064 0.000 1.344) 1.346 6.345 ( 1.413 -0.000 -5.164) 5.354 6.451 ( -3.998 0.000 4.005) 5.658 7.386 ( -0.828 0.000 -2.228) 2.377 7.389 ( -0.965 0.000 -26.783) 26.800 7.723 ( 2.102 -0.000 3.989) 4.509 7.740 ( 3.803 -0.000 -3.584) 5.226 7.842 ( -2.205 0.000 1.235) 2.528 8.081 ( 5.484 -0.000 -9.514) 10.981 8.615 ( -2.770 0.000 -1.346) 3.080 8.851 ( -3.257 0.000 4.145) 5.272 9.091 ( -8.345 0.000 6.156) 10.370 10.549 ( 2.272 -0.000 1.259) 2.598 11.797 ( 10.502 -0.000 -2.888) 10.892 12.703 ( -8.510 0.000 5.479) 10.121 13.160 ( 1.480 -0.000 2.289) 2.726 13.283 ( -31.131 0.000 6.748) 31.854 13.904 ( -9.583 0.000 -1.766) 9.744 14.021 ( 0.538 -0.000 -2.961) 3.009 14.155 ( 11.941 -0.000 -0.627) 11.957 15.135 ( 22.330 -0.000 -1.709) 22.395 15.935 ( -0.719 0.000 1.779) 1.918 19.203 ( -0.542 0.000 1.710) 1.794 20.153 ( 0.451 -0.000 -1.413) 1.483 22.599 ( -12.247 0.000 -3.209) 12.660 23.550 ( 29.820 -0.000 -14.256) 33.052 27.008 ( -3.281 0.000 5.140) 6.098 29.735 ( -9.496 0.000 -0.209) 9.498 ======================= Grid point 613 (283/429) ======================= q-point: ( 0.14 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( 9.030 -11.773 10.909) 18.416 2.287 ( 23.324 -28.386 15.246) 39.777 3.342 ( 0.857 -26.356 -2.978) 26.538 3.762 ( 6.851 2.678 -3.451) 8.125 3.943 ( -1.761 1.103 -2.429) 3.196 4.632 ( 4.578 -14.371 -4.398) 15.711 4.744 ( 1.793 -12.603 31.928) 34.372 5.211 ( 6.611 -6.365 2.552) 9.525 5.646 ( -0.685 -16.209 1.864) 16.330 6.372 ( 1.112 -3.117 -5.284) 6.235 6.448 ( -3.008 -1.564 5.923) 6.825 7.161 ( -4.767 21.123 -3.660) 21.961 7.456 ( -4.287 -6.968 -4.987) 9.582 7.479 ( 1.500 7.726 -11.941) 14.301 7.723 ( 3.695 0.612 -6.900) 7.851 7.928 ( 1.666 -8.096 -11.897) 14.487 8.318 ( 0.138 -7.850 1.375) 7.970 8.757 ( 1.647 -15.379 2.651) 15.693 8.860 ( -3.887 -4.642 0.954) 6.129 9.070 ( -6.146 -0.851 9.071) 10.990 10.535 ( 1.322 2.718 1.274) 3.280 11.779 ( 11.912 7.838 -3.206) 14.616 12.473 ( -22.739 24.754 9.786) 35.009 12.816 ( -5.749 16.143 8.166) 18.983 13.063 ( -18.108 9.109 -1.661) 20.338 13.563 ( 0.543 16.409 -0.613) 16.429 13.892 ( 9.064 12.228 0.391) 15.227 14.563 ( 24.377 32.335 3.284) 40.627 15.083 ( 4.300 -51.185 -17.591) 54.294 16.751 ( -11.456 -56.134 9.998) 58.157 19.523 ( 3.805 -31.038 -5.217) 31.703 20.161 ( 1.583 -0.883 -1.467) 2.332 22.564 ( -14.350 -5.004 -3.784) 15.661 23.715 ( 28.473 -2.735 -17.327) 33.443 27.003 ( -2.410 -0.199 6.404) 6.846 29.543 ( -12.430 12.915 2.828) 18.146 ======================= Grid point 614 (284/429) ======================= q-point: ( 0.21 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( 9.553 -21.466 8.409) 24.955 2.959 ( 11.156 -25.187 20.112) 34.108 3.696 ( 1.402 -9.098 -4.573) 10.278 3.936 ( -6.307 -4.311 -4.109) 8.674 4.028 ( 17.332 -22.803 -9.410) 30.148 4.862 ( 1.051 -8.425 -6.032) 10.415 5.083 ( 4.671 -15.714 17.643) 24.083 5.490 ( 4.340 -17.761 7.450) 19.743 5.976 ( -2.923 -15.147 4.039) 15.946 6.402 ( -2.147 2.762 5.700) 6.688 6.603 ( -1.527 -16.774 -0.114) 16.844 6.720 ( 3.598 17.151 2.456) 17.696 7.401 ( 2.359 -0.984 -12.087) 12.354 7.542 ( -10.047 -5.675 -5.471) 12.770 7.755 ( -0.420 -5.834 -18.601) 19.499 8.163 ( 0.684 -18.697 -4.098) 19.153 8.375 ( 2.629 -0.342 3.653) 4.513 8.910 ( -0.613 -7.405 2.462) 7.828 9.029 ( -2.712 -1.626 6.360) 7.102 9.246 ( -3.322 -22.935 1.931) 23.254 10.476 ( 0.952 4.495 2.055) 5.033 11.647 ( 8.835 13.773 -2.510) 16.554 11.788 ( -17.910 28.647 13.467) 36.370 12.584 ( -3.490 12.790 1.667) 13.362 12.687 ( -11.814 21.754 -6.768) 25.664 13.272 ( 2.081 12.552 3.890) 13.304 13.743 ( 7.569 8.426 -1.647) 11.445 14.098 ( 19.695 28.135 0.900) 34.355 16.082 ( -7.215 -53.060 -15.314) 55.695 17.688 ( -12.182 -47.205 19.071) 52.349 20.123 ( -0.524 -14.549 -0.798) 14.581 20.310 ( 13.563 -26.045 -15.802) 33.346 22.613 ( -16.074 -10.229 -2.418) 19.206 23.905 ( 24.347 -4.970 -18.418) 30.931 27.017 ( -1.440 -1.210 7.640) 7.868 29.174 ( -12.409 18.475 6.255) 23.118 ======================= Grid point 615 (285/429) ======================= q-point: ( 0.29 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( 7.793 -23.788 5.976) 25.736 3.401 ( 5.195 -14.897 19.625) 25.180 3.860 ( -1.537 -7.564 -3.089) 8.314 4.003 ( -2.757 -7.700 -3.641) 8.953 4.413 ( 12.703 -7.218 -17.062) 22.463 5.028 ( -0.862 -12.232 -4.602) 13.097 5.321 ( -1.021 -3.140 0.283) 3.314 5.873 ( 0.667 -17.094 9.032) 19.344 6.156 ( -1.292 -4.773 9.499) 10.709 6.234 ( 3.297 8.209 14.309) 16.823 6.562 ( 1.670 -0.681 -3.934) 4.328 7.011 ( -3.949 -10.016 4.239) 11.571 7.582 ( -3.073 -9.997 -3.923) 11.170 7.612 ( 3.413 -22.550 -11.537) 25.559 7.865 ( -0.881 -10.609 -19.888) 22.558 8.435 ( 0.016 -6.554 3.469) 7.415 8.595 ( 0.770 -23.486 3.917) 23.822 9.030 ( -3.016 -1.490 3.711) 5.009 9.168 ( -0.029 -20.053 1.251) 20.092 9.662 ( -2.865 -23.124 -0.108) 23.301 10.377 ( -0.814 7.264 2.516) 7.730 11.124 ( -1.056 30.484 5.917) 31.070 11.544 ( 0.453 7.837 1.057) 7.921 12.169 ( -3.203 23.487 -5.670) 24.373 12.272 ( -5.196 17.706 1.652) 18.527 13.157 ( -1.640 2.196 3.578) 4.507 13.632 ( 5.484 7.977 -1.405) 9.782 13.755 ( 10.296 17.421 1.059) 20.264 16.872 ( -13.087 -40.372 -11.213) 43.896 18.394 ( -7.871 -29.133 17.947) 35.111 20.258 ( 4.988 -4.913 4.058) 8.093 20.929 ( 13.382 -27.413 -22.832) 38.103 22.760 ( -16.299 -15.547 0.056) 22.524 24.103 ( 19.233 -6.079 -16.797) 26.249 27.065 ( -0.470 -2.939 8.518) 9.023 28.771 ( -10.601 18.337 7.190) 22.368 ======================= Grid point 616 (286/429) ======================= q-point: ( 0.36 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.217 ( 5.193 -19.985 3.729) 20.983 3.709 ( 4.216 -12.505 11.274) 17.357 3.926 ( -8.528 -4.249 0.322) 9.533 4.148 ( 0.574 -6.690 -4.918) 8.324 4.449 ( 6.484 2.399 -8.932) 11.295 5.186 ( -10.402 10.108 -5.917) 15.665 5.218 ( -0.984 -7.224 -7.023) 10.123 6.005 ( 1.222 0.040 4.873) 5.024 6.228 ( 2.046 -0.885 12.273) 12.474 6.358 ( 7.912 -6.343 6.177) 11.874 6.674 ( -0.312 -9.211 9.635) 13.334 6.987 ( -8.059 0.236 -0.125) 8.064 7.780 ( 4.631 -13.043 -8.741) 16.370 7.966 ( -7.994 -13.344 -12.366) 19.872 8.173 ( 8.393 -14.905 -4.130) 17.597 8.653 ( 3.643 -13.679 -0.846) 14.181 8.970 ( -2.387 -10.205 3.787) 11.144 9.148 ( -6.959 -22.074 7.169) 24.230 9.620 ( 2.181 -22.510 -2.553) 22.759 10.090 ( -10.775 -10.790 -0.521) 15.258 10.231 ( 7.500 -8.582 0.853) 11.429 10.685 ( 5.462 16.924 0.555) 17.792 11.350 ( -1.569 13.851 3.424) 14.354 11.835 ( -8.497 7.629 3.370) 11.906 11.940 ( 5.489 16.345 -2.060) 17.365 13.132 ( -5.409 0.055 0.853) 5.476 13.465 ( 6.562 11.904 2.299) 13.786 13.590 ( 2.369 5.599 -1.700) 6.313 17.431 ( -12.965 -29.822 -6.429) 33.148 18.744 ( -6.104 -10.648 10.874) 16.398 20.394 ( 7.923 -3.971 6.020) 10.714 21.351 ( 11.394 -14.721 -21.560) 28.484 22.995 ( -13.531 -17.720 1.758) 22.364 24.275 ( 14.155 -4.714 -13.092) 19.850 27.151 ( 0.298 -4.475 8.803) 9.879 28.409 ( -8.168 15.756 6.208) 18.802 ======================= Grid point 617 (287/429) ======================= q-point: ( 0.43 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.551 ( 2.822 -12.306 2.541) 12.879 3.887 ( -4.437 -3.433 -7.209) 9.135 3.984 ( -6.133 -5.742 6.916) 10.881 4.210 ( -0.263 -3.229 -2.107) 3.865 4.474 ( 4.985 -2.842 3.398) 6.669 4.922 ( -5.520 9.364 -5.064) 11.992 5.273 ( -5.295 -2.346 -4.189) 7.148 6.009 ( 5.136 1.937 2.288) 5.947 6.227 ( -0.901 5.426 3.913) 6.751 6.411 ( -3.283 -0.373 4.056) 5.231 6.788 ( -2.448 -4.122 16.262) 16.954 7.158 ( 7.160 -14.291 -1.723) 16.077 8.017 ( 3.636 -8.875 -6.835) 11.777 8.134 ( -2.779 -11.296 -12.156) 16.825 8.343 ( 0.454 -3.494 3.648) 5.072 8.800 ( -2.994 -1.648 -0.413) 3.442 9.102 ( -0.211 -7.955 -0.490) 7.973 9.564 ( -4.250 -12.626 -2.144) 13.493 9.923 ( 0.147 -5.932 -3.776) 7.033 10.034 ( 6.765 -8.049 2.893) 10.905 10.516 ( -1.747 2.598 0.322) 3.147 10.838 ( 2.080 -32.105 -0.525) 32.176 11.137 ( 0.709 4.484 6.287) 7.755 11.666 ( -8.653 7.146 2.263) 11.448 11.802 ( 8.369 3.164 3.115) 9.474 13.050 ( -6.824 5.269 -1.257) 8.712 13.344 ( 3.723 4.080 2.613) 6.111 13.512 ( 0.265 3.618 -1.405) 3.890 17.844 ( -9.775 -22.726 -2.831) 24.900 18.814 ( -3.936 0.447 4.703) 6.149 20.497 ( 6.765 -1.145 6.155) 9.218 21.555 ( 8.545 -5.860 -18.508) 21.211 23.245 ( -8.963 -14.685 2.320) 17.360 24.379 ( 9.297 -1.298 -8.862) 12.910 27.261 ( 0.583 -5.113 8.580) 10.005 28.113 ( -5.903 12.687 4.580) 14.724 ======================= Grid point 618 (288/429) ======================= q-point: ( 0.50 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.704 ( 1.610 -1.472 5.756) 6.156 3.827 ( -11.951 1.741 -6.344) 13.642 4.015 ( 1.283 -0.792 -4.388) 4.640 4.317 ( -1.678 -7.051 6.305) 9.606 4.602 ( 2.100 -5.374 9.873) 11.435 4.804 ( -1.756 -0.469 -5.349) 5.649 5.248 ( -2.797 2.087 -0.083) 3.491 6.000 ( -6.798 -0.091 -5.665) 8.850 6.060 ( 6.348 8.613 3.106) 11.141 6.455 ( -2.440 -3.600 7.031) 8.267 6.883 ( 2.116 -1.681 13.011) 13.289 7.427 ( 5.586 -9.529 -1.496) 11.146 8.076 ( -7.577 -0.692 -8.752) 11.597 8.295 ( 7.197 -4.044 -12.678) 15.129 8.395 ( -0.585 -3.238 13.791) 14.178 8.799 ( -0.460 -2.096 -2.139) 3.030 9.242 ( -0.094 -6.837 -2.815) 7.394 9.604 ( -5.342 1.293 -11.275) 12.544 9.888 ( 3.928 5.071 -4.065) 7.594 10.261 ( 9.144 -5.506 9.429) 14.242 10.581 ( -7.513 -9.810 -3.911) 12.961 11.178 ( 0.664 6.467 6.373) 9.103 11.225 ( 2.098 -13.128 1.229) 13.351 11.650 ( -4.651 -11.035 1.556) 12.076 11.832 ( 3.075 -1.200 8.043) 8.694 12.900 ( -4.216 5.500 -0.969) 6.997 13.334 ( 0.638 -0.353 1.510) 1.677 13.447 ( -0.303 3.071 -0.779) 3.183 18.178 ( -5.764 -18.292 -0.561) 19.187 18.736 ( -0.758 6.346 0.609) 6.420 20.537 ( 2.954 0.879 5.496) 6.301 21.626 ( 6.326 -1.167 -16.384) 17.602 23.438 ( -4.384 -9.471 2.328) 10.693 24.396 ( 4.682 2.273 -5.194) 7.353 27.375 ( 0.137 -5.054 8.050) 9.506 27.885 ( -4.095 9.234 3.472) 10.681 ======================= Grid point 619 (289/429) ======================= q-point: (-0.43 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.652 ( -6.940 5.019 8.105) 11.791 3.744 ( 0.959 2.924 -1.990) 3.664 4.012 ( 4.197 3.128 2.162) 5.663 4.481 ( -5.147 -11.518 4.443) 13.375 4.645 ( 2.491 2.378 1.649) 3.819 4.884 ( -1.114 -5.574 0.688) 5.726 5.167 ( -0.658 4.381 -0.384) 4.447 5.930 ( -13.449 -4.298 -7.753) 16.108 6.065 ( 14.465 1.801 2.840) 14.851 6.509 ( -3.092 -2.029 6.368) 7.364 6.885 ( 1.525 5.471 11.939) 13.221 7.551 ( 1.366 -1.874 -3.774) 4.429 7.972 ( -10.017 3.810 -1.643) 10.842 8.309 ( 3.677 1.334 -9.899) 10.643 8.549 ( 9.337 -6.759 9.852) 15.163 8.872 ( 0.760 -5.022 -6.321) 8.109 9.304 ( 0.792 2.659 -2.699) 3.871 9.498 ( -1.275 0.116 -12.529) 12.594 9.836 ( 1.206 3.125 -0.334) 3.366 10.409 ( 3.506 -4.596 4.496) 7.324 10.692 ( -4.702 -5.806 -6.275) 9.757 10.940 ( -2.177 14.400 7.142) 16.221 11.417 ( 2.486 -3.734 1.824) 4.843 11.751 ( -6.207 0.637 4.781) 7.860 11.884 ( 0.170 0.253 7.949) 7.954 12.835 ( -0.051 -0.438 0.542) 0.698 13.355 ( -0.484 -1.144 1.800) 2.187 13.392 ( 0.384 2.558 -0.305) 2.604 18.467 ( -2.375 -14.419 0.681) 14.629 18.587 ( 3.053 9.325 -2.085) 10.031 20.524 ( -1.902 1.735 4.951) 5.581 21.624 ( 5.039 1.373 -15.790) 16.631 23.559 ( 0.081 -4.464 1.624) 4.751 24.334 ( 0.382 5.040 -2.405) 5.597 27.461 ( -1.981 -2.067 5.834) 6.499 27.756 ( -1.635 2.210 5.199) 5.882 ======================= Grid point 620 (290/429) ======================= q-point: (-0.36 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.505 ( -4.692 9.086 11.554) 15.429 3.684 ( 2.132 6.263 3.829) 7.645 3.982 ( 5.743 2.131 7.861) 9.966 4.567 ( 0.415 3.950 -6.948) 8.004 4.716 ( -2.101 -12.254 5.665) 13.662 4.854 ( -1.108 8.122 -3.120) 8.771 5.165 ( 3.236 -4.038 -2.284) 5.656 5.977 ( -13.176 -8.830 -6.780) 17.249 6.138 ( 11.487 -0.699 4.673) 12.421 6.508 ( -4.525 1.403 7.079) 8.519 6.747 ( 2.187 11.813 10.216) 15.770 7.509 ( -2.415 4.020 -5.811) 7.468 7.849 ( -6.763 4.459 4.799) 9.415 8.274 ( 2.761 2.251 -11.538) 12.075 8.769 ( 15.582 -6.360 5.768) 17.791 8.890 ( -1.213 3.408 -10.983) 11.563 9.192 ( 2.282 5.668 -3.444) 7.014 9.565 ( 3.652 -4.736 -1.842) 6.257 9.753 ( -5.610 3.602 -2.551) 7.138 10.410 ( -8.011 4.777 1.181) 9.401 10.605 ( 4.676 11.689 -7.205) 14.506 10.870 ( -2.359 -4.532 9.259) 10.575 11.409 ( 0.442 3.235 -0.541) 3.310 11.529 ( -5.409 18.793 3.028) 19.789 11.874 ( -2.260 0.676 9.336) 9.629 12.915 ( 3.229 -6.127 3.034) 7.562 13.337 ( -1.830 1.684 -0.023) 2.487 13.389 ( 1.392 -0.472 3.048) 3.384 18.372 ( 5.768 14.069 -3.781) 15.668 18.731 ( 0.660 -12.093 1.222) 12.172 20.470 ( -6.562 2.349 4.763) 8.442 21.576 ( 4.716 3.648 -16.834) 17.859 23.612 ( 4.972 0.634 -0.083) 5.013 24.205 ( -3.622 7.531 -0.542) 8.374 27.423 ( -4.720 3.749 1.875) 6.313 27.835 ( 1.011 -8.117 10.110) 13.005 ======================= Grid point 621 (291/429) ======================= q-point: (-0.29 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.292 ( -2.843 14.538 13.711) 20.185 3.524 ( 1.138 12.107 11.559) 16.777 4.054 ( 6.610 -3.462 7.548) 10.614 4.454 ( 0.512 6.849 -6.235) 9.277 4.623 ( -4.329 12.637 -7.275) 15.210 4.941 ( -1.183 -10.583 2.786) 11.008 5.283 ( 10.606 -4.115 -6.685) 13.195 6.039 ( -10.510 -5.335 -8.512) 14.539 6.214 ( -1.813 -2.087 15.343) 15.590 6.418 ( -3.385 7.649 10.774) 13.640 6.553 ( 5.182 10.781 0.995) 12.003 7.388 ( -3.034 6.110 -2.935) 7.426 7.749 ( -0.853 4.208 5.234) 6.770 8.203 ( 3.073 4.992 -15.240) 16.328 8.683 ( 0.547 13.975 -10.786) 17.661 8.869 ( 10.027 10.897 2.976) 15.105 9.109 ( 1.747 4.372 -0.034) 4.708 9.578 ( 5.411 7.992 1.734) 9.806 9.781 ( -9.860 -15.852 -2.775) 18.873 10.189 ( -8.467 15.894 -5.156) 18.732 10.379 ( 2.391 9.990 1.040) 10.325 10.753 ( 3.463 24.712 1.798) 25.018 11.314 ( -2.914 -7.781 0.473) 8.323 11.410 ( -5.732 -6.269 -1.476) 8.622 11.885 ( 2.202 -0.610 12.187) 12.399 13.078 ( 4.467 -7.218 4.840) 9.772 13.302 ( -4.451 -0.255 -0.856) 4.539 13.409 ( 1.523 -0.114 4.537) 4.787 18.089 ( 8.608 20.118 -5.089) 22.466 18.925 ( 0.390 -7.266 1.751) 7.485 20.379 ( -9.545 3.422 4.888) 11.257 21.469 ( 5.356 7.713 -19.960) 22.058 23.587 ( 10.250 6.539 -2.626) 12.439 24.006 ( -7.015 10.465 0.499) 12.609 27.315 ( -5.515 4.536 0.994) 7.210 28.070 ( 1.809 -13.493 12.960) 18.796 ======================= Grid point 622 (292/429) ======================= q-point: (-0.21 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.960 ( -1.610 22.088 13.717) 26.051 3.328 ( -1.140 11.777 19.128) 22.492 4.161 ( 7.576 -0.187 1.568) 7.739 4.281 ( -0.756 10.901 -3.362) 11.433 4.350 ( -6.257 9.570 -9.113) 14.622 5.048 ( -0.660 0.824 1.628) 1.940 5.360 ( 11.773 3.969 -4.443) 13.195 5.994 ( -6.538 3.837 9.813) 12.400 6.245 ( -7.139 2.183 8.172) 11.068 6.303 ( -4.658 -2.401 2.336) 5.737 6.409 ( 3.636 7.615 -2.763) 8.880 7.233 ( -0.603 9.091 3.132) 9.634 7.732 ( 5.448 -0.093 3.118) 6.278 8.023 ( 5.058 16.203 -17.630) 24.473 8.320 ( 3.296 23.943 -10.990) 26.550 8.561 ( -5.427 15.873 3.827) 17.206 9.016 ( -0.977 8.461 1.936) 8.734 9.384 ( 0.058 11.835 -0.753) 11.860 9.651 ( -0.959 31.707 -6.611) 32.403 10.043 ( -6.126 4.468 -1.752) 7.782 10.259 ( 6.854 2.303 1.510) 7.387 10.545 ( -3.522 -19.480 -0.782) 19.811 11.485 ( -2.700 -5.848 -5.105) 8.219 11.631 ( -3.030 -20.078 1.973) 20.401 12.032 ( 7.484 -11.188 14.724) 19.949 13.204 ( 2.201 -2.026 3.649) 4.718 13.323 ( -6.028 -6.416 -0.155) 8.805 13.441 ( 1.809 -1.939 4.939) 5.606 17.676 ( 10.266 29.322 -6.282) 31.696 18.975 ( -4.764 2.415 2.581) 5.932 20.261 ( -8.318 4.224 4.491) 10.354 21.248 ( 6.589 15.858 -25.212) 30.505 23.469 ( 12.382 12.392 -4.596) 18.111 23.745 ( -6.295 12.704 0.640) 14.192 27.203 ( -5.754 4.029 1.233) 7.132 28.403 ( 2.277 -18.076 14.550) 23.316 ======================= Grid point 623 (293/429) ======================= q-point: (-0.14 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.521 ( -0.822 26.049 14.407) 29.779 3.108 ( -4.080 15.981 22.479) 27.881 3.954 ( 1.112 15.881 -6.909) 17.354 4.147 ( -5.527 8.809 -6.356) 12.188 4.195 ( 4.656 6.751 -2.919) 8.706 4.911 ( 0.964 11.992 6.364) 13.611 5.218 ( 6.711 14.911 4.737) 17.024 5.797 ( -3.864 19.206 13.444) 23.761 6.227 ( -0.829 4.480 2.526) 5.209 6.309 ( -5.737 -8.331 -3.892) 10.838 6.409 ( -2.140 -6.670 2.511) 7.442 7.044 ( 1.095 14.604 1.013) 14.680 7.536 ( 2.235 24.119 -4.978) 24.729 7.803 ( 11.114 0.003 -1.345) 11.195 7.975 ( 6.376 12.741 -20.274) 24.780 8.278 ( -10.410 13.592 4.982) 17.830 8.757 ( -3.210 15.935 -0.409) 16.261 9.094 ( 4.607 21.268 -4.801) 22.285 9.242 ( -7.586 2.823 -4.103) 9.075 9.724 ( -2.710 19.009 -2.279) 19.336 10.331 ( 2.320 -3.306 2.796) 4.912 11.184 ( -4.250 -40.705 0.945) 40.937 11.550 ( -3.044 -6.349 -4.050) 8.123 12.044 ( 6.794 -23.378 3.812) 24.642 12.405 ( 6.079 -19.196 12.698) 23.805 13.231 ( -6.147 -3.162 -0.417) 6.925 13.439 ( 0.269 -6.680 1.877) 6.944 13.540 ( 0.954 -7.294 4.546) 8.648 17.058 ( 10.289 42.095 -8.213) 44.106 18.727 ( -15.443 20.148 3.198) 25.586 20.167 ( -1.652 3.046 2.249) 4.131 20.826 ( 7.201 28.541 -28.722) 41.127 23.234 ( 1.332 15.882 -1.947) 16.056 23.516 ( 8.528 10.986 -2.980) 14.224 27.110 ( -5.514 2.667 2.010) 6.446 28.819 ( 2.035 -21.946 13.657) 25.928 ======================= Grid point 624 (294/429) ======================= q-point: (-0.07 0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( 0.090 23.861 15.088) 28.231 2.684 ( -3.105 32.141 18.161) 37.047 3.710 ( 5.591 10.136 -3.081) 11.978 3.853 ( -5.678 18.724 -2.909) 19.781 4.047 ( 0.499 6.426 -6.991) 9.508 4.693 ( 4.979 15.353 13.713) 21.179 5.000 ( -0.374 10.560 11.162) 15.370 5.361 ( 0.371 24.456 7.212) 25.500 6.001 ( -0.669 18.324 4.351) 18.845 6.428 ( -2.613 -2.394 3.090) 4.702 6.523 ( 1.962 5.145 -1.018) 5.600 6.835 ( -5.888 -12.949 -7.339) 16.007 7.383 ( 5.108 -1.027 0.980) 5.301 7.756 ( 1.020 6.743 -20.764) 21.856 7.854 ( 15.181 11.519 -0.551) 19.064 7.924 ( -5.904 10.677 -3.055) 12.578 8.510 ( -4.410 7.407 -4.117) 9.553 8.866 ( 1.141 6.749 3.518) 7.696 9.153 ( -7.005 3.787 -5.570) 9.717 9.326 ( -5.773 18.840 -0.651) 19.716 10.417 ( 2.582 -3.836 2.603) 5.306 11.565 ( -0.797 -6.980 -3.042) 7.656 12.013 ( -8.952 -40.092 8.510) 41.952 12.531 ( 6.526 -17.188 -0.645) 18.396 12.898 ( 9.049 -31.781 13.262) 35.606 13.272 ( -13.592 -7.455 -1.030) 15.536 13.575 ( 6.317 -5.980 -0.540) 8.715 13.767 ( 4.255 -15.158 3.753) 16.185 16.177 ( 7.927 55.207 -11.813) 57.010 18.022 ( -22.329 44.237 1.462) 49.575 20.095 ( 13.122 19.078 -9.703) 25.106 20.217 ( -3.623 20.298 -11.935) 23.823 22.939 ( -6.673 12.432 0.176) 14.111 23.421 ( 20.825 7.440 -7.107) 23.228 27.050 ( -4.880 1.079 2.999) 5.829 29.271 ( 0.068 -22.277 8.998) 24.025 ======================= Grid point 627 (295/429) ======================= q-point: ( 0.14 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( 11.698 -0.000 10.676) 15.837 2.238 ( 37.591 -0.000 13.158) 39.828 3.040 ( -1.010 0.000 -1.302) 1.648 3.801 ( -2.035 0.000 -3.136) 3.739 4.020 ( 7.274 -0.000 -1.447) 7.416 4.413 ( -0.499 0.000 -2.171) 2.227 4.748 ( 10.425 -0.000 29.709) 31.485 5.195 ( 5.965 -0.000 -1.391) 6.125 5.484 ( -0.375 0.000 1.012) 1.079 6.341 ( 1.357 -0.000 -5.127) 5.303 6.425 ( -3.897 0.000 7.244) 8.226 7.275 ( -2.924 0.000 -22.985) 23.170 7.364 ( -1.680 0.000 -1.944) 2.569 7.690 ( -6.847 0.000 -11.635) 13.500 7.761 ( 2.342 -0.000 1.738) 2.917 7.828 ( -1.431 0.000 3.309) 3.605 8.095 ( 3.519 -0.000 -11.282) 11.818 8.631 ( 3.870 -0.000 2.513) 4.615 8.823 ( -4.451 0.000 5.885) 7.379 9.057 ( -3.831 0.000 12.011) 12.607 10.565 ( -0.154 0.000 1.266) 1.275 11.942 ( 16.224 -0.000 -3.939) 16.695 12.550 ( -23.423 0.000 5.131) 23.978 12.926 ( -29.546 0.000 10.110) 31.228 13.205 ( 2.802 -0.000 0.369) 2.826 13.799 ( -6.673 0.000 -3.683) 7.622 14.014 ( 0.144 -0.000 -2.985) 2.988 14.329 ( 17.754 -0.000 0.624) 17.765 15.400 ( 23.507 -0.000 -1.748) 23.572 15.933 ( -0.859 0.000 1.737) 1.938 19.203 ( -0.533 0.000 1.713) 1.794 20.153 ( 0.467 -0.000 -1.396) 1.472 22.430 ( -13.441 0.000 -6.504) 14.932 23.816 ( 27.284 -0.000 -19.990) 33.824 27.003 ( -1.633 0.000 7.635) 7.807 29.586 ( -16.732 0.000 1.512) 16.800 ======================= Grid point 628 (296/429) ======================= q-point: ( 0.21 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( 14.460 -11.629 7.980) 20.199 2.632 ( 25.137 -18.459 15.999) 35.051 3.350 ( 3.185 -26.512 -2.992) 26.870 3.778 ( -4.672 -1.803 -4.352) 6.635 3.973 ( 10.499 3.619 -1.540) 11.212 4.624 ( -0.644 -15.306 -4.371) 15.931 4.939 ( 12.517 -8.139 20.729) 25.546 5.288 ( 6.193 -7.542 0.898) 9.800 5.642 ( -1.056 -15.681 1.454) 15.784 6.365 ( 1.017 -2.864 -4.922) 5.785 6.446 ( -1.992 -3.099 9.595) 10.278 7.094 ( -5.015 15.763 -2.990) 16.810 7.385 ( -4.546 -3.117 -5.770) 7.980 7.446 ( 0.725 8.505 -11.892) 14.638 7.705 ( -2.435 3.166 -12.204) 12.841 7.873 ( -1.772 -9.881 -5.388) 11.394 8.343 ( 2.869 -9.509 -0.640) 9.953 8.779 ( -4.968 -13.642 -0.432) 14.525 8.840 ( 3.078 -4.853 7.363) 9.340 9.062 ( -2.745 0.023 13.074) 13.359 10.545 ( -0.528 2.108 2.361) 3.209 11.918 ( 11.938 10.276 -2.022) 15.881 12.203 ( -28.497 21.786 10.317) 37.325 12.717 ( -12.977 7.451 5.541) 15.957 12.959 ( -1.754 16.664 -3.363) 17.091 13.555 ( -0.300 13.047 -3.529) 13.519 14.006 ( 10.517 12.780 0.561) 16.561 14.791 ( 10.247 5.207 5.167) 12.602 15.103 ( 13.646 -17.432 -19.470) 29.482 16.687 ( -8.077 -53.260 14.514) 55.790 19.546 ( 3.141 -32.162 -3.692) 32.525 20.177 ( 2.309 -2.744 -2.160) 4.187 22.383 ( -13.478 -4.469 -6.950) 15.809 23.943 ( 24.053 -1.982 -21.360) 32.229 27.013 ( -0.789 -0.268 8.913) 8.952 29.380 ( -17.711 10.891 3.379) 21.065 ======================= Grid point 629 (297/429) ======================= q-point: ( 0.29 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.421 ( 15.066 -18.657 5.246) 24.548 3.151 ( 8.239 -20.054 20.376) 29.753 3.711 ( 2.468 -8.405 -2.073) 9.002 3.831 ( -8.604 -7.788 -3.129) 12.020 4.198 ( 19.685 -18.373 -15.103) 30.873 4.813 ( -4.944 -8.129 -4.684) 10.605 5.225 ( 10.639 -9.792 6.991) 16.061 5.566 ( 4.722 -16.809 6.489) 18.626 5.963 ( -1.724 -16.019 3.139) 16.414 6.411 ( -0.512 1.107 7.789) 7.883 6.548 ( -6.543 -1.368 2.897) 7.285 6.823 ( 9.328 -0.303 6.342) 11.284 7.380 ( 2.383 -3.937 -15.879) 16.532 7.421 ( -7.690 -3.882 -1.292) 8.711 7.658 ( -3.747 -4.369 -20.923) 21.700 8.113 ( -4.575 -17.483 -0.896) 18.094 8.457 ( 7.534 -3.385 1.232) 8.351 8.886 ( -5.324 -8.345 1.187) 9.970 9.044 ( -1.299 0.062 11.418) 11.492 9.221 ( -1.599 -21.806 2.130) 21.968 10.490 ( -0.560 4.390 4.367) 6.218 11.615 ( -20.669 21.940 15.363) 33.832 11.751 ( 10.232 15.958 -4.133) 19.402 12.492 ( -9.246 13.307 -0.073) 16.204 12.606 ( -0.812 19.001 -8.317) 20.757 13.297 ( 0.730 12.491 1.139) 12.564 13.818 ( 6.924 10.819 -2.016) 13.002 14.323 ( 18.666 33.186 0.516) 38.079 15.917 ( -11.862 -49.901 -12.848) 52.876 17.659 ( -6.485 -48.161 20.936) 52.914 20.127 ( 0.485 -16.740 2.220) 16.893 20.401 ( 12.864 -26.518 -16.044) 33.557 22.424 ( -14.397 -9.844 -5.006) 18.146 24.084 ( 19.850 -3.923 -20.662) 28.920 27.042 ( 0.098 -1.284 10.031) 10.114 29.033 ( -15.850 15.788 5.112) 22.949 ======================= Grid point 630 (298/429) ======================= q-point: ( 0.36 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.880 ( 11.701 -20.308 2.810) 23.605 3.521 ( 3.373 -13.316 17.674) 22.384 3.800 ( -8.861 -4.695 0.922) 10.070 3.989 ( 3.437 -10.202 -4.454) 11.651 4.480 ( 10.867 -3.057 -20.024) 22.987 4.940 ( -9.963 -10.680 -6.199) 15.866 5.348 ( 5.316 2.741 -1.009) 6.066 5.900 ( -0.563 -11.976 3.346) 12.448 6.188 ( -0.507 -7.355 9.691) 12.176 6.343 ( 4.959 1.006 15.078) 15.905 6.543 ( -1.116 -5.076 0.189) 5.200 6.996 ( -1.299 1.084 5.116) 5.389 7.525 ( 0.240 -12.796 -10.634) 16.640 7.629 ( 0.684 -17.914 -2.933) 18.165 7.826 ( 7.881 -21.902 -18.495) 29.729 8.382 ( -8.607 -14.472 2.784) 17.066 8.658 ( 5.756 -12.744 1.838) 14.104 9.023 ( -1.114 -1.266 4.055) 4.391 9.154 ( -4.393 -21.445 3.632) 22.190 9.624 ( -3.279 -22.271 -0.047) 22.511 10.374 ( -2.450 8.203 5.363) 10.103 11.147 ( 0.983 24.763 6.561) 25.636 11.527 ( -5.457 8.998 3.254) 11.015 12.071 ( -5.679 21.680 -7.342) 23.583 12.287 ( 4.546 16.140 -2.204) 16.912 13.140 ( -2.837 4.526 1.647) 5.589 13.673 ( 3.134 7.719 -2.261) 8.632 13.883 ( 10.744 22.544 1.268) 25.006 16.676 ( -14.380 -41.013 -8.256) 44.238 18.386 ( -5.249 -27.864 17.161) 33.143 20.337 ( 5.281 -7.844 6.086) 11.245 20.999 ( 13.560 -26.348 -22.262) 37.064 22.581 ( -14.434 -16.529 -1.465) 21.993 24.236 ( 15.435 -5.082 -17.736) 24.055 27.103 ( 0.938 -2.896 10.670) 11.096 28.660 ( -12.730 15.852 5.257) 20.999 ======================= Grid point 631 (299/429) ======================= q-point: ( 0.43 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.286 ( 5.712 -16.777 -0.082) 17.723 3.774 ( 0.695 -7.389 0.247) 7.426 3.835 ( -8.722 -6.513 12.134) 16.301 4.150 ( 3.176 -4.420 -6.177) 8.233 4.489 ( 6.064 0.426 -7.987) 10.037 4.971 ( -15.811 -0.640 -6.046) 16.939 5.253 ( 4.077 5.827 -5.429) 8.947 5.992 ( -5.229 -2.327 -0.440) 5.740 6.297 ( -0.576 -2.787 9.709) 10.118 6.423 ( 2.162 0.435 4.472) 4.987 6.736 ( 4.029 -6.475 18.709) 20.203 6.957 ( 3.533 -6.251 -3.597) 8.031 7.814 ( 5.565 -15.655 -4.784) 17.290 7.852 ( -4.182 -12.230 -11.692) 17.429 8.246 ( 6.446 -9.708 -3.254) 12.099 8.665 ( 0.357 -13.549 -4.230) 14.199 8.955 ( -1.956 -14.837 1.947) 15.091 9.113 ( -4.164 -17.787 8.038) 19.958 9.633 ( 1.293 -24.250 -2.530) 24.415 9.969 ( -9.908 -9.038 0.961) 13.446 10.304 ( 3.900 -13.224 2.658) 14.040 10.743 ( 4.389 19.232 0.131) 19.727 11.342 ( -3.622 10.626 7.132) 13.300 11.709 ( -10.683 9.793 0.514) 14.501 12.052 ( 12.176 12.883 -3.322) 18.035 13.062 ( -6.525 1.996 -0.876) 6.879 13.533 ( 3.176 10.015 1.723) 10.647 13.615 ( 3.596 9.734 -1.621) 10.502 17.268 ( -11.734 -31.871 -4.295) 34.233 18.720 ( -4.993 -9.741 9.978) 14.811 20.507 ( 7.294 -4.341 7.218) 11.142 21.399 ( 10.975 -13.464 -21.602) 27.720 22.859 ( -11.135 -19.962 0.981) 22.879 24.369 ( 11.013 -3.740 -13.344) 17.701 27.197 ( 1.530 -4.164 10.618) 11.507 28.327 ( -9.545 13.749 4.271) 17.274 ======================= Grid point 632 (300/429) ======================= q-point: ( 0.50 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.567 ( -0.106 -12.168 -2.589) 12.440 3.761 ( -13.944 0.893 1.408) 14.044 3.966 ( 1.506 -3.530 -4.817) 6.159 4.230 ( 2.229 -5.733 4.270) 7.488 4.553 ( 6.468 -2.856 4.014) 8.130 4.836 ( -6.420 4.660 -1.831) 8.141 5.214 ( -2.254 -1.507 -6.576) 7.113 5.943 ( -12.793 1.478 -7.016) 14.665 6.307 ( 9.703 9.295 6.495) 14.924 6.388 ( -5.000 -3.024 11.607) 12.995 6.862 ( 4.899 -4.352 11.316) 13.076 7.245 ( 8.353 -13.812 -0.032) 16.141 7.966 ( -4.460 -5.412 -8.099) 10.713 8.144 ( 7.683 -14.161 -6.268) 17.287 8.350 ( -1.890 -2.862 3.691) 5.039 8.762 ( -2.794 -1.649 -3.597) 4.843 9.108 ( 1.341 -6.870 -0.126) 7.001 9.509 ( -2.995 -10.568 -5.204) 12.154 9.910 ( -0.274 -2.354 -2.375) 3.355 10.083 ( 0.346 -19.958 2.798) 20.156 10.508 ( -0.300 6.673 2.218) 7.038 10.863 ( 2.012 -30.513 0.858) 30.591 11.173 ( 1.695 3.431 4.885) 6.205 11.553 ( -11.959 2.484 6.266) 13.728 11.933 ( 11.901 7.042 -0.656) 13.844 12.962 ( -7.117 4.219 -2.387) 8.611 13.389 ( 2.239 5.958 2.654) 6.896 13.507 ( 0.056 3.994 -2.012) 4.473 17.736 ( -7.639 -24.940 -1.642) 26.135 18.789 ( -3.371 0.032 4.376) 5.524 20.592 ( 5.650 0.462 6.549) 8.662 21.579 ( 7.641 -5.028 -18.622) 20.747 23.164 ( -6.470 -16.820 1.714) 18.102 24.438 ( 6.775 -0.214 -8.802) 11.109 27.308 ( 1.575 -4.450 10.027) 11.082 28.053 ( -6.906 11.167 2.987) 13.465 ======================= Grid point 633 (301/429) ======================= q-point: ( 0.57 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.633 ( -15.353 2.032 2.033) 15.620 3.746 ( 0.468 -6.756 -3.297) 7.532 4.021 ( 2.728 -2.967 -5.532) 6.845 4.344 ( 0.607 -3.042 9.920) 10.394 4.669 ( 2.690 -3.448 11.262) 12.082 4.770 ( -0.222 -1.843 -5.631) 5.929 5.217 ( -1.762 0.258 -3.189) 3.652 5.802 ( -16.266 1.189 -8.288) 18.295 6.230 ( 14.191 6.204 4.565) 16.147 6.456 ( -3.218 -3.333 10.785) 11.738 6.965 ( 4.053 -0.717 9.025) 9.919 7.478 ( 4.162 -6.961 -1.027) 8.175 7.958 ( -7.228 0.901 -5.247) 8.977 8.326 ( 4.947 -0.739 -10.714) 11.824 8.457 ( 2.935 -9.619 12.826) 16.299 8.777 ( -1.271 -3.407 -5.930) 6.956 9.254 ( 3.255 -6.969 -0.965) 7.752 9.495 ( -5.692 3.792 -13.154) 14.826 9.902 ( 1.552 1.771 -3.023) 3.832 10.396 ( 6.567 -7.070 7.989) 12.528 10.486 ( -5.282 -4.884 -1.453) 7.339 11.192 ( -0.905 3.629 4.790) 6.077 11.252 ( 1.116 -10.140 0.368) 10.207 11.595 ( -6.364 -12.866 5.355) 15.320 11.906 ( 4.927 1.629 5.150) 7.311 12.849 ( -3.847 2.893 -1.495) 5.040 13.344 ( 0.128 0.526 1.599) 1.688 13.441 ( -0.137 2.776 -1.048) 2.970 18.122 ( -3.779 -20.189 -0.130) 20.540 18.728 ( -0.886 5.040 0.575) 5.150 20.587 ( 2.144 3.404 5.603) 6.897 21.633 ( 5.576 -0.705 -16.502) 17.432 23.405 ( -2.735 -11.326 1.891) 11.804 24.422 ( 3.115 3.517 -5.002) 6.862 27.412 ( 0.815 -3.813 9.101) 9.901 27.845 ( -4.803 7.729 2.353) 9.399 ======================= Grid point 634 (302/429) ======================= q-point: (-0.36 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.547 ( -11.575 -0.073 5.058) 12.632 3.796 ( 5.208 2.456 -0.782) 5.811 4.075 ( 4.715 0.179 3.438) 5.838 4.440 ( -4.917 -7.987 5.584) 10.916 4.680 ( 2.606 2.170 0.854) 3.497 4.884 ( 0.165 -5.332 2.672) 5.967 5.157 ( -0.397 3.456 -1.899) 3.963 5.743 ( -13.483 -5.705 -7.853) 16.614 6.239 ( 13.606 2.697 3.526) 14.312 6.499 ( -3.455 -1.152 8.227) 8.997 6.947 ( 1.927 6.009 8.344) 10.461 7.540 ( -0.406 1.033 -5.088) 5.208 7.875 ( -6.901 2.202 3.641) 8.107 8.310 ( 2.606 1.761 -8.097) 8.687 8.703 ( 11.262 -9.858 8.760) 17.342 8.842 ( -0.959 -4.488 -9.716) 10.746 9.284 ( -2.844 5.998 -6.217) 9.095 9.448 ( 1.111 -6.919 -8.677) 11.153 9.848 ( 1.397 5.342 -1.359) 5.686 10.447 ( -0.369 2.785 2.551) 3.795 10.634 ( -2.293 -11.168 0.111) 11.401 10.950 ( 0.284 16.010 4.525) 16.640 11.428 ( -0.492 -3.966 -3.126) 5.073 11.708 ( -5.407 0.920 8.666) 10.256 11.915 ( 0.206 1.923 7.344) 7.594 12.837 ( 0.051 -3.117 0.577) 3.171 13.351 ( -1.158 -0.158 1.895) 2.226 13.401 ( 1.271 1.148 -0.305) 1.740 18.449 ( -1.192 -15.432 0.861) 15.502 18.607 ( 1.918 7.188 -2.259) 7.774 20.521 ( -1.830 4.550 5.031) 7.026 21.622 ( 4.783 1.644 -15.901) 16.686 23.566 ( 0.057 -6.452 1.508) 6.626 24.330 ( 0.458 6.534 -2.318) 6.948 27.461 ( -1.870 1.092 5.947) 6.329 27.756 ( -1.755 -1.027 5.089) 5.480 ======================= Grid point 635 (303/429) ======================= q-point: (-0.29 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.479 ( -5.668 4.898 10.218) 12.670 3.740 ( 4.464 6.758 3.563) 8.849 4.088 ( 6.619 1.628 10.013) 12.113 4.520 ( -3.134 0.108 -8.705) 9.253 4.708 ( -2.810 -4.284 3.236) 6.059 4.847 ( 1.188 6.265 -0.951) 6.448 5.202 ( 4.208 -7.220 -0.276) 8.361 5.801 ( -12.621 -8.732 -6.706) 16.749 6.272 ( 8.085 2.167 6.715) 10.731 6.486 ( -3.570 1.815 6.001) 7.214 6.812 ( 2.808 10.721 7.646) 13.465 7.448 ( -4.284 4.581 -6.756) 9.218 7.819 ( -2.624 2.703 8.719) 9.498 8.268 ( 3.206 2.886 -10.162) 11.040 8.823 ( -2.948 3.954 -12.412) 13.356 8.977 ( 16.715 -6.805 6.098) 19.049 9.177 ( -1.416 0.872 -7.306) 7.493 9.563 ( -3.780 -3.849 -1.558) 5.615 9.719 ( 2.069 6.599 -2.181) 7.252 10.310 ( -9.665 8.440 1.902) 12.972 10.651 ( 6.527 12.482 -4.244) 14.711 10.882 ( -1.011 -8.711 7.009) 11.226 11.386 ( -2.057 4.151 -5.969) 7.556 11.487 ( -3.911 20.296 4.806) 21.220 11.898 ( -1.241 -0.010 12.228) 12.291 12.954 ( 1.696 -7.768 2.658) 8.384 13.319 ( -1.483 2.491 0.840) 3.019 13.417 ( 1.730 -0.815 2.243) 2.948 18.411 ( 3.239 11.983 -3.369) 12.862 18.742 ( 0.575 -12.474 0.694) 12.507 20.421 ( -5.052 4.844 4.841) 8.510 21.569 ( 5.088 3.830 -16.815) 17.980 23.653 ( 1.765 -1.860 0.388) 2.594 24.177 ( -0.426 9.381 -1.051) 9.450 27.382 ( -3.953 5.067 2.734) 6.984 27.877 ( 0.218 -9.653 9.263) 13.380 ======================= Grid point 636 (304/429) ======================= q-point: (-0.21 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.314 ( -1.361 13.198 12.213) 18.033 3.595 ( 3.383 12.136 12.487) 17.738 4.159 ( 6.635 -3.000 6.940) 10.059 4.419 ( -2.164 6.004 -7.711) 10.009 4.532 ( -6.132 13.256 -8.406) 16.852 4.953 ( 0.822 -8.951 3.288) 9.572 5.391 ( 11.631 -6.725 -3.003) 13.767 5.870 ( -12.430 -7.404 -8.694) 16.880 6.252 ( -3.122 3.629 17.630) 18.268 6.409 ( -2.522 5.889 3.765) 7.431 6.628 ( 5.758 12.096 3.875) 13.946 7.334 ( -4.516 3.685 -3.656) 6.880 7.777 ( 1.582 2.484 7.552) 8.106 8.190 ( 4.379 5.729 -14.693) 16.367 8.637 ( -1.603 10.753 -10.927) 15.414 8.973 ( 4.910 19.644 2.824) 20.444 9.119 ( 0.992 5.929 -1.712) 6.250 9.637 ( 3.022 7.686 1.849) 8.464 9.676 ( -5.028 -17.269 -2.335) 18.137 10.082 ( -7.927 10.881 -1.465) 13.542 10.422 ( 5.146 12.920 -1.808) 14.024 10.798 ( 3.037 27.465 1.195) 27.659 11.251 ( -8.352 -11.454 2.366) 14.372 11.372 ( 1.842 -4.326 -5.755) 7.431 11.955 ( 0.267 -4.098 14.576) 15.144 13.130 ( 1.734 -8.739 3.800) 9.685 13.258 ( -2.652 2.586 0.106) 3.706 13.445 ( 2.102 -0.500 3.347) 3.984 18.146 ( 4.452 18.238 -5.169) 19.473 18.925 ( -1.666 -6.078 2.085) 6.638 20.307 ( -5.911 4.690 4.769) 8.926 21.462 ( 6.387 8.008 -19.518) 22.042 23.641 ( -0.919 4.139 -0.442) 4.263 23.979 ( 3.929 11.839 -2.081) 12.647 27.264 ( -4.383 5.195 2.319) 7.182 28.127 ( 0.309 -14.581 11.561) 18.611 ======================= Grid point 637 (305/429) ======================= q-point: (-0.14 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.005 ( 0.824 21.820 12.613) 25.217 3.401 ( 1.571 13.117 18.862) 23.028 4.218 ( -2.926 13.765 -8.522) 16.452 4.254 ( -0.501 4.635 -6.516) 8.012 4.274 ( 2.820 1.611 0.760) 3.335 5.057 ( 1.727 0.668 0.615) 1.951 5.480 ( 10.231 6.044 -0.917) 11.918 5.940 ( -4.981 -8.375 -3.879) 10.488 6.173 ( -12.544 7.248 23.099) 27.266 6.265 ( -3.310 4.061 -0.957) 5.325 6.471 ( 7.232 7.828 -0.865) 10.692 7.233 ( -1.440 5.562 1.558) 5.953 7.781 ( 1.104 0.091 3.248) 3.431 8.019 ( 6.880 14.129 -21.608) 26.719 8.366 ( 8.892 23.706 -2.947) 25.489 8.471 ( -11.314 19.008 -0.309) 22.123 9.007 ( -1.913 8.768 2.701) 9.372 9.355 ( -5.136 16.049 1.538) 16.920 9.621 ( -0.119 27.325 -5.936) 27.963 10.010 ( 1.318 7.054 -1.805) 7.399 10.320 ( 2.002 0.977 1.211) 2.535 10.516 ( 0.132 -17.442 -1.335) 17.493 11.424 ( -4.074 -6.738 -3.072) 8.452 11.638 ( 2.994 -22.029 -0.466) 22.237 12.135 ( 0.268 -12.753 14.513) 19.322 13.194 ( -3.377 1.799 0.924) 3.936 13.308 ( 1.109 -8.294 2.553) 8.748 13.485 ( 3.141 -2.012 3.080) 4.837 17.736 ( 4.229 27.729 -7.290) 28.981 18.912 ( -8.333 6.486 5.118) 11.735 20.210 ( -2.961 3.329 3.811) 5.863 21.243 ( 8.409 16.450 -23.740) 30.082 23.456 ( -10.978 11.939 1.389) 16.278 23.807 ( 16.335 11.389 -6.779) 21.036 27.153 ( -4.321 4.407 2.926) 6.830 28.463 ( -0.518 -18.830 12.605) 22.665 ======================= Grid point 638 (306/429) ======================= q-point: (-0.07 0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.579 ( 1.913 26.116 12.879) 29.182 3.166 ( 0.503 17.626 20.847) 27.304 3.925 ( -1.255 13.375 -7.522) 15.396 4.088 ( -1.559 7.722 -5.393) 9.547 4.247 ( 7.460 9.972 -5.323) 13.543 4.956 ( 3.867 9.541 2.202) 10.528 5.303 ( 4.297 15.748 5.362) 17.182 5.808 ( -3.410 21.235 15.072) 26.262 6.197 ( -6.685 3.896 4.123) 8.767 6.221 ( -5.741 -16.845 1.226) 17.839 6.452 ( 6.774 -1.808 -1.010) 7.083 7.051 ( -0.066 18.174 -0.536) 18.182 7.543 ( 2.341 20.369 -4.118) 20.912 7.807 ( -0.239 3.128 -20.174) 20.417 8.049 ( 2.840 9.411 -0.235) 9.833 8.204 ( 1.934 12.833 0.862) 13.007 8.702 ( -6.167 18.740 0.901) 19.749 9.125 ( 1.338 18.664 -0.227) 18.713 9.146 ( -5.116 5.267 -4.433) 8.577 9.696 ( -1.124 20.097 -0.923) 20.149 10.363 ( 1.543 -3.408 1.400) 3.994 11.145 ( -3.574 -38.369 2.776) 38.635 11.521 ( -0.104 -7.384 -2.317) 7.739 12.113 ( 5.116 -26.276 -1.209) 26.797 12.470 ( -4.368 -20.185 11.915) 23.843 13.159 ( -4.261 -0.605 1.310) 4.498 13.483 ( 5.410 -8.301 0.732) 9.935 13.586 ( 4.278 -6.923 2.743) 8.588 17.100 ( 2.670 41.168 -10.635) 42.603 18.562 ( -16.366 25.480 9.403) 31.710 20.169 ( 0.808 1.269 1.673) 2.250 20.827 ( 10.456 29.179 -25.874) 40.376 23.125 ( -15.266 14.291 2.231) 21.031 23.705 ( 23.596 9.924 -11.046) 27.880 27.067 ( -3.875 2.823 4.015) 6.253 28.861 ( -2.747 -21.817 11.371) 24.756 ======================= Grid point 642 (307/429) ======================= q-point: ( 0.21 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( 14.347 -0.000 8.732) 16.795 2.726 ( 38.381 -0.000 12.966) 40.512 3.020 ( -1.832 0.000 -0.859) 2.023 3.712 ( -11.424 0.000 -2.143) 11.624 4.148 ( 14.455 -0.000 -1.260) 14.510 4.400 ( -0.439 0.000 -2.003) 2.050 4.982 ( 15.766 -0.000 14.181) 21.206 5.258 ( 6.890 -0.000 -1.667) 7.088 5.481 ( -0.731 0.000 0.804) 1.086 6.338 ( 1.371 -0.000 -5.140) 5.320 6.423 ( -1.990 0.000 10.943) 11.123 7.152 ( -6.300 0.000 -15.747) 16.961 7.336 ( -1.962 0.000 -1.724) 2.612 7.531 ( -10.326 0.000 -17.141) 20.012 7.778 ( 0.152 -0.000 -0.435) 0.461 7.843 ( 1.155 -0.000 5.380) 5.503 8.085 ( 1.822 -0.000 -9.696) 9.865 8.648 ( -4.858 0.000 2.211) 5.337 8.834 ( 3.637 -0.000 7.346) 8.197 9.083 ( -0.717 0.000 14.777) 14.795 10.560 ( -1.969 0.000 3.006) 3.593 12.074 ( -5.395 0.000 8.223) 9.835 12.259 ( -14.572 0.000 -4.358) 15.210 12.722 ( -12.369 0.000 3.972) 12.991 13.231 ( 1.048 -0.000 1.618) 1.928 13.720 ( -4.527 0.000 -5.625) 7.220 14.003 ( -0.091 0.000 -3.002) 3.003 14.554 ( 20.755 -0.000 1.966) 20.848 15.634 ( 18.339 -0.000 -1.658) 18.414 15.929 ( -0.941 0.000 1.689) 1.933 19.203 ( -0.530 0.000 1.717) 1.796 20.154 ( 0.481 -0.000 -1.380) 1.461 22.258 ( -11.250 0.000 -9.351) 14.629 24.016 ( 21.918 -0.000 -23.150) 31.879 27.026 ( -0.152 0.000 10.136) 10.137 29.378 ( -20.645 0.000 2.585) 20.806 ======================= Grid point 643 (308/429) ======================= q-point: ( 0.29 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( 16.788 -12.541 6.233) 21.862 2.922 ( 13.801 -9.521 13.666) 21.631 3.416 ( 10.458 -25.749 0.433) 27.795 3.655 ( -13.834 -2.449 -1.148) 14.096 4.122 ( 15.965 1.948 -5.527) 17.007 4.598 ( -1.279 -12.444 -3.763) 13.064 5.150 ( 14.903 -6.288 4.076) 16.680 5.370 ( 8.088 -8.008 2.580) 11.671 5.635 ( -0.648 -15.225 0.927) 15.267 6.360 ( 1.347 -2.869 -4.572) 5.563 6.481 ( 0.828 -4.226 13.641) 14.305 7.017 ( -7.752 8.844 -1.385) 11.842 7.312 ( -3.552 0.105 -8.637) 9.339 7.406 ( -1.050 4.618 -9.266) 10.406 7.599 ( -5.453 5.773 -11.305) 13.816 7.872 ( 2.346 -6.585 -1.087) 7.075 8.368 ( 2.341 -13.330 -2.402) 13.745 8.672 ( -12.887 -7.750 3.032) 15.341 8.935 ( 7.570 -7.556 5.230) 11.906 9.096 ( -0.458 1.277 13.929) 13.995 10.543 ( -2.020 1.291 5.030) 5.572 11.819 ( -31.714 13.884 17.377) 38.737 12.130 ( 13.094 13.452 -10.557) 21.538 12.617 ( -5.827 5.729 1.631) 8.332 12.936 ( -1.508 20.552 -1.703) 20.678 13.532 ( -0.926 10.624 -5.671) 12.079 14.131 ( 11.099 12.738 0.637) 16.907 14.830 ( -2.601 -26.142 0.896) 26.286 15.250 ( 20.122 24.503 -13.574) 34.489 16.670 ( -4.863 -53.991 15.466) 56.373 19.567 ( 2.199 -33.130 -1.781) 33.251 20.196 ( 2.737 -4.992 -2.948) 6.411 22.215 ( -10.546 -3.811 -9.339) 14.593 24.104 ( 18.733 -1.588 -23.242) 29.894 27.050 ( 0.534 -0.350 11.293) 11.311 29.175 ( -20.090 9.001 3.341) 22.266 ======================= Grid point 644 (309/429) ======================= q-point: ( 0.36 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.629 ( 18.432 -16.379 3.315) 24.880 3.276 ( 1.334 -17.519 16.474) 24.085 3.646 ( -13.666 -5.144 1.572) 14.686 3.812 ( 6.279 -11.488 -0.121) 13.092 4.349 ( 17.938 -13.528 -20.496) 30.412 4.729 ( -6.624 -6.007 -3.636) 9.653 5.349 ( 8.254 -5.706 0.179) 10.036 5.646 ( 5.678 -14.669 3.268) 16.065 5.954 ( -1.351 -16.493 1.285) 16.598 6.441 ( 2.099 -4.842 0.492) 5.300 6.516 ( -3.289 8.154 16.552) 18.742 6.950 ( 7.768 -8.311 6.271) 12.990 7.314 ( -2.819 -5.939 -11.123) 12.921 7.389 ( 1.206 -5.278 -3.575) 6.487 7.531 ( -4.685 -5.489 -17.119) 18.577 8.076 ( -1.293 -13.673 -1.065) 13.775 8.539 ( 6.789 -6.248 -0.814) 9.262 8.786 ( -13.211 -11.773 1.492) 17.758 9.074 ( -1.169 2.123 12.110) 12.350 9.235 ( 2.516 -17.931 1.638) 18.180 10.494 ( -2.781 4.580 7.893) 9.540 11.437 ( -20.103 11.655 15.333) 27.840 11.841 ( 8.066 21.883 -5.461) 23.954 12.424 ( -1.045 15.483 -4.667) 16.204 12.563 ( -2.164 15.546 -5.523) 16.639 13.300 ( -0.162 12.022 -1.238) 12.086 13.886 ( 6.269 14.251 -1.959) 15.692 14.516 ( 14.754 36.450 0.277) 39.324 15.734 ( -12.633 -47.557 -9.018) 50.026 17.684 ( -2.447 -48.091 18.770) 51.682 20.144 ( -0.162 -19.033 5.170) 19.724 20.484 ( 12.308 -27.579 -16.293) 34.316 22.255 ( -11.267 -9.150 -6.953) 16.093 24.206 ( 15.206 -3.459 -21.361) 26.448 27.091 ( 1.283 -1.371 12.196) 12.339 28.860 ( -17.132 13.231 3.889) 21.993 ======================= Grid point 645 (310/429) ======================= q-point: ( 0.43 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.036 ( 13.945 -15.579 0.995) 20.933 3.598 ( 0.109 -13.481 11.579) 17.771 3.680 ( -13.791 -5.866 6.953) 16.521 4.035 ( 7.069 -9.224 -5.476) 12.847 4.508 ( 6.063 -0.198 -18.533) 19.500 4.799 ( -8.494 -6.449 -7.275) 12.910 5.404 ( 3.820 4.816 -1.094) 6.244 5.872 ( -5.248 -7.306 -1.248) 9.082 6.168 ( -7.593 -8.348 5.640) 12.616 6.446 ( 6.265 -0.396 8.593) 10.641 6.613 ( 9.462 -10.839 11.760) 18.583 7.010 ( 0.530 6.016 2.324) 6.471 7.496 ( 0.674 -15.774 -10.996) 19.240 7.619 ( 1.437 -11.188 -3.217) 11.730 7.899 ( 11.763 -34.727 -7.900) 37.506 8.291 ( -7.397 -12.369 0.493) 14.421 8.714 ( 3.428 -7.508 -0.999) 8.314 9.021 ( -1.599 -7.499 -0.820) 7.711 9.101 ( -7.222 -19.391 9.001) 22.565 9.598 ( -1.009 -19.713 -0.349) 19.742 10.358 ( -4.706 8.188 8.588) 12.765 11.193 ( 2.124 17.139 7.767) 18.937 11.446 ( -10.240 13.461 3.918) 17.361 12.008 ( -0.048 22.645 -10.897) 25.130 12.335 ( 5.253 11.386 -2.457) 12.778 13.109 ( -2.939 7.170 0.123) 7.750 13.690 ( 1.484 8.892 -2.560) 9.371 13.997 ( 8.195 25.364 1.279) 26.686 16.499 ( -11.812 -41.964 -5.250) 43.910 18.397 ( -3.174 -25.808 14.634) 29.837 20.416 ( 3.656 -10.684 7.977) 13.826 21.070 ( 13.219 -25.211 -22.114) 36.047 22.426 ( -11.345 -17.435 -2.567) 20.959 24.324 ( 11.507 -4.595 -17.673) 21.584 27.163 ( 2.038 -2.842 12.536) 13.015 28.526 ( -13.465 13.459 3.599) 19.376 ======================= Grid point 646 (311/429) ======================= q-point: ( 0.50 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.341 ( 4.482 -11.466 -2.136) 12.495 3.684 ( -13.062 -2.367 4.985) 14.180 3.864 ( 2.978 -9.774 6.287) 11.997 4.165 ( 3.581 -2.453 -7.496) 8.662 4.518 ( 2.511 -4.230 -5.457) 7.348 4.822 ( -5.630 -1.737 -3.031) 6.626 5.250 ( -1.524 8.206 -5.622) 10.063 5.879 ( -11.294 0.359 -6.547) 13.059 6.271 ( -7.896 -6.864 13.340) 16.954 6.509 ( 8.411 2.663 3.688) 9.563 6.864 ( 5.491 -0.357 12.344) 13.514 7.027 ( 10.268 -13.445 -0.277) 16.920 7.788 ( 0.036 -11.857 -9.251) 15.039 7.863 ( 3.527 -16.704 1.808) 17.168 8.289 ( 3.529 -3.851 -4.373) 6.813 8.636 ( -1.641 -14.295 -6.263) 15.693 8.944 ( -0.092 -18.631 -1.476) 18.690 9.109 ( -1.834 -14.035 7.662) 16.095 9.621 ( -1.581 -27.589 -3.923) 27.911 9.890 ( -4.804 -6.937 3.069) 8.979 10.338 ( -0.143 -15.801 4.710) 16.489 10.781 ( 2.099 21.942 -0.183) 22.043 11.317 ( -6.466 3.341 11.521) 13.627 11.620 ( -3.860 14.351 -3.851) 15.352 12.171 ( 10.605 10.281 -3.471) 15.173 12.984 ( -6.210 3.868 -1.680) 7.507 13.547 ( -0.649 6.909 -0.174) 6.942 13.659 ( 4.056 14.580 -0.051) 15.134 17.142 ( -8.052 -33.565 -2.598) 34.615 18.705 ( -3.493 -8.655 8.573) 12.673 20.606 ( 4.906 -4.694 8.234) 10.672 21.438 ( 9.984 -11.947 -21.908) 26.877 22.753 ( -7.737 -22.127 0.311) 23.443 24.427 ( 7.641 -3.172 -12.951) 15.368 27.263 ( 2.527 -3.778 12.124) 12.948 28.227 ( -10.150 11.809 2.731) 15.810 ======================= Grid point 647 (312/429) ======================= q-point: ( 0.57 0.21 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.537 ( -2.921 -10.339 -3.951) 11.447 3.600 ( -15.286 2.580 4.591) 16.168 3.980 ( 4.953 -2.131 -8.428) 10.005 4.272 ( 1.116 -7.684 6.514) 10.135 4.645 ( 7.152 -4.829 0.497) 8.644 4.787 ( -1.796 3.312 5.895) 6.997 5.157 ( -3.062 -1.769 -9.945) 10.555 5.743 ( -15.257 3.426 -7.690) 17.426 6.378 ( -5.001 -5.100 14.981) 16.597 6.453 ( 10.687 7.643 4.161) 13.782 6.949 ( 4.648 -4.053 3.114) 6.909 7.343 ( 7.507 -11.039 3.940) 13.919 7.907 ( -1.670 -3.094 -3.073) 4.669 8.217 ( 6.603 -16.077 -0.218) 17.382 8.329 ( -2.156 -2.080 -0.936) 3.139 8.707 ( -3.587 -1.846 -6.447) 7.605 9.126 ( 2.392 -7.503 -3.005) 8.429 9.459 ( -1.823 -7.803 -6.988) 10.632 9.903 ( -0.245 -0.723 1.252) 1.467 10.078 ( -1.789 -23.114 1.463) 23.229 10.517 ( -0.665 3.325 4.259) 5.444 10.889 ( 1.771 -28.797 1.800) 28.907 11.205 ( 1.445 3.760 2.288) 4.632 11.455 ( -9.690 1.542 8.246) 12.817 12.053 ( 9.592 8.180 -1.475) 12.692 12.876 ( -6.107 3.277 -2.643) 7.417 13.411 ( -0.123 6.355 2.655) 6.888 13.500 ( 0.345 4.697 -2.283) 5.234 17.663 ( -4.128 -26.504 -0.971) 26.842 18.771 ( -2.431 -0.000 3.929) 4.620 20.670 ( 3.424 1.648 6.887) 7.866 21.590 ( 6.522 -4.326 -18.808) 20.371 23.112 ( -3.571 -18.433 1.067) 18.806 24.468 ( 4.064 0.362 -8.309) 9.256 27.370 ( 2.406 -3.666 11.222) 12.048 27.980 ( -7.553 9.651 1.738) 12.377 ======================= Grid point 648 (313/429) ======================= q-point: (-0.36 -0.79 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.472 ( -14.149 0.340 4.091) 14.732 3.733 ( -0.581 -10.497 -2.935) 10.915 4.034 ( 3.170 -3.088 -6.179) 7.600 4.388 ( -0.048 -1.680 10.462) 10.596 4.733 ( 1.372 2.353 4.408) 5.181 4.778 ( 4.600 -5.547 2.826) 7.740 5.183 ( -1.026 -1.451 -6.486) 6.726 5.599 ( -13.617 0.330 -6.831) 15.238 6.395 ( 10.586 4.909 4.981) 12.688 6.461 ( -2.383 -2.563 10.627) 11.189 7.020 ( 1.302 -0.151 2.588) 2.901 7.515 ( 2.478 -3.873 0.715) 4.653 7.889 ( -3.451 2.151 2.152) 4.601 8.329 ( 1.474 0.188 -6.348) 6.520 8.549 ( 5.789 -13.957 8.800) 17.486 8.724 ( -2.500 -4.183 -10.021) 11.143 9.292 ( 3.754 -8.786 -6.808) 11.731 9.390 ( -3.643 7.607 -9.154) 12.447 9.913 ( 1.875 0.815 -0.710) 2.164 10.365 ( -6.910 -12.062 -2.375) 14.102 10.550 ( 6.658 1.692 9.953) 12.093 11.195 ( -1.179 -2.252 1.218) 2.819 11.248 ( -1.281 -3.334 0.614) 3.625 11.555 ( -4.785 -15.134 7.733) 17.656 11.972 ( 3.446 4.222 3.704) 6.589 12.806 ( -2.683 0.426 -1.366) 3.041 13.347 ( -0.764 0.940 1.875) 2.232 13.437 ( 0.065 2.241 -1.305) 2.594 18.093 ( -1.128 -21.312 -0.115) 21.342 18.720 ( -0.950 4.357 0.628) 4.503 20.625 ( 0.833 5.216 5.662) 7.744 21.631 ( 4.925 -0.518 -16.597) 17.320 23.390 ( -1.134 -12.374 1.444) 12.509 24.430 ( 1.500 3.974 -4.579) 6.246 27.460 ( 1.407 -2.236 10.035) 10.377 27.794 ( -5.365 5.924 1.407) 8.116 ======================= Grid point 649 (314/429) ======================= q-point: (-0.29 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.452 ( -8.817 -3.350 7.497) 12.049 3.841 ( 4.249 0.306 -3.557) 5.550 4.133 ( 3.118 -4.939 1.885) 6.138 4.414 ( -3.852 -2.175 7.440) 8.656 4.706 ( 1.449 1.820 0.159) 2.332 4.908 ( 1.808 -3.048 3.623) 5.068 5.147 ( 0.448 1.540 -2.202) 2.724 5.581 ( -9.842 -6.217 -5.862) 13.034 6.388 ( 8.741 3.382 5.448) 10.841 6.490 ( -2.455 -0.360 6.127) 6.610 6.975 ( -1.084 4.982 3.146) 5.991 7.508 ( -1.531 4.370 -4.664) 6.572 7.852 ( -1.602 0.782 10.234) 10.388 8.311 ( 2.195 1.546 -6.235) 6.789 8.763 ( -5.106 -4.988 -8.021) 10.737 8.879 ( 13.627 -12.365 2.942) 18.635 9.192 ( -6.844 6.167 -9.991) 13.590 9.460 ( 4.646 -6.764 -6.575) 10.515 9.859 ( 1.692 6.095 -1.677) 6.544 10.412 ( -6.061 4.922 1.785) 8.009 10.649 ( 2.172 -10.621 5.258) 12.048 10.980 ( 2.545 15.643 1.881) 15.960 11.388 ( -3.201 -3.828 -5.207) 7.212 11.693 ( -3.312 1.238 9.951) 10.560 11.940 ( -0.643 2.348 7.044) 7.453 12.839 ( -0.042 -4.863 0.611) 4.902 13.345 ( -1.271 0.292 2.215) 2.570 13.414 ( 1.137 -0.032 -0.568) 1.271 18.446 ( 0.187 -15.685 0.826) 15.708 18.612 ( 0.382 5.914 -2.217) 6.328 20.520 ( -1.594 6.467 5.066) 8.368 21.617 ( 4.780 1.593 -15.915) 16.694 23.570 ( -0.421 -7.134 1.505) 7.303 24.328 ( 0.797 6.706 -2.340) 7.147 27.463 ( -1.785 4.078 6.004) 7.474 27.754 ( -1.818 -4.103 5.034) 6.744 ======================= Grid point 650 (315/429) ======================= q-point: (-0.21 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.467 ( -2.988 1.775 10.906) 11.446 3.804 ( 5.005 5.446 1.592) 7.566 4.195 ( 5.400 1.151 9.148) 10.685 4.442 ( -5.379 -1.041 -6.826) 8.752 4.669 ( -4.174 4.356 -2.356) 6.477 4.866 ( 1.285 1.957 1.689) 2.887 5.263 ( 5.688 -10.406 2.276) 12.076 5.655 ( -8.734 -7.137 -4.860) 12.281 6.360 ( 1.622 4.689 9.396) 10.626 6.472 ( -1.273 2.019 1.709) 2.936 6.859 ( 1.070 7.876 5.241) 9.521 7.370 ( -4.835 5.810 -5.595) 9.405 7.854 ( 2.297 2.022 10.701) 11.130 8.273 ( 3.621 3.065 -7.688) 9.033 8.732 ( -4.663 3.549 -13.725) 14.924 9.082 ( -7.478 0.432 -0.866) 7.540 9.214 ( 18.116 -12.223 -0.874) 21.871 9.495 ( -4.521 5.802 -5.427) 9.141 9.756 ( 4.181 2.752 -1.763) 5.307 10.214 ( -9.100 10.201 4.720) 14.462 10.714 ( 6.531 13.596 -3.685) 15.527 10.899 ( 0.244 -10.186 5.674) 11.663 11.329 ( -3.832 5.235 -5.526) 8.522 11.482 ( 0.322 19.865 3.687) 20.207 11.922 ( -3.164 -0.753 12.579) 12.993 12.974 ( 0.426 -8.525 2.086) 8.787 13.310 ( -0.933 2.878 1.488) 3.371 13.442 ( 1.278 -1.424 1.390) 2.365 18.418 ( -0.001 10.969 -2.878) 11.340 18.748 ( 0.145 -12.103 0.374) 12.110 20.395 ( -2.575 6.284 4.986) 8.424 21.569 ( 5.732 3.669 -16.677) 18.012 23.651 ( -2.681 -1.590 1.398) 3.416 24.190 ( 3.747 8.524 -2.348) 9.602 27.354 ( -3.104 5.975 3.703) 7.685 27.907 ( -0.647 -10.684 8.253) 13.516 ======================= Grid point 651 (316/429) ======================= q-point: (-0.14 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.355 ( 1.145 12.044 10.918) 16.297 3.688 ( 4.846 11.371 12.279) 17.423 4.246 ( 4.676 -2.526 3.547) 6.390 4.345 ( -5.892 5.778 -7.481) 11.139 4.437 ( -4.683 12.545 -7.813) 15.503 4.976 ( 1.216 -8.291 2.162) 8.654 5.528 ( 12.892 -9.398 1.191) 15.998 5.700 ( -11.897 -5.833 -8.490) 15.737 6.269 ( -4.600 5.884 15.635) 17.328 6.393 ( -1.877 6.281 2.218) 6.920 6.709 ( 5.148 11.213 5.822) 13.643 7.256 ( -6.755 1.557 -3.819) 7.915 7.835 ( 4.119 3.479 5.550) 7.738 8.196 ( 5.208 6.324 -10.998) 13.714 8.562 ( -4.567 8.173 -11.658) 14.953 8.972 ( -5.863 16.101 2.416) 17.305 9.132 ( 2.119 13.674 -2.593) 14.078 9.656 ( 5.514 -19.637 -2.573) 20.558 9.676 ( -0.051 12.852 3.606) 13.348 10.003 ( -5.104 7.856 -0.873) 9.409 10.476 ( 5.452 12.126 -2.374) 13.505 10.825 ( 1.181 30.610 0.188) 30.634 11.170 ( -6.945 -11.147 2.847) 13.439 11.403 ( 7.030 -6.730 -5.129) 11.001 11.981 ( -5.293 -5.592 13.744) 15.754 13.151 ( 0.323 -9.341 2.490) 9.672 13.243 ( -0.800 3.759 1.380) 4.084 13.478 ( 1.849 -1.281 1.910) 2.950 18.146 ( -1.192 17.391 -5.272) 18.211 18.904 ( -3.378 -4.166 3.013) 6.152 20.286 ( -0.890 5.022 4.956) 7.112 21.471 ( 7.563 7.872 -19.048) 21.954 23.576 ( -9.530 6.743 2.108) 11.863 24.064 ( 11.877 8.465 -5.513) 15.591 27.233 ( -3.102 5.619 3.814) 7.466 28.161 ( -1.370 -15.034 9.931) 18.070 ======================= Grid point 652 (317/429) ======================= q-point: (-0.07 0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.069 ( 2.766 21.425 10.559) 24.045 3.499 ( 3.597 13.991 17.887) 22.992 4.117 ( -6.453 10.323 -8.247) 14.705 4.215 ( -2.086 8.618 -5.116) 10.236 4.344 ( 7.346 -1.987 -3.695) 8.459 5.091 ( 4.145 -0.168 -0.568) 4.187 5.543 ( -0.739 7.938 -3.863) 8.859 5.884 ( 0.789 -15.284 -4.530) 15.961 6.156 ( -7.001 10.836 27.516) 30.390 6.227 ( -2.485 6.483 0.111) 6.944 6.553 ( 6.917 8.044 0.603) 10.626 7.199 ( -5.622 1.711 0.659) 5.914 7.786 ( 0.223 3.946 -3.385) 5.204 8.033 ( 8.219 14.703 -16.035) 23.256 8.310 ( -13.853 16.843 -5.762) 22.556 8.480 ( 9.810 22.182 2.105) 24.346 8.995 ( -2.253 8.512 3.581) 9.505 9.289 ( -7.881 20.390 3.849) 22.197 9.606 ( 0.961 23.670 -4.651) 24.141 10.051 ( 6.570 9.582 -1.767) 11.752 10.299 ( -5.536 1.625 -0.330) 5.779 10.548 ( 5.289 -16.217 -0.165) 17.058 11.379 ( -2.491 -9.998 -0.820) 10.336 11.690 ( 6.901 -19.964 -1.807) 21.200 12.133 ( -9.010 -12.906 11.334) 19.396 13.176 ( -0.835 2.879 2.349) 3.808 13.336 ( 2.337 -9.562 1.795) 10.006 13.530 ( 3.272 -2.848 1.160) 4.491 17.710 ( -3.793 27.066 -8.332) 28.573 18.837 ( -8.762 9.771 8.393) 15.578 20.223 ( 2.472 3.105 3.992) 5.629 21.263 ( 10.029 16.302 -22.576) 29.598 23.310 ( -14.842 13.755 2.744) 20.421 23.982 ( 18.689 8.389 -10.206) 22.887 27.127 ( -2.726 4.625 4.839) 7.227 28.483 ( -3.439 -18.592 10.491) 21.623 ======================= Grid point 657 (318/429) ======================= q-point: ( 0.29 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( 14.134 -0.000 7.723) 16.106 2.990 ( -2.845 0.000 -0.867) 2.974 3.179 ( 31.804 -0.000 13.449) 34.531 3.540 ( -17.877 0.000 1.061) 17.908 4.306 ( 14.167 -0.000 -4.735) 14.937 4.390 ( -0.090 0.000 -1.935) 1.937 5.173 ( 12.705 -0.000 -5.279) 13.758 5.375 ( 15.394 -0.000 2.888) 15.662 5.473 ( -1.054 0.000 0.754) 1.296 6.335 ( 1.456 -0.000 -5.203) 5.403 6.466 ( 1.720 -0.000 13.072) 13.184 7.007 ( -12.521 0.000 -6.270) 14.003 7.308 ( -1.790 0.000 -1.553) 2.370 7.364 ( -6.049 0.000 -18.819) 19.767 7.771 ( -0.951 0.000 0.272) 0.989 7.882 ( 2.126 -0.000 4.612) 5.078 8.059 ( -1.536 0.000 -7.566) 7.720 8.566 ( -9.763 0.000 5.043) 10.988 8.929 ( 7.848 -0.000 4.000) 8.808 9.139 ( 0.564 -0.000 13.998) 14.010 10.548 ( -2.888 0.000 6.163) 6.806 11.790 ( -35.893 0.000 16.744) 39.607 12.301 ( 9.973 -0.000 -11.421) 15.163 12.657 ( 0.150 -0.000 -0.733) 0.748 13.241 ( -0.395 0.000 2.079) 2.116 13.649 ( -3.999 0.000 -7.407) 8.418 13.991 ( -0.118 0.000 -3.009) 3.011 14.807 ( 21.450 -0.000 3.408) 21.719 15.800 ( 12.350 -0.000 -2.297) 12.562 15.924 ( -0.947 0.000 1.645) 1.898 19.203 ( -0.532 0.000 1.721) 1.801 20.154 ( 0.489 -0.000 -1.367) 1.452 22.112 ( -7.707 0.000 -11.005) 13.435 24.146 ( 16.415 -0.000 -24.238) 29.273 27.073 ( 0.929 -0.000 12.389) 12.424 29.146 ( -21.477 0.000 2.754) 21.652 ======================= Grid point 658 (319/429) ======================= q-point: ( 0.36 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.450 ( 15.361 -14.535 6.060) 21.999 3.032 ( 0.852 -8.970 5.933) 10.788 3.470 ( -18.893 -3.651 3.529) 19.564 3.589 ( 15.488 -17.511 7.369) 24.511 4.270 ( 14.670 -0.239 -10.264) 17.906 4.566 ( -1.667 -8.749 -4.765) 10.101 5.272 ( 6.960 -5.497 -5.289) 10.326 5.496 ( 9.199 -6.078 2.013) 11.207 5.657 ( 7.252 -14.214 -0.564) 15.967 6.363 ( 2.236 -3.391 -4.534) 6.088 6.571 ( 5.600 -5.566 15.608) 17.492 6.892 ( -13.692 2.211 -1.521) 13.953 7.246 ( -1.722 1.290 -9.394) 9.637 7.356 ( -2.168 -1.135 -5.886) 6.374 7.537 ( -0.656 11.573 -4.109) 12.299 7.899 ( 2.805 -5.126 -1.274) 5.981 8.361 ( -3.955 -18.756 -2.948) 19.394 8.544 ( -9.304 -2.757 5.617) 11.212 9.036 ( 7.223 -6.545 2.912) 10.173 9.144 ( 0.311 2.142 11.540) 11.741 10.540 ( -2.835 0.827 8.876) 9.355 11.527 ( -28.917 9.155 15.944) 34.267 12.213 ( 6.620 11.976 -9.489) 16.651 12.610 ( 4.698 6.305 -2.673) 8.305 12.909 ( -2.249 23.456 -0.469) 23.569 13.490 ( -2.260 8.640 -7.319) 11.547 14.260 ( 11.075 9.947 0.644) 14.900 14.781 ( -5.041 -23.533 -1.160) 24.095 15.413 ( 14.450 35.913 -8.214) 39.573 16.691 ( -0.474 -56.798 12.855) 58.237 19.581 ( 0.700 -33.713 0.284) 33.721 20.217 ( 3.064 -7.336 -3.826) 8.823 22.079 ( -6.723 -3.026 -10.587) 12.901 24.200 ( 13.592 -1.515 -23.433) 27.132 27.107 ( 1.410 -0.457 13.325) 13.407 28.958 ( -19.756 7.447 2.883) 21.309 ======================= Grid point 659 (320/429) ======================= q-point: ( 0.43 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.849 ( 16.904 -15.570 3.630) 23.267 3.306 ( -3.074 -17.271 8.610) 19.542 3.478 ( -17.855 -7.029 6.885) 20.386 3.902 ( 7.832 -9.206 2.097) 12.268 4.445 ( 12.811 -7.700 -23.907) 28.195 4.646 ( -5.303 -4.528 -2.687) 7.473 5.410 ( 2.189 -5.656 1.026) 6.151 5.685 ( -0.776 -9.056 -1.533) 9.218 5.962 ( 3.554 -12.030 -0.270) 12.547 6.464 ( 4.174 -4.852 -4.455) 7.798 6.602 ( 3.966 4.470 22.226) 23.015 7.008 ( -1.177 -12.775 -0.314) 12.833 7.244 ( -2.332 -6.556 -10.279) 12.413 7.404 ( 3.303 -11.262 -1.567) 11.840 7.472 ( 2.306 -4.674 -4.134) 6.653 8.076 ( 2.720 -11.115 -3.031) 11.837 8.597 ( -6.843 -10.553 -3.359) 13.018 8.623 ( -4.584 -10.995 3.665) 12.463 9.104 ( -0.832 3.027 10.028) 10.508 9.278 ( 4.011 -14.316 0.106) 14.867 10.488 ( -4.387 5.567 11.882) 13.835 11.280 ( -16.805 4.196 14.090) 22.328 11.893 ( 5.007 24.488 -5.148) 25.519 12.405 ( 0.519 20.205 -11.330) 23.170 12.537 ( 1.131 11.041 -0.409) 11.106 13.282 ( -1.658 10.853 -3.059) 11.397 13.945 ( 5.220 18.368 -1.428) 19.149 14.654 ( 9.144 38.675 0.364) 39.743 15.575 ( -10.255 -47.123 -5.489) 48.537 17.739 ( 1.319 -46.934 14.485) 49.136 20.154 ( -2.381 -21.332 7.579) 22.763 20.561 ( 11.793 -28.674 -16.503) 35.123 22.121 ( -7.256 -8.188 -8.032) 13.572 24.274 ( 10.608 -3.416 -20.865) 23.655 27.159 ( 2.065 -1.520 13.922) 14.157 28.680 ( -16.357 11.157 2.913) 20.013 ======================= Grid point 660 (321/429) ======================= q-point: ( 0.50 0.29 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.184 ( 9.681 -10.556 2.096) 14.475 3.527 ( -15.335 -7.021 6.926) 18.232 3.641 ( 0.128 -16.481 8.865) 18.714 4.096 ( 7.626 -7.186 -7.786) 13.054 4.466 ( -3.665 1.670 -10.653) 11.389 4.731 ( 2.876 -5.744 -11.124) 12.846 5.401 ( -4.766 7.766 0.405) 9.120 5.791 ( -5.254 -4.660 -4.086) 8.125 6.107 ( -6.979 -6.497 8.198) 12.575 6.542 ( 7.268 -2.600 -0.396) 7.729 6.799 ( 11.886 -12.273 16.885) 24.021 7.011 ( -0.075 4.640 -3.386) 5.744 7.462 ( 0.995 -18.048 -9.581) 20.458 7.640 ( 1.176 -10.664 1.737) 10.868 7.998 ( 6.458 -39.935 1.188) 40.471 8.249 ( 3.056 -5.216 -4.249) 7.389 8.712 ( -3.248 -6.831 -3.239) 8.228 8.967 ( -3.902 -22.860 -3.978) 23.529 9.094 ( -1.241 -6.377 10.079) 11.992 9.594 ( 0.698 -17.660 -1.831) 17.768 10.338 ( -5.008 7.883 11.879) 15.111 11.231 ( -3.806 0.871 12.430) 13.029 11.357 ( -4.456 28.619 0.366) 28.966 11.970 ( 0.599 21.609 -13.146) 25.301 12.386 ( 5.089 8.428 -2.078) 10.062 13.075 ( -2.809 9.088 -0.800) 9.546 13.689 ( -0.045 10.523 -2.137) 10.738 14.074 ( 4.442 26.742 1.345) 27.142 16.376 ( -7.002 -42.917 -3.215) 43.603 18.423 ( -0.552 -23.434 11.494) 26.107 20.472 ( 0.497 -13.318 9.409) 16.314 21.134 ( 12.416 -23.839 -22.400) 34.989 22.309 ( -7.209 -18.236 -3.105) 19.854 24.367 ( 7.396 -4.478 -16.842) 18.932 27.240 ( 2.797 -2.841 13.856) 14.418 28.386 ( -12.831 11.555 2.585) 17.460 ======================= Grid point 661 (322/429) ======================= q-point: (-0.43 -0.71 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.366 ( 0.355 -6.786 -0.132) 6.796 3.543 ( -15.709 -1.754 8.059) 17.743 3.928 ( 6.745 -8.481 -1.225) 10.905 4.170 ( 1.919 -1.858 -7.275) 7.750 4.501 ( -1.777 -9.839 -1.584) 10.123 4.836 ( 8.601 -3.150 -3.766) 9.904 5.169 ( -9.624 9.060 -2.918) 13.536 5.734 ( -8.057 4.393 -7.358) 11.763 6.241 ( -7.012 -8.830 15.079) 18.828 6.603 ( 6.311 1.450 -0.257) 6.480 6.925 ( 2.196 0.409 -1.035) 2.462 7.173 ( 10.773 -13.567 8.679) 19.377 7.789 ( 4.458 -11.127 -4.226) 12.710 7.891 ( -2.155 -18.408 7.055) 19.831 8.306 ( 4.153 -0.651 -7.020) 8.183 8.586 ( -3.551 -12.313 -5.213) 13.835 8.943 ( 2.231 -18.358 -6.072) 19.464 9.122 ( -0.473 -13.832 5.976) 15.075 9.578 ( -2.058 -28.931 -4.891) 29.414 9.879 ( 0.077 -7.899 2.901) 8.416 10.348 ( -1.542 -15.707 7.973) 17.682 10.785 ( -1.354 22.663 0.208) 22.704 11.290 ( -6.164 -1.556 13.269) 14.713 11.583 ( 0.002 17.085 -6.130) 18.152 12.261 ( 7.227 8.297 -3.803) 11.642 12.914 ( -4.750 5.576 -1.541) 7.485 13.527 ( -2.395 6.283 -0.351) 6.733 13.696 ( 2.194 16.158 0.422) 16.312 17.069 ( -3.198 -34.694 -1.803) 34.887 18.706 ( -1.396 -7.367 7.073) 10.308 20.675 ( 1.453 -5.228 9.049) 10.552 21.463 ( 8.671 -10.356 -22.462) 26.210 22.689 ( -3.594 -23.869 -0.214) 24.139 24.447 ( 4.053 -2.984 -12.045) 13.055 27.342 ( 3.188 -3.403 13.014) 13.824 28.120 ( -9.917 10.285 1.959) 14.421 ======================= Grid point 662 (323/429) ======================= q-point: (-0.36 -0.71 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.430 ( -14.824 1.933 7.293) 16.633 3.513 ( -2.477 -8.666 -1.891) 9.210 4.005 ( 5.150 -1.092 -11.226) 12.400 4.302 ( -0.267 -8.345 7.451) 11.190 4.689 ( 2.573 -7.759 -2.659) 8.596 4.865 ( 6.971 6.761 12.121) 15.532 5.071 ( -3.454 -5.909 -12.009) 13.822 5.572 ( -9.410 4.959 -7.248) 12.872 6.372 ( -6.439 -5.718 16.361) 18.488 6.570 ( 7.661 5.043 0.929) 9.219 6.979 ( 1.032 -3.919 -4.610) 6.138 7.436 ( 4.647 -7.552 7.341) 11.512 7.909 ( 1.144 -1.180 4.606) 4.891 8.259 ( -3.728 -15.565 9.074) 18.398 8.331 ( 8.389 -4.061 -11.534) 14.829 8.636 ( -4.130 -1.833 -7.348) 8.626 9.130 ( 1.938 -8.430 -9.023) 12.499 9.419 ( -0.603 -5.772 -6.347) 8.600 9.920 ( 1.620 -1.739 4.550) 5.133 10.067 ( -0.685 -18.496 0.457) 18.514 10.520 ( -2.058 -4.752 5.815) 7.786 10.913 ( 1.052 -26.065 1.418) 26.125 11.220 ( 0.521 3.901 0.093) 3.937 11.395 ( -7.126 1.921 10.469) 12.809 12.135 ( 5.752 8.646 -2.388) 10.655 12.809 ( -4.004 2.457 -1.960) 5.090 13.406 ( -2.260 5.300 2.566) 6.307 13.498 ( 0.547 5.908 -1.910) 6.234 17.636 ( -0.110 -27.314 -1.009) 27.332 18.764 ( -1.134 0.468 3.516) 3.724 20.719 ( 0.568 2.252 7.157) 7.525 21.589 ( 5.546 -3.892 -19.065) 20.233 23.091 ( -0.547 -19.283 0.468) 19.297 24.469 ( 1.257 0.410 -7.455) 7.571 27.444 ( 2.958 -2.926 11.888) 12.595 27.897 ( -7.739 8.442 1.135) 11.509 ======================= Grid point 663 (324/429) ======================= q-point: (-0.29 -0.71 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.353 ( -10.381 -1.714 7.834) 13.117 3.719 ( -0.354 -12.664 -1.482) 12.756 4.038 ( 1.897 -2.695 -8.181) 8.820 4.417 ( -1.340 -2.001 10.178) 10.459 4.745 ( 0.596 1.367 -0.184) 1.503 4.866 ( 5.222 -2.174 6.672) 8.746 5.159 ( 2.231 -2.381 -6.576) 7.341 5.458 ( -6.844 -0.180 -5.224) 8.612 6.437 ( -6.426 -2.063 14.783) 16.251 6.535 ( 8.305 3.493 -0.727) 9.039 7.009 ( -2.894 0.019 -3.218) 4.328 7.541 ( 1.161 -0.993 2.191) 2.671 7.898 ( 0.760 2.635 10.223) 10.585 8.316 ( -0.268 -0.914 -4.598) 4.696 8.596 ( -3.710 -8.459 -3.674) 9.941 8.705 ( 7.675 -11.951 -1.792) 14.316 9.233 ( -2.997 -0.018 -18.274) 18.518 9.393 ( 4.222 0.240 -1.217) 4.400 9.943 ( 2.944 1.887 1.506) 3.808 10.286 ( -5.001 -11.134 -1.771) 12.334 10.651 ( 4.179 2.050 10.842) 11.799 11.151 ( -4.331 -11.064 -7.098) 13.841 11.253 ( -0.630 5.629 7.192) 9.154 11.542 ( -2.493 -17.169 7.798) 19.021 12.009 ( 1.062 5.826 2.580) 6.459 12.779 ( -1.363 -1.292 -0.769) 2.029 13.342 ( -1.415 0.831 2.221) 2.761 13.432 ( 0.008 1.768 -1.350) 2.224 18.095 ( 1.661 -21.626 -0.580) 21.697 18.712 ( -0.879 4.488 0.825) 4.647 20.646 ( -0.808 6.099 5.636) 8.344 21.624 ( 4.571 -0.642 -16.636) 17.264 23.390 ( 0.356 -12.496 1.068) 12.547 24.422 ( -0.095 3.622 -3.984) 5.385 27.517 ( 1.855 -0.258 10.786) 10.948 27.734 ( -5.731 3.800 0.702) 6.912 ======================= Grid point 664 (325/429) ======================= q-point: (-0.21 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.408 ( -4.587 -5.962 10.272) 12.731 3.871 ( 3.969 -1.499 -5.185) 6.699 4.145 ( -1.446 -9.507 -1.668) 9.760 4.413 ( -1.777 2.585 10.056) 10.533 4.710 ( -0.534 2.518 -0.913) 2.731 4.936 ( 0.701 0.564 1.378) 1.646 5.161 ( 2.536 -1.449 0.331) 2.940 5.493 ( -1.987 -5.760 -2.571) 6.613 6.433 ( -6.038 1.093 11.134) 12.713 6.516 ( 5.140 2.810 -2.535) 6.383 6.948 ( -4.141 3.029 0.184) 5.134 7.482 ( -0.588 6.923 -1.916) 7.207 7.909 ( 3.445 0.122 13.409) 13.845 8.314 ( 1.714 0.649 -3.856) 4.269 8.651 ( -7.513 -4.711 -12.063) 14.971 9.041 ( 9.718 -10.207 -1.381) 14.161 9.082 ( -3.176 1.158 -4.677) 5.771 9.485 ( 4.553 -4.063 -9.373) 11.184 9.872 ( 1.391 6.467 -1.771) 6.848 10.349 ( -6.046 5.266 3.792) 8.869 10.703 ( 3.282 -9.208 6.175) 11.562 11.011 ( 1.819 14.299 -0.478) 14.422 11.332 ( -3.111 -3.495 -3.462) 5.820 11.704 ( -1.156 1.397 9.272) 9.447 11.948 ( -2.404 2.383 6.325) 7.174 12.840 ( -0.184 -5.682 0.647) 5.722 13.339 ( -1.154 0.285 2.461) 2.733 13.421 ( 0.486 -0.802 -0.840) 1.259 18.459 ( 1.507 -14.984 0.566) 15.070 18.600 ( -1.182 5.641 -1.955) 6.086 20.522 ( -1.372 7.089 5.029) 8.799 21.614 ( 5.032 1.225 -15.821) 16.647 23.568 ( -0.987 -6.333 1.617) 6.610 24.330 ( 1.138 5.476 -2.453) 6.107 27.464 ( -1.790 6.328 5.962) 8.876 27.752 ( -1.775 -6.438 5.077) 8.389 ======================= Grid point 665 (326/429) ======================= q-point: (-0.14 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.494 ( 0.417 -0.210 11.494) 11.503 3.865 ( 5.379 3.080 -1.016) 6.282 4.265 ( 1.162 -1.840 3.814) 4.391 4.354 ( -6.167 2.473 -1.037) 6.725 4.605 ( -4.402 8.473 -4.588) 10.594 4.879 ( -0.121 -0.112 1.359) 1.369 5.330 ( 2.556 -12.319 3.195) 12.981 5.591 ( 0.956 -4.328 -0.661) 4.481 6.371 ( -5.132 4.002 8.412) 10.635 6.470 ( 0.410 3.368 -1.509) 3.713 6.872 ( -2.184 3.681 5.077) 6.640 7.313 ( -1.811 8.861 -2.609) 9.413 7.941 ( 5.979 2.390 9.107) 11.153 8.293 ( 3.580 2.781 -4.074) 6.095 8.615 ( -6.814 2.393 -14.526) 16.223 8.969 ( -9.265 -1.119 -3.113) 9.838 9.379 ( 1.712 -6.997 -0.488) 7.220 9.477 ( 13.154 4.280 -5.143) 14.758 9.782 ( 1.614 1.155 -3.533) 4.052 10.143 ( -6.609 10.714 6.126) 14.000 10.754 ( 2.430 14.026 -4.223) 14.848 10.943 ( 3.766 -9.120 6.873) 12.025 11.268 ( -3.217 6.561 -4.354) 8.506 11.518 ( 3.755 17.314 2.745) 17.928 11.913 ( -6.288 -0.387 11.577) 13.180 12.981 ( -0.470 -8.820 1.623) 8.980 13.308 ( -0.494 2.802 1.751) 3.340 13.455 ( 0.486 -2.057 0.543) 2.182 18.389 ( -3.266 11.504 -2.435) 12.204 18.749 ( -0.291 -11.126 0.399) 11.137 20.400 ( 0.083 6.157 5.130) 8.014 21.577 ( 6.441 3.207 -16.484) 17.986 23.608 ( -5.608 0.963 2.273) 6.127 24.238 ( 6.286 5.583 -3.682) 9.178 27.339 ( -2.237 6.428 4.744) 8.296 27.923 ( -1.538 -11.147 7.126) 13.320 ======================= Grid point 666 (327/429) ======================= q-point: (-0.07 0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.419 ( 3.285 11.563 9.311) 15.205 3.790 ( 5.478 10.008 10.184) 15.293 4.214 ( -8.611 6.729 -7.598) 13.310 4.299 ( -1.020 -0.954 0.133) 1.403 4.382 ( 0.369 8.633 -4.164) 9.592 4.991 ( 0.677 -9.267 -0.448) 9.303 5.529 ( -11.775 -5.768 -7.499) 15.105 5.698 ( 13.672 -6.766 5.016) 16.058 6.266 ( -4.395 5.535 10.375) 12.553 6.390 ( -0.266 5.733 3.375) 6.658 6.779 ( 1.941 8.462 8.367) 12.057 7.162 ( -6.768 3.066 -2.982) 8.006 7.905 ( 6.027 6.256 -0.033) 8.687 8.225 ( 4.787 6.302 -5.610) 9.701 8.447 ( -7.545 8.100 -12.079) 16.384 8.900 ( -7.059 8.647 2.163) 11.370 9.132 ( -0.254 13.789 -2.862) 14.085 9.664 ( -3.457 12.465 2.184) 13.118 9.762 ( 11.686 -8.607 1.518) 14.593 9.960 ( -1.316 5.320 -3.068) 6.281 10.520 ( 3.272 8.361 -1.797) 9.157 10.828 ( -0.191 33.552 -0.894) 33.564 11.122 ( -3.723 -10.312 4.442) 11.829 11.491 ( 11.281 -8.154 -4.395) 14.597 11.935 ( -10.833 -4.789 11.800) 16.719 13.155 ( -1.661 -9.220 1.947) 9.569 13.250 ( 1.510 2.919 1.702) 3.701 13.500 ( 1.227 -2.221 0.532) 2.592 18.081 ( -6.533 18.153 -5.025) 19.937 18.874 ( -4.127 -2.394 4.077) 6.275 20.321 ( 3.613 4.307 5.302) 7.728 21.493 ( 8.509 7.393 -18.688) 21.824 23.464 ( -11.287 9.678 2.840) 15.137 24.184 ( 12.773 5.240 -7.376) 15.653 27.222 ( -1.792 5.746 5.400) 8.086 28.169 ( -3.051 -14.806 8.164) 17.180 ======================= Grid point 672 (328/429) ======================= q-point: ( 0.36 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( 10.055 -0.000 8.311) 13.045 2.953 ( -2.365 0.000 -1.969) 3.078 3.322 ( -21.862 0.000 6.484) 22.804 3.539 ( 22.175 -0.000 12.803) 25.605 4.384 ( 0.341 -0.000 -1.948) 1.977 4.414 ( 9.209 -0.000 -10.668) 14.093 5.238 ( 4.759 -0.000 -8.655) 9.877 5.463 ( -1.264 0.000 0.869) 1.534 5.615 ( 24.711 -0.000 -2.637) 24.851 6.333 ( 1.600 -0.000 -5.303) 5.539 6.539 ( 1.802 -0.000 5.965) 6.231 6.841 ( -12.051 0.000 3.118) 12.448 7.264 ( -2.239 0.000 -11.175) 11.397 7.285 ( -1.277 0.000 -1.405) 1.898 7.760 ( -1.338 0.000 1.079) 1.720 7.921 ( 1.960 -0.000 3.734) 4.217 7.978 ( -8.650 0.000 -5.453) 10.225 8.506 ( -3.144 0.000 6.335) 7.072 9.027 ( 7.484 -0.000 1.107) 7.565 9.189 ( 0.365 -0.000 9.771) 9.778 10.547 ( -2.305 0.000 10.535) 10.784 11.476 ( -28.961 0.000 14.337) 32.316 12.322 ( 0.225 -0.000 -5.268) 5.273 12.705 ( 8.843 -0.000 -6.786) 11.147 13.244 ( -0.038 0.000 1.931) 1.931 13.571 ( -4.657 0.000 -8.647) 9.821 13.979 ( 0.069 -0.000 -3.003) 3.004 15.050 ( 17.583 -0.000 5.108) 18.310 15.904 ( 8.559 -0.000 -4.309) 9.582 15.920 ( -0.875 0.000 1.614) 1.835 19.204 ( -0.538 0.000 1.724) 1.806 20.155 ( 0.491 -0.000 -1.361) 1.447 22.004 ( -3.940 0.000 -11.546) 12.200 24.213 ( 11.174 -0.000 -23.770) 26.265 27.136 ( 1.515 -0.000 14.175) 14.256 28.920 ( -19.537 0.000 2.580) 19.707 ======================= Grid point 673 (329/429) ======================= q-point: ( 0.43 0.36 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.613 ( 7.286 -16.871 8.676) 20.322 3.037 ( 0.604 -10.260 -0.682) 10.300 3.262 ( -21.521 -5.202 9.327) 24.025 3.779 ( 11.813 -9.347 8.877) 17.485 4.371 ( 10.927 -2.356 -14.297) 18.148 4.523 ( -2.691 -5.683 -5.304) 8.226 5.291 ( -0.018 -5.342 -3.506) 6.390 5.532 ( -1.368 -6.893 0.915) 7.087 5.826 ( 20.647 -7.533 -4.910) 22.520 6.376 ( 3.025 -4.610 -5.007) 7.448 6.657 ( -8.855 -13.477 -7.734) 17.885 6.761 ( 2.127 5.182 15.482) 16.464 7.206 ( -1.767 1.213 -2.607) 3.374 7.324 ( -1.034 -2.700 -2.331) 3.714 7.538 ( 1.616 10.618 0.030) 10.741 7.920 ( 1.387 -5.542 -1.848) 6.005 8.240 ( -13.037 -16.428 -0.403) 20.976 8.542 ( 3.589 -3.429 4.623) 6.783 9.113 ( 4.118 -4.701 2.165) 6.614 9.186 ( 2.125 1.578 4.981) 5.641 10.552 ( -1.851 1.167 13.555) 13.730 11.291 ( -21.953 5.116 13.367) 26.206 12.221 ( 0.540 9.706 -5.312) 11.077 12.668 ( 6.684 8.089 -8.062) 13.233 12.897 ( 0.968 25.598 0.636) 25.624 13.425 ( -4.280 6.983 -8.164) 11.565 14.385 ( 10.360 1.964 0.375) 10.551 14.714 ( -5.850 -10.668 -1.397) 12.247 15.505 ( 5.165 39.297 -3.134) 39.759 16.758 ( 5.829 -59.186 7.246) 59.913 19.583 ( -1.283 -33.413 2.251) 33.514 20.238 ( 3.409 -9.713 -4.772) 11.346 21.985 ( -2.930 -2.310 -10.914) 11.534 24.241 ( 8.502 -1.656 -22.392) 24.009 27.177 ( 1.816 -0.621 14.754) 14.878 28.757 ( -16.995 6.384 2.667) 18.349 ======================= Grid point 674 (330/429) ======================= q-point: (-0.50 -0.64 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.993 ( 1.565 -16.462 9.245) 18.945 3.286 ( -16.156 -9.965 8.692) 20.878 3.334 ( 2.899 -15.973 2.074) 16.366 3.990 ( 6.415 -7.286 0.374) 9.715 4.449 ( 2.219 -1.070 -19.342) 19.498 4.608 ( 1.250 -6.491 -5.786) 8.785 5.410 ( -4.016 -5.596 4.662) 8.318 5.639 ( -3.774 -6.129 -2.571) 7.643 6.019 ( 5.215 -3.556 -0.323) 6.321 6.503 ( 5.496 -5.584 -5.266) 9.440 6.708 ( -1.479 -6.011 11.125) 12.731 6.960 ( 0.880 -11.060 -5.490) 12.379 7.202 ( -1.100 -4.947 -1.506) 5.287 7.417 ( -0.758 -10.636 -1.489) 10.767 7.556 ( 9.869 -10.093 5.982) 15.331 8.119 ( 6.946 -12.851 -4.028) 15.153 8.402 ( -17.052 -12.894 0.024) 21.378 8.685 ( 6.076 -7.476 -0.439) 9.644 9.127 ( -0.582 2.526 6.802) 7.279 9.321 ( 4.300 -11.483 -2.645) 12.544 10.492 ( -3.202 7.218 15.818) 17.679 11.161 ( -12.816 -0.522 12.582) 17.967 11.925 ( 3.700 23.749 -3.459) 24.283 12.334 ( -4.580 22.105 -12.011) 25.571 12.588 ( 6.898 11.468 -1.298) 13.446 13.239 ( -3.595 9.051 -3.860) 10.476 13.989 ( 2.999 22.245 -0.722) 22.458 14.723 ( 2.388 39.710 1.092) 39.796 15.469 ( -5.231 -48.236 -3.212) 48.625 17.822 ( 5.675 -44.942 9.345) 46.252 20.142 ( -5.366 -23.309 9.188) 25.622 20.630 ( 11.168 -29.486 -16.793) 35.723 22.032 ( -3.103 -7.324 -8.321) 11.511 24.293 ( 5.774 -3.667 -19.510) 20.674 27.238 ( 2.393 -1.774 14.830) 15.127 28.518 ( -13.682 9.859 2.808) 17.096 ======================= Grid point 675 (331/429) ======================= q-point: (-0.43 -0.64 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.237 ( -3.625 -8.842 7.697) 12.271 3.367 ( -18.709 -8.356 11.041) 23.275 3.721 ( 11.672 -17.065 -0.153) 20.675 4.141 ( 6.765 -4.712 -13.501) 15.819 4.380 ( -5.871 1.142 -2.099) 6.338 4.744 ( 4.937 -7.728 -12.868) 15.801 5.320 ( -8.278 10.019 4.333) 13.700 5.751 ( 0.625 -2.366 -4.373) 5.011 6.062 ( -7.212 -5.353 9.330) 12.951 6.599 ( 4.052 -3.012 -4.207) 6.572 6.920 ( -2.982 -7.154 7.826) 11.015 7.032 ( 8.651 -4.871 -2.779) 10.309 7.470 ( 4.391 -20.078 -0.327) 20.555 7.625 ( -4.810 -12.316 0.213) 13.224 8.060 ( 3.180 -31.686 7.226) 32.655 8.324 ( 10.360 -3.157 -6.202) 12.480 8.633 ( -5.148 -16.988 -4.718) 18.367 8.928 ( -1.344 -17.671 -4.119) 18.194 9.131 ( 2.532 -5.423 5.811) 8.342 9.594 ( 1.205 -16.536 -4.229) 17.111 10.344 ( -2.163 7.597 14.955) 16.913 11.186 ( -10.294 -3.003 13.725) 17.418 11.363 ( 2.876 32.995 0.300) 33.121 11.919 ( -0.724 18.323 -13.851) 22.981 12.430 ( 3.742 8.403 -2.224) 9.464 13.040 ( -2.651 9.437 -1.011) 9.854 13.673 ( -1.695 12.111 -1.097) 12.278 14.107 ( 0.440 26.827 1.643) 26.881 16.318 ( -1.276 -43.605 -2.461) 43.693 18.472 ( 2.822 -20.806 8.304) 22.579 20.494 ( -3.229 -15.706 10.379) 19.101 21.184 ( 11.116 -22.125 -23.311) 34.007 22.243 ( -2.410 -19.099 -3.069) 19.494 24.367 ( 2.953 -4.701 -15.437) 16.405 27.326 ( 2.968 -2.943 14.065) 14.672 28.260 ( -10.747 10.484 2.870) 15.285 ======================= Grid point 676 (332/429) ======================= q-point: (-0.36 -0.64 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.345 ( -7.972 -4.786 9.235) 13.105 3.397 ( -12.726 -3.128 4.883) 13.985 4.003 ( 9.128 -3.219 -9.908) 13.851 4.161 ( 0.169 -4.890 -1.826) 5.223 4.498 ( 2.722 -12.102 -0.896) 12.437 4.894 ( -0.572 -8.165 -12.520) 14.959 5.091 ( 1.894 10.796 8.759) 14.031 5.649 ( -2.769 8.019 -7.067) 11.041 6.213 ( -7.987 -10.017 15.359) 20.001 6.643 ( 1.633 -0.353 -2.582) 3.075 6.921 ( -0.084 -0.471 -6.786) 6.803 7.299 ( 4.649 -11.840 8.774) 15.453 7.816 ( -4.853 -10.168 4.532) 12.144 7.902 ( 5.899 -21.068 3.773) 22.201 8.348 ( 7.775 0.962 -7.757) 11.025 8.518 ( -5.727 -10.449 -1.608) 12.024 8.941 ( 2.368 -13.695 -10.465) 17.398 9.143 ( 1.161 -15.704 3.573) 16.148 9.555 ( 1.591 -29.207 -4.940) 29.664 9.896 ( 1.567 -11.277 0.430) 11.394 10.376 ( 0.502 -13.054 11.819) 17.617 10.756 ( -3.865 21.678 1.140) 22.049 11.274 ( -5.150 -2.063 12.489) 13.666 11.568 ( 1.265 16.922 -6.126) 18.042 12.300 ( 2.104 7.008 -4.463) 8.571 12.870 ( -2.104 6.689 -0.638) 7.041 13.493 ( -3.522 6.104 0.592) 7.072 13.710 ( -0.003 16.352 0.528) 16.361 17.055 ( 1.843 -35.209 -1.964) 35.312 18.728 ( 1.113 -5.755 5.660) 8.149 20.704 ( -2.321 -5.970 9.700) 11.624 21.469 ( 7.283 -9.044 -23.312) 26.044 22.672 ( 0.910 -24.848 -0.602) 24.872 24.430 ( 0.271 -3.233 -10.717) 11.197 27.427 ( 3.027 -3.193 12.526) 13.276 28.022 ( -8.485 9.550 2.726) 13.063 ======================= Grid point 677 (333/429) ======================= q-point: (-0.29 -0.64 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.307 ( -12.319 0.890 10.999) 16.538 3.489 ( -1.670 -9.590 1.148) 9.802 4.006 ( 2.856 -0.159 -13.145) 13.452 4.326 ( -0.080 -7.874 7.640) 10.972 4.715 ( 3.354 -6.510 -0.894) 7.377 4.888 ( -6.860 0.385 -1.166) 6.969 5.113 ( 14.860 -2.758 0.398) 15.119 5.476 ( -2.785 5.984 -7.214) 9.778 6.350 ( -8.408 -5.979 17.311) 20.153 6.627 ( 2.434 2.346 -0.764) 3.466 6.943 ( -2.702 -3.177 -9.110) 10.019 7.495 ( 0.971 -5.786 6.594) 8.826 7.942 ( -1.805 -3.181 11.183) 11.765 8.251 ( 1.023 -6.654 0.787) 6.778 8.397 ( 7.589 -9.587 -7.421) 14.303 8.572 ( -2.140 -3.225 -4.648) 6.049 9.103 ( 1.208 -7.984 -14.051) 16.206 9.399 ( 0.630 -5.441 -4.639) 7.178 9.975 ( 4.740 -4.618 4.741) 8.141 10.065 ( 0.199 -10.621 0.180) 10.624 10.518 ( -2.288 -12.374 7.037) 14.417 10.915 ( -1.312 -21.253 -0.308) 21.296 11.223 ( 0.241 1.016 0.138) 1.053 11.368 ( -4.868 3.581 11.893) 13.340 12.161 ( 0.727 8.007 -3.652) 8.831 12.775 ( -0.972 2.255 -0.542) 2.514 13.385 ( -3.062 4.034 2.870) 5.821 13.496 ( -0.123 6.558 -1.352) 6.697 17.652 ( 3.759 -27.401 -1.697) 27.710 18.772 ( 0.347 1.496 3.192) 3.542 20.734 ( -2.537 2.271 7.304) 8.059 21.577 ( 4.885 -3.837 -19.401) 20.371 23.103 ( 2.484 -19.239 -0.033) 19.399 24.442 ( -1.569 -0.106 -6.297) 6.491 27.520 ( 2.623 -2.681 11.095) 11.712 27.817 ( -6.930 8.098 2.097) 10.863 ======================= Grid point 678 (334/429) ======================= q-point: (-0.21 -0.64 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.298 ( -5.439 -3.897 11.541) 13.341 3.716 ( 0.142 -13.703 0.851) 13.730 4.011 ( -0.862 -2.161 -9.941) 10.210 4.440 ( -0.776 -2.474 9.905) 10.239 4.747 ( -0.296 1.472 0.093) 1.504 4.913 ( 0.701 -2.617 1.298) 3.004 5.192 ( 4.881 1.366 -4.911) 7.058 5.425 ( 4.963 -1.607 -1.281) 5.372 6.402 ( -8.766 -1.782 13.268) 16.001 6.594 ( 2.597 2.662 -1.014) 3.855 6.941 ( -5.807 -0.531 -5.333) 7.902 7.557 ( 0.390 0.517 1.865) 1.974 7.972 ( 3.104 1.391 15.494) 15.863 8.289 ( -1.338 -2.421 -5.221) 5.909 8.509 ( -4.708 -3.115 -10.054) 11.531 8.821 ( 9.998 -16.920 3.439) 19.952 9.134 ( -2.227 3.345 -17.149) 17.613 9.432 ( 4.359 -1.907 -4.654) 6.656 9.977 ( 1.366 4.365 0.593) 4.612 10.252 ( -0.110 -11.109 1.032) 11.158 10.723 ( 1.588 4.116 10.244) 11.154 11.061 ( -6.194 -13.172 -7.764) 16.498 11.273 ( -1.057 5.369 8.193) 9.852 11.554 ( -0.288 -18.442 6.686) 19.619 12.014 ( -1.567 6.252 1.623) 6.647 12.769 ( -0.025 -1.818 0.057) 1.820 13.334 ( -1.393 0.389 2.550) 2.931 13.425 ( -0.472 1.473 -1.128) 1.914 18.125 ( 4.171 -21.205 -1.435) 21.659 18.707 ( -0.656 5.467 1.144) 5.624 20.647 ( -2.639 5.989 5.497) 8.546 21.613 ( 4.501 -1.065 -16.628) 17.260 23.406 ( 1.851 -11.663 0.778) 11.835 24.399 ( -1.648 2.489 -3.256) 4.418 27.580 ( 1.921 2.827 11.215) 11.724 27.671 ( -5.695 0.689 0.367) 5.748 ======================= Grid point 679 (335/429) ======================= q-point: (-0.14 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.424 ( 0.003 -7.712 12.295) 14.514 3.896 ( 3.982 -2.456 -5.558) 7.265 4.088 ( -6.497 -10.251 -3.432) 12.612 4.444 ( 0.040 3.826 11.227) 11.861 4.688 ( -2.065 4.015 -2.489) 5.155 4.933 ( -1.003 2.448 -0.461) 2.685 5.186 ( 0.602 -3.393 1.073) 3.609 5.533 ( 9.084 -4.243 1.812) 10.189 6.373 ( -9.407 0.585 5.085) 10.709 6.544 ( 0.940 3.729 -1.300) 4.059 6.896 ( -5.400 1.100 2.140) 5.912 7.484 ( 1.539 7.521 -0.263) 7.681 8.017 ( 6.365 0.119 12.823) 14.316 8.319 ( 0.362 -1.328 -0.896) 1.643 8.513 ( -7.904 -3.398 -13.616) 16.107 8.972 ( -3.754 6.530 -10.701) 13.086 9.200 ( 8.929 -15.510 5.701) 18.783 9.497 ( 5.285 -2.839 -12.654) 14.004 9.871 ( -0.398 6.533 -2.394) 6.969 10.313 ( -3.171 7.185 5.487) 9.580 10.763 ( 3.577 -10.072 3.803) 11.344 11.006 ( -2.277 10.934 -0.908) 11.205 11.305 ( -0.366 -1.724 0.237) 1.779 11.734 ( 0.783 1.293 8.139) 8.278 11.931 ( -4.379 2.556 5.444) 7.439 12.840 ( -0.354 -5.694 0.662) 5.743 13.337 ( -0.787 0.230 2.519) 2.649 13.419 ( -0.284 -1.315 -0.984) 1.667 18.483 ( 2.508 -13.012 0.196) 13.253 18.573 ( -2.330 5.965 -1.590) 6.598 20.525 ( -1.334 6.298 4.948) 8.120 21.615 ( 5.351 0.610 -15.689) 16.587 23.561 ( -1.208 -4.279 1.758) 4.781 24.335 ( 1.216 3.159 -2.571) 4.251 27.465 ( -1.884 7.312 5.850) 9.551 27.752 ( -1.656 -7.486 5.188) 9.257 ======================= Grid point 680 (336/429) ======================= q-point: (-0.07 0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.558 ( 3.206 -0.922 10.974) 11.469 3.916 ( 5.079 0.546 -3.898) 6.426 4.194 ( -10.029 -4.496 -4.676) 11.944 4.343 ( -1.192 7.540 6.617) 10.103 4.551 ( -2.302 8.937 -1.509) 9.351 4.871 ( -1.377 -0.844 -0.888) 1.843 5.325 ( -3.735 -8.850 1.624) 9.742 5.681 ( 11.816 -4.777 4.699) 13.584 6.314 ( -8.225 0.881 1.588) 8.423 6.466 ( -0.427 4.011 -0.312) 4.046 6.851 ( -5.261 1.634 8.586) 10.202 7.316 ( 3.110 11.323 -0.709) 11.764 8.046 ( 7.603 3.577 4.392) 9.481 8.322 ( 2.613 2.319 0.500) 3.529 8.471 ( -8.866 0.959 -14.349) 16.895 8.869 ( -6.150 -0.260 -1.913) 6.446 9.331 ( -3.704 5.620 -5.730) 8.839 9.665 ( 16.842 -8.007 -0.592) 18.658 9.761 ( -1.953 0.259 -6.223) 6.527 10.115 ( -2.255 10.828 6.432) 12.794 10.737 ( -2.277 12.491 -4.673) 13.530 11.027 ( 5.232 -6.128 9.143) 12.186 11.228 ( -1.132 7.967 -3.643) 8.833 11.583 ( 5.896 13.986 1.677) 15.271 11.868 ( -8.482 1.081 10.565) 13.591 12.974 ( -1.764 -8.686 1.017) 8.921 13.311 ( 0.021 2.353 1.710) 2.909 13.458 ( -0.128 -2.605 -0.127) 2.612 18.329 ( -5.668 13.357 -1.906) 14.634 18.746 ( -0.516 -9.683 0.555) 9.712 20.432 ( 2.081 4.531 5.255) 7.244 21.592 ( 6.892 2.545 -16.340) 17.916 23.547 ( -6.407 4.075 2.662) 8.046 24.298 ( 6.772 2.387 -4.604) 8.530 27.338 ( -1.395 6.409 5.832) 8.777 27.925 ( -2.426 -11.028 5.922) 12.751 ======================= Grid point 687 (337/429) ======================= q-point: (-0.57 -0.57 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.466 ( -0.026 0.000 10.816) 10.816 2.938 ( 2.563 -0.000 -4.525) 5.200 3.099 ( -23.114 0.000 13.256) 26.646 3.784 ( 13.498 -0.000 10.805) 17.290 4.383 ( 0.678 -0.000 -2.021) 2.132 4.434 ( 3.148 -0.000 -15.309) 15.629 5.227 ( -2.443 0.000 -4.576) 5.188 5.452 ( -1.306 0.000 1.125) 1.724 5.886 ( 24.326 -0.000 -6.744) 25.244 6.332 ( 1.779 -0.000 -5.416) 5.701 6.447 ( -12.500 0.000 -13.254) 18.218 6.867 ( 8.415 -0.000 13.838) 16.196 7.208 ( -5.886 0.000 2.791) 6.514 7.270 ( -0.527 0.000 -1.276) 1.380 7.749 ( -1.644 0.000 1.756) 2.405 7.844 ( -9.633 0.000 -5.090) 10.895 7.953 ( 1.400 -0.000 2.960) 3.274 8.544 ( 4.746 -0.000 6.518) 8.063 9.099 ( 4.279 -0.000 -0.137) 4.282 9.222 ( 2.057 -0.000 2.280) 3.071 10.583 ( 0.737 -0.000 15.602) 15.620 11.241 ( -20.837 0.000 11.480) 23.791 12.294 ( -2.542 0.000 -0.921) 2.704 12.770 ( 6.978 -0.000 -9.253) 11.590 13.262 ( 2.457 -0.000 0.754) 2.570 13.479 ( -5.666 0.000 -8.857) 10.515 13.971 ( 0.434 -0.000 -2.988) 3.020 15.219 ( 7.066 -0.000 7.188) 10.079 15.916 ( -0.739 0.000 1.601) 1.764 15.980 ( 9.613 -0.000 -7.808) 12.385 19.204 ( -0.549 0.000 1.726) 1.811 20.155 ( 0.485 -0.000 -1.362) 1.446 21.936 ( -0.696 0.000 -11.438) 11.460 24.225 ( 5.790 -0.000 -22.183) 22.926 27.209 ( 1.608 -0.000 15.151) 15.236 28.731 ( -15.169 0.000 2.945) 15.453 ======================= Grid point 688 (338/429) ======================= q-point: (-0.50 -0.57 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.651 ( -7.642 -16.976 12.498) 22.423 3.045 ( -15.707 -6.961 12.475) 21.232 3.093 ( 2.783 -11.895 -1.864) 12.357 3.915 ( 7.380 -4.582 5.831) 10.462 4.405 ( 5.007 -1.440 -18.534) 19.252 4.478 ( -1.815 -6.364 -1.498) 6.786 5.250 ( -6.800 -6.055 1.769) 9.275 5.511 ( -2.394 -5.691 1.070) 6.266 6.020 ( 13.734 -2.350 -6.490) 15.371 6.391 ( 1.307 -6.501 -5.856) 8.846 6.456 ( -8.995 -9.414 -14.136) 19.218 6.917 ( 9.621 0.767 7.797) 12.407 7.182 ( -4.080 0.137 10.269) 11.051 7.308 ( -1.021 -3.492 -0.423) 3.663 7.572 ( 4.277 6.239 1.182) 7.655 7.902 ( -3.572 -8.244 -2.095) 9.226 8.132 ( -4.035 -11.592 -0.064) 12.274 8.620 ( 6.131 -3.513 4.115) 8.177 9.137 ( -0.674 -1.696 2.556) 3.141 9.240 ( 6.684 -0.950 -3.383) 7.552 10.609 ( 2.044 2.386 18.310) 18.577 11.124 ( -15.472 2.197 10.504) 18.829 12.200 ( -1.651 8.128 -2.132) 8.564 12.676 ( 0.446 13.241 -7.831) 15.390 12.947 ( 7.618 23.571 -2.289) 24.877 13.334 ( -6.393 5.440 -7.477) 11.241 14.495 ( 8.642 -17.244 -0.438) 19.293 14.640 ( -6.234 11.779 -0.862) 13.354 15.506 ( -4.186 38.892 1.521) 39.146 16.876 ( 12.346 -59.600 0.419) 60.867 19.568 ( -3.343 -31.909 3.886) 32.318 20.259 ( 3.728 -12.086 -5.698) 13.872 21.930 ( 0.208 -1.858 -10.711) 10.873 24.228 ( 3.019 -1.949 -20.432) 20.746 27.253 ( 1.663 -0.852 15.052) 15.168 28.601 ( -12.038 5.937 3.576) 13.891 ======================= Grid point 689 (339/429) ======================= q-point: (-0.43 -0.57 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.955 ( -13.327 -17.825 13.000) 25.775 3.104 ( -20.958 -8.787 16.485) 28.075 3.466 ( 16.426 -18.832 -5.344) 25.554 4.046 ( 4.961 -5.772 -5.315) 9.283 4.388 ( -2.080 1.480 -9.778) 10.106 4.602 ( 1.431 -6.711 -8.857) 11.204 5.358 ( -9.338 -4.890 9.864) 14.436 5.609 ( 0.325 -7.776 -2.677) 8.231 6.053 ( 0.465 2.791 -1.276) 3.104 6.532 ( 0.818 -6.569 -6.434) 9.231 6.630 ( -7.539 -16.619 -1.607) 18.320 7.010 ( 4.392 -2.811 -6.120) 8.040 7.229 ( 4.672 -7.547 10.971) 14.112 7.387 ( -2.567 -7.133 -1.538) 7.735 7.685 ( 6.927 -13.586 5.991) 16.385 8.159 ( -2.974 -21.656 -1.125) 21.888 8.287 ( 3.686 -6.248 -3.170) 7.917 8.736 ( 2.670 -5.541 -1.217) 6.270 9.146 ( 1.024 0.584 3.447) 3.643 9.359 ( 5.325 -8.616 -5.412) 11.484 10.542 ( 0.936 9.380 18.595) 20.848 11.081 ( -9.175 -3.352 11.700) 15.241 11.953 ( 2.793 20.697 -1.878) 20.968 12.229 ( -6.376 24.167 -9.886) 26.878 12.659 ( 6.689 13.748 -4.599) 15.966 13.178 ( -4.593 6.912 -2.790) 8.755 14.002 ( -0.640 24.623 -0.154) 24.632 14.717 ( -4.412 38.552 2.626) 38.892 15.436 ( 1.226 -48.969 -2.622) 49.054 17.938 ( 10.517 -42.473 4.002) 43.938 20.100 ( -8.084 -24.738 10.078) 27.909 20.689 ( 10.253 -29.783 -17.509) 36.038 21.988 ( 0.625 -7.052 -7.919) 10.623 24.260 ( 0.452 -4.187 -17.455) 17.956 27.318 ( 1.875 -2.113 14.117) 14.397 28.400 ( -9.032 9.545 4.476) 13.882 ======================= Grid point 690 (340/429) ======================= q-point: (-0.36 -0.57 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.182 ( -21.189 -9.867 12.254) 26.392 3.191 ( -9.997 -10.582 13.468) 19.832 3.880 ( 15.463 -14.639 -2.775) 21.474 4.139 ( 3.644 -0.861 -19.804) 20.155 4.346 ( 0.062 -3.382 4.058) 5.283 4.712 ( -2.726 -7.069 -11.963) 14.160 5.297 ( 0.097 6.754 9.332) 11.520 5.754 ( 2.167 0.370 -4.693) 5.182 6.006 ( -8.178 -5.441 8.547) 13.021 6.599 ( -1.237 -2.836 -4.913) 5.806 6.880 ( -3.796 -6.537 -0.129) 7.560 7.082 ( -0.567 -11.034 -1.388) 11.135 7.502 ( -6.639 -14.871 3.754) 16.713 7.616 ( 10.222 -16.966 1.442) 19.860 8.113 ( -0.778 -25.579 6.809) 26.481 8.365 ( 1.506 -3.880 -4.973) 6.485 8.643 ( 10.676 -20.510 -6.353) 23.979 8.886 ( -3.420 -13.429 -4.188) 14.477 9.191 ( 5.396 -6.035 1.777) 8.288 9.596 ( 2.588 -15.545 -5.604) 16.726 10.400 ( 1.588 7.606 15.598) 17.427 11.133 ( -7.609 0.215 14.979) 16.802 11.390 ( 0.889 31.511 0.753) 31.533 11.859 ( -0.819 13.984 -12.861) 19.017 12.446 ( 0.278 10.227 -3.227) 10.728 13.013 ( -1.439 8.369 -0.129) 8.492 13.642 ( -3.439 13.052 0.256) 13.500 14.097 ( -3.324 25.792 2.079) 26.088 16.327 ( 4.317 -43.894 -2.788) 44.194 18.550 ( 6.446 -17.870 5.263) 19.713 20.477 ( -6.512 -17.711 11.015) 21.850 21.212 ( 9.269 -20.143 -25.095) 33.488 22.234 ( 2.675 -20.242 -2.516) 20.572 24.320 ( -1.823 -5.329 -13.503) 14.631 27.403 ( 1.710 -3.151 12.036) 12.559 28.173 ( -6.677 10.490 5.535) 13.611 ======================= Grid point 691 (341/429) ======================= q-point: (-0.29 -0.57 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.228 ( -16.496 -4.395 13.518) 21.776 3.330 ( -5.778 -7.540 7.017) 11.810 4.035 ( 4.204 3.825 -14.830) 15.882 4.183 ( 3.006 -9.129 4.148) 10.468 4.560 ( 9.443 -12.118 -3.400) 15.735 4.767 ( -9.858 -4.776 -8.522) 13.879 5.246 ( 14.643 4.182 7.254) 16.867 5.609 ( 0.030 9.598 -6.012) 11.325 6.171 ( -9.500 -10.839 15.879) 21.445 6.626 ( -2.842 -1.947 -2.508) 4.261 6.878 ( -2.450 0.123 -8.463) 8.811 7.335 ( -2.369 -12.446 5.029) 13.631 7.739 ( -8.952 -14.490 3.451) 17.378 8.033 ( 12.021 -18.204 5.302) 22.450 8.373 ( -1.267 -1.923 -9.099) 9.386 8.489 ( 3.068 -5.998 2.792) 7.293 8.917 ( 0.985 -9.917 -11.946) 15.557 9.175 ( 2.913 -15.912 0.687) 16.191 9.579 ( 5.391 -29.567 -4.597) 30.404 9.917 ( 2.481 -13.683 -1.283) 13.966 10.441 ( 2.429 -10.955 11.672) 16.191 10.712 ( -4.852 22.572 2.983) 23.279 11.261 ( -4.734 -1.118 11.235) 12.243 11.569 ( 2.605 15.494 -4.471) 16.335 12.271 ( -4.072 6.541 -5.250) 9.324 12.865 ( 1.264 6.881 0.648) 7.026 13.454 ( -4.085 5.736 2.144) 7.361 13.700 ( -2.168 15.692 0.558) 15.851 17.094 ( 6.406 -35.156 -2.815) 35.846 18.773 ( 3.528 -3.795 4.370) 6.778 20.694 ( -5.833 -6.705 10.124) 13.471 21.456 ( 5.985 -8.413 -24.487) 26.575 22.705 ( 5.467 -24.881 -0.885) 25.490 24.375 ( -3.582 -3.997 -8.985) 10.466 27.492 ( 0.687 -3.316 9.069) 9.680 27.960 ( -4.730 9.910 6.562) 12.792 ======================= Grid point 692 (342/429) ======================= q-point: (-0.21 -0.57 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.235 ( -8.292 -2.482 13.881) 16.358 3.480 ( -1.944 -10.625 4.934) 11.874 3.975 ( 0.152 0.835 -11.886) 11.916 4.358 ( 1.155 -7.040 6.086) 9.378 4.740 ( -0.284 -2.302 -1.096) 2.565 4.828 ( 0.927 -7.281 -2.510) 7.757 5.263 ( 7.732 4.021 -5.612) 10.366 5.488 ( 10.518 3.374 0.258) 11.049 6.311 ( -9.916 -6.047 18.705) 22.018 6.625 ( -2.185 0.204 -0.226) 2.206 6.854 ( -6.258 -2.110 -10.808) 12.666 7.505 ( -1.842 -6.343 2.817) 7.181 7.933 ( -6.581 -9.266 9.903) 15.074 8.297 ( 7.077 3.180 -3.842) 8.658 8.418 ( 0.794 -6.664 -4.788) 8.244 8.585 ( 5.758 -10.488 0.159) 11.966 9.063 ( 1.342 -6.650 -14.456) 15.969 9.399 ( 1.983 -5.769 -3.641) 7.104 10.035 ( 2.002 -3.477 -1.451) 4.266 10.088 ( 4.843 -7.810 3.539) 9.847 10.520 ( -2.331 -17.051 7.436) 18.747 10.877 ( -4.678 -14.983 -1.997) 15.822 11.232 ( 0.732 -3.775 2.020) 4.343 11.372 ( -2.336 5.726 12.257) 13.729 12.124 ( -4.423 5.884 -4.792) 8.783 12.784 ( 2.302 2.967 1.099) 3.913 13.362 ( -2.800 2.929 3.617) 5.432 13.484 ( -1.286 6.428 -0.908) 6.618 17.706 ( 7.055 -26.857 -2.760) 27.905 18.795 ( 1.696 3.003 2.916) 4.516 20.715 ( -5.587 1.808 7.215) 9.302 21.558 ( 4.520 -4.219 -19.779) 20.723 23.148 ( 5.526 -18.290 -0.461) 19.112 24.388 ( -4.309 -1.197 -4.879) 6.619 27.566 ( -1.152 -3.410 5.717) 6.756 27.774 ( -2.688 9.132 7.708) 12.249 ======================= Grid point 693 (343/429) ======================= q-point: (-0.14 -0.57 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.313 ( -0.603 -6.071 14.329) 15.574 3.725 ( -0.379 -14.270 3.630) 14.729 3.951 ( -2.758 -1.020 -9.626) 10.065 4.474 ( 0.825 -3.053 8.325) 8.905 4.741 ( -0.517 2.252 -0.209) 2.320 4.916 ( 0.002 -2.461 -0.044) 2.461 5.190 ( -0.018 2.627 -8.048) 8.466 5.564 ( 16.282 -0.635 3.484) 16.662 6.338 ( -9.911 0.028 10.077) 14.134 6.595 ( -1.592 1.821 0.411) 2.453 6.845 ( -7.951 -2.735 -3.213) 9.001 7.564 ( 0.195 0.004 0.031) 0.198 8.051 ( -1.655 -3.808 15.295) 15.849 8.261 ( 2.663 -0.110 -8.884) 9.275 8.439 ( -1.433 -0.105 -6.358) 6.518 8.936 ( 7.858 -17.070 0.866) 18.812 9.065 ( 0.327 3.769 -11.753) 12.347 9.460 ( 4.442 -1.838 -6.926) 8.431 9.965 ( -2.599 4.882 -2.444) 6.047 10.294 ( 5.125 -9.209 4.440) 11.436 10.755 ( -1.545 7.320 4.596) 8.780 10.964 ( -6.646 -15.440 -3.181) 17.108 11.293 ( -0.512 2.961 8.575) 9.086 11.578 ( 0.249 -18.864 5.288) 19.592 11.987 ( -3.969 5.361 1.173) 6.773 12.780 ( 1.540 -0.947 1.014) 2.073 13.331 ( -0.743 -0.100 2.752) 2.853 13.413 ( -1.216 1.245 -0.698) 1.875 18.177 ( 6.096 -20.148 -2.451) 21.192 18.706 ( -0.324 7.122 1.482) 7.282 20.626 ( -4.467 4.924 5.262) 8.478 21.604 ( 4.562 -1.717 -16.621) 17.321 23.438 ( 3.427 -9.917 0.531) 10.505 24.361 ( -3.092 0.657 -2.435) 3.990 27.597 ( -5.599 4.254 1.566) 7.204 27.654 ( 1.902 -0.637 10.137) 10.333 ======================= Grid point 694 (344/429) ======================= q-point: (-0.07 -0.57 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.494 ( 3.732 -8.414 12.880) 15.831 3.919 ( 3.127 -1.453 -6.076) 6.986 3.985 ( -8.976 -10.122 -1.527) 13.615 4.488 ( 0.217 4.985 10.288) 11.434 4.650 ( -2.487 4.467 -3.092) 5.975 4.917 ( -1.364 3.461 -0.669) 3.780 5.185 ( -1.087 -4.343 0.964) 4.580 5.687 ( 14.840 -2.691 3.694) 15.528 6.261 ( -11.238 1.293 -1.518) 11.413 6.538 ( -1.410 3.536 0.726) 3.876 6.851 ( -5.189 -1.055 7.383) 9.085 7.509 ( 2.949 6.393 -0.781) 7.083 8.125 ( 3.660 -0.789 8.771) 9.537 8.301 ( -2.519 -4.627 -4.053) 6.647 8.405 ( -1.654 1.535 -7.048) 7.400 8.909 ( -1.148 6.549 -8.162) 10.527 9.284 ( 3.030 -10.385 2.742) 11.160 9.521 ( 7.078 -5.929 -13.365) 16.244 9.848 ( -1.720 5.692 -2.073) 6.297 10.317 ( 0.101 9.136 5.813) 10.829 10.798 ( 1.736 -8.823 -3.693) 9.721 10.966 ( -4.731 3.842 4.274) 7.444 11.323 ( 2.025 0.873 3.479) 4.119 11.776 ( 1.650 0.333 6.150) 6.376 11.892 ( -5.771 3.007 5.609) 8.591 12.837 ( -0.461 -4.697 0.613) 4.759 13.340 ( -0.231 0.406 2.354) 2.400 13.409 ( -0.803 -1.798 -0.902) 2.166 18.513 ( 1.779 -4.028 0.497) 4.432 18.540 ( -1.539 0.661 -1.900) 2.533 20.527 ( -1.505 4.270 4.885) 6.660 21.619 ( 5.496 -0.126 -15.619) 16.558 23.555 ( -0.928 -1.445 1.822) 2.503 24.338 ( 0.983 0.287 -2.605) 2.799 27.465 ( -1.995 6.769 5.754) 9.106 27.753 ( -1.553 -6.972 5.281) 8.883 ======================= Grid point 702 (345/429) ======================= 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.441 ( -11.485 0.000 12.696) 17.120 2.906 ( -21.654 0.000 21.453) 30.481 2.983 ( 8.072 -0.000 -6.015) 10.067 3.934 ( 7.498 -0.000 6.911) 10.197 4.384 ( 0.926 -0.000 -2.155) 2.346 4.386 ( -0.907 0.000 -15.125) 15.152 5.144 ( -12.069 0.000 3.272) 12.505 5.442 ( -1.177 0.000 1.475) 1.887 5.995 ( -6.795 0.000 -13.495) 15.110 6.333 ( 1.956 -0.000 -5.517) 5.853 6.356 ( 14.801 -0.000 -14.369) 20.629 6.972 ( -3.087 0.000 0.674) 3.160 7.189 ( 0.390 -0.000 21.231) 21.235 7.264 ( 0.362 -0.000 -1.182) 1.236 7.736 ( -1.956 0.000 2.351) 3.058 7.766 ( 0.721 -0.000 -5.567) 5.613 7.974 ( 0.657 -0.000 2.245) 2.339 8.632 ( 5.422 -0.000 4.969) 7.355 9.124 ( 1.346 -0.000 0.231) 1.365 9.264 ( 6.366 -0.000 -5.472) 8.395 10.689 ( 6.687 -0.000 20.109) 21.192 11.080 ( -14.469 0.000 8.394) 16.728 12.260 ( -3.844 0.000 1.695) 4.201 12.794 ( 3.411 -0.000 -9.020) 9.644 13.290 ( 0.304 -0.000 -2.248) 2.268 13.395 ( -1.603 0.000 -6.579) 6.771 13.967 ( 0.904 -0.000 -2.966) 3.101 15.249 ( -6.701 0.000 8.449) 10.784 15.915 ( -0.565 0.000 1.611) 1.707 16.074 ( 13.017 -0.000 -11.461) 17.344 19.204 ( -0.561 0.000 1.726) 1.815 20.156 ( 0.473 -0.000 -1.371) 1.450 21.901 ( 1.727 -0.000 -11.040) 11.174 24.180 ( -0.136 0.000 -19.649) 19.649 27.280 ( 0.999 -0.000 14.607) 14.641 28.608 ( -8.532 0.000 4.818) 9.798 ======================= Grid point 703 (346/429) ======================= q-point: (-0.43 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.556 ( -16.297 -15.829 13.302) 26.327 2.885 ( -20.164 -5.599 24.028) 31.864 3.185 ( 11.013 -16.287 -6.443) 20.690 3.993 ( 4.503 -1.873 0.103) 4.878 4.364 ( -0.667 -0.950 -11.631) 11.689 4.470 ( 0.778 -6.876 -3.369) 7.696 5.145 ( -15.607 -8.197 10.110) 20.322 5.489 ( -2.140 -4.801 0.672) 5.299 5.986 ( -11.680 -8.489 -15.890) 21.471 6.346 ( 1.851 -1.844 -4.658) 5.341 6.485 ( 12.851 -3.948 -7.437) 15.363 6.939 ( -6.694 -2.981 -4.699) 8.705 7.237 ( 3.236 0.344 18.762) 19.042 7.305 ( 1.700 -2.540 0.017) 3.057 7.641 ( 6.542 4.362 0.522) 7.880 7.850 ( -3.095 -10.048 -0.562) 10.529 8.140 ( 4.324 -11.125 -0.373) 11.941 8.682 ( 1.600 -2.027 1.203) 2.849 9.148 ( 2.631 -1.007 1.558) 3.219 9.303 ( 7.659 -1.648 -7.637) 10.941 10.742 ( 8.453 4.676 21.523) 23.591 11.010 ( -10.948 -0.235 8.018) 13.572 12.165 ( -3.777 7.336 -0.456) 8.264 12.644 ( -1.089 17.097 -5.290) 17.930 13.025 ( 7.942 22.952 -7.450) 25.404 13.234 ( -6.548 3.399 -3.553) 8.189 14.527 ( -5.170 -29.106 -2.569) 29.673 14.614 ( 4.649 23.919 1.123) 24.392 15.429 ( -10.828 37.138 4.398) 38.934 17.034 ( 16.881 -59.635 -6.014) 62.269 19.536 ( -5.029 -29.290 5.032) 30.141 20.280 ( 3.821 -14.257 -6.549) 16.148 21.908 ( 2.555 -1.785 -10.122) 10.591 24.158 ( -3.010 -2.376 -17.547) 17.961 27.320 ( 0.483 -1.086 13.317) 13.370 28.521 ( -4.825 6.165 6.511) 10.182 ======================= Grid point 704 (347/429) ======================= q-point: (-0.36 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( -20.902 -17.426 11.476) 29.534 2.967 ( -16.062 -9.408 24.891) 31.082 3.618 ( 12.963 -21.296 -6.105) 25.668 4.063 ( 4.017 -4.183 -12.620) 13.889 4.352 ( -0.474 0.954 0.205) 1.085 4.570 ( -0.917 -5.156 -9.197) 10.583 5.269 ( -15.507 -8.761 16.646) 24.379 5.619 ( 2.729 -10.226 -3.447) 11.131 6.016 ( -3.458 1.904 -7.589) 8.554 6.449 ( -6.960 -11.294 -3.067) 13.616 6.625 ( 3.152 -9.781 0.211) 10.278 6.961 ( -8.034 -2.091 -3.632) 9.061 7.315 ( 0.322 -3.613 0.630) 3.682 7.420 ( 11.064 -10.506 4.504) 15.908 7.726 ( -1.925 -12.702 1.572) 12.943 8.120 ( -0.204 -17.194 0.774) 17.213 8.400 ( 13.975 -12.760 -3.026) 19.164 8.722 ( -3.652 -3.499 -3.496) 6.149 9.190 ( 5.507 -0.547 1.508) 5.736 9.402 ( 6.184 -6.674 -7.315) 11.675 10.642 ( 3.779 12.119 16.997) 21.214 11.047 ( -4.015 -5.182 13.731) 15.216 11.967 ( 0.307 13.720 -2.558) 13.960 12.130 ( -4.936 30.370 -5.773) 31.306 12.690 ( 2.419 15.705 -7.791) 17.697 13.128 ( -2.507 5.030 0.240) 5.625 13.972 ( -4.623 24.758 0.232) 25.187 14.647 ( -10.005 35.596 4.417) 37.238 15.474 ( 7.031 -48.680 -3.273) 49.294 18.089 ( 15.009 -39.913 -1.350) 42.663 20.036 ( -9.818 -25.630 10.395) 29.348 20.730 ( 8.720 -29.340 -19.120) 36.090 21.987 ( 4.010 -7.819 -6.709) 11.056 24.174 ( -5.218 -4.989 -14.578) 16.267 27.376 ( -0.260 -2.368 10.823) 11.082 28.358 ( -2.113 10.244 8.684) 13.595 ======================= Grid point 705 (348/429) ======================= q-point: (-0.29 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.982 ( -21.147 -12.725 11.238) 27.118 3.133 ( -10.790 -10.725 20.235) 25.316 4.012 ( 7.466 -13.619 -1.266) 15.582 4.099 ( 3.031 1.448 -17.814) 18.128 4.407 ( 7.327 -7.718 2.658) 10.969 4.624 ( -3.075 -3.878 -11.410) 12.438 5.349 ( -1.548 -3.051 14.235) 14.641 5.757 ( 1.568 2.879 -4.959) 5.944 5.960 ( -2.961 -5.071 5.445) 8.008 6.542 ( -5.672 -3.778 -2.966) 7.433 6.843 ( -3.228 -3.743 -0.183) 4.946 7.027 ( -6.714 -16.082 -0.481) 17.434 7.421 ( -5.906 -11.585 -2.645) 13.270 7.781 ( 13.245 -16.810 5.789) 22.170 8.059 ( -9.554 -22.205 0.750) 24.185 8.401 ( 7.325 -10.506 -3.338) 13.235 8.730 ( 3.328 -9.528 -8.106) 12.945 8.852 ( 3.761 -18.507 -2.417) 19.039 9.265 ( 7.071 -6.011 -0.526) 9.296 9.617 ( 4.702 -14.810 -5.519) 16.489 10.476 ( 1.689 8.232 11.681) 14.390 11.137 ( -2.290 1.757 19.475) 19.688 11.384 ( -1.723 32.547 -0.771) 32.601 11.814 ( 0.799 9.698 -10.608) 14.395 12.408 ( -4.425 12.642 -4.029) 13.987 13.013 ( 1.102 6.975 1.364) 7.193 13.598 ( -4.813 12.910 1.701) 13.882 14.048 ( -6.728 23.900 2.434) 24.948 16.392 ( 9.080 -43.836 -3.717) 44.920 18.655 ( 9.318 -14.676 2.427) 17.553 20.430 ( -8.741 -19.082 11.312) 23.843 21.207 ( 6.890 -18.354 -27.783) 34.004 22.286 ( 7.927 -21.582 -1.652) 23.051 24.226 ( -6.636 -6.406 -10.925) 14.297 27.441 ( -1.750 -3.227 7.153) 8.040 28.162 ( -0.310 11.475 11.001) 15.900 ======================= Grid point 706 (349/429) ======================= q-point: (-0.21 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.102 ( -13.972 -8.766 13.002) 21.002 3.296 ( -6.681 -9.157 12.954) 17.213 4.012 ( 0.812 4.387 -9.561) 10.551 4.236 ( 3.529 -8.213 2.183) 9.202 4.641 ( -5.970 -7.633 -4.634) 10.741 4.686 ( 13.892 -7.938 -7.230) 17.558 5.385 ( 3.619 4.069 -0.523) 5.471 5.649 ( 11.505 6.049 1.906) 13.138 6.120 ( -9.843 -10.764 16.734) 22.199 6.567 ( -6.071 -3.189 -1.090) 6.944 6.803 ( -5.473 1.839 -7.957) 9.831 7.303 ( -4.475 -13.669 1.787) 14.494 7.656 ( -6.585 -15.574 0.040) 16.908 8.185 ( 10.200 -17.477 3.655) 20.563 8.296 ( -5.243 -7.890 -3.724) 10.179 8.551 ( 5.182 -1.192 -3.076) 6.143 8.891 ( 1.925 -9.536 -7.771) 12.452 9.212 ( 4.070 -14.052 -1.748) 14.733 9.634 ( 6.754 -29.776 -4.299) 30.833 9.948 ( 4.104 -13.484 -1.536) 14.178 10.484 ( -1.560 -11.161 3.867) 11.914 10.680 ( -3.734 26.382 7.446) 27.666 11.261 ( -2.043 -0.061 11.725) 11.901 11.596 ( 4.444 13.920 -2.356) 14.801 12.173 ( -9.276 6.638 -5.507) 12.666 12.900 ( 3.947 6.395 1.823) 7.733 13.419 ( -3.900 4.981 3.905) 7.434 13.665 ( -4.311 14.377 0.492) 15.017 17.176 ( 10.110 -34.630 -3.915) 36.287 18.837 ( 5.154 -1.662 3.193) 6.287 20.648 ( -8.789 -7.113 10.109) 15.167 21.425 ( 4.907 -8.755 -25.829) 27.711 22.789 ( 9.915 -23.961 -1.182) 25.958 24.283 ( -7.250 -5.281 -6.831) 11.274 27.496 ( -3.866 -3.305 3.205) 6.012 27.975 ( 1.085 10.909 12.786) 16.843 ======================= Grid point 707 (350/429) ======================= q-point: (-0.14 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.218 ( -4.579 -6.972 15.662) 17.745 3.478 ( -2.715 -11.760 8.058) 14.512 3.934 ( -0.387 2.204 -7.520) 7.846 4.395 ( 2.292 -6.640 3.265) 7.746 4.712 ( -1.576 -4.882 -2.569) 5.737 4.880 ( 6.590 -3.699 0.227) 7.560 5.249 ( -0.742 6.534 -12.958) 14.531 5.693 ( 19.803 2.042 5.072) 20.544 6.270 ( -9.748 -5.890 21.057) 23.939 6.584 ( -5.137 -1.772 1.008) 5.527 6.724 ( -9.291 -1.152 -10.529) 14.090 7.484 ( -2.182 -7.654 -0.682) 7.988 7.876 ( -7.624 -11.429 4.750) 14.536 8.319 ( 1.093 0.485 -12.113) 12.172 8.459 ( 7.458 0.807 5.544) 9.328 8.664 ( 6.998 -14.982 -1.275) 16.585 9.036 ( 2.228 -5.107 -10.058) 11.498 9.417 ( 3.362 -6.052 -2.930) 7.518 10.021 ( -1.844 3.337 -3.379) 5.094 10.180 ( 7.978 -12.365 1.651) 14.807 10.509 ( -4.540 -17.808 5.911) 19.305 10.803 ( -6.435 -11.948 -1.947) 13.710 11.258 ( 2.125 -5.217 3.525) 6.645 11.402 ( -0.535 7.458 12.367) 14.452 12.033 ( -7.979 2.807 -5.075) 9.864 12.833 ( 4.859 3.993 2.590) 6.802 13.350 ( -1.857 1.991 4.376) 5.153 13.459 ( -2.656 5.663 -0.581) 6.282 17.789 ( 9.503 -25.769 -3.828) 27.731 18.830 ( 2.561 4.740 2.613) 5.988 20.661 ( -8.292 0.965 6.802) 10.768 21.535 ( 4.368 -4.999 -20.106) 21.174 23.225 ( 8.508 -16.495 -0.917) 18.583 24.309 ( -6.787 -2.817 -3.258) 8.038 27.532 ( -5.778 -3.038 0.215) 6.532 27.817 ( 2.281 9.425 13.447) 16.579 ======================= Grid point 708 (351/429) ======================= q-point: (-0.07 -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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.382 ( 2.634 -8.194 15.594) 17.811 3.723 ( -3.355 -13.322 4.797) 14.551 3.898 ( -0.540 -0.141 -5.652) 5.680 4.518 ( 2.299 -3.877 5.161) 6.852 4.735 ( -0.561 4.824 -0.373) 4.870 4.911 ( -1.043 -1.706 -0.385) 2.037 5.158 ( 0.138 1.376 -7.594) 7.719 5.776 ( 17.614 1.293 3.494) 18.004 6.252 ( -10.085 3.645 4.903) 11.791 6.570 ( -3.323 0.876 1.998) 3.975 6.750 ( -7.961 -6.859 3.154) 10.972 7.561 ( 0.053 -1.565 -2.257) 2.747 8.019 ( -9.114 -8.110 6.138) 13.657 8.287 ( 5.808 1.553 -11.784) 13.229 8.453 ( 5.763 3.086 4.114) 7.724 8.966 ( 1.483 -5.222 -10.630) 11.935 9.089 ( 5.827 -7.251 1.253) 9.386 9.487 ( 4.976 -0.906 -7.010) 8.644 9.910 ( -4.873 3.818 -3.327) 7.028 10.379 ( 5.693 -6.609 5.504) 10.314 10.712 ( -4.454 3.877 -7.674) 9.683 10.900 ( -6.003 -11.353 7.108) 14.678 11.331 ( 1.570 0.514 8.390) 8.551 11.590 ( -1.312 -18.966 3.746) 19.377 11.938 ( -5.418 3.195 1.948) 6.585 12.812 ( 3.127 1.118 2.018) 3.886 13.338 ( 0.215 -0.504 2.566) 2.624 13.393 ( -1.937 0.933 0.001) 2.151 18.243 ( 7.168 -18.529 -3.330) 20.145 18.711 ( 0.055 9.089 1.685) 9.244 20.586 ( -5.992 3.016 5.002) 8.367 21.594 ( 4.603 -2.468 -16.663) 17.462 23.487 ( 4.909 -7.350 0.267) 8.843 24.312 ( -4.234 -1.758 -1.586) 4.851 27.534 ( -5.772 0.082 0.785) 5.825 27.719 ( 2.105 3.743 11.039) 11.845 ======================= Grid point 717 (352/429) ======================= q-point: (-0.43 -0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( -17.681 0.000 13.378) 22.172 2.769 ( -19.015 0.000 29.414) 35.025 3.057 ( 8.222 -0.000 -5.870) 10.103 4.013 ( 3.880 -0.000 1.575) 4.188 4.319 ( -2.596 0.000 -8.928) 9.298 4.388 ( 1.226 -0.000 -2.362) 2.662 4.976 ( -22.361 0.000 12.945) 25.838 5.437 ( -0.921 0.000 1.857) 2.073 5.742 ( -20.472 0.000 -22.139) 30.153 6.336 ( 2.091 -0.000 -5.584) 5.963 6.573 ( 24.617 -0.000 -8.042) 25.897 6.835 ( -14.872 0.000 -2.151) 15.027 7.269 ( 1.295 -0.000 -1.148) 1.730 7.328 ( 6.770 -0.000 17.634) 18.889 7.722 ( -2.261 0.000 2.901) 3.678 7.821 ( 10.868 -0.000 -3.362) 11.376 7.984 ( -0.157 0.000 1.581) 1.589 8.668 ( -1.428 0.000 -0.090) 1.431 9.166 ( 6.434 -0.000 0.727) 6.475 9.318 ( 7.509 -0.000 -8.989) 11.713 10.891 ( 15.020 -0.000 22.806) 27.308 10.962 ( -11.356 0.000 5.272) 12.520 12.215 ( -5.604 0.000 2.997) 6.355 12.792 ( 2.280 -0.000 -8.455) 8.757 13.219 ( -8.095 0.000 -2.762) 8.553 13.427 ( 7.955 -0.000 -4.349) 9.066 13.969 ( 1.384 -0.000 -2.941) 3.250 15.143 ( -16.608 0.000 8.247) 18.543 15.916 ( -0.389 0.000 1.640) 1.686 16.175 ( 12.316 -0.000 -14.593) 19.096 19.204 ( -0.572 0.000 1.725) 1.817 20.156 ( 0.457 -0.000 -1.385) 1.459 21.891 ( 3.451 -0.000 -10.290) 10.853 24.077 ( -6.455 0.000 -15.959) 17.215 27.332 ( -0.797 0.000 11.751) 11.778 28.584 ( 0.406 -0.000 8.732) 8.742 ======================= Grid point 718 (353/429) ======================= q-point: (-0.36 -0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.393 ( -20.494 -14.520 13.236) 28.390 2.776 ( -17.146 -5.858 31.213) 36.091 3.272 ( 7.932 -17.877 -5.848) 20.414 4.022 ( 2.678 -0.232 -6.426) 6.965 4.327 ( -1.187 -3.012 -1.699) 3.657 4.460 ( -0.155 -5.023 -4.183) 6.538 4.971 ( -23.909 -10.782 18.563) 32.132 5.454 ( -4.521 -4.880 -3.332) 7.440 5.761 ( -13.622 -15.487 -16.647) 26.505 6.358 ( 1.921 -1.284 -3.181) 3.932 6.617 ( 9.629 4.811 0.085) 10.765 6.817 ( -6.936 -5.995 -6.829) 11.432 7.298 ( 2.629 -1.246 0.047) 2.910 7.389 ( 7.505 -0.484 9.255) 11.925 7.696 ( 3.249 7.528 -2.625) 8.609 7.842 ( 0.442 -12.259 2.964) 12.620 8.214 ( 8.111 -14.004 0.128) 16.184 8.656 ( -4.474 -0.834 -3.009) 5.456 9.219 ( 8.282 -0.856 0.811) 8.365 9.355 ( 7.152 -1.482 -9.423) 11.923 10.873 ( -6.468 5.631 7.214) 11.206 11.013 ( 13.368 -0.229 21.230) 25.089 12.109 ( -5.905 7.325 0.077) 9.409 12.621 ( -0.013 18.407 -3.413) 18.720 13.027 ( -2.703 19.451 -9.439) 21.789 13.206 ( 3.369 6.552 0.518) 7.385 14.429 ( -9.557 2.817 -1.931) 10.149 14.680 ( 4.859 -10.440 1.086) 11.567 15.304 ( -13.726 35.992 4.755) 38.813 17.206 ( 18.698 -61.610 -11.948) 65.484 19.493 ( -5.984 -25.965 5.591) 27.226 20.295 ( 3.377 -15.762 -7.358) 17.719 21.913 ( 4.540 -2.221 -8.834) 10.178 24.031 ( -9.088 -2.904 -13.426) 16.471 27.354 ( -2.058 -1.161 9.248) 9.545 28.550 ( 4.390 7.038 11.291) 14.010 ======================= Grid point 719 (354/429) ======================= q-point: (-0.29 -0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.591 ( -23.036 -16.413 11.574) 30.561 2.909 ( -12.957 -10.591 30.755) 35.014 3.702 ( 5.568 -21.987 -5.742) 23.396 4.052 ( 3.515 -3.238 -15.393) 16.118 4.376 ( 1.090 -1.270 7.551) 7.735 4.527 ( 0.777 -4.549 -10.796) 11.741 5.119 ( -23.401 -14.331 21.936) 35.131 5.624 ( 0.442 -13.212 -6.284) 14.637 5.949 ( -1.365 -6.999 -9.376) 11.780 6.394 ( -2.562 -4.718 2.440) 5.897 6.662 ( 2.048 -8.345 2.035) 8.830 6.843 ( -9.744 -1.232 -0.009) 9.822 7.303 ( -0.589 0.156 -2.980) 3.042 7.541 ( 5.597 -13.147 -5.668) 15.372 7.720 ( 3.468 -8.052 4.148) 9.699 8.148 ( 4.015 -17.619 -1.111) 18.105 8.530 ( 6.779 -13.451 -3.739) 15.519 8.655 ( -1.937 -4.123 -2.444) 5.170 9.280 ( 9.530 0.243 -0.068) 9.533 9.438 ( 4.998 -6.522 -8.625) 11.913 10.698 ( -4.107 10.792 8.483) 14.328 11.136 ( 9.771 -1.594 20.938) 23.161 11.930 ( -3.462 7.022 -5.874) 9.787 12.089 ( -1.017 36.427 0.192) 36.442 12.655 ( -2.964 16.244 -7.988) 18.343 13.130 ( 1.844 4.760 2.331) 5.611 13.904 ( -7.424 23.002 0.595) 24.178 14.526 ( -14.433 32.130 5.733) 35.687 15.565 ( 11.181 -48.401 -4.369) 49.868 18.263 ( 17.643 -37.603 -6.696) 42.073 19.959 ( -10.055 -26.151 10.035) 29.760 20.740 ( 5.997 -27.936 -21.799) 35.938 22.033 ( 7.892 -9.891 -4.497) 13.429 24.037 ( -10.564 -6.007 -10.610) 16.133 27.385 ( -3.638 -2.252 5.817) 7.221 28.422 ( 5.978 11.799 14.097) 19.331 ======================= Grid point 720 (355/429) ======================= q-point: (-0.21 -0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.792 ( -19.128 -15.876 11.264) 27.291 3.098 ( -10.045 -10.409 24.883) 28.782 4.022 ( -0.846 -7.900 -5.107) 9.445 4.105 ( 4.690 -4.533 -8.859) 11.001 4.459 ( -2.506 -6.726 2.189) 7.505 4.630 ( 13.831 -5.782 -12.683) 19.636 5.315 ( -14.428 -12.445 16.032) 24.901 5.767 ( 2.380 -1.411 -1.239) 3.032 5.998 ( 6.969 -0.390 1.498) 7.139 6.459 ( -7.661 -3.682 0.457) 8.512 6.788 ( -6.640 0.399 -0.069) 6.652 6.964 ( -3.900 -19.241 2.091) 19.744 7.360 ( -2.158 -9.738 -4.570) 10.971 7.887 ( -1.664 -20.818 -6.205) 21.786 7.989 ( 2.607 -16.433 5.697) 17.587 8.468 ( 6.476 -9.664 -8.212) 14.240 8.676 ( -4.463 -12.277 -2.116) 13.233 8.934 ( 8.951 -17.169 -3.834) 19.739 9.345 ( 7.392 -4.618 -1.835) 8.907 9.658 ( 5.995 -15.436 -5.202) 17.357 10.498 ( -4.117 8.264 5.998) 11.010 11.236 ( 5.257 6.359 24.793) 26.130 11.353 ( -1.933 32.201 -2.988) 32.397 11.796 ( 1.933 5.982 -8.903) 10.899 12.325 ( -7.117 15.272 -2.995) 17.113 13.046 ( 3.426 6.117 2.283) 7.374 13.549 ( -5.206 11.670 3.179) 13.168 13.963 ( -9.819 21.387 2.546) 23.671 16.501 ( 12.663 -43.594 -4.745) 45.643 18.772 ( 10.102 -11.600 -0.061) 15.382 20.366 ( -9.685 -19.419 11.038) 24.346 21.162 ( 4.243 -17.615 -30.890) 35.812 22.402 ( 13.346 -22.582 -0.958) 26.248 24.091 ( -10.919 -7.823 -7.592) 15.430 27.415 ( -5.443 -2.902 2.258) 6.568 28.246 ( 5.782 13.135 16.147) 21.603 ======================= Grid point 721 (356/429) ======================= q-point: (-0.14 -0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.010 ( -10.638 -13.932 13.129) 21.901 3.275 ( -6.586 -9.949 16.685) 20.512 3.997 ( 1.236 4.216 -3.898) 5.874 4.273 ( 2.385 -8.529 -0.027) 8.856 4.565 ( -3.823 -7.478 -4.764) 9.656 4.838 ( 15.970 -6.736 -6.888) 18.651 5.347 ( -5.215 4.497 -5.778) 8.989 5.850 ( 17.017 -0.424 8.339) 18.956 6.077 ( -8.234 -8.679 16.580) 20.445 6.486 ( -7.536 -3.929 0.179) 8.500 6.697 ( -8.394 3.803 -6.066) 11.033 7.265 ( -2.655 -13.911 0.553) 14.173 7.595 ( -2.827 -14.719 -2.565) 15.206 8.182 ( -4.452 -12.171 -8.639) 15.575 8.340 ( 7.241 -16.674 5.508) 18.995 8.560 ( 0.717 -3.555 -8.569) 9.305 8.916 ( 4.620 -8.543 -0.259) 9.716 9.255 ( 5.198 -12.074 -3.143) 13.516 9.687 ( 4.903 -30.051 -4.603) 30.795 10.001 ( 6.105 -11.626 -1.009) 13.170 10.426 ( -8.409 -7.317 -1.802) 11.291 10.670 ( -3.764 25.286 7.047) 26.518 11.314 ( 3.367 2.505 13.007) 13.667 11.653 ( 6.351 12.347 -0.116) 13.885 12.028 ( -12.461 7.222 -4.861) 15.201 12.964 ( 5.646 5.582 2.858) 8.439 13.397 ( -2.964 3.927 5.443) 7.337 13.606 ( -6.424 12.546 0.259) 14.097 17.291 ( 12.713 -33.731 -4.860) 36.373 18.908 ( 5.331 0.213 2.183) 5.764 20.571 ( -11.043 -6.971 9.390) 16.085 21.379 ( 4.240 -10.126 -26.926) 29.078 22.920 ( 14.068 -22.160 -1.724) 26.306 24.162 ( -10.383 -6.955 -4.300) 13.216 27.438 ( -6.675 -3.084 -0.108) 7.354 28.066 ( 4.703 12.308 16.317) 20.972 ======================= Grid point 722 (357/429) ======================= q-point: (-0.07 -0.43 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.239 ( -2.494 -11.533 16.104) 19.964 3.478 ( -3.061 -12.175 9.714) 15.873 3.923 ( 1.636 3.458 -1.339) 4.053 4.431 ( 2.813 -6.798 -0.003) 7.357 4.694 ( -0.107 -7.844 -3.201) 8.472 4.949 ( 3.533 2.918 2.215) 5.089 5.194 ( 1.437 4.769 -14.362) 15.201 5.926 ( 17.260 2.997 2.891) 17.756 6.252 ( -7.482 -4.309 22.916) 24.488 6.508 ( -9.534 -4.611 0.188) 10.592 6.589 ( -6.994 -1.295 -6.299) 9.501 7.457 ( -1.548 -8.087 -2.533) 8.615 7.807 ( -6.180 -10.437 1.923) 12.281 8.274 ( -0.101 -2.777 -12.606) 12.908 8.584 ( 10.132 1.770 4.385) 11.181 8.718 ( 4.561 -16.682 -5.372) 18.109 9.044 ( 3.384 -3.912 -3.336) 6.155 9.454 ( 4.638 -6.335 -1.672) 8.027 9.974 ( -4.276 8.270 -3.574) 9.973 10.266 ( 6.799 -17.109 -2.429) 18.570 10.451 ( -8.713 -12.522 3.774) 15.715 10.735 ( -4.135 -15.372 0.116) 15.919 11.300 ( 2.711 -3.129 2.093) 4.639 11.445 ( -0.458 9.843 12.804) 16.157 11.920 ( -8.250 -0.655 -3.344) 8.926 12.909 ( 6.287 4.889 3.870) 8.855 13.353 ( -0.680 1.412 4.548) 4.810 13.419 ( -3.916 4.167 -0.187) 5.721 17.890 ( 10.833 -24.210 -4.601) 26.919 18.869 ( 2.683 6.321 2.253) 7.227 20.579 ( -10.253 -0.234 6.119) 11.943 21.510 ( 4.401 -6.012 -20.282) 21.608 23.333 ( 11.096 -13.928 -1.525) 17.873 24.212 ( -8.716 -4.891 -1.557) 10.115 27.457 ( -6.700 -3.112 -0.599) 7.412 27.903 ( 3.341 10.391 14.446) 18.106 ======================= Grid point 732 (358/429) ======================= q-point: (-0.36 -0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( -20.452 0.000 14.148) 24.869 2.681 ( -18.099 0.000 34.283) 38.768 3.116 ( 5.672 -0.000 -5.402) 7.833 4.035 ( 0.204 -0.000 -2.325) 2.334 4.265 ( -4.595 0.000 1.283) 4.771 4.395 ( 1.649 -0.000 -2.634) 3.108 4.757 ( -24.449 0.000 18.992) 30.959 5.403 ( -24.610 0.000 -21.806) 32.881 5.435 ( -0.609 0.000 2.199) 2.281 6.339 ( 2.152 -0.000 -5.608) 6.007 6.667 ( -10.994 0.000 -1.832) 11.145 6.818 ( 21.494 -0.000 -7.860) 22.886 7.285 ( 2.173 -0.000 -1.200) 2.482 7.451 ( 6.591 -0.000 10.003) 11.979 7.706 ( -2.514 0.000 3.437) 4.258 7.947 ( 10.863 -0.000 -2.697) 11.192 7.983 ( -0.948 0.000 0.983) 1.366 8.620 ( -4.016 0.000 -2.954) 4.986 9.248 ( 6.765 -0.000 -4.156) 7.940 9.379 ( 9.498 -0.000 -6.585) 11.557 10.847 ( -11.945 0.000 2.626) 12.230 11.200 ( 24.173 -0.000 23.066) 33.412 12.155 ( -6.866 0.000 3.386) 7.655 12.786 ( 2.376 -0.000 -8.622) 8.943 13.125 ( -7.658 0.000 2.742) 8.134 13.511 ( 9.487 -0.000 -5.199) 10.818 13.977 ( 1.778 -0.000 -2.918) 3.417 14.950 ( -21.781 0.000 7.475) 23.028 15.918 ( -0.247 0.000 1.683) 1.701 16.228 ( 6.636 -0.000 -17.939) 19.127 19.204 ( -0.580 0.000 1.722) 1.817 20.156 ( 0.441 -0.000 -1.402) 1.470 21.904 ( 5.127 -0.000 -8.655) 10.060 23.920 ( -12.237 0.000 -10.792) 16.316 27.343 ( -3.514 0.000 7.235) 8.043 28.687 ( 10.637 -0.000 13.225) 16.971 ======================= Grid point 733 (359/429) ======================= q-point: (-0.29 -0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -22.065 -12.959 13.726) 29.038 2.709 ( -16.901 -7.683 34.153) 38.873 3.319 ( 3.826 -17.907 -4.327) 18.815 4.010 ( 0.495 0.179 -9.188) 9.203 4.317 ( -3.491 -6.711 7.990) 11.003 4.434 ( -1.768 -2.407 -4.107) 5.078 4.768 ( -22.315 -10.222 20.536) 32.002 5.317 ( -14.480 -11.870 -12.830) 22.697 5.618 ( -4.640 -16.622 -2.830) 17.488 6.366 ( 1.970 -2.187 -3.821) 4.823 6.621 ( -6.305 -0.428 -0.269) 6.326 6.830 ( 10.172 4.922 -2.839) 11.651 7.330 ( 3.424 -0.249 -1.162) 3.625 7.491 ( 6.210 2.085 0.902) 6.613 7.720 ( 4.401 3.941 -3.548) 6.891 7.855 ( -0.644 -11.628 2.384) 11.887 8.290 ( 3.639 -15.296 -1.692) 15.813 8.603 ( -1.061 -0.880 -1.336) 1.920 9.299 ( 5.445 -3.167 -6.583) 9.111 9.413 ( 9.093 1.202 -5.717) 10.808 10.766 ( -13.041 1.952 2.776) 13.476 11.338 ( 26.140 5.070 23.096) 35.248 12.037 ( -6.559 7.710 0.246) 10.126 12.616 ( 1.005 18.192 -2.557) 18.398 12.945 ( -6.162 16.688 -2.450) 17.957 13.274 ( 7.754 10.817 -1.839) 13.435 14.302 ( -11.369 13.668 -1.559) 17.847 14.718 ( -0.560 -22.214 3.668) 22.521 15.167 ( -11.508 32.301 1.533) 34.324 17.358 ( 17.124 -66.330 -17.746) 70.766 19.445 ( -5.720 -22.541 5.424) 23.879 20.299 ( 2.040 -15.854 -8.026) 17.886 21.950 ( 7.317 -3.388 -6.273) 10.216 23.858 ( -14.059 -3.417 -7.931) 16.500 27.340 ( -4.881 -0.985 4.671) 6.827 28.703 ( 13.507 8.560 15.229) 22.083 ======================= Grid point 734 (360/429) ======================= q-point: (-0.21 -0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( -21.792 -16.937 12.265) 30.202 2.885 ( -12.572 -11.709 33.194) 37.376 3.712 ( -0.174 -20.660 -3.811) 21.009 4.035 ( 3.374 -3.947 -14.620) 15.514 4.390 ( -4.054 -1.026 4.433) 6.094 4.534 ( 5.883 -9.479 -5.571) 12.470 4.921 ( -23.923 -16.696 22.509) 36.847 5.575 ( -4.162 -17.866 -7.634) 19.869 5.922 ( -0.178 -15.265 -1.964) 15.392 6.404 ( 2.189 0.061 2.427) 3.269 6.660 ( -3.859 -8.411 -0.973) 9.304 6.790 ( 0.157 2.423 6.478) 6.918 7.274 ( -2.956 1.947 -3.585) 5.038 7.527 ( 1.115 -8.571 -10.516) 13.612 7.819 ( 8.705 -7.883 -0.007) 11.744 8.195 ( 5.756 -20.977 -3.123) 21.976 8.467 ( -7.934 -5.416 -7.001) 11.886 8.725 ( 8.017 -10.250 3.148) 13.388 9.392 ( 10.250 1.426 -2.710) 10.698 9.447 ( 2.386 -8.196 -9.577) 12.830 10.622 ( -12.013 6.428 4.552) 14.365 11.403 ( 21.336 6.272 22.632) 31.729 11.863 ( -4.027 6.139 -6.298) 9.673 12.089 ( -0.320 36.919 2.210) 36.986 12.585 ( -4.303 15.891 -4.302) 17.016 13.178 ( 4.695 5.593 2.121) 7.604 13.815 ( -8.337 20.140 1.064) 21.823 14.363 ( -18.103 28.549 6.384) 34.402 15.689 ( 13.691 -48.774 -5.486) 50.955 18.425 ( 15.932 -36.000 -11.603) 41.042 19.889 ( -7.822 -26.348 8.444) 28.752 20.700 ( 1.776 -25.652 -24.548) 35.550 22.140 ( 13.269 -12.937 -1.769) 18.616 23.862 ( -14.587 -6.984 -5.638) 17.127 27.341 ( -6.261 -1.827 1.933) 6.802 28.587 ( 12.205 14.202 17.348) 25.527 ======================= Grid point 735 (361/429) ======================= q-point: (-0.14 -0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.638 ( -15.354 -19.480 11.909) 27.514 3.085 ( -9.329 -10.122 27.177) 30.465 3.995 ( -1.091 -8.892 -3.053) 9.464 4.117 ( 3.256 -5.832 -7.722) 10.210 4.413 ( -4.270 -4.580 -2.163) 6.624 4.771 ( 14.875 -9.614 -7.518) 19.240 5.180 ( -16.667 -16.635 13.448) 27.118 5.787 ( -0.152 -8.073 4.083) 9.048 6.099 ( 8.610 -0.371 0.002) 8.618 6.385 ( -5.597 -0.353 2.820) 6.278 6.703 ( -7.835 1.608 -0.391) 8.008 6.952 ( -1.063 -16.610 5.423) 17.505 7.345 ( 2.859 -10.579 -4.871) 11.992 7.789 ( -6.586 -21.161 -8.418) 23.707 8.068 ( 6.002 -14.455 -3.531) 16.045 8.460 ( -1.784 -3.393 -7.305) 8.250 8.671 ( 3.256 -21.312 2.018) 21.653 9.003 ( 5.849 -15.778 -4.646) 17.457 9.403 ( 3.850 -2.491 -3.501) 5.769 9.713 ( 6.832 -17.250 -5.025) 19.222 10.434 ( -9.380 7.174 3.822) 12.412 11.306 ( -3.065 40.801 0.884) 40.925 11.443 ( 12.872 4.602 20.559) 24.689 11.779 ( 0.098 2.387 -8.548) 8.876 12.245 ( -4.973 18.416 -0.143) 19.076 13.103 ( 4.912 5.546 2.489) 7.815 13.508 ( -4.411 9.687 4.498) 11.555 13.845 ( -12.521 18.436 2.407) 22.415 16.640 ( 14.907 -43.321 -5.552) 46.149 18.872 ( 7.420 -9.612 -1.790) 12.274 20.296 ( -9.201 -18.033 9.800) 22.492 21.078 ( 2.077 -18.733 -33.344) 38.303 22.581 ( 18.654 -22.577 -1.085) 29.306 23.927 ( -14.053 -9.270 -3.714) 17.240 27.344 ( -7.253 -2.551 -0.087) 7.690 28.397 ( 8.858 15.534 18.209) 25.521 ======================= Grid point 736 (362/429) ======================= q-point: (-0.07 -0.36 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.957 ( -7.309 -18.440 13.565) 24.030 3.270 ( -5.613 -10.248 18.506) 21.886 4.016 ( 3.340 3.625 0.496) 4.954 4.291 ( 1.476 -9.782 -1.883) 10.070 4.509 ( -2.990 -8.660 -5.806) 10.846 4.981 ( 11.630 -4.330 -3.778) 12.972 5.267 ( -2.976 1.946 -7.368) 8.181 6.025 ( -3.799 -16.087 24.107) 29.230 6.087 ( 10.567 4.600 0.172) 11.526 6.406 ( -6.347 -3.100 0.644) 7.093 6.572 ( -10.263 4.809 -3.325) 11.811 7.244 ( -1.907 -13.498 1.627) 13.728 7.585 ( 3.460 -11.244 -3.361) 12.235 8.102 ( -3.164 -14.190 -9.562) 17.401 8.398 ( 2.565 -18.419 -8.717) 20.538 8.544 ( 0.859 -8.012 0.827) 8.100 8.973 ( 3.749 -7.666 2.382) 8.860 9.308 ( 6.056 -10.805 -3.394) 12.843 9.705 ( 1.552 -30.880 -5.508) 31.406 10.078 ( 7.573 -8.903 0.004) 11.688 10.299 ( -11.870 -4.851 -2.554) 13.075 10.639 ( -4.920 23.681 3.454) 24.432 11.414 ( 5.766 7.288 9.263) 13.121 11.744 ( 8.495 9.387 4.232) 13.349 11.864 ( -13.393 9.565 -3.015) 16.732 13.047 ( 6.565 4.668 3.809) 8.910 13.393 ( -1.572 2.817 6.288) 7.068 13.522 ( -8.254 10.345 -0.150) 13.236 17.425 ( 13.939 -32.525 -5.450) 35.803 18.968 ( 3.623 1.161 1.519) 4.097 20.469 ( -12.250 -6.306 7.895) 15.879 21.326 ( 4.237 -12.221 -27.253) 30.167 23.093 ( 17.486 -19.565 -2.754) 26.385 24.019 ( -12.609 -8.794 -1.624) 15.458 27.356 ( -7.302 -3.201 -0.726) 8.006 28.188 ( 5.476 14.324 16.943) 22.852 ======================= Grid point 747 (363/429) ======================= q-point: (-0.29 -0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( -21.022 0.000 15.143) 25.909 2.581 ( -22.840 0.000 32.891) 40.044 3.145 ( 2.680 -0.000 -4.864) 5.554 3.995 ( -8.578 0.000 6.124) 10.540 4.217 ( -6.235 0.000 7.075) 9.430 4.406 ( 2.036 -0.000 -2.912) 3.553 4.616 ( -10.507 0.000 16.650) 19.688 5.029 ( -28.203 0.000 -16.194) 32.521 5.439 ( -0.299 0.000 2.430) 2.449 6.343 ( 2.126 -0.000 -5.587) 5.978 6.564 ( -4.655 0.000 -4.996) 6.828 7.008 ( 14.675 -0.000 -1.951) 14.804 7.309 ( 2.882 -0.000 -1.370) 3.191 7.568 ( 10.648 -0.000 1.923) 10.820 7.690 ( -2.646 0.000 3.984) 4.783 7.970 ( -1.638 0.000 0.480) 1.707 8.004 ( 1.644 -0.000 -7.490) 7.668 8.593 ( 0.820 -0.000 0.251) 0.858 9.265 ( 1.560 -0.000 -11.039) 11.149 9.483 ( 10.756 -0.000 -4.018) 11.482 10.703 ( -14.651 0.000 1.761) 14.757 11.594 ( 29.514 -0.000 19.613) 35.436 12.095 ( -4.849 0.000 3.922) 6.236 12.786 ( 3.292 -0.000 -7.019) 7.753 13.076 ( -4.467 0.000 7.839) 9.022 13.601 ( 10.056 -0.000 -5.913) 11.665 13.988 ( 2.008 -0.000 -2.901) 3.528 14.717 ( -23.291 0.000 6.607) 24.210 15.922 ( -0.166 0.000 1.731) 1.739 16.178 ( -3.440 0.000 -21.006) 21.286 19.203 ( -0.585 0.000 1.718) 1.815 20.155 ( 0.427 -0.000 -1.419) 1.482 21.951 ( 8.248 -0.000 -5.529) 9.930 23.728 ( -16.083 0.000 -4.500) 16.701 27.308 ( -5.790 0.000 3.285) 6.657 28.914 ( 19.364 -0.000 14.955) 24.466 ======================= Grid point 748 (364/429) ======================= q-point: (-0.21 -0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( -21.280 -11.722 14.570) 28.329 2.615 ( -21.856 -12.321 30.855) 39.768 3.332 ( 0.628 -17.187 -1.878) 17.300 3.970 ( -2.558 -1.519 -4.275) 5.209 4.281 ( -11.214 -9.025 15.625) 21.244 4.384 ( -4.223 -0.678 -5.509) 6.974 4.666 ( -6.192 -4.735 15.441) 17.297 5.086 ( -16.678 -22.856 -8.674) 29.594 5.594 ( -0.743 -14.976 2.080) 15.138 6.375 ( 2.382 -3.155 -4.715) 6.153 6.556 ( -3.474 -2.123 -2.614) 4.838 6.949 ( 9.891 9.271 3.581) 14.022 7.365 ( 3.012 2.685 -0.617) 4.082 7.526 ( 1.629 7.948 -4.381) 9.221 7.773 ( 7.342 -1.241 -9.433) 12.017 7.849 ( -0.585 -13.820 0.848) 13.858 8.273 ( -2.772 -12.520 -3.716) 13.351 8.638 ( 4.622 -4.043 4.045) 7.353 9.291 ( 0.058 -5.078 -11.895) 12.933 9.502 ( 8.192 2.969 -5.286) 10.192 10.612 ( -15.202 1.228 3.176) 15.579 11.737 ( 26.513 5.339 16.528) 31.696 11.981 ( -0.556 10.124 3.150) 10.618 12.628 ( 2.653 18.044 -0.664) 18.251 12.885 ( -4.568 18.334 3.407) 19.200 13.360 ( 8.941 11.870 -3.246) 15.211 14.163 ( -11.964 17.748 -1.141) 21.434 14.670 ( -12.787 -10.402 9.278) 18.915 15.077 ( -2.241 10.927 -5.444) 12.412 17.447 ( 10.691 -72.695 -22.560) 76.862 19.409 ( -3.479 -20.060 4.143) 20.776 20.280 ( -0.180 -13.749 -7.911) 15.863 22.044 ( 12.518 -5.356 -2.589) 13.859 23.663 ( -16.727 -3.713 -1.904) 17.239 27.284 ( -6.636 -0.692 1.646) 6.871 28.953 ( 19.504 10.768 15.489) 27.134 ======================= Grid point 749 (365/429) ======================= q-point: (-0.14 -0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( -18.033 -18.655 13.264) 29.140 2.854 ( -14.370 -15.072 31.412) 37.688 3.683 ( -2.706 -19.053 -1.047) 19.273 4.025 ( 3.911 -5.451 -12.889) 14.530 4.315 ( -9.300 -3.404 -3.855) 10.627 4.572 ( -2.279 -16.253 9.128) 18.780 4.802 ( -7.407 -12.260 16.455) 21.816 5.488 ( -6.852 -23.523 -3.650) 24.771 5.924 ( 0.123 -17.345 2.886) 17.584 6.444 ( 2.921 0.098 0.731) 3.013 6.599 ( -4.398 -5.954 -2.672) 7.870 6.871 ( 7.340 4.639 10.186) 13.385 7.207 ( -5.430 1.835 -4.836) 7.499 7.526 ( 5.126 -4.319 -8.746) 11.019 7.878 ( 5.167 -7.971 -11.011) 14.542 8.231 ( -0.525 -23.572 -4.146) 23.939 8.388 ( 0.724 -4.000 -2.581) 4.816 8.807 ( 3.876 -8.798 3.794) 10.335 9.415 ( -1.023 -5.601 -9.867) 11.392 9.481 ( 6.647 -3.508 -5.888) 9.548 10.491 ( -12.770 4.054 4.863) 14.254 11.749 ( 20.043 10.481 12.631) 25.906 11.799 ( 1.156 8.354 1.467) 8.561 12.092 ( -0.754 38.240 2.739) 38.345 12.543 ( -1.358 15.238 0.627) 15.312 13.246 ( 6.139 6.543 1.003) 9.028 13.728 ( -7.612 16.660 1.501) 18.378 14.164 ( -20.923 24.825 6.582) 33.127 15.830 ( 14.788 -49.920 -6.527) 52.471 18.514 ( 7.098 -36.029 -14.440) 39.458 19.856 ( -1.741 -25.824 4.602) 26.289 20.601 ( -2.857 -23.085 -25.011) 34.156 22.325 ( 19.937 -15.646 -0.155) 25.344 23.672 ( -16.516 -7.552 -0.613) 18.171 27.265 ( -7.343 -1.426 0.220) 7.483 28.808 ( 14.588 17.312 17.193) 28.427 ======================= Grid point 750 (366/429) ======================= q-point: (-0.07 -0.29 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( -10.336 -22.847 13.060) 28.273 3.083 ( -8.702 -10.855 26.958) 30.336 3.974 ( -0.775 -12.862 -2.382) 13.104 4.131 ( 3.875 -4.912 -6.483) 9.009 4.346 ( -5.457 -5.418 -5.324) 9.353 4.876 ( 3.981 -12.937 2.320) 13.733 5.086 ( -4.296 -16.291 6.584) 18.089 5.794 ( -2.429 -12.481 7.902) 14.971 6.167 ( 3.620 -5.800 0.165) 6.839 6.359 ( -1.343 4.988 2.159) 5.598 6.606 ( -9.013 4.002 -0.570) 9.878 6.976 ( 0.990 -12.260 7.338) 14.323 7.397 ( 9.073 -16.298 -3.513) 18.981 7.700 ( -3.279 -16.555 -7.712) 18.555 8.078 ( 2.996 -13.453 -17.666) 22.406 8.411 ( -5.201 -5.649 3.815) 8.574 8.729 ( 5.085 -20.989 0.131) 21.596 9.038 ( 3.986 -16.861 -5.389) 18.145 9.399 ( -1.616 -1.764 -4.992) 5.536 9.764 ( 4.447 -18.595 -5.079) 19.783 10.342 ( -7.958 6.192 4.285) 10.956 11.271 ( -3.085 41.684 -0.720) 41.804 11.652 ( 7.006 11.137 9.000) 15.941 11.751 ( 3.371 1.178 2.246) 4.218 12.227 ( 1.048 20.356 2.802) 20.574 13.173 ( 5.651 4.885 2.327) 7.824 13.484 ( -2.942 7.500 5.048) 9.507 13.700 ( -14.126 15.211 2.271) 20.882 16.793 ( 15.619 -43.060 -6.117) 46.212 18.913 ( 0.637 -10.233 -2.157) 10.477 20.233 ( -7.236 -14.110 7.375) 17.489 20.972 ( 1.604 -21.818 -33.845) 40.300 22.813 ( 22.927 -21.228 -2.491) 31.345 23.751 ( -15.571 -10.368 -0.011) 18.706 27.258 ( -7.504 -2.436 -0.411) 7.900 28.567 ( 8.802 18.322 17.757) 26.990 ======================= Grid point 762 (367/429) ======================= q-point: (-0.21 -0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.793 ( -19.389 0.000 16.140) 25.227 2.376 ( -32.798 0.000 26.066) 41.895 3.144 ( 0.325 -0.000 -4.287) 4.299 3.914 ( -13.028 0.000 22.994) 26.428 4.189 ( -2.055 0.000 3.153) 3.763 4.419 ( 2.132 -0.000 -3.101) 3.763 4.594 ( -13.132 0.000 1.197) 13.186 4.696 ( -13.019 0.000 3.715) 13.538 5.446 ( -0.036 0.000 2.500) 2.500 6.346 ( 2.022 -0.000 -5.528) 5.886 6.518 ( -0.850 0.000 -4.262) 4.346 7.143 ( 9.323 -0.000 3.509) 9.961 7.339 ( 3.264 -0.000 -1.679) 3.670 7.676 ( -2.544 0.000 4.553) 5.216 7.701 ( 13.996 -0.000 -9.746) 17.055 7.948 ( -4.199 0.000 -8.794) 9.745 7.950 ( -2.159 0.000 0.112) 2.162 8.629 ( 3.201 -0.000 3.710) 4.900 9.214 ( -2.532 0.000 -12.808) 13.056 9.560 ( 4.949 -0.000 -7.201) 8.737 10.542 ( -14.220 0.000 4.018) 14.777 11.870 ( 3.011 -0.000 4.482) 5.400 12.189 ( 22.491 -0.000 11.440) 25.233 12.837 ( 9.832 -0.000 -0.260) 9.835 13.074 ( -1.537 0.000 8.573) 8.710 13.697 ( 10.788 -0.000 -6.273) 12.480 14.000 ( 2.029 -0.000 -2.894) 3.534 14.481 ( -21.692 0.000 5.767) 22.445 15.927 ( -0.163 0.000 1.774) 1.782 15.984 ( -17.005 0.000 -21.579) 27.474 19.203 ( -0.584 0.000 1.714) 1.811 20.155 ( 0.419 -0.000 -1.431) 1.491 22.064 ( 14.524 -0.000 -1.565) 14.608 23.531 ( -17.134 0.000 1.254) 17.180 27.242 ( -6.882 0.000 1.111) 6.971 29.215 ( 23.546 -0.000 12.154) 26.498 ======================= Grid point 763 (368/429) ======================= q-point: (-0.14 -0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.833 ( -17.919 -11.141 15.507) 26.186 2.430 ( -28.125 -20.451 24.059) 42.286 3.327 ( -0.670 -16.964 0.362) 16.981 3.937 ( -2.726 -3.477 4.406) 6.239 4.167 ( -14.480 -0.538 0.527) 14.500 4.322 ( -5.893 -5.935 8.395) 11.850 4.719 ( 4.140 -1.721 13.287) 14.023 4.908 ( -10.481 -28.952 -1.952) 30.852 5.602 ( 0.224 -15.005 2.934) 15.291 6.383 ( 2.231 -3.909 -5.408) 7.036 6.521 ( -1.367 -1.347 -1.877) 2.684 7.084 ( 10.573 8.201 7.609) 15.393 7.385 ( 0.372 11.223 -0.423) 11.238 7.519 ( 1.007 3.933 -4.808) 6.293 7.777 ( 1.485 -2.626 -12.707) 13.060 7.855 ( 2.551 -12.921 -8.942) 15.919 8.254 ( 1.565 -12.705 1.095) 12.848 8.702 ( 2.862 -5.278 5.525) 8.159 9.222 ( -3.923 -6.115 -12.946) 14.845 9.528 ( -0.134 2.833 -8.196) 8.673 10.472 ( -10.942 0.918 5.668) 12.357 11.825 ( -5.683 3.681 -1.519) 6.939 12.251 ( 30.036 11.666 13.081) 34.776 12.690 ( 7.608 22.923 5.229) 24.712 12.867 ( -1.200 19.033 6.156) 20.040 13.454 ( 10.307 12.398 -4.317) 16.691 14.028 ( -11.115 18.234 -0.840) 21.372 14.501 ( -23.129 12.667 12.243) 29.074 15.068 ( 4.638 -19.204 -9.962) 22.126 17.421 ( -0.380 -77.455 -23.448) 80.927 19.402 ( 0.568 -20.088 1.224) 20.134 20.239 ( -2.155 -9.497 -6.188) 11.538 22.225 ( 20.177 -7.457 0.126) 21.511 23.473 ( -16.675 -3.653 2.744) 17.290 27.208 ( -7.142 -0.433 0.483) 7.171 29.235 ( 20.207 13.279 11.982) 26.986 ======================= Grid point 764 (369/429) ======================= q-point: (-0.07 -0.21 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( -11.952 -21.072 14.573) 28.272 2.787 ( -15.855 -21.547 26.368) 37.563 3.656 ( -1.611 -17.258 1.120) 17.369 4.026 ( 3.423 -7.183 -11.160) 13.707 4.165 ( -12.603 -7.725 -4.970) 15.595 4.571 ( -4.332 -17.767 16.005) 24.302 4.849 ( 3.696 -8.519 12.119) 15.268 5.406 ( -6.205 -26.916 0.751) 27.633 5.946 ( 1.313 -17.621 4.257) 18.176 6.463 ( -0.332 0.496 1.396) 1.518 6.548 ( -2.492 -5.064 -3.271) 6.523 6.980 ( 2.796 11.326 2.297) 11.890 7.160 ( 2.395 -2.835 2.694) 4.586 7.576 ( 8.858 -2.886 -6.961) 11.630 7.865 ( 3.162 -7.782 -19.999) 21.691 8.149 ( -8.905 -18.588 -2.273) 20.736 8.455 ( 8.655 -9.198 -1.095) 12.677 8.842 ( 0.193 -7.027 3.484) 7.846 9.349 ( -3.942 -6.838 -10.040) 12.771 9.488 ( -1.612 -6.433 -6.539) 9.314 10.396 ( -6.489 3.149 5.631) 9.151 11.698 ( -6.116 5.070 -5.914) 9.904 12.086 ( -2.946 39.014 10.134) 40.416 12.133 ( 26.399 21.216 8.932) 35.026 12.567 ( 3.916 15.138 5.536) 16.588 13.322 ( 6.736 7.732 -0.441) 10.264 13.654 ( -6.691 12.693 1.391) 14.415 13.945 ( -21.123 20.810 6.746) 30.410 15.972 ( 14.507 -51.676 -7.645) 54.215 18.464 ( -6.990 -38.362 -13.190) 41.164 19.889 ( 6.496 -24.212 -1.465) 25.111 20.462 ( -5.712 -20.809 -21.749) 30.638 22.584 ( 25.344 -16.633 -1.098) 30.335 23.490 ( -15.866 -7.490 2.842) 17.774 27.182 ( -7.233 -1.182 0.168) 7.331 29.027 ( 12.698 20.323 14.683) 28.104 ======================= Grid point 777 (370/429) ======================= q-point: (-0.14 -0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( -15.252 0.000 16.760) 22.661 2.050 ( -37.602 0.000 20.311) 42.737 3.125 ( -0.977 0.000 -3.698) 3.824 3.887 ( -8.288 0.000 26.219) 27.497 4.173 ( -1.994 0.000 -8.837) 9.060 4.327 ( -22.741 0.000 12.887) 26.139 4.430 ( 1.816 -0.000 -3.129) 3.617 4.767 ( 7.751 -0.000 11.585) 13.939 5.456 ( 0.145 -0.000 2.386) 2.391 6.348 ( 1.865 -0.000 -5.440) 5.751 6.505 ( 0.174 -0.000 -2.151) 2.158 7.264 ( 9.100 -0.000 7.165) 11.582 7.369 ( 3.085 -0.000 -2.098) 3.731 7.668 ( -2.010 0.000 5.085) 5.468 7.750 ( 4.818 -0.000 -29.171) 29.567 7.921 ( 4.201 -0.000 2.331) 4.804 7.923 ( -2.470 0.000 -0.073) 2.471 8.675 ( 1.949 -0.000 4.265) 4.689 9.116 ( -6.427 0.000 -12.270) 13.851 9.520 ( -6.614 0.000 -9.198) 11.329 10.443 ( -5.877 0.000 6.709) 8.919 11.828 ( -6.668 0.000 -0.551) 6.690 12.494 ( 18.513 -0.000 6.809) 19.726 13.046 ( 21.256 -0.000 10.030) 23.504 13.099 ( 3.906 -0.000 3.544) 5.274 13.803 ( 12.046 -0.000 -6.090) 13.498 14.012 ( 1.840 -0.000 -2.897) 3.432 14.277 ( -17.262 0.000 4.825) 17.924 15.641 ( -29.712 0.000 -17.258) 34.361 15.931 ( -0.238 0.000 1.804) 1.820 19.203 ( -0.577 0.000 1.711) 1.806 20.154 ( 0.418 -0.000 -1.437) 1.497 22.275 ( 22.568 -0.000 0.421) 22.572 23.355 ( -15.308 0.000 4.327) 15.908 27.166 ( -6.901 0.000 0.594) 6.926 29.509 ( 21.068 -0.000 6.269) 21.981 ======================= Grid point 778 (371/429) ======================= q-point: (-0.07 -0.14 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -11.612 -11.493 16.409) 23.156 2.186 ( -26.616 -29.416 18.671) 43.844 3.324 ( -0.217 -18.405 1.101) 18.439 3.942 ( -0.252 -1.572 4.474) 4.749 3.980 ( -14.329 0.991 -6.526) 15.776 4.321 ( -3.954 -8.425 21.107) 23.067 4.780 ( -4.104 -16.202 6.011) 17.762 4.875 ( 6.023 -13.402 6.914) 16.239 5.617 ( 0.489 -15.608 2.966) 15.895 6.386 ( 1.799 -4.101 -5.742) 7.282 6.504 ( -1.273 -0.122 -0.368) 1.331 7.247 ( 12.263 5.717 9.135) 16.325 7.362 ( -3.639 21.882 -1.332) 22.223 7.525 ( 2.812 -6.404 -4.002) 8.058 7.739 ( 1.252 -3.670 -14.617) 15.123 7.829 ( 1.191 -7.314 -13.314) 15.238 8.305 ( 4.673 -14.735 2.440) 15.650 8.741 ( 0.592 -5.023 5.470) 7.450 9.111 ( -7.121 -7.406 -12.207) 15.955 9.436 ( -10.077 1.475 -7.535) 12.668 10.423 ( -1.859 1.405 6.210) 6.633 11.744 ( -6.051 4.248 -2.499) 7.804 12.546 ( 14.705 5.727 4.837) 16.505 12.782 ( -0.486 32.363 6.813) 33.076 12.997 ( 22.028 19.381 11.636) 31.563 13.565 ( 12.435 13.098 -5.316) 18.826 13.904 ( -10.625 18.631 -0.819) 21.463 14.261 ( -25.540 24.692 12.976) 37.820 15.091 ( 5.976 -38.766 -12.113) 41.052 17.275 ( -10.991 -77.101 -18.034) 79.941 19.427 ( 3.950 -22.988 -2.623) 23.472 20.193 ( -2.447 -4.628 -3.492) 6.293 22.491 ( 25.345 -8.511 -0.504) 26.741 23.313 ( -12.938 -3.293 4.132) 13.975 27.131 ( -6.695 -0.259 0.755) 6.743 29.476 ( 14.991 15.181 7.015) 22.460 ======================= Grid point 792 (372/429) ======================= q-point: (-0.07 -0.07 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 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 420 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( -8.708 0.000 16.538) 18.690 1.732 ( -27.611 0.000 18.010) 32.966 3.098 ( -1.308 0.000 -3.106) 3.370 3.887 ( -5.632 0.000 9.120) 10.719 4.041 ( -8.571 0.000 -5.215) 10.033 4.279 ( -5.844 0.000 32.067) 32.596 4.436 ( 1.178 -0.000 -2.987) 3.211 4.904 ( 9.007 -0.000 8.855) 12.631 5.466 ( 0.212 -0.000 2.112) 2.123 6.348 ( 1.691 -0.000 -5.339) 5.600 6.498 ( -0.869 0.000 -0.257) 0.906 7.391 ( 2.123 -0.000 -2.449) 3.241 7.408 ( 11.635 -0.000 4.868) 12.613 7.663 ( 0.691 -0.000 -26.230) 26.239 7.670 ( -0.840 0.000 5.358) 5.423 7.894 ( -2.561 0.000 -0.017) 2.561 7.996 ( 7.037 -0.000 -2.763) 7.561 8.701 ( 0.084 -0.000 2.315) 2.316 8.986 ( -8.710 0.000 -8.776) 12.365 9.368 ( -13.544 0.000 -5.998) 14.813 10.450 ( 2.031 -0.000 5.617) 5.973 11.756 ( -4.325 0.000 -1.508) 4.580 12.656 ( 7.546 -0.000 6.194) 9.763 13.111 ( 0.283 -0.000 4.364) 4.373 13.378 ( 22.435 -0.000 4.375) 22.857 13.916 ( 9.489 -0.000 -4.038) 10.312 14.020 ( 1.478 -0.000 -2.912) 3.265 14.143 ( -7.208 0.000 2.346) 7.580 15.228 ( -30.856 0.000 -8.861) 32.103 15.934 ( -0.375 0.000 1.816) 1.854 19.203 ( -0.567 0.000 1.709) 1.800 20.154 ( 0.424 -0.000 -1.436) 1.497 22.549 ( 23.054 -0.000 -1.165) 23.084 23.232 ( -6.968 0.000 3.092) 7.623 27.094 ( -6.135 0.000 1.323) 6.276 29.716 ( 12.320 -0.000 0.944) 12.356 ======================= Grid point 793 (373/429) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 219 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( -0.000 0.000 0.000) 0.000 1.794 ( -0.000 0.000 0.000) 0.000 3.046 ( 0.000 -0.000 0.000) 0.000 3.766 ( 0.000 -0.000 0.000) 0.000 3.931 ( -0.000 0.000 0.000) 0.000 4.406 ( -0.000 0.000 0.000) 0.000 4.983 ( 0.000 -0.000 -0.000) 0.000 5.029 ( -0.000 0.000 0.000) 0.000 5.493 ( -0.000 0.000 0.000) 0.000 6.293 ( -0.000 0.000 0.000) 0.000 6.545 ( 0.000 -0.000 -0.000) 0.000 7.083 ( 0.000 -0.000 0.000) 0.000 7.372 ( -0.000 0.000 0.000) 0.000 7.683 ( -0.000 0.000 0.000) 0.000 7.744 ( -0.000 0.000 0.000) 0.000 7.866 ( 0.000 -0.000 0.000) 0.000 7.987 ( -0.000 0.000 0.000) 0.000 8.624 ( 0.000 -0.000 0.000) 0.000 8.895 ( -0.000 0.000 0.000) 0.000 9.207 ( 0.000 -0.000 0.000) 0.000 10.535 ( 0.000 -0.000 0.000) 0.000 11.716 ( -0.000 0.000 0.000) 0.000 12.805 ( -0.000 0.000 0.000) 0.000 13.139 ( 0.000 -0.000 0.000) 0.000 13.547 ( -0.000 0.000 0.000) 0.000 13.964 ( -0.000 0.000 0.000) 0.000 13.993 ( -0.000 0.000 0.000) 0.000 14.083 ( 0.000 -0.000 0.000) 0.000 14.966 ( 0.000 -0.000 0.000) 0.000 15.954 ( -0.000 0.000 0.000) 0.000 19.221 ( -0.000 0.000 0.000) 0.000 20.138 ( 0.000 -0.000 0.000) 0.000 22.671 ( -0.000 0.000 0.000) 0.000 23.237 ( 0.000 -0.000 0.000) 0.000 27.070 ( -0.000 0.000 0.000) 0.000 29.778 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 795 (374/429) ======================= q-point: ( 0.07 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( 1.476 -11.811 -1.626) 12.014 2.182 ( 12.640 -36.045 -0.821) 38.206 3.317 ( -0.600 -24.684 0.002) 24.691 3.693 ( 4.051 5.481 2.230) 7.171 3.939 ( -0.750 -1.182 0.475) 1.478 4.554 ( 0.242 -11.572 -0.999) 11.617 5.015 ( -0.426 -3.975 -1.947) 4.447 5.162 ( 1.462 -14.644 -4.739) 15.461 5.663 ( -0.223 -17.286 -0.305) 17.290 6.322 ( -0.050 -3.607 0.144) 3.610 6.551 ( 0.178 -0.755 -0.738) 1.071 7.111 ( -0.160 -2.436 5.496) 6.014 7.334 ( 0.132 30.725 0.898) 30.739 7.501 ( -3.719 -12.427 -0.416) 12.978 7.637 ( -1.523 3.100 -3.007) 4.580 7.797 ( 1.151 -5.774 -1.958) 6.204 8.349 ( -0.703 -11.163 0.630) 11.203 8.776 ( 1.417 -17.362 1.448) 17.480 8.890 ( 0.363 0.072 1.036) 1.100 9.216 ( 1.523 -0.528 3.652) 3.992 10.509 ( 0.576 2.609 -1.339) 2.988 11.666 ( 3.199 5.736 -0.215) 6.571 12.719 ( -9.554 11.353 0.771) 14.858 12.832 ( 6.039 25.801 -1.153) 26.523 13.372 ( -16.872 13.036 0.273) 21.323 13.616 ( -11.752 15.431 3.093) 19.641 13.776 ( 12.184 20.121 -1.560) 23.574 14.258 ( 16.084 36.596 -4.827) 40.264 14.951 ( -1.178 -56.987 0.783) 57.005 16.944 ( 0.015 -66.349 4.593) 66.508 19.432 ( 0.763 -21.336 -1.048) 21.375 20.145 ( 0.353 -0.693 0.223) 0.810 22.704 ( -12.078 -7.281 0.198) 14.104 23.293 ( 11.251 -2.922 -4.553) 12.485 27.075 ( 0.921 -0.182 1.181) 1.509 29.647 ( -4.134 12.099 -0.378) 12.791 ======================= Grid point 796 (375/429) ======================= q-point: ( 0.14 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.236 ( 2.906 -22.864 -3.261) 23.277 2.965 ( 13.611 -34.073 -2.243) 36.760 3.647 ( -0.328 -7.294 -0.065) 7.302 3.842 ( 4.907 -19.090 2.102) 19.822 3.976 ( -1.847 -3.466 2.037) 4.424 4.758 ( 1.320 -10.463 -3.209) 11.023 5.123 ( -0.659 -8.362 -4.698) 9.614 5.542 ( 1.678 -23.363 -3.893) 23.745 6.030 ( -1.910 -17.002 -0.599) 17.119 6.485 ( -2.189 -13.764 0.222) 13.939 6.595 ( 5.806 -6.310 -4.356) 9.618 6.789 ( 1.907 26.059 6.251) 26.866 7.191 ( 0.625 -4.637 7.092) 8.497 7.573 ( -2.389 0.338 -2.672) 3.600 7.684 ( -17.027 -10.829 -3.962) 20.564 8.054 ( 11.157 -19.000 -0.630) 22.042 8.456 ( -2.559 -5.249 3.950) 7.050 8.905 ( 0.321 -3.395 -1.875) 3.892 9.119 ( 2.623 -8.196 5.094) 10.000 9.333 ( 0.120 -15.301 3.896) 15.790 10.447 ( 1.733 4.134 -1.870) 4.857 11.561 ( 4.148 7.726 0.825) 8.808 12.078 ( -5.627 40.831 4.352) 41.446 12.508 ( -0.705 20.390 -5.148) 21.042 12.866 ( -21.024 20.949 -4.082) 29.959 13.315 ( 2.502 9.821 4.091) 10.930 13.614 ( 7.849 7.104 -2.744) 10.936 13.875 ( 13.060 18.862 -3.151) 23.157 16.016 ( -6.205 -55.684 -1.720) 56.055 18.057 ( -1.073 -48.221 12.873) 49.921 19.949 ( 2.649 -30.490 -5.544) 31.103 20.184 ( 2.913 -3.221 2.483) 5.002 22.811 ( -19.035 -13.467 1.461) 23.363 23.452 ( 16.911 -6.603 -7.881) 19.791 27.096 ( 1.854 -1.086 2.306) 3.152 29.314 ( -6.469 18.876 -1.623) 20.020 ======================= Grid point 797 (376/429) ======================= q-point: ( 0.21 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( 3.009 -25.053 -5.054) 25.734 3.455 ( 8.313 -12.848 -7.253) 16.934 3.875 ( 1.024 -15.168 3.267) 15.549 4.044 ( -0.143 -4.561 7.303) 8.612 4.148 ( 0.612 -10.518 -3.088) 10.979 4.960 ( 1.411 -10.248 -2.242) 10.585 5.262 ( -3.346 -6.532 -7.674) 10.619 5.957 ( -0.517 -19.732 -1.422) 19.790 6.181 ( -1.668 0.779 1.891) 2.639 6.351 ( 5.926 11.844 0.564) 13.256 6.626 ( 3.376 -2.602 -1.759) 4.611 7.047 ( 0.812 -18.840 -0.317) 18.860 7.364 ( 1.718 -14.695 4.231) 15.388 7.642 ( -0.240 -11.627 5.781) 12.987 7.770 ( -16.594 -12.737 -7.948) 22.378 8.421 ( 10.148 -7.757 2.078) 12.941 8.722 ( -5.227 -27.633 4.621) 28.500 9.025 ( -0.992 -9.740 -2.179) 10.029 9.233 ( 3.340 -7.139 5.649) 9.697 9.700 ( -0.641 -20.546 2.019) 20.655 10.366 ( 1.419 5.614 -1.854) 6.080 11.192 ( 0.606 39.073 2.734) 39.173 11.542 ( 3.539 8.529 2.067) 9.463 12.073 ( -0.553 21.232 -5.191) 21.864 12.417 ( -14.680 17.358 -3.722) 23.036 13.226 ( -0.886 2.183 2.739) 3.613 13.524 ( 6.923 7.085 -2.546) 10.228 13.637 ( 6.577 11.555 -2.897) 13.607 16.891 ( -10.456 -42.833 -2.082) 44.139 18.730 ( -2.454 -22.246 12.123) 25.453 20.259 ( 6.476 -5.384 1.124) 8.496 20.559 ( 4.389 -27.674 -2.896) 28.169 22.993 ( -19.959 -16.947 3.088) 26.365 23.691 ( 16.958 -9.687 -8.694) 21.378 27.149 ( 2.667 -2.625 3.246) 4.954 28.902 ( -6.689 19.831 -3.082) 21.155 ======================= Grid point 798 (377/429) ======================= q-point: ( 0.29 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.154 ( 2.787 -21.424 -6.299) 22.504 3.629 ( 3.287 -6.274 -13.179) 14.961 4.103 ( -1.316 -7.177 2.804) 7.817 4.155 ( -4.289 -5.624 10.094) 12.325 4.307 ( 4.357 -8.174 0.147) 9.264 5.101 ( 2.957 -1.736 -3.269) 4.738 5.225 ( -13.179 2.312 -5.573) 14.495 6.060 ( 6.528 6.780 6.269) 11.309 6.246 ( 1.841 -9.208 0.363) 9.397 6.376 ( 2.120 -4.115 1.140) 4.767 6.715 ( 5.270 -6.609 -14.521) 16.802 7.168 ( -8.114 -1.558 9.810) 12.826 7.606 ( 1.813 -10.872 2.622) 11.330 7.883 ( -5.030 -11.704 -6.064) 14.109 8.165 ( -0.144 -25.973 6.068) 26.673 8.624 ( 2.872 -12.057 0.671) 12.412 9.036 ( -1.355 -5.121 0.498) 5.321 9.316 ( -6.384 -21.849 3.435) 23.020 9.589 ( 2.087 -25.561 2.333) 25.752 10.126 ( 9.638 -14.275 0.308) 17.227 10.190 ( -8.037 3.211 -1.044) 8.717 10.608 ( 6.464 18.784 -0.845) 19.883 11.413 ( -0.175 10.310 4.392) 11.208 11.738 ( 9.667 16.068 -1.987) 18.857 12.062 ( -14.814 8.741 -4.352) 17.742 13.193 ( -5.296 0.855 -0.997) 5.456 13.402 ( 8.156 9.266 0.708) 12.364 13.518 ( 1.363 3.546 -4.250) 5.700 17.507 ( -11.374 -30.661 -0.716) 32.711 18.952 ( -3.746 -3.555 5.908) 7.847 20.402 ( 9.537 -4.003 3.837) 11.032 21.016 ( 3.692 -18.548 -3.173) 19.177 23.212 ( -16.709 -16.405 3.671) 23.702 23.950 ( 14.045 -9.399 -7.275) 18.399 27.235 ( 3.144 -4.007 3.813) 6.362 28.507 ( -5.583 17.523 -3.982) 18.817 ======================= Grid point 799 (378/429) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.497 ( 2.102 -14.657 -6.419) 16.139 3.718 ( 1.840 -4.762 -12.494) 13.497 4.098 ( -8.869 2.045 -7.257) 11.641 4.278 ( -0.945 -6.739 11.739) 13.569 4.535 ( 3.746 -11.723 8.805) 15.133 4.947 ( -2.218 11.830 1.879) 12.182 5.202 ( -7.129 -3.875 -9.426) 12.438 6.014 ( 6.549 4.416 6.319) 10.115 6.272 ( -1.915 5.897 -0.765) 6.247 6.468 ( 1.574 -3.849 3.753) 5.602 6.876 ( 3.395 -10.252 -21.969) 24.480 7.202 ( -3.573 -4.653 19.605) 20.464 7.834 ( 6.526 -9.912 -3.442) 12.357 8.040 ( -4.568 -8.216 -2.330) 9.684 8.505 ( -0.184 -10.836 11.353) 15.695 8.819 ( -7.075 -5.902 -3.441) 9.835 9.098 ( -1.246 -3.926 -0.637) 4.168 9.562 ( -5.711 -6.323 -4.349) 9.566 9.873 ( 5.868 10.718 -1.237) 12.282 10.069 ( 3.674 -20.553 10.831) 23.521 10.487 ( 3.175 -1.198 -4.002) 5.247 10.772 ( 0.456 -29.936 -3.294) 30.120 11.247 ( -0.849 1.781 6.584) 6.873 11.541 ( 11.140 11.206 -3.117) 16.106 11.936 ( -8.389 -1.443 -0.785) 8.548 13.083 ( -6.272 6.586 -3.615) 9.786 13.332 ( 4.439 2.214 1.740) 5.257 13.469 ( 0.076 1.870 -3.505) 3.973 17.936 ( -9.627 -22.247 0.770) 24.253 18.908 ( -2.860 5.765 1.630) 6.639 20.514 ( 8.273 -1.657 3.440) 9.112 21.286 ( 2.776 -9.403 -2.393) 10.092 23.409 ( -11.622 -12.060 3.052) 17.024 24.155 ( 9.954 -6.197 -5.091) 12.783 27.343 ( 3.118 -4.681 3.889) 6.838 28.176 ( -4.081 14.044 -4.150) 15.202 ======================= Grid point 800 (379/429) ======================= q-point: ( 0.43 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.690 ( -0.417 -5.948 -4.688) 7.585 3.782 ( 5.595 -1.766 -7.389) 9.435 3.989 ( -10.990 0.470 -4.718) 11.969 4.425 ( 0.283 -7.068 8.080) 10.739 4.737 ( 1.471 6.804 5.704) 8.999 4.797 ( -1.529 -9.449 2.842) 9.985 5.192 ( -2.427 0.595 -7.902) 8.288 5.984 ( 8.414 4.457 5.904) 11.203 6.085 ( -9.241 7.375 -3.658) 12.376 6.540 ( 1.166 -2.108 3.298) 4.084 7.025 ( 1.986 -6.645 -9.551) 11.804 7.339 ( 1.560 -5.670 9.789) 11.419 8.007 ( 7.424 -4.758 -4.904) 10.089 8.117 ( -5.860 -3.460 -0.693) 6.841 8.652 ( -1.890 -2.043 12.491) 12.797 8.784 ( -4.833 0.141 -3.079) 5.732 9.182 ( 0.012 -5.880 -3.120) 6.656 9.526 ( -6.482 5.435 -5.533) 10.107 9.806 ( 6.353 1.029 0.242) 6.440 10.355 ( 5.512 -5.425 12.141) 14.395 10.571 ( -4.774 -7.962 -5.502) 10.791 11.073 ( 5.133 -2.571 -8.866) 10.562 11.324 ( 0.648 -1.882 8.217) 8.455 11.625 ( 3.256 -16.585 -2.279) 17.055 11.951 ( -1.934 -2.163 1.463) 3.249 12.915 ( -4.101 6.277 -2.571) 7.927 13.344 ( 0.851 -1.126 0.775) 1.610 13.427 ( -0.256 2.152 -2.222) 3.104 18.256 ( -6.508 -17.032 1.595) 18.303 18.742 ( -0.360 10.551 -0.585) 10.574 20.573 ( 4.601 -0.378 1.906) 4.994 21.412 ( 1.527 -3.612 -1.310) 4.134 23.534 ( -5.903 -6.034 1.711) 8.613 24.273 ( 5.170 -2.714 -2.672) 6.422 27.454 ( 2.464 -4.577 3.284) 6.148 27.926 ( -2.648 9.566 -3.464) 10.513 ======================= Grid point 801 (380/429) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 394 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.716 ( -0.000 0.000 0.000) 0.000 3.824 ( -0.000 0.000 0.000) 0.000 3.952 ( 0.000 0.000 0.000) 0.000 4.542 ( -0.000 -0.000 0.000) 0.000 4.626 ( -0.000 0.000 -0.000) 0.000 4.935 ( -0.000 0.000 -0.000) 0.000 5.149 ( -0.000 0.000 0.000) 0.000 5.960 ( 0.000 0.000 0.000) 0.000 5.982 ( -0.000 -0.000 -0.000) 0.000 6.567 ( -0.000 0.000 0.000) 0.000 7.088 ( -0.000 0.000 0.000) 0.000 7.413 ( -0.000 0.000 0.000) 0.000 8.073 ( -0.000 0.000 0.000) 0.000 8.121 ( 0.000 0.000 -0.000) 0.000 8.645 ( -0.000 0.000 0.000) 0.000 8.794 ( -0.000 0.000 0.000) 0.000 9.285 ( -0.000 0.000 0.000) 0.000 9.377 ( 0.000 -0.000 0.000) 0.000 9.829 ( -0.000 -0.000 0.000) 0.000 10.430 ( 0.000 0.000 0.000) 0.000 10.646 ( -0.000 0.000 0.000) 0.000 11.046 ( -0.000 0.000 0.000) 0.000 11.387 ( -0.000 0.000 0.000) 0.000 11.819 ( -0.000 0.000 0.000) 0.000 11.975 ( -0.000 0.000 0.000) 0.000 12.835 ( -0.000 0.000 0.000) 0.000 13.380 ( 0.000 -0.000 0.000) 0.000 13.381 ( -0.000 0.000 -0.000) 0.000 18.507 ( 0.000 0.000 -0.000) 0.000 18.530 ( -0.000 -0.000 0.000) 0.000 20.591 ( -0.000 0.000 -0.000) 0.000 21.447 ( -0.000 0.000 0.000) 0.000 23.574 ( -0.000 0.000 0.000) 0.000 24.310 ( -0.000 0.000 0.000) 0.000 27.522 ( -0.000 0.000 0.000) 0.000 27.809 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 810 (381/429) ======================= q-point: ( 0.07 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.775 ( 7.132 -0.000 -2.567) 7.580 1.947 ( 26.203 -0.000 -2.503) 26.322 3.049 ( 0.042 -0.000 1.368) 1.368 3.818 ( 6.357 -0.000 5.538) 8.431 3.926 ( -0.145 0.000 -0.310) 0.343 4.403 ( -0.643 0.000 0.224) 0.681 4.965 ( 0.654 -0.000 -10.635) 10.655 5.028 ( 1.809 -0.000 -6.049) 6.314 5.492 ( -0.135 0.000 -0.391) 0.414 6.293 ( -0.169 0.000 0.097) 0.195 6.540 ( -0.560 0.000 -1.182) 1.308 7.101 ( -0.206 0.000 10.538) 10.540 7.365 ( -1.268 0.000 0.104) 1.273 7.621 ( -7.736 0.000 -7.952) 11.094 7.744 ( 0.633 -0.000 -1.777) 1.886 7.874 ( 0.832 -0.000 1.784) 1.969 7.981 ( -0.563 0.000 -1.208) 1.333 8.655 ( 2.920 -0.000 4.391) 5.274 8.899 ( 0.531 -0.000 1.796) 1.872 9.240 ( 2.894 -0.000 7.357) 7.906 10.534 ( 1.010 -0.000 -2.699) 2.881 11.756 ( 7.117 -0.000 -1.215) 7.220 12.743 ( -9.705 0.000 -1.722) 9.856 13.161 ( 3.011 -0.000 -0.917) 3.148 13.405 ( -23.864 0.000 2.727) 24.019 13.871 ( -12.488 0.000 -0.231) 12.490 13.990 ( -0.469 0.000 -0.039) 0.471 14.158 ( 11.999 -0.000 0.363) 12.004 15.126 ( 23.367 -0.000 1.783) 23.435 15.953 ( -0.187 0.000 -0.025) 0.189 19.221 ( 0.014 -0.000 -0.000) 0.014 20.138 ( 0.017 -0.000 0.017) 0.024 22.548 ( -17.808 0.000 -1.394) 17.863 23.336 ( 16.811 -0.000 -7.711) 18.495 27.085 ( 1.786 -0.000 2.332) 2.938 29.727 ( -8.750 0.000 -0.432) 8.761 ======================= Grid point 811 (382/429) ======================= q-point: ( 0.14 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.935 ( 8.766 -11.317 -4.110) 14.893 2.418 ( 28.001 -30.451 -3.127) 41.486 3.309 ( -0.674 -22.789 0.196) 22.800 3.781 ( 6.652 4.766 6.108) 10.211 3.934 ( 0.381 -0.905 2.010) 2.237 4.552 ( 0.753 -11.612 -2.787) 11.965 4.994 ( -0.315 -4.332 -5.942) 7.361 5.162 ( 4.462 -15.202 -13.070) 20.539 5.656 ( -0.619 -16.792 -0.839) 16.825 6.322 ( -0.192 -3.680 0.412) 3.708 6.550 ( 0.594 -1.881 -2.194) 2.950 7.148 ( -0.134 -2.366 15.305) 15.488 7.336 ( -2.115 26.527 2.404) 26.720 7.425 ( -6.876 -3.020 -4.000) 8.509 7.586 ( -3.674 0.022 -6.077) 7.101 7.813 ( 2.819 -8.097 -1.646) 8.730 8.335 ( -1.799 -12.068 -0.253) 12.204 8.795 ( 0.051 -12.325 0.144) 12.326 8.921 ( 3.317 -3.329 6.308) 7.866 9.267 ( 2.415 0.261 9.646) 9.947 10.516 ( 2.443 2.162 -3.032) 4.454 11.733 ( 8.668 6.552 -1.152) 10.927 12.578 ( -16.147 13.364 1.278) 20.999 12.886 ( 4.130 24.370 -2.100) 24.806 13.079 ( -29.967 16.204 1.972) 34.125 13.529 ( -5.600 11.709 -1.531) 13.069 13.895 ( 10.034 15.752 0.149) 18.677 14.500 ( 27.598 35.424 -9.964) 45.998 14.932 ( -3.217 -50.404 2.560) 50.571 16.973 ( -0.890 -66.568 12.818) 67.797 19.442 ( 2.391 -22.044 -2.946) 22.368 20.154 ( 0.907 -1.681 0.756) 2.054 22.502 ( -20.176 -7.060 -1.967) 21.466 23.449 ( 18.568 -2.960 -9.855) 21.228 27.104 ( 2.652 -0.210 3.417) 4.330 29.553 ( -11.662 11.484 -1.507) 16.437 ======================= Grid point 812 (383/429) ======================= q-point: ( 0.21 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.286 ( 9.051 -20.725 -5.404) 23.252 3.146 ( 19.238 -27.911 -5.611) 34.360 3.650 ( 1.033 -11.069 -0.554) 11.131 3.883 ( -1.357 -12.635 1.887) 12.847 3.992 ( 3.887 -4.247 6.913) 8.997 4.756 ( 0.477 -10.674 -4.903) 11.756 5.102 ( 2.577 -7.868 -9.193) 12.371 5.549 ( 2.843 -22.710 -6.452) 23.779 6.002 ( -2.138 -16.483 -1.166) 16.662 6.464 ( -2.040 -10.790 0.533) 10.994 6.635 ( 4.855 -5.034 -7.121) 9.981 6.861 ( 5.170 17.214 10.101) 20.618 7.230 ( 0.169 -3.017 8.075) 8.622 7.459 ( -12.177 -8.818 -7.743) 16.911 7.556 ( -5.358 -0.354 3.582) 6.455 8.143 ( 4.451 -23.473 0.505) 23.896 8.436 ( -2.257 -3.174 1.819) 4.299 8.901 ( -0.193 -4.047 -2.085) 4.556 9.180 ( 3.514 -8.675 7.567) 12.036 9.344 ( -2.220 -11.876 7.308) 14.120 10.474 ( 4.581 4.043 -2.140) 6.474 11.628 ( 6.576 9.377 1.081) 11.504 11.999 ( -12.518 34.051 7.762) 37.100 12.451 ( -4.764 23.516 -12.536) 27.071 12.639 ( -14.116 14.762 -1.388) 20.472 13.317 ( -2.345 8.192 0.709) 8.551 13.694 ( 7.591 9.920 -2.661) 12.771 14.060 ( 20.405 25.459 -4.384) 32.920 15.912 ( -10.292 -53.407 -2.236) 54.436 18.094 ( -4.188 -47.925 21.332) 52.625 19.971 ( 6.383 -29.572 -9.348) 31.664 20.239 ( 4.215 -6.560 4.606) 9.056 22.579 ( -20.958 -13.860 -0.735) 25.137 23.621 ( 17.906 -6.324 -10.426) 21.663 27.139 ( 3.481 -1.090 4.386) 5.704 29.199 ( -11.810 17.458 -3.495) 21.365 ======================= Grid point 813 (384/429) ======================= q-point: ( 0.29 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.743 ( 7.487 -22.959 -6.632) 25.043 3.521 ( 9.047 -7.344 -12.485) 17.078 3.905 ( 1.612 -14.212 4.162) 14.896 4.038 ( -5.231 -6.671 6.853) 10.901 4.176 ( 4.796 -8.620 0.859) 9.901 4.925 ( -6.324 -9.321 -5.335) 12.463 5.235 ( 4.718 -2.843 -5.895) 8.068 5.940 ( -1.242 -18.508 -2.625) 18.735 6.181 ( 0.821 -3.734 -0.968) 3.943 6.403 ( 3.206 8.651 -0.987) 9.278 6.665 ( 4.066 -3.695 -0.067) 5.495 7.050 ( -0.364 -8.919 0.557) 8.943 7.379 ( -2.246 -13.839 -1.439) 14.094 7.601 ( -3.992 -14.364 -2.588) 15.132 7.695 ( 1.514 -18.768 11.670) 22.153 8.492 ( 0.997 -4.723 -0.305) 4.837 8.679 ( -4.088 -29.374 4.409) 29.983 9.013 ( -0.093 -8.386 -2.007) 8.624 9.285 ( 1.261 -6.851 6.989) 9.868 9.685 ( -3.729 -21.345 2.591) 21.822 10.394 ( 4.318 7.694 -0.880) 8.867 11.210 ( 0.471 36.046 3.818) 36.251 11.595 ( 3.407 7.817 3.739) 9.311 12.004 ( -7.591 15.013 -11.302) 20.267 12.275 ( -6.344 18.640 -1.526) 19.749 13.197 ( -4.384 3.398 0.257) 5.552 13.577 ( 4.303 5.996 -3.956) 8.374 13.742 ( 12.504 17.894 -1.824) 21.906 16.745 ( -13.339 -42.850 -1.706) 44.911 18.735 ( -5.715 -20.466 14.908) 25.957 20.358 ( 9.789 -8.559 1.831) 13.131 20.606 ( 5.865 -25.964 -3.373) 26.831 22.774 ( -19.519 -18.777 1.379) 27.119 23.844 ( 15.645 -8.860 -9.129) 20.164 27.203 ( 4.109 -2.479 5.101) 7.004 28.791 ( -9.961 17.946 -5.074) 21.143 ======================= Grid point 814 (385/429) ======================= q-point: ( 0.36 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.168 ( 4.448 -19.575 -7.536) 21.442 3.624 ( 4.791 -4.148 -14.670) 15.981 4.062 ( -5.167 -1.381 -3.269) 6.268 4.158 ( -2.781 -7.829 13.049) 15.470 4.370 ( 5.089 -9.631 3.492) 11.439 5.009 ( -13.140 -7.198 -7.591) 16.795 5.176 ( 3.499 9.767 1.702) 10.514 6.071 ( -7.028 1.069 1.748) 7.320 6.311 ( 8.812 -8.546 -1.133) 12.328 6.415 ( 4.080 -2.539 0.368) 4.820 6.723 ( 6.354 -2.051 -16.648) 17.937 7.116 ( -7.997 -4.511 15.704) 18.191 7.622 ( 2.141 -14.669 -6.530) 16.199 7.850 ( -0.063 -10.876 7.616) 13.278 8.218 ( 4.235 -22.987 5.889) 24.104 8.624 ( -1.891 -9.504 -2.749) 10.072 9.011 ( -3.404 -6.296 -0.267) 7.162 9.257 ( -5.641 -19.816 3.214) 20.853 9.617 ( 0.945 -24.808 2.593) 24.961 10.080 ( -9.059 -11.886 -0.341) 14.949 10.256 ( 10.331 -3.191 1.736) 10.951 10.677 ( 6.159 19.580 -0.955) 20.548 11.425 ( -0.430 13.009 3.883) 13.583 11.832 ( -1.165 -0.119 -2.620) 2.870 11.896 ( -2.047 17.439 -3.706) 17.945 13.112 ( -7.154 2.634 -2.559) 8.042 13.493 ( 5.193 6.509 -0.638) 8.351 13.526 ( 4.516 8.788 -3.282) 10.411 17.368 ( -12.494 -32.165 0.005) 34.506 18.922 ( -5.350 -3.122 6.150) 8.729 20.537 ( 10.797 -3.371 5.006) 12.369 21.049 ( 4.457 -17.834 -4.105) 18.835 23.040 ( -15.410 -19.057 2.579) 24.643 24.074 ( 12.338 -8.087 -6.817) 16.251 27.295 ( 4.337 -3.588 5.377) 7.784 28.414 ( -7.435 15.640 -5.678) 18.224 ======================= Grid point 815 (386/429) ======================= q-point: ( 0.43 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.482 ( 0.259 -13.887 -8.146) 16.102 3.713 ( 4.884 -5.431 -12.133) 14.162 3.961 ( -10.952 4.421 -4.379) 12.597 4.315 ( 0.406 -7.353 9.282) 11.848 4.598 ( 2.155 -10.885 6.661) 12.942 4.940 ( -2.062 10.255 8.107) 13.234 5.098 ( -4.765 -4.564 -10.495) 12.397 5.992 ( -10.689 1.665 -3.110) 11.256 6.318 ( 7.441 10.822 5.572) 14.267 6.511 ( 3.241 -3.563 4.201) 6.392 6.840 ( 4.189 -10.545 -20.461) 23.397 7.250 ( 0.621 -7.514 16.503) 18.143 7.893 ( 7.048 -11.728 -8.169) 15.936 8.013 ( -1.683 -5.027 8.856) 10.321 8.538 ( -1.442 -11.111 10.509) 15.361 8.726 ( -6.259 -2.951 -6.209) 9.297 9.072 ( -2.219 -4.414 -3.141) 5.854 9.481 ( -5.450 -5.547 -4.048) 8.767 9.914 ( 2.060 6.497 2.036) 7.113 10.145 ( 1.864 -23.493 7.432) 24.711 10.509 ( 3.017 3.274 -1.370) 4.658 10.785 ( 4.005 -26.535 -3.912) 27.120 11.258 ( -1.312 -1.066 5.251) 5.516 11.611 ( 2.228 11.766 -5.080) 13.008 11.888 ( 1.206 -3.861 2.132) 4.573 12.990 ( -7.309 5.195 -4.099) 9.860 13.386 ( 3.807 5.133 1.347) 6.531 13.458 ( 0.340 2.013 -3.747) 4.267 17.829 ( -9.586 -24.271 1.281) 26.127 18.878 ( -3.295 4.869 1.490) 6.065 20.623 ( 8.234 0.630 3.803) 9.092 21.309 ( 2.839 -8.826 -2.883) 9.709 23.294 ( -10.126 -14.828 2.379) 18.113 24.243 ( 8.488 -4.447 -4.531) 10.599 27.400 ( 4.041 -3.939 5.148) 7.639 28.105 ( -5.161 12.443 -5.466) 14.538 ======================= Grid point 816 (387/429) ======================= q-point: ( 0.50 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.648 ( -2.195 -5.618 -9.124) 10.937 3.817 ( -0.116 -0.479 0.311) 0.583 3.862 ( -4.346 -6.149 -7.110) 10.356 4.465 ( 1.357 -6.209 7.682) 9.970 4.731 ( -1.764 5.671 -0.422) 5.954 4.840 ( 2.524 -5.972 10.237) 12.117 5.134 ( -2.625 -2.318 -7.379) 8.168 5.872 ( -15.700 1.711 -5.831) 16.835 6.175 ( 11.674 9.248 6.819) 16.380 6.572 ( 2.179 -0.650 3.261) 3.976 7.012 ( 2.470 -7.477 -11.350) 13.814 7.399 ( 2.933 -3.486 8.776) 9.888 8.057 ( -4.904 -0.709 8.060) 9.461 8.087 ( 8.155 -5.682 -6.155) 11.691 8.639 ( -3.221 0.564 -3.131) 4.527 8.748 ( -2.905 -5.466 6.904) 9.272 9.167 ( -0.463 -7.697 -5.131) 9.262 9.434 ( -6.348 4.701 -2.917) 8.421 9.863 ( 3.724 1.976 0.932) 4.317 10.474 ( 0.545 -10.918 6.071) 12.504 10.494 ( 1.465 1.893 1.012) 2.599 11.093 ( 4.018 -7.630 -9.083) 12.524 11.344 ( -1.468 2.638 5.384) 6.172 11.639 ( 0.627 -16.370 -1.840) 16.485 11.960 ( 1.919 -2.004 2.336) 3.627 12.857 ( -4.200 3.548 -2.666) 6.110 13.357 ( 0.820 -0.021 0.613) 1.024 13.418 ( 0.068 1.963 -2.051) 2.840 18.190 ( -6.010 -19.103 1.754) 20.103 18.735 ( -0.397 8.928 -0.688) 8.963 20.631 ( 4.207 2.548 1.983) 5.303 21.422 ( 1.231 -3.048 -1.513) 3.619 23.478 ( -4.819 -8.860 1.357) 10.177 24.319 ( 4.293 -0.551 -2.300) 4.902 27.500 ( 3.109 -3.157 4.217) 6.117 27.877 ( -3.334 7.840 -4.403) 9.590 ======================= Grid point 817 (388/429) ======================= q-point: (-0.43 0.07 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.690 ( -2.771 -3.949 -4.293) 6.457 3.792 ( -5.404 1.505 4.801) 7.384 4.002 ( 7.365 -5.479 -2.142) 9.426 4.547 ( -0.236 4.060 3.660) 5.471 4.629 ( 1.073 -1.523 -2.021) 2.749 4.936 ( 0.308 2.169 -0.394) 2.225 5.150 ( -0.267 -3.351 2.088) 3.957 5.787 ( -14.238 -4.078 -6.114) 16.023 6.147 ( 13.158 2.748 5.560) 14.546 6.572 ( 0.769 1.768 -0.233) 1.942 7.080 ( -0.098 -0.586 -4.005) 4.048 7.417 ( 0.266 3.659 1.253) 3.876 8.034 ( -6.027 1.321 7.146) 9.441 8.184 ( 7.461 -0.617 0.853) 7.535 8.623 ( 0.110 -1.919 -12.149) 12.300 8.808 ( 1.144 -0.226 4.241) 4.398 9.290 ( -0.571 4.832 2.773) 5.600 9.355 ( -3.157 -11.787 -0.884) 12.234 9.829 ( 0.288 3.789 -0.078) 3.801 10.425 ( 0.427 5.633 -4.145) 7.007 10.668 ( 1.799 -6.473 5.443) 8.647 11.037 ( -1.704 6.482 0.678) 6.736 11.371 ( -1.567 -1.077 -3.144) 3.675 11.813 ( -1.395 0.900 1.005) 1.941 11.985 ( 1.810 0.567 -0.192) 1.906 12.837 ( 0.267 -3.198 0.149) 3.213 13.377 ( 0.182 2.112 -1.034) 2.359 13.387 ( 0.330 -2.339 1.131) 2.619 18.490 ( -2.415 -14.635 1.677) 14.927 18.548 ( 2.639 10.747 -1.680) 11.193 20.590 ( -0.158 3.121 0.124) 3.127 21.445 ( -0.279 0.558 -0.172) 0.648 23.577 ( 0.445 -3.013 -0.112) 3.047 24.309 ( -0.262 2.488 0.104) 2.504 27.523 ( 0.072 3.272 0.112) 3.274 27.809 ( -0.105 -3.360 -0.112) 3.363 ======================= Grid point 818 (389/429) ======================= q-point: (-0.36 0.07 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.687 ( -2.660 6.797 1.962) 7.558 3.761 ( -2.920 -2.541 6.828) 7.849 4.128 ( 9.779 -2.557 5.004) 11.279 4.404 ( 0.914 8.461 -4.883) 9.811 4.673 ( -3.226 2.655 -9.852) 10.701 4.832 ( 3.300 1.856 2.060) 4.311 5.248 ( 2.525 -3.701 7.922) 9.101 5.819 ( -12.789 -7.463 -8.340) 16.994 6.233 ( 10.768 -2.642 5.226) 12.257 6.520 ( -0.333 3.254 -3.440) 4.747 7.040 ( -0.903 4.247 7.516) 8.680 7.290 ( -0.956 7.660 -9.462) 12.212 7.950 ( -5.504 5.607 4.602) 9.106 8.195 ( 4.968 4.146 7.291) 9.749 8.604 ( -0.385 2.883 -16.394) 16.650 8.871 ( 8.892 -4.327 0.724) 9.915 9.198 ( 0.345 5.240 5.401) 7.533 9.599 ( 0.411 -11.535 4.653) 12.445 9.720 ( -6.283 4.895 -1.171) 8.050 10.279 ( -0.577 8.726 -9.628) 13.006 10.632 ( 2.400 10.440 5.474) 12.030 11.042 ( -5.716 -4.239 7.268) 10.172 11.280 ( -0.682 6.062 -8.640) 10.576 11.584 ( -4.921 18.833 1.463) 19.520 11.988 ( 4.478 0.321 -0.100) 4.491 12.963 ( 2.601 -8.252 1.764) 8.831 13.333 ( -0.569 2.352 -0.504) 2.471 13.439 ( 0.596 -2.313 1.803) 2.993 18.321 ( 5.627 14.864 -1.151) 15.935 18.747 ( 0.271 -11.962 0.385) 11.972 20.517 ( -4.026 3.274 -1.482) 5.397 21.399 ( -1.436 4.106 0.911) 4.444 23.595 ( 5.874 2.832 -1.775) 6.758 24.224 ( -5.145 5.308 2.558) 7.822 27.420 ( -1.710 5.663 -2.237) 6.324 27.962 ( 1.829 -10.923 2.378) 11.327 ======================= Grid point 819 (390/429) ======================= q-point: (-0.29 0.07 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.485 ( -2.895 13.816 3.905) 14.646 3.757 ( 0.359 4.293 11.075) 11.883 4.204 ( 4.445 2.471 6.090) 7.934 4.260 ( 3.744 5.195 -9.704) 11.627 4.453 ( -4.778 11.293 -8.480) 14.909 4.970 ( 1.887 -9.641 0.733) 9.851 5.330 ( 9.247 -0.049 9.777) 13.457 5.860 ( -13.098 -6.593 -9.744) 17.606 6.315 ( 3.263 0.493 1.709) 3.716 6.446 ( -0.199 3.707 -3.375) 5.017 6.922 ( -2.442 11.415 20.202) 23.332 7.177 ( 4.112 -0.072 -18.513) 18.964 7.781 ( -3.960 9.694 0.618) 10.490 8.113 ( 3.736 8.600 8.885) 12.917 8.464 ( 0.251 8.738 -11.372) 14.344 8.916 ( 8.454 12.373 1.161) 15.031 9.106 ( 0.017 4.187 -0.031) 4.187 9.632 ( 3.461 4.764 3.074) 6.642 9.774 ( -11.310 -12.145 1.325) 16.648 10.023 ( 1.981 17.284 -8.462) 19.346 10.459 ( -4.314 6.762 4.350) 9.124 10.794 ( 1.931 30.949 2.175) 31.085 11.236 ( 1.849 -5.376 -6.560) 8.681 11.417 ( -11.566 -9.191 2.732) 15.023 12.043 ( 8.382 -2.773 1.598) 8.972 13.150 ( 3.064 -8.839 2.196) 9.609 13.281 ( -2.996 1.703 -1.298) 3.683 13.481 ( 0.142 -1.571 2.452) 2.916 18.033 ( 7.359 20.266 -0.262) 21.562 18.930 ( 1.901 -6.311 -1.339) 6.726 20.418 ( -6.322 3.720 -2.406) 7.720 21.265 ( -2.042 9.838 1.557) 10.167 23.529 ( 11.230 8.901 -3.336) 14.713 24.058 ( -9.976 8.511 4.800) 13.964 27.302 ( -1.969 5.253 -2.409) 6.106 28.226 ( 2.610 -15.294 2.575) 15.728 ======================= Grid point 820 (391/429) ======================= q-point: (-0.21 0.07 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.148 ( -1.461 21.350 3.578) 21.697 3.644 ( -1.432 9.578 8.756) 13.055 4.096 ( 2.045 7.184 -8.443) 11.273 4.150 ( -1.187 9.944 -2.763) 10.388 4.284 ( -0.629 4.506 2.149) 5.031 5.073 ( -2.338 1.022 1.187) 2.815 5.402 ( 11.978 2.424 7.676) 14.432 5.926 ( -10.420 -12.261 -6.967) 17.534 6.241 ( 0.526 8.981 -1.224) 9.080 6.358 ( -0.325 5.119 -1.133) 5.253 6.711 ( -2.927 9.681 8.494) 13.208 7.212 ( 3.812 0.517 -3.860) 5.450 7.576 ( -0.706 9.539 -4.145) 10.424 7.945 ( 0.189 13.993 5.733) 15.124 8.216 ( 11.239 20.719 -0.655) 23.580 8.551 ( -8.449 17.545 -3.500) 19.785 9.044 ( 0.467 4.751 -0.380) 4.789 9.368 ( 4.345 21.608 -2.494) 22.181 9.559 ( -1.754 27.557 -1.164) 27.637 10.029 ( -6.480 6.782 0.320) 9.385 10.283 ( 6.756 0.687 1.036) 6.870 10.540 ( -5.594 -17.854 0.312) 18.713 11.399 ( -0.164 -7.036 -2.840) 7.590 11.657 ( -5.377 -21.501 1.325) 22.202 12.223 ( 10.166 -11.009 2.908) 15.265 13.218 ( -1.189 1.620 -1.584) 2.558 13.339 ( -2.032 -8.857 1.147) 9.159 13.518 ( -0.837 -2.589 2.438) 3.653 17.618 ( 7.027 29.365 0.784) 30.205 18.965 ( 1.707 4.462 -3.813) 6.113 20.303 ( -5.656 4.176 -2.021) 7.316 20.991 ( -2.100 19.014 1.729) 19.208 23.383 ( 15.222 13.693 -4.286) 20.918 23.814 ( -13.666 11.117 6.360) 18.730 27.197 ( -1.652 4.303 -1.971) 5.013 28.568 ( 2.988 -18.818 2.036) 19.162 ======================= Grid point 821 (392/429) ======================= q-point: (-0.14 0.07 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( -0.562 25.599 1.954) 25.680 3.402 ( -3.489 17.209 2.245) 17.702 3.860 ( -0.129 15.822 -1.263) 15.872 4.014 ( -1.040 4.267 -2.338) 4.975 4.160 ( 0.505 10.423 1.086) 10.491 4.946 ( -1.176 9.587 0.699) 9.684 5.321 ( 2.102 10.262 3.447) 11.028 5.964 ( 0.162 20.109 0.432) 20.115 6.211 ( 5.072 -7.768 -2.503) 9.609 6.275 ( -6.843 -9.305 0.691) 11.572 6.604 ( -1.293 1.871 1.004) 2.486 7.039 ( -0.601 24.062 0.175) 24.070 7.337 ( -0.769 14.663 -1.887) 14.804 7.631 ( 0.316 8.550 -2.070) 8.803 8.003 ( 17.065 11.176 7.466) 21.722 8.263 ( -14.156 10.192 -4.945) 18.131 8.751 ( 1.862 25.321 -1.849) 25.456 9.050 ( 1.578 12.402 1.563) 12.600 9.180 ( -2.464 6.397 -2.753) 7.387 9.694 ( -0.319 19.481 -0.706) 19.496 10.366 ( 0.018 -3.746 0.862) 3.844 11.179 ( -0.387 -40.460 -1.006) 40.474 11.507 ( -1.404 -9.263 -0.657) 9.392 12.084 ( -0.214 -24.077 1.431) 24.121 12.575 ( 8.307 -19.410 2.282) 21.236 13.195 ( -2.880 -1.311 -2.421) 3.984 13.474 ( -2.347 -6.420 1.401) 6.978 13.603 ( -1.683 -7.587 1.279) 7.876 16.983 ( 4.070 42.855 0.993) 43.059 18.712 ( 0.423 23.659 -4.775) 24.140 20.207 ( -2.181 3.135 -0.339) 3.834 20.531 ( -1.642 28.760 1.133) 28.829 23.183 ( 13.420 15.607 -3.224) 20.834 23.539 ( -12.284 10.357 5.270) 16.910 27.120 ( -0.924 2.713 -1.112) 3.074 28.961 ( 2.353 -20.873 1.024) 21.030 ======================= Grid point 822 (393/429) ======================= q-point: (-0.07 0.07 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 399 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( -0.000 23.434 0.000) 23.434 2.886 ( -0.000 36.663 0.000) 36.663 3.651 ( -0.000 4.251 0.000) 4.251 3.804 ( 0.000 22.239 0.000) 22.239 3.985 ( 0.000 4.141 0.000) 4.141 4.756 ( -0.000 10.114 0.000) 10.114 5.137 ( 0.000 8.803 0.000) 8.803 5.539 ( 0.000 23.526 -0.000) 23.526 6.043 ( -0.000 17.617 0.000) 17.617 6.505 ( 0.000 20.431 -0.000) 20.431 6.559 ( -0.000 -0.828 -0.000) 0.828 6.768 ( 0.000 -27.695 -0.000) 27.695 7.174 ( 0.000 4.933 0.000) 4.933 7.589 ( -0.000 -1.379 0.000) 1.379 7.866 ( -0.000 21.980 0.000) 21.980 7.919 ( -0.000 7.566 0.000) 7.566 8.463 ( -0.000 6.432 0.000) 6.432 8.908 ( 0.000 3.443 0.000) 3.443 9.093 ( -0.000 7.772 0.000) 7.772 9.323 ( -0.000 16.622 0.000) 16.622 10.442 ( 0.000 -4.144 0.000) 4.144 11.535 ( -0.000 -7.218 0.000) 7.218 12.101 ( -0.000 -42.779 0.000) 42.779 12.520 ( -0.000 -19.661 0.000) 19.661 13.048 ( -0.000 -30.183 0.000) 30.183 13.247 ( 0.000 -6.370 0.000) 6.370 13.568 ( 0.000 -4.758 0.000) 4.758 13.807 ( 0.000 -14.929 0.000) 14.929 16.056 ( -0.000 56.645 0.000) 56.645 18.037 ( -0.000 48.220 0.000) 48.220 19.945 ( -0.000 31.458 0.000) 31.458 20.161 ( -0.000 1.421 0.000) 1.421 22.941 ( -0.000 13.585 0.000) 13.585 23.348 ( 0.000 6.372 0.000) 6.372 27.081 ( -0.000 1.086 0.000) 1.086 29.354 ( 0.000 -19.377 0.000) 19.377 ======================= Grid point 826 (394/429) ======================= q-point: ( 0.14 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.877 ( 12.896 -0.000 -4.722) 13.733 2.319 ( 39.525 -0.000 -5.505) 39.907 3.055 ( -0.463 0.000 2.711) 2.750 3.858 ( -5.678 0.000 7.702) 9.568 4.007 ( 14.753 -0.000 3.562) 15.177 4.394 ( -1.076 0.000 0.377) 1.140 4.927 ( 1.369 -0.000 -15.215) 15.276 5.028 ( 5.504 -0.000 -15.858) 16.786 5.487 ( -0.257 0.000 -0.705) 0.751 6.290 ( -0.311 0.000 0.175) 0.356 6.525 ( -0.686 0.000 -2.328) 2.427 7.156 ( 0.216 -0.000 19.021) 19.022 7.345 ( -2.117 0.000 0.142) 2.122 7.467 ( -12.881 0.000 -9.763) 16.163 7.745 ( 1.032 -0.000 -2.612) 2.809 7.896 ( 1.443 -0.000 2.674) 3.038 7.968 ( -0.033 0.000 -3.062) 3.062 8.690 ( 0.039 -0.000 2.311) 2.311 8.931 ( 2.641 -0.000 6.477) 6.995 9.310 ( 2.321 -0.000 12.171) 12.390 10.544 ( 3.078 -0.000 -3.311) 4.521 11.860 ( 12.131 -0.000 -3.488) 12.623 12.580 ( -18.214 0.000 -1.933) 18.316 13.063 ( -28.337 0.000 3.586) 28.563 13.216 ( 0.995 -0.000 -2.008) 2.241 13.737 ( -10.276 0.000 -0.643) 10.296 13.982 ( -0.846 0.000 -0.070) 0.849 14.333 ( 18.466 -0.000 -0.917) 18.489 15.424 ( 24.339 -0.000 5.282) 24.906 15.950 ( -0.338 0.000 -0.045) 0.341 19.221 ( 0.025 -0.000 -0.001) 0.025 20.139 ( 0.030 -0.000 0.031) 0.044 22.319 ( -19.088 0.000 -4.143) 19.533 23.509 ( 18.720 -0.000 -11.377) 21.906 27.127 ( 3.357 -0.000 4.399) 5.534 29.581 ( -15.889 0.000 -1.711) 15.981 ======================= Grid point 827 (395/429) ======================= q-point: ( 0.21 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( 15.347 -10.475 -5.860) 19.483 2.750 ( 31.346 -22.715 -5.917) 39.161 3.307 ( 0.414 -21.579 -0.240) 21.584 3.813 ( -5.263 1.486 6.542) 8.526 4.018 ( 10.691 3.293 7.459) 13.445 4.550 ( 0.919 -11.095 -3.819) 11.770 4.978 ( 3.425 -5.676 -9.913) 11.925 5.171 ( 7.349 -15.823 -18.224) 25.228 5.643 ( -0.891 -15.999 -1.165) 16.066 6.320 ( -0.354 -3.763 0.588) 3.826 6.551 ( 1.707 -3.746 -3.258) 5.250 7.218 ( 0.484 -1.664 20.119) 20.193 7.241 ( -12.719 8.166 -3.670) 15.554 7.381 ( -0.634 13.557 -0.550) 13.583 7.530 ( -2.509 1.380 -2.237) 3.633 7.841 ( 2.473 -8.697 -0.399) 9.050 8.312 ( -0.835 -12.534 -2.744) 12.858 8.768 ( -4.241 -8.344 -1.342) 9.456 9.000 ( 4.535 -5.884 9.433) 12.007 9.326 ( 0.066 1.526 12.319) 12.413 10.549 ( 5.066 1.340 -1.955) 5.593 11.844 ( 11.593 7.862 -3.269) 14.384 12.343 ( -26.786 13.501 1.962) 30.060 12.784 ( -19.376 12.525 -0.861) 23.088 12.915 ( 1.179 25.265 -0.561) 25.299 13.463 ( -4.177 9.234 -4.499) 11.088 14.015 ( 10.894 15.716 0.469) 19.128 14.761 ( 23.443 15.610 -14.196) 31.540 14.909 ( -1.361 -23.710 6.002) 24.496 17.008 ( -3.601 -66.135 18.275) 68.708 19.466 ( 4.028 -23.749 -4.209) 24.453 20.169 ( 1.035 -3.347 1.416) 3.778 22.267 ( -18.265 -6.603 -4.220) 19.875 23.618 ( 17.726 -2.829 -11.771) 21.465 27.158 ( 4.046 -0.263 5.269) 6.648 29.378 ( -17.026 10.348 -3.350) 20.203 ======================= Grid point 828 (396/429) ======================= q-point: ( 0.29 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.405 ( 15.620 -17.823 -6.626) 24.608 3.327 ( 16.226 -20.430 -9.363) 27.719 3.660 ( 1.272 -13.702 -2.506) 13.987 3.846 ( -5.814 -8.603 4.683) 11.391 4.092 ( 6.896 -3.804 9.621) 12.433 4.719 ( -3.725 -8.424 -5.780) 10.874 5.141 ( 11.493 -9.076 -10.929) 18.273 5.556 ( 2.910 -21.306 -7.584) 22.802 5.974 ( -2.071 -16.841 -1.736) 17.057 6.439 ( -2.635 -7.651 0.532) 8.110 6.661 ( 4.486 -1.729 -5.710) 7.465 6.960 ( 5.154 4.936 6.948) 9.960 7.199 ( -5.118 -0.822 -7.067) 8.764 7.375 ( -2.367 -6.368 7.012) 9.763 7.530 ( -2.873 -3.929 10.039) 11.157 8.157 ( -3.200 -22.364 3.817) 22.912 8.433 ( 2.765 -3.796 -3.395) 5.794 8.872 ( -4.103 -6.339 -2.213) 7.869 9.246 ( 2.739 -8.377 7.882) 11.824 9.331 ( -5.221 -7.542 8.599) 12.573 10.537 ( 6.759 4.021 0.162) 7.866 11.706 ( 5.972 12.939 0.598) 14.263 11.845 ( -18.894 20.985 6.897) 29.067 12.324 ( -5.894 26.374 -14.519) 30.678 12.549 ( -3.464 13.887 0.082) 14.313 13.284 ( -2.696 7.571 -2.052) 8.295 13.769 ( 7.400 13.236 -2.534) 15.374 14.278 ( 20.010 30.109 -4.522) 36.434 15.777 ( -11.845 -50.958 -1.684) 52.343 18.108 ( -8.107 -47.146 23.532) 53.313 20.026 ( 9.784 -29.895 -11.250) 33.406 20.307 ( 3.790 -9.828 6.830) 12.554 22.347 ( -18.281 -13.817 -2.512) 23.052 23.775 ( 15.886 -5.993 -10.580) 20.005 27.206 ( 4.672 -1.119 6.004) 7.690 29.028 ( -15.046 15.395 -5.475) 22.212 ======================= Grid point 829 (397/429) ======================= q-point: ( 0.36 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.832 ( 12.658 -19.276 -7.026) 24.107 3.559 ( 6.737 -3.976 -15.773) 17.606 3.929 ( -0.319 -12.487 2.296) 12.701 3.997 ( -5.966 -8.369 7.693) 12.838 4.248 ( 5.861 -7.250 4.612) 10.401 4.792 ( -11.383 -5.838 -7.543) 14.851 5.315 ( 10.191 -0.368 -1.809) 10.357 5.902 ( -3.828 -14.944 -3.684) 15.860 6.173 ( -0.683 -7.164 -5.754) 9.214 6.426 ( 2.604 2.233 -1.349) 3.686 6.720 ( 5.353 -3.951 1.546) 6.830 7.045 ( -1.088 -0.969 0.724) 1.627 7.318 ( -2.530 -14.139 -7.005) 15.981 7.636 ( 6.101 -17.611 6.355) 19.691 7.783 ( 5.295 -22.529 13.235) 26.660 8.443 ( -8.529 -8.881 1.113) 12.364 8.673 ( 0.663 -21.453 0.574) 21.471 8.998 ( -1.584 -9.549 -2.702) 10.050 9.304 ( -2.814 -6.587 7.167) 10.133 9.641 ( -4.928 -20.535 2.098) 21.222 10.450 ( 4.677 8.989 1.890) 10.308 11.235 ( 1.463 31.784 4.119) 32.083 11.630 ( -1.580 5.470 6.363) 8.539 11.842 ( -9.239 14.493 -16.036) 23.507 12.258 ( 2.590 16.837 -1.050) 17.067 13.142 ( -4.521 5.239 -1.213) 7.025 13.603 ( 3.364 7.392 -4.577) 9.322 13.880 ( 11.985 21.414 -1.149) 24.566 16.588 ( -13.150 -42.996 -0.664) 44.967 18.709 ( -8.008 -19.369 13.842) 25.118 20.485 ( 10.931 -11.480 1.444) 15.917 20.664 ( 5.835 -24.002 -2.119) 24.792 22.568 ( -16.909 -20.340 0.088) 26.451 23.977 ( 13.229 -8.161 -8.157) 17.555 27.277 ( 5.087 -2.338 6.460) 8.549 28.644 ( -11.623 15.609 -6.707) 20.585 ======================= Grid point 830 (398/429) ======================= q-point: ( 0.43 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.204 ( 6.661 -15.302 -7.124) 18.146 3.628 ( 5.432 -3.985 -15.196) 16.623 3.978 ( -7.966 2.511 -1.199) 8.438 4.174 ( -2.218 -9.416 9.748) 13.733 4.444 ( 5.347 -8.955 4.265) 11.268 4.836 ( -12.024 -8.619 -5.837) 15.904 5.230 ( 3.358 11.546 3.661) 12.570 5.940 ( -14.425 0.773 -3.649) 14.899 6.393 ( 5.821 -13.101 -3.506) 14.759 6.473 ( 5.993 -0.816 1.351) 6.197 6.737 ( 5.880 2.753 -13.924) 15.363 7.127 ( 0.001 -8.377 15.768) 17.855 7.627 ( 4.124 -17.797 -7.196) 19.635 7.922 ( 4.474 -8.948 13.759) 17.012 8.283 ( 2.671 -17.874 5.194) 18.804 8.573 ( -3.846 -9.034 -4.980) 11.009 8.954 ( -5.594 -7.950 -2.085) 9.943 9.216 ( -3.391 -16.763 2.372) 17.266 9.621 ( -2.022 -25.869 1.619) 25.999 9.986 ( -7.236 -11.716 0.663) 13.786 10.368 ( 7.364 -6.767 3.529) 10.606 10.739 ( 5.058 20.595 -0.782) 21.221 11.430 ( -0.391 14.594 1.235) 14.651 11.684 ( -12.556 -1.224 -3.039) 12.977 12.001 ( 11.966 12.291 -1.402) 17.211 13.021 ( -6.873 4.160 -2.813) 8.513 13.505 ( 1.291 3.792 -4.609) 6.107 13.600 ( 6.535 14.218 0.506) 15.656 17.233 ( -11.120 -33.537 0.728) 35.340 18.879 ( -5.773 -3.336 5.203) 8.457 20.675 ( 9.723 -2.454 5.180) 11.287 21.084 ( 4.321 -16.963 -4.352) 18.037 22.887 ( -12.702 -21.508 1.658) 25.034 24.178 ( 9.900 -7.004 -5.591) 13.354 27.371 ( 5.104 -3.144 6.450) 8.806 28.301 ( -8.259 13.551 -6.850) 17.284 ======================= Grid point 831 (399/429) ======================= q-point: ( 0.50 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.455 ( 0.651 -11.314 -7.788) 13.751 3.723 ( 4.239 -5.192 -15.154) 16.570 3.831 ( -10.307 4.485 3.229) 11.695 4.352 ( 1.003 -8.406 5.983) 10.366 4.639 ( 2.047 -8.226 4.465) 9.581 4.944 ( -3.923 -4.306 6.907) 9.036 5.031 ( -0.575 6.509 -4.704) 8.052 5.806 ( -17.033 2.231 -6.694) 18.437 6.431 ( 7.784 9.061 5.054) 12.970 6.568 ( 3.138 -2.730 6.281) 7.533 6.819 ( 4.593 -10.920 -18.279) 21.782 7.339 ( 5.494 -7.647 11.830) 15.120 7.937 ( 4.942 -12.201 -2.626) 13.424 8.063 ( 3.555 -1.637 8.804) 9.635 8.544 ( -5.095 -12.348 10.604) 17.055 8.632 ( -4.812 -0.851 -9.080) 10.312 9.024 ( -2.985 -5.413 -6.404) 8.900 9.415 ( -3.733 -4.450 -2.702) 6.406 9.946 ( 1.626 4.452 3.994) 6.198 10.151 ( -3.636 -24.814 3.440) 25.314 10.551 ( 3.832 1.000 1.393) 4.198 10.826 ( 5.153 -21.390 -3.469) 22.274 11.254 ( -2.048 -2.838 3.049) 4.641 11.573 ( -3.703 6.479 -4.134) 8.531 11.962 ( 8.063 0.564 2.567) 8.481 12.895 ( -6.585 4.235 -3.697) 8.659 13.425 ( 2.659 6.842 -0.435) 7.353 13.451 ( 0.382 2.328 -2.082) 3.146 17.734 ( -7.832 -25.958 1.469) 27.154 18.846 ( -3.071 3.826 1.112) 5.030 20.723 ( 6.729 2.666 3.454) 8.020 21.328 ( 2.337 -8.211 -2.835) 8.996 23.200 ( -7.666 -17.147 1.662) 18.856 24.313 ( 6.396 -3.106 -3.497) 7.924 27.471 ( 4.637 -3.182 6.003) 8.226 28.021 ( -5.692 10.812 -6.315) 13.754 ======================= Grid point 832 (400/429) ======================= q-point: ( 0.57 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.582 ( -2.818 -3.859 -9.965) 11.052 3.741 ( -8.272 -4.299 3.230) 9.867 3.880 ( 5.223 -7.718 -5.301) 10.721 4.507 ( 1.743 -5.848 5.049) 7.921 4.718 ( -0.451 3.801 0.909) 3.934 4.904 ( 2.288 -1.220 7.933) 8.346 5.084 ( -1.786 -5.116 -4.178) 6.842 5.663 ( -16.316 0.654 -6.391) 17.535 6.329 ( 11.075 7.467 5.700) 14.522 6.605 ( 1.298 0.638 2.674) 3.040 6.997 ( 1.983 -7.247 -10.663) 13.044 7.467 ( 3.782 -0.719 6.313) 7.394 8.036 ( -4.227 0.842 10.358) 11.219 8.174 ( 9.064 -5.489 -2.737) 10.944 8.574 ( -2.866 0.438 -11.799) 12.150 8.753 ( -2.826 -8.712 12.249) 15.295 9.119 ( -3.430 -8.300 -9.654) 13.186 9.375 ( -2.926 4.132 0.796) 5.126 9.907 ( 3.092 3.022 2.620) 5.055 10.388 ( -6.939 -9.148 -4.551) 12.351 10.628 ( 8.570 2.245 10.956) 14.090 11.091 ( 1.275 -12.061 -9.362) 15.321 11.339 ( -1.680 7.247 3.240) 8.114 11.631 ( -0.927 -17.618 -0.813) 17.661 12.000 ( 3.137 -0.054 1.929) 3.683 12.806 ( -2.991 0.797 -2.023) 3.698 13.367 ( 0.721 0.619 0.087) 0.954 13.412 ( 0.060 1.762 -1.306) 2.194 18.136 ( -4.495 -20.724 1.515) 21.259 18.728 ( -0.356 7.412 -0.622) 7.447 20.680 ( 3.130 4.980 1.657) 6.111 21.428 ( 0.769 -2.532 -1.368) 2.979 23.436 ( -3.257 -11.057 0.906) 11.563 24.353 ( 2.992 1.065 -1.650) 3.579 27.555 ( 3.621 -1.457 4.970) 6.319 27.818 ( -3.830 5.858 -5.122) 8.673 ======================= Grid point 833 (401/429) ======================= q-point: (-0.36 0.14 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.637 ( -3.381 -6.677 -3.145) 8.118 3.754 ( -3.596 1.247 2.521) 4.566 4.076 ( 6.103 -8.806 -1.406) 10.806 4.564 ( -0.238 5.892 7.037) 9.181 4.630 ( 1.355 -0.734 -5.276) 5.497 4.940 ( 0.539 3.035 -0.499) 3.122 5.161 ( 0.398 -5.602 3.886) 6.830 5.610 ( -12.369 -5.079 -5.974) 14.645 6.310 ( 11.760 2.739 5.270) 13.175 6.573 ( -0.579 2.919 -1.285) 3.242 7.060 ( -0.368 -1.163 -4.582) 4.741 7.426 ( 0.334 6.753 1.197) 6.866 8.002 ( -4.034 1.999 6.282) 7.729 8.277 ( 5.980 -0.152 7.368) 9.491 8.563 ( -0.854 -2.542 -17.074) 17.283 8.854 ( 4.631 -1.537 3.420) 5.959 9.252 ( -9.472 -6.073 5.378) 12.471 9.337 ( 2.140 -5.278 -3.501) 6.685 9.838 ( 0.957 6.192 0.665) 6.300 10.412 ( 0.344 4.689 -4.509) 6.514 10.716 ( 2.194 -7.658 6.291) 10.151 11.015 ( -2.190 12.592 0.548) 12.793 11.337 ( -1.787 -2.266 -3.777) 4.753 11.796 ( -1.964 2.025 0.760) 2.921 12.010 ( 2.364 0.240 0.066) 2.377 12.840 ( 0.233 -5.327 0.158) 5.334 13.376 ( 0.224 2.074 -0.698) 2.200 13.395 ( 0.428 -2.620 0.822) 2.779 18.472 ( -1.714 -16.779 1.236) 16.912 18.570 ( 1.995 9.755 -1.240) 10.034 20.589 ( -0.197 5.642 0.156) 5.647 21.440 ( -0.348 1.003 -0.215) 1.083 23.583 ( 0.558 -5.474 -0.141) 5.504 24.306 ( -0.332 4.534 0.132) 4.548 27.524 ( 0.091 5.967 0.141) 5.969 27.807 ( -0.132 -6.125 -0.141) 6.128 ======================= Grid point 834 (402/429) ======================= q-point: (-0.29 0.14 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.662 ( -2.368 6.908 1.551) 7.465 3.756 ( -1.285 -5.790 2.864) 6.586 4.236 ( 6.111 -4.056 2.894) 7.885 4.410 ( 1.473 9.833 0.440) 9.952 4.602 ( -2.934 6.297 -8.545) 11.013 4.873 ( 2.321 -0.214 1.698) 2.884 5.310 ( 3.397 -7.260 7.276) 10.825 5.653 ( -10.355 -6.234 -7.696) 14.329 6.359 ( 7.976 0.374 4.868) 9.351 6.498 ( -1.504 3.349 -3.887) 5.346 7.059 ( 0.023 0.257 5.338) 5.345 7.248 ( -0.865 10.456 -6.973) 12.597 7.916 ( -2.882 6.230 2.760) 7.398 8.275 ( 2.951 4.706 10.042) 11.476 8.535 ( -1.280 2.402 -14.175) 14.434 8.977 ( 9.535 -7.034 -3.548) 12.368 9.238 ( 2.417 4.233 10.062) 11.181 9.508 ( -12.565 -8.576 -4.101) 15.756 9.718 ( 2.327 3.946 2.057) 5.022 10.262 ( 1.718 10.282 -5.340) 11.712 10.667 ( 0.755 13.441 4.109) 14.075 10.998 ( -4.990 -9.544 3.074) 11.200 11.257 ( 1.017 7.022 -4.877) 8.609 11.535 ( -3.886 21.755 0.693) 22.110 12.037 ( 3.403 -1.550 0.317) 3.752 12.987 ( 0.911 -9.057 0.772) 9.136 13.328 ( -0.171 3.081 -0.167) 3.091 13.451 ( 0.527 -2.430 1.005) 2.682 18.370 ( 3.300 13.155 -0.582) 13.575 18.751 ( 0.146 -12.910 0.175) 12.912 20.475 ( -2.385 5.462 -0.808) 6.014 21.388 ( -0.877 4.440 0.453) 4.548 23.647 ( 3.948 -0.158 -1.241) 4.141 24.181 ( -3.491 7.873 1.680) 8.774 27.399 ( -0.876 6.350 -1.130) 6.509 27.984 ( 0.931 -11.793 1.207) 11.891 ======================= Grid point 835 (403/429) ======================= q-point: (-0.21 0.14 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.470 ( -1.256 13.210 1.333) 13.337 3.793 ( 0.360 3.196 4.692) 5.688 4.232 ( 1.242 9.077 -2.086) 9.396 4.302 ( 3.703 1.475 2.561) 4.738 4.374 ( -3.852 10.683 -5.636) 12.678 4.988 ( 0.710 -7.668 0.517) 7.718 5.486 ( 11.469 -4.545 10.564) 16.242 5.670 ( -13.202 -5.296 -10.619) 17.751 6.347 ( 1.271 4.090 0.761) 4.350 6.436 ( 0.017 2.947 -1.560) 3.335 6.960 ( -0.967 14.131 9.582) 17.101 7.158 ( 1.729 -4.773 -8.888) 10.236 7.752 ( -1.298 9.823 -0.028) 9.909 8.171 ( 1.177 9.178 5.434) 10.731 8.435 ( 0.357 5.264 -5.712) 7.776 9.008 ( 6.214 22.435 -0.242) 23.281 9.097 ( -1.528 3.072 0.408) 3.455 9.628 ( -4.433 -17.462 -0.002) 18.016 9.701 ( -0.786 6.123 1.269) 6.302 10.028 ( 1.740 14.530 -3.020) 14.942 10.431 ( -2.119 10.336 1.988) 10.737 10.819 ( 1.036 31.064 0.784) 31.091 11.250 ( 4.899 -7.920 -5.281) 10.706 11.312 ( -8.759 -8.355 3.671) 12.649 12.118 ( 3.438 -5.250 0.734) 6.318 13.167 ( -0.152 -9.174 0.385) 9.183 13.263 ( -0.183 3.285 -0.176) 3.295 13.489 ( 0.106 -1.313 0.885) 1.587 18.092 ( 2.795 18.970 -0.027) 19.174 18.941 ( 0.657 -6.509 -0.531) 6.564 20.361 ( -2.398 4.973 -0.866) 5.589 21.253 ( -0.753 10.068 0.538) 10.111 23.623 ( 5.895 5.613 -1.928) 8.365 23.978 ( -5.429 11.318 2.461) 12.792 27.281 ( -0.674 5.564 -0.815) 5.663 28.253 ( 0.897 -15.977 0.871) 16.026 ======================= Grid point 836 (404/429) ======================= q-point: (-0.14 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 401 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.147 ( -0.000 21.026 0.000) 21.026 3.654 ( -0.000 11.314 0.000) 11.314 4.093 ( -0.000 5.513 0.000) 5.513 4.132 ( 0.000 12.386 0.000) 12.386 4.288 ( 0.000 3.654 0.000) 3.654 5.062 ( -0.000 1.569 0.000) 1.569 5.504 ( 0.000 7.096 0.000) 7.096 5.833 ( -0.000 -17.809 0.000) 17.809 6.242 ( 0.000 8.803 0.000) 8.803 6.355 ( -0.000 5.385 0.000) 5.385 6.710 ( 0.000 10.816 -0.000) 10.816 7.226 ( 0.000 0.355 0.000) 0.355 7.564 ( -0.000 9.153 0.000) 9.153 7.950 ( -0.000 16.811 0.000) 16.811 8.334 ( -0.000 5.661 -0.000) 5.661 8.450 ( 0.000 30.532 0.000) 30.532 9.045 ( -0.000 4.674 0.000) 4.674 9.389 ( 0.000 20.725 0.000) 20.725 9.546 ( -0.000 28.940 0.000) 28.940 9.992 ( 0.000 6.115 0.000) 6.115 10.331 ( -0.000 0.330 0.000) 0.330 10.502 ( -0.000 -17.787 0.000) 17.787 11.392 ( -0.000 -5.455 0.000) 5.455 11.629 ( -0.000 -23.773 0.000) 23.773 12.291 ( -0.000 -12.437 0.000) 12.437 13.197 ( -0.000 2.057 0.000) 2.057 13.338 ( -0.000 -7.817 0.000) 7.817 13.518 ( 0.000 -2.223 0.000) 2.223 17.661 ( -0.000 28.825 0.000) 28.825 18.967 ( 0.000 4.969 -0.000) 4.969 20.266 ( -0.000 4.149 0.000) 4.149 20.982 ( -0.000 19.177 0.000) 19.177 23.483 ( 0.000 11.611 0.000) 11.611 23.727 ( -0.000 12.830 0.000) 12.830 27.184 ( -0.000 4.408 0.000) 4.408 28.589 ( -0.000 -19.278 0.000) 19.278 ======================= Grid point 842 (405/429) ======================= q-point: ( 0.21 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.026 ( 16.568 -0.000 -6.248) 17.707 2.754 ( 40.281 -0.000 -10.348) 41.589 3.055 ( -1.870 0.000 3.979) 4.396 3.794 ( -10.486 0.000 9.450) 14.116 4.217 ( 16.093 -0.000 8.907) 18.394 4.382 ( -1.163 0.000 0.418) 1.235 4.898 ( 5.033 -0.000 -17.262) 17.981 5.046 ( 10.905 -0.000 -23.008) 25.461 5.481 ( -0.346 0.000 -0.881) 0.947 6.287 ( -0.401 0.000 0.217) 0.456 6.514 ( 0.752 -0.000 -2.637) 2.742 7.242 ( 0.777 -0.000 23.443) 23.456 7.266 ( -16.591 0.000 -7.994) 18.416 7.320 ( -2.403 0.000 0.119) 2.406 7.748 ( 1.148 -0.000 -2.589) 2.832 7.924 ( 1.704 -0.000 2.725) 3.214 7.962 ( 1.257 -0.000 -4.192) 4.376 8.667 ( -4.509 0.000 -0.181) 4.513 8.997 ( 3.180 -0.000 9.261) 9.791 9.366 ( -1.092 0.000 12.550) 12.597 10.585 ( 5.326 -0.000 -0.425) 5.343 11.985 ( 11.507 -0.000 -7.801) 13.902 12.305 ( -27.888 0.000 -0.029) 27.888 12.800 ( -17.689 0.000 3.685) 18.069 13.228 ( 1.983 -0.000 -4.201) 4.645 13.630 ( -8.207 0.000 -1.150) 8.287 13.971 ( -1.058 0.000 -0.087) 1.061 14.562 ( 22.377 -0.000 -1.857) 22.454 15.687 ( 16.964 -0.000 8.311) 18.890 15.946 ( -0.423 0.000 -0.056) 0.426 19.221 ( 0.031 -0.000 -0.001) 0.031 20.139 ( 0.038 -0.000 0.039) 0.055 22.106 ( -14.842 0.000 -5.364) 15.781 23.668 ( 16.749 -0.000 -12.236) 20.742 27.191 ( 4.479 -0.000 5.933) 7.434 29.364 ( -19.970 0.000 -3.806) 20.330 ======================= Grid point 843 (406/429) ======================= q-point: ( 0.29 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 19.035 -10.912 -7.082) 23.055 3.037 ( 20.337 -14.613 -5.828) 25.712 3.326 ( 5.884 -20.311 -6.027) 21.989 3.751 ( -10.001 -0.654 9.929) 14.108 4.172 ( 9.156 5.603 10.056) 14.708 4.541 ( -0.011 -8.583 -4.007) 9.472 5.022 ( 11.637 -8.993 -10.096) 17.839 5.198 ( 10.363 -14.886 -20.739) 27.552 5.628 ( -0.991 -15.093 -1.207) 15.174 6.319 ( -0.263 -3.842 0.565) 3.892 6.574 ( 4.759 -5.810 -3.262) 8.188 7.060 ( -15.098 6.046 -6.998) 17.705 7.300 ( -0.311 1.531 21.188) 21.246 7.359 ( -2.992 2.138 -0.109) 3.679 7.528 ( 1.533 9.872 4.103) 10.800 7.863 ( 1.606 -7.979 -0.472) 8.153 8.303 ( 1.477 -13.342 -3.924) 13.985 8.690 ( -8.394 -6.290 -0.944) 10.532 9.080 ( 3.231 -6.072 9.136) 11.435 9.350 ( -3.373 2.495 10.577) 11.379 10.616 ( 6.539 0.552 2.198) 6.920 11.933 ( -3.114 7.027 -8.314) 11.322 12.033 ( -16.926 13.591 2.700) 21.875 12.632 ( -7.995 9.702 0.025) 12.572 12.918 ( -0.204 26.185 -0.475) 26.190 13.399 ( -3.548 7.422 -6.343) 10.388 14.145 ( 11.455 14.693 0.771) 18.646 14.816 ( -2.362 -36.311 -3.793) 36.585 15.052 ( 20.352 37.185 -4.682) 42.648 17.019 ( -6.980 -64.831 19.832) 68.155 19.502 ( 5.056 -26.499 -4.514) 27.352 20.186 ( 0.645 -5.125 1.974) 5.530 22.069 ( -13.431 -5.583 -4.754) 15.303 23.762 ( 15.164 -2.750 -11.300) 19.110 27.232 ( 4.886 -0.349 6.469) 8.114 29.153 ( -19.136 8.923 -5.403) 21.794 ======================= Grid point 844 (407/429) ======================= q-point: ( 0.36 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( 20.277 -15.639 -7.425) 26.662 3.424 ( 6.731 -14.405 -9.588) 18.567 3.652 ( -0.102 -14.189 -6.300) 15.525 3.803 ( -5.471 -8.830 7.900) 13.051 4.206 ( 6.500 -1.926 10.086) 12.153 4.639 ( -5.497 -4.554 -7.139) 10.096 5.277 ( 17.303 -9.556 -7.061) 20.989 5.557 ( 2.429 -19.203 -8.585) 21.174 5.937 ( -3.111 -15.923 -2.235) 16.378 6.415 ( -1.422 -4.670 0.096) 4.883 6.705 ( 6.071 -1.455 -3.194) 7.013 6.967 ( -3.901 -6.919 -8.246) 11.449 7.178 ( 3.347 2.418 3.839) 5.638 7.380 ( -0.655 -5.672 4.024) 6.985 7.575 ( 0.909 -8.199 17.257) 19.127 8.115 ( -5.522 -16.979 3.826) 18.259 8.474 ( 6.392 -6.359 -4.496) 10.075 8.783 ( -10.245 -9.339 -1.850) 13.985 9.287 ( -3.704 2.130 8.191) 9.239 9.301 ( -1.482 -13.485 5.271) 14.554 10.619 ( 5.937 4.763 4.125) 8.657 11.618 ( -19.810 11.360 0.940) 22.855 11.785 ( 4.780 13.871 0.861) 14.696 12.236 ( -1.652 28.712 -11.584) 31.004 12.533 ( -0.061 13.428 1.072) 13.471 13.244 ( -2.443 7.066 -3.871) 8.419 13.845 ( 7.453 17.102 -1.901) 18.752 14.471 ( 16.595 33.608 -4.284) 37.725 15.639 ( -11.321 -49.210 -0.790) 50.502 18.084 ( -10.126 -46.308 20.532) 51.658 20.105 ( 11.284 -30.746 -11.726) 34.787 20.369 ( 1.856 -12.934 8.816) 15.763 22.153 ( -13.799 -12.889 -3.011) 19.121 23.903 ( 13.003 -5.749 -9.032) 16.844 27.287 ( 5.242 -1.213 6.876) 8.732 28.828 ( -15.554 13.151 -6.944) 21.520 ======================= Grid point 845 (408/429) ======================= q-point: ( 0.43 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.976 ( 16.912 -14.865 -6.736) 23.503 3.559 ( 3.600 -3.710 -15.302) 16.152 3.911 ( -2.145 -9.037 -2.057) 9.513 3.955 ( -9.006 -11.006 11.946) 18.573 4.340 ( 7.070 -6.538 5.368) 11.025 4.640 ( -9.365 -3.253 -8.186) 12.857 5.421 ( 7.070 3.712 1.901) 8.208 5.815 ( -8.889 -7.381 -4.084) 12.254 6.137 ( 0.533 -12.356 -8.662) 15.099 6.464 ( 4.419 -2.433 -0.272) 5.052 6.800 ( 7.697 -1.648 0.111) 7.872 7.027 ( -1.638 -4.262 -0.814) 4.637 7.304 ( 3.216 -14.283 -2.349) 14.828 7.739 ( 5.146 -17.594 8.948) 20.399 7.905 ( 8.777 -24.867 8.957) 27.850 8.340 ( -9.689 -10.985 3.298) 15.014 8.681 ( 0.483 -12.859 -1.422) 12.946 8.951 ( -4.547 -13.995 -3.837) 15.207 9.275 ( -5.952 -6.339 5.986) 10.557 9.598 ( -3.640 -18.405 0.968) 18.786 10.502 ( 2.005 9.736 4.674) 10.985 11.278 ( 3.619 27.368 3.731) 27.857 11.568 ( -11.964 1.828 2.834) 12.431 11.737 ( 0.512 18.359 -13.358) 22.710 12.304 ( 5.357 13.232 -0.511) 14.285 13.089 ( -3.679 6.928 -1.862) 8.062 13.623 ( 3.027 9.394 -3.905) 10.614 13.998 ( 9.138 23.995 -0.951) 25.694 16.449 ( -10.806 -43.305 0.201) 44.633 18.662 ( -8.020 -19.133 10.644) 23.317 20.607 ( 10.044 -13.855 -1.009) 17.142 20.720 ( 4.263 -22.037 0.995) 22.468 22.396 ( -12.947 -21.352 -0.499) 24.976 24.084 ( 10.168 -7.557 -6.246) 14.125 27.363 ( 5.410 -2.284 6.979) 9.121 28.486 ( -11.320 13.346 -7.438) 19.015 ======================= Grid point 846 (409/429) ======================= q-point: ( 0.50 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.268 ( 8.578 -9.566 -5.190) 13.858 3.634 ( 5.714 -4.846 -15.841) 17.523 3.875 ( -10.744 4.999 3.287) 12.297 4.175 ( -2.758 -11.657 6.512) 13.635 4.524 ( 5.468 -7.504 5.030) 10.560 4.706 ( -6.258 -10.736 -6.601) 14.071 5.267 ( -0.634 12.562 6.438) 14.130 5.744 ( -15.228 2.661 -6.588) 16.804 6.422 ( 2.306 -14.263 -3.343) 14.829 6.551 ( 6.106 -2.867 1.134) 6.840 6.753 ( 4.290 5.330 -8.975) 11.285 7.222 ( 7.099 -10.832 10.657) 16.772 7.671 ( 6.993 -18.778 -3.038) 20.267 8.028 ( 4.239 -9.310 13.060) 16.590 8.291 ( -4.159 -10.168 1.929) 11.154 8.529 ( -0.106 -9.565 -2.945) 10.008 8.875 ( -5.923 -8.559 -4.307) 11.264 9.195 ( -1.793 -15.217 1.374) 15.383 9.583 ( -5.008 -27.712 0.519) 28.166 9.926 ( -3.867 -13.268 0.917) 13.850 10.448 ( 3.998 -8.823 5.074) 10.935 10.780 ( 2.608 22.195 -1.110) 22.375 11.425 ( -0.009 15.037 -2.700) 15.278 11.559 ( -8.169 -3.111 -0.108) 8.742 12.124 ( 9.969 9.568 -0.561) 13.829 12.941 ( -5.474 5.635 -2.277) 8.180 13.502 ( 1.030 4.405 -3.877) 5.958 13.664 ( 4.359 15.905 0.426) 16.497 17.126 ( -8.142 -34.620 0.992) 35.579 18.834 ( -4.832 -3.889 3.656) 7.199 20.789 ( 7.109 -1.595 4.302) 8.461 21.113 ( 3.393 -16.085 -3.760) 16.864 22.767 ( -9.005 -23.535 0.983) 25.219 24.257 ( 6.948 -6.122 -3.901) 10.048 27.455 ( 5.181 -2.820 6.604) 8.854 28.182 ( -7.749 11.728 -6.993) 15.701 ======================= Grid point 847 (410/429) ======================= q-point: ( 0.57 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.447 ( 2.617 -8.232 -5.945) 10.486 3.657 ( -6.169 2.676 -8.731) 11.020 3.790 ( -0.293 -3.980 2.110) 4.514 4.379 ( 0.781 -9.564 3.122) 10.091 4.687 ( 3.599 -5.509 4.719) 8.098 4.895 ( -3.072 -11.387 -7.870) 14.178 5.050 ( 0.262 10.188 11.157) 15.111 5.585 ( -15.925 2.519 -7.877) 17.944 6.519 ( 5.418 4.307 1.366) 7.055 6.625 ( 1.824 0.384 8.616) 8.816 6.807 ( 3.794 -11.042 -14.417) 18.552 7.448 ( 6.878 -5.933 6.895) 11.404 8.000 ( 5.598 -10.509 4.987) 12.909 8.134 ( 4.392 0.613 2.865) 5.280 8.475 ( -10.137 -14.046 1.713) 17.406 8.580 ( -1.240 -0.302 -1.497) 1.967 8.962 ( -2.949 -6.173 -7.520) 10.167 9.377 ( -1.765 -3.882 -1.312) 4.462 9.978 ( 1.182 0.535 4.117) 4.317 10.111 ( -4.098 -20.218 1.081) 20.658 10.590 ( 1.803 -6.399 1.575) 6.832 10.870 ( 4.225 -16.002 -2.144) 16.688 11.238 ( -1.890 -4.157 1.203) 4.723 11.524 ( -2.618 3.866 -2.263) 5.189 12.058 ( 6.669 3.685 1.802) 7.829 12.819 ( -4.559 3.338 -2.559) 6.203 13.439 ( 1.314 3.436 -3.761) 5.261 13.457 ( 0.476 6.983 1.839) 7.236 17.665 ( -5.036 -27.134 1.170) 27.622 18.819 ( -2.185 2.917 0.658) 3.703 20.797 ( 4.333 4.152 2.430) 6.475 21.340 ( 1.492 -7.693 -2.116) 8.118 23.134 ( -4.717 -18.846 0.978) 19.452 24.361 ( 3.961 -2.162 -2.189) 5.016 27.547 ( 4.586 -2.700 5.970) 7.998 27.933 ( -5.341 9.620 -6.200) 12.630 ======================= Grid point 848 (411/429) ======================= q-point: ( 0.64 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.522 ( -2.010 -2.041 -6.057) 6.700 3.679 ( -4.313 -7.714 2.065) 9.076 3.913 ( 2.914 -8.257 -2.381) 9.074 4.538 ( 1.092 -5.772 2.249) 6.290 4.728 ( 1.025 4.561 1.478) 4.903 4.932 ( -0.217 -1.205 0.207) 1.242 5.083 ( 1.879 -5.050 3.815) 6.602 5.471 ( -12.436 -1.199 -6.001) 13.861 6.463 ( 8.930 5.343 3.819) 11.085 6.612 ( -1.457 2.033 1.028) 2.704 6.981 ( 0.952 -6.657 -6.488) 9.344 7.523 ( 2.735 1.872 3.112) 4.546 8.034 ( -2.115 3.023 7.371) 8.242 8.267 ( 7.254 -6.657 2.002) 10.047 8.494 ( -3.171 0.309 -12.130) 12.541 8.775 ( -0.968 -13.235 11.541) 17.587 9.030 ( -4.765 -4.653 -10.182) 12.166 9.365 ( -0.237 2.069 1.270) 2.439 9.952 ( 2.700 4.657 2.951) 6.139 10.301 ( -5.163 -10.522 -3.537) 12.242 10.750 ( 6.126 5.314 8.563) 11.793 11.055 ( -1.346 -16.716 -8.076) 18.613 11.337 ( -0.362 10.961 1.881) 11.127 11.616 ( -1.186 -19.019 -0.405) 19.061 12.036 ( 2.054 1.640 1.024) 2.821 12.776 ( -1.404 -1.198 -1.028) 2.113 13.374 ( 0.529 0.910 -0.233) 1.079 13.409 ( -0.092 1.554 -0.481) 1.630 18.101 ( -2.377 -21.729 0.881) 21.877 18.723 ( -0.215 6.333 -0.372) 6.348 20.713 ( 1.654 6.571 0.950) 6.842 21.430 ( 0.342 -2.172 -0.822) 2.348 23.411 ( -1.606 -12.453 0.447) 12.564 24.374 ( 1.521 2.071 -0.855) 2.709 27.618 ( 3.970 0.568 5.468) 6.781 27.753 ( -4.098 3.633 -5.553) 7.800 ======================= Grid point 849 (412/429) ======================= q-point: (-0.29 0.21 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.601 ( -1.402 -7.989 -1.008) 8.173 3.731 ( -1.249 0.978 0.590) 1.693 4.122 ( 2.312 -10.708 -0.481) 10.965 4.591 ( -0.360 6.120 8.633) 10.588 4.618 ( 0.878 1.000 -7.983) 8.093 4.944 ( 0.319 2.687 -0.213) 2.714 5.185 ( 0.955 -6.336 2.753) 6.974 5.483 ( -5.743 -5.819 -3.288) 8.813 6.444 ( 8.267 2.783 4.274) 9.714 6.541 ( -3.858 3.451 -2.787) 5.879 7.043 ( -0.265 -1.545 -1.905) 2.467 7.432 ( 0.149 8.582 0.424) 8.594 7.987 ( -1.393 2.471 2.461) 3.756 8.366 ( 3.161 1.450 10.410) 10.975 8.487 ( -1.547 -3.673 -13.982) 14.539 8.928 ( 5.505 -1.053 0.959) 5.686 9.155 ( -7.689 -14.663 1.814) 16.656 9.351 ( 1.180 0.039 -0.995) 1.544 9.851 ( 0.590 7.081 0.526) 7.125 10.402 ( 0.092 1.766 -1.883) 2.583 10.753 ( 0.963 -7.064 2.794) 7.658 10.997 ( -1.002 16.919 0.077) 16.949 11.311 ( -0.748 -3.304 -1.652) 3.769 11.780 ( -0.910 2.732 0.227) 2.888 12.032 ( 1.056 -0.233 0.091) 1.085 12.843 ( 0.069 -6.225 0.061) 6.225 13.377 ( 0.097 2.033 -0.246) 2.050 13.401 ( 0.198 -2.850 0.303) 2.873 18.462 ( -0.606 -17.629 0.447) 17.645 18.582 ( 0.731 8.851 -0.449) 8.892 20.588 ( -0.087 7.053 0.070) 7.054 21.437 ( -0.155 1.248 -0.096) 1.261 23.587 ( 0.250 -6.874 -0.063) 6.878 24.303 ( -0.149 5.705 0.059) 5.708 27.526 ( 0.041 7.514 0.064) 7.514 27.805 ( -0.059 -7.712 -0.063) 7.712 ======================= Grid point 850 (413/429) ======================= q-point: (-0.21 0.21 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 399 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.651 ( -0.000 6.908 0.000) 6.908 3.753 ( 0.000 -6.966 -0.000) 6.966 4.277 ( -0.000 -4.768 0.000) 4.768 4.426 ( -0.000 10.221 0.000) 10.221 4.563 ( -0.000 7.739 0.000) 7.739 4.891 ( 0.000 -0.720 0.000) 0.720 5.356 ( 0.000 -10.411 0.000) 10.411 5.565 ( -0.000 -3.934 -0.000) 3.934 6.439 ( -0.000 4.604 -0.000) 4.604 6.458 ( 0.000 0.417 0.000) 0.417 7.071 ( 0.000 -2.653 -0.000) 2.653 7.228 ( 0.000 12.734 0.000) 12.734 7.905 ( -0.000 6.463 0.000) 6.463 8.317 ( -0.000 5.279 0.000) 5.279 8.494 ( -0.000 1.715 0.000) 1.715 9.030 ( -0.000 -7.199 0.000) 7.199 9.325 ( 0.000 1.264 0.000) 1.264 9.367 ( -0.000 -4.045 0.000) 4.045 9.738 ( -0.000 2.313 0.000) 2.313 10.264 ( 0.000 10.608 0.000) 10.608 10.679 ( -0.000 15.014 0.000) 15.014 10.971 ( -0.000 -11.122 0.000) 11.122 11.257 ( -0.000 5.860 0.000) 5.860 11.512 ( 0.000 23.445 0.000) 23.445 12.058 ( -0.000 -2.293 0.000) 2.293 12.993 ( -0.000 -9.154 0.000) 9.154 13.327 ( -0.000 3.256 0.000) 3.256 13.457 ( 0.000 -2.478 0.000) 2.478 18.388 ( -0.000 12.496 0.000) 12.496 18.752 ( 0.000 -13.242 0.000) 13.242 20.460 ( -0.000 6.287 0.000) 6.287 21.383 ( -0.000 4.557 0.000) 4.557 23.669 ( -0.000 -1.526 0.000) 1.526 24.163 ( -0.000 9.089 0.000) 9.089 27.392 ( -0.000 6.585 0.000) 6.585 27.992 ( -0.000 -12.093 0.000) 12.093 ======================= Grid point 858 (414/429) ======================= q-point: ( 0.29 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.200 ( 18.027 -0.000 -7.095) 19.372 3.038 ( -4.150 0.000 5.062) 6.546 3.119 ( 31.905 -0.000 -18.706) 36.984 3.702 ( -12.806 0.000 14.918) 19.661 4.372 ( -0.916 0.000 0.353) 0.982 4.397 ( 8.292 -0.000 8.799) 12.090 4.932 ( 11.033 -0.000 -13.623) 17.530 5.124 ( 19.730 -0.000 -25.135) 31.953 5.473 ( -0.379 0.000 -0.883) 0.960 6.283 ( -0.416 0.000 0.216) 0.469 6.533 ( 4.156 -0.000 -1.096) 4.298 7.035 ( -19.395 0.000 -4.801) 19.980 7.293 ( -2.200 0.000 0.078) 2.201 7.338 ( 1.178 -0.000 20.724) 20.757 7.752 ( 1.041 -0.000 -2.116) 2.359 7.953 ( 1.612 -0.000 2.297) 2.806 7.960 ( 0.006 -0.000 -2.935) 2.935 8.602 ( -5.677 0.000 -0.213) 5.681 9.062 ( 2.172 -0.000 8.899) 9.160 9.371 ( -4.947 0.000 8.582) 9.906 10.660 ( 6.247 -0.000 4.895) 7.937 11.869 ( -27.018 0.000 -8.642) 28.367 12.168 ( 6.678 -0.000 -2.315) 7.068 12.681 ( -6.569 0.000 3.594) 7.488 13.228 ( 1.245 -0.000 -5.139) 5.287 13.538 ( -7.285 0.000 -1.313) 7.402 13.959 ( -1.060 0.000 -0.086) 1.063 14.820 ( 23.989 -0.000 -2.755) 24.146 15.862 ( 7.765 -0.000 9.680) 12.409 15.940 ( -0.424 0.000 -0.057) 0.428 19.222 ( 0.031 -0.000 -0.001) 0.031 20.140 ( 0.038 -0.000 0.039) 0.055 21.948 ( -9.571 0.000 -4.689) 10.658 23.799 ( 13.770 -0.000 -10.821) 17.513 27.269 ( 4.940 -0.000 6.643) 8.279 29.114 ( -20.150 0.000 -5.734) 20.950 ======================= Grid point 859 (415/429) ======================= q-point: ( 0.36 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( 20.052 -12.452 -7.834) 24.870 3.136 ( -0.201 -13.313 2.998) 13.648 3.395 ( 12.586 -12.835 -22.062) 28.458 3.681 ( -9.398 -2.593 15.968) 18.709 4.285 ( 4.613 4.190 8.293) 10.374 4.521 ( -0.764 -4.785 -4.002) 6.285 5.143 ( 9.529 -14.413 -1.438) 17.338 5.280 ( 20.981 -8.535 -23.418) 32.580 5.615 ( -0.030 -14.339 -1.166) 14.386 6.319 ( 0.051 -4.028 0.306) 4.040 6.642 ( 8.313 -8.145 -1.163) 11.696 6.851 ( -16.835 4.222 -6.010) 18.367 7.312 ( -3.729 0.443 2.032) 4.270 7.372 ( 0.088 2.410 13.248) 13.466 7.575 ( 1.956 9.208 7.516) 12.045 7.877 ( 1.387 -6.942 -1.020) 7.153 8.301 ( -1.268 -15.741 -2.899) 16.056 8.595 ( -6.168 -2.727 0.355) 6.753 9.138 ( 1.503 -5.567 7.423) 9.400 9.326 ( -6.102 2.505 6.015) 8.927 10.708 ( 6.242 0.427 7.244) 9.572 11.637 ( -26.696 5.964 -6.048) 28.015 12.077 ( 8.216 12.235 -3.653) 15.184 12.583 ( -1.698 9.069 0.375) 9.234 12.912 ( -0.685 26.510 0.859) 26.532 13.335 ( -3.346 5.871 -7.085) 9.791 14.277 ( 11.024 9.842 1.042) 14.815 14.762 ( -5.025 -23.422 -1.143) 23.982 15.253 ( 18.297 36.915 -6.929) 41.779 16.996 ( -8.853 -63.609 17.554) 66.578 19.544 ( 4.877 -29.759 -3.905) 30.408 20.197 ( 0.014 -6.398 2.078) 6.727 21.930 ( -8.363 -4.274 -3.776) 10.123 23.878 ( 11.846 -2.718 -9.013) 15.131 27.313 ( 4.966 -0.486 6.680) 8.338 28.918 ( -17.579 7.555 -6.579) 20.233 ======================= Grid point 860 (416/429) ======================= q-point: ( 0.43 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.801 ( 22.232 -14.941 -8.098) 27.983 3.423 ( -1.384 -12.212 -4.202) 12.989 3.601 ( -5.123 -13.757 -6.118) 15.904 3.779 ( -3.304 -7.821 5.194) 9.952 4.310 ( 5.662 -1.937 8.494) 10.391 4.557 ( -3.692 -1.373 -7.503) 8.474 5.440 ( 10.368 -7.528 2.165) 12.995 5.551 ( 3.083 -14.687 -11.165) 18.705 5.908 ( 1.747 -13.245 -3.262) 13.752 6.412 ( 1.124 -4.899 -0.631) 5.066 6.754 ( 1.967 -5.629 -4.189) 7.288 6.883 ( -2.381 -7.480 -6.090) 9.935 7.235 ( 2.396 2.133 5.123) 6.044 7.409 ( 2.536 -11.889 4.317) 12.901 7.649 ( 2.040 -9.763 12.516) 16.004 8.083 ( -1.765 -12.796 3.195) 13.306 8.516 ( -0.505 -9.186 -3.256) 9.759 8.653 ( -7.415 -8.806 -0.359) 11.518 9.245 ( -5.596 1.979 3.978) 7.146 9.315 ( -0.964 -10.741 3.905) 11.469 10.693 ( 3.162 6.958 7.274) 10.551 11.406 ( -15.538 2.036 -3.452) 16.046 11.844 ( 4.865 16.510 1.145) 17.250 12.185 ( -1.129 30.358 -9.325) 31.778 12.552 ( 2.042 12.202 2.492) 12.620 13.201 ( -2.266 6.384 -4.463) 8.112 13.921 ( 6.574 20.887 -1.058) 21.923 14.619 ( 11.793 36.368 -3.511) 38.393 15.520 ( -9.031 -48.541 -0.096) 49.374 18.038 ( -9.012 -45.804 14.611) 48.916 20.189 ( 10.626 -31.628 -11.069) 35.154 20.410 ( -0.864 -15.554 9.580) 18.288 22.014 ( -8.824 -11.374 -2.414) 14.597 24.002 ( 9.382 -5.544 -6.384) 12.630 27.371 ( 4.933 -1.414 6.543) 8.315 28.636 ( -13.124 11.260 -6.993) 18.653 ======================= Grid point 861 (417/429) ======================= q-point: ( 0.50 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.157 ( 18.524 -10.551 -5.805) 22.094 3.538 ( 2.099 -5.179 -12.163) 13.385 3.855 ( -13.797 -5.205 9.375) 17.474 3.886 ( -3.074 -14.445 0.093) 14.768 4.440 ( 5.700 -5.840 6.572) 10.478 4.536 ( -2.605 -2.642 -8.958) 9.696 5.456 ( -3.353 7.217 2.736) 8.415 5.708 ( -5.441 -1.278 -2.556) 6.146 6.135 ( 3.766 -14.061 -7.013) 16.158 6.515 ( 4.312 -3.989 -0.163) 5.876 6.862 ( 2.908 3.891 -3.869) 6.210 7.027 ( 2.566 -15.929 1.315) 16.188 7.369 ( 8.313 -14.361 1.506) 16.662 7.772 ( -5.601 -17.862 5.950) 19.643 8.048 ( 12.473 -24.821 2.739) 27.913 8.277 ( -3.718 -9.338 6.672) 12.064 8.656 ( -5.089 -8.691 -1.014) 10.122 8.882 ( -3.479 -18.208 -4.215) 19.011 9.228 ( -5.022 -5.376 3.709) 8.239 9.563 ( -2.840 -16.848 -0.189) 17.087 10.530 ( -0.090 9.748 5.240) 11.067 11.338 ( 4.337 21.930 2.747) 22.523 11.440 ( -9.174 6.829 -1.718) 11.565 11.709 ( 0.286 16.070 -7.326) 17.664 12.364 ( 4.910 10.799 0.303) 11.867 13.046 ( -2.613 7.942 -1.835) 8.560 13.642 ( 2.300 11.305 -2.479) 11.799 14.079 ( 5.620 25.828 -0.698) 26.441 16.348 ( -7.042 -43.688 0.491) 44.255 18.613 ( -5.817 -19.345 6.561) 21.240 20.700 ( 7.924 -15.398 -4.592) 17.916 20.764 ( 1.488 -20.684 4.775) 21.280 22.274 ( -8.098 -21.811 -0.509) 23.272 24.160 ( 6.462 -7.058 -3.845) 10.313 27.446 ( 4.633 -2.395 5.987) 7.940 28.343 ( -8.728 11.684 -6.430) 15.938 ======================= Grid point 862 (418/429) ======================= q-point: ( 0.57 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 788 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.352 ( 7.876 -4.083 -2.037) 9.102 3.643 ( 6.983 -4.714 -17.755) 19.652 3.763 ( -13.007 4.466 10.428) 17.258 4.164 ( -2.158 -14.283 3.170) 14.789 4.577 ( -1.267 -8.765 5.674) 10.518 4.670 ( 5.298 -9.084 -7.466) 12.897 5.252 ( -6.137 10.235 6.512) 13.595 5.585 ( -7.378 6.815 -5.708) 11.552 6.431 ( 1.103 -14.198 -1.778) 14.352 6.609 ( 3.459 -4.365 0.274) 5.577 6.765 ( 2.088 5.625 -4.239) 7.347 7.337 ( 6.768 -11.922 4.974) 14.583 7.764 ( 10.293 -18.285 0.080) 20.983 8.061 ( -7.326 -16.926 5.730) 19.313 8.251 ( -0.342 1.050 1.308) 1.711 8.541 ( 1.828 -7.644 0.822) 7.902 8.797 ( -4.257 -8.592 -4.881) 10.760 9.184 ( -0.829 -15.196 0.582) 15.229 9.527 ( -4.148 -29.118 0.181) 29.413 9.899 ( -1.604 -15.778 0.332) 15.863 10.499 ( 1.924 -10.433 4.485) 11.518 10.789 ( 0.089 24.000 -1.577) 24.052 11.416 ( 0.876 14.468 -4.029) 15.044 11.495 ( -4.110 -3.875 2.006) 5.995 12.215 ( 5.835 8.221 -0.047) 10.081 12.884 ( -3.199 6.724 -1.296) 7.558 13.500 ( 0.616 4.863 -2.166) 5.360 13.702 ( 2.136 17.024 0.202) 17.158 17.058 ( -4.265 -35.319 0.684) 35.583 18.800 ( -2.745 -4.398 1.863) 5.509 20.864 ( 3.700 -1.027 2.475) 4.568 21.132 ( 1.866 -15.413 -2.237) 15.686 22.692 ( -4.661 -24.895 0.464) 25.331 24.306 ( 3.591 -5.517 -1.987) 6.876 27.530 ( 3.803 -2.787 4.827) 6.748 28.083 ( -5.242 10.652 -5.069) 12.909 ======================= Grid point 863 (419/429) ======================= q-point: ( 0.64 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.470 ( 3.738 -6.709 -2.788) 8.171 3.565 ( -5.622 4.602 -1.556) 7.430 3.798 ( 0.497 -6.014 0.049) 6.034 4.393 ( 0.237 -10.284 0.955) 10.331 4.755 ( 4.008 -4.682 7.685) 9.851 4.828 ( -2.685 -8.171 -10.606) 13.656 5.096 ( 0.463 4.357 8.401) 9.475 5.418 ( -7.395 4.038 -5.398) 10.007 6.562 ( 1.889 -0.212 -0.174) 1.909 6.665 ( 0.541 4.218 4.825) 6.432 6.799 ( 1.549 -11.495 -6.221) 13.161 7.526 ( 3.124 -4.225 2.228) 5.707 8.094 ( 5.720 -8.296 8.211) 12.999 8.163 ( 0.371 2.584 -4.790) 5.455 8.373 ( -6.095 -16.291 -0.346) 17.397 8.569 ( -0.641 -0.813 0.672) 1.235 8.914 ( -1.316 -6.529 -3.604) 7.573 9.362 ( -0.437 -3.869 -0.378) 3.912 9.998 ( 0.270 -8.614 1.936) 8.833 10.080 ( -1.445 -9.981 0.032) 10.086 10.604 ( 0.264 -11.792 0.536) 11.807 10.900 ( 1.646 -12.756 -0.670) 12.879 11.225 ( -0.728 -5.144 0.289) 5.203 11.499 ( -0.832 3.334 -0.730) 3.513 12.116 ( 2.511 5.283 0.673) 5.888 12.776 ( -1.647 2.628 -0.920) 3.235 13.438 ( 0.426 2.190 -1.440) 2.656 13.465 ( 0.158 8.835 0.720) 8.866 17.630 ( -1.727 -27.733 0.446) 27.791 18.803 ( -0.793 2.391 0.214) 2.528 20.837 ( 1.489 4.929 0.880) 5.224 21.346 ( 0.507 -7.398 -0.790) 7.458 23.101 ( -1.585 -19.750 0.323) 19.816 24.386 ( 1.340 -1.666 -0.743) 2.264 27.608 ( 2.499 -2.973 3.239) 5.057 27.865 ( -2.773 9.496 -3.324) 10.437 ======================= Grid point 864 (420/429) ======================= q-point: ( 0.71 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 401 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.499 ( 0.000 -1.446 -0.000) 1.446 3.658 ( -0.000 -8.727 0.000) 8.727 3.926 ( -0.000 -8.545 0.000) 8.545 4.548 ( 0.000 -5.795 -0.000) 5.795 4.740 ( -0.000 5.816 0.000) 5.816 4.925 ( -0.000 -3.619 0.000) 3.619 5.116 ( -0.000 -2.835 0.000) 2.835 5.376 ( -0.000 -2.606 -0.000) 2.606 6.539 ( 0.000 3.037 0.000) 3.037 6.590 ( -0.000 3.959 0.000) 3.959 6.974 ( -0.000 -6.367 0.000) 6.367 7.546 ( -0.000 2.954 -0.000) 2.954 8.036 ( -0.000 4.029 0.000) 4.029 8.328 ( 0.000 -9.113 0.000) 9.113 8.438 ( -0.000 2.197 -0.000) 2.197 8.799 ( -0.000 -18.304 -0.000) 18.304 8.973 ( -0.000 0.114 0.000) 0.114 9.367 ( -0.000 1.152 0.000) 1.152 9.976 ( 0.000 5.971 0.000) 5.971 10.261 ( -0.000 -11.829 0.000) 11.829 10.808 ( -0.000 8.940 -0.000) 8.940 11.025 ( 0.000 -20.755 0.000) 20.755 11.340 ( -0.000 12.442 0.000) 12.442 11.607 ( -0.000 -19.764 0.000) 19.764 12.050 ( -0.000 2.230 0.000) 2.230 12.766 ( -0.000 -1.911 0.000) 1.911 13.376 ( 0.000 1.010 -0.000) 1.010 13.407 ( -0.000 1.443 0.000) 1.443 18.089 ( -0.000 -22.067 0.000) 22.067 18.721 ( -0.000 5.942 0.000) 5.942 20.724 ( -0.000 7.123 -0.000) 7.123 21.431 ( -0.000 -2.044 0.000) 2.044 23.402 ( -0.000 -12.932 0.000) 12.932 24.381 ( -0.000 2.414 0.000) 2.414 27.681 ( 0.000 8.791 0.000) 8.791 27.689 ( -0.000 -4.662 0.000) 4.662 ======================= Grid point 874 (421/429) ======================= q-point: ( 0.36 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 427 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.376 ( 17.227 -0.000 -7.174) 18.661 2.996 ( -6.661 0.000 5.701) 8.768 3.313 ( 15.873 -0.000 -25.279) 29.849 3.640 ( -7.950 0.000 19.177) 20.760 4.365 ( -0.521 0.000 0.232) 0.570 4.467 ( 1.253 -0.000 3.226) 3.461 5.016 ( 8.751 -0.000 -6.762) 11.060 5.332 ( 31.166 -0.000 -19.829) 36.940 5.466 ( -0.330 0.000 -0.709) 0.782 6.279 ( -0.345 0.000 0.173) 0.386 6.572 ( -3.924 0.000 4.759) 6.168 6.826 ( -8.426 0.000 -6.317) 10.531 7.272 ( -1.647 0.000 0.042) 1.648 7.413 ( 0.290 -0.000 14.542) 14.545 7.756 ( 0.779 -0.000 -1.460) 1.655 7.914 ( -7.638 0.000 -0.999) 7.703 7.976 ( 1.235 -0.000 1.627) 2.043 8.568 ( 0.427 -0.000 1.454) 1.516 9.109 ( 0.940 -0.000 7.033) 7.096 9.320 ( -7.526 0.000 3.181) 8.170 10.759 ( 6.421 -0.000 9.658) 11.598 11.526 ( -25.421 0.000 -8.856) 26.920 12.243 ( 6.960 -0.000 -3.900) 7.978 12.656 ( -0.835 0.000 2.787) 2.910 13.224 ( 1.591 -0.000 -4.751) 5.010 13.454 ( -6.785 0.000 -1.061) 6.868 13.947 ( -0.852 0.000 -0.068) 0.855 15.074 ( 22.082 -0.000 -3.482) 22.354 15.936 ( -0.342 0.000 -0.046) 0.345 15.938 ( -0.032 0.000 9.077) 9.077 19.222 ( 0.024 -0.000 -0.001) 0.024 20.140 ( 0.031 -0.000 0.031) 0.044 21.851 ( -5.253 0.000 -3.060) 6.079 23.900 ( 10.012 -0.000 -7.817) 12.702 27.347 ( 4.511 -0.000 6.134) 7.614 28.880 ( -16.427 0.000 -6.180) 17.551 ======================= Grid point 875 (422/429) ======================= q-point: ( 0.43 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( 18.380 -14.690 -7.869) 24.810 3.105 ( -7.314 -14.186 6.970) 17.416 3.398 ( 2.163 -5.934 -19.118) 20.134 3.671 ( -1.954 -3.454 10.572) 11.292 4.344 ( 1.943 1.015 4.761) 5.241 4.500 ( -0.532 -2.101 -3.083) 3.768 5.198 ( 2.690 -14.360 -1.600) 14.697 5.467 ( 15.567 -2.873 -10.151) 18.805 5.659 ( 14.122 -14.415 -4.863) 20.757 6.321 ( 0.086 -4.272 -0.211) 4.279 6.584 ( -21.686 -6.498 2.096) 22.735 6.795 ( 12.379 -0.600 -4.501) 13.186 7.287 ( -1.164 -1.113 0.624) 1.727 7.410 ( -0.548 4.590 8.394) 9.583 7.613 ( 0.078 5.589 6.030) 8.222 7.883 ( 0.050 -7.726 -1.471) 7.865 8.226 ( -9.270 -14.575 -1.015) 17.302 8.592 ( 4.333 -1.028 1.881) 4.834 9.170 ( 0.234 -4.834 4.938) 6.914 9.262 ( -7.132 1.686 1.555) 7.492 10.810 ( 5.934 1.403 10.608) 12.236 11.343 ( -19.825 2.740 -8.631) 21.795 12.144 ( 5.572 12.198 -2.739) 13.687 12.578 ( 0.319 10.155 -0.452) 10.170 12.914 ( 0.126 26.198 2.260) 26.296 13.274 ( -2.983 4.374 -6.194) 8.148 14.399 ( 9.545 -2.078 1.077) 9.827 14.697 ( -5.736 -4.990 -0.652) 7.631 15.409 ( 12.799 37.134 -5.671) 39.685 16.955 ( -7.615 -63.440 12.154) 65.041 19.580 ( 3.471 -32.668 -2.632) 32.957 20.202 ( -0.349 -6.893 1.570) 7.078 21.848 ( -4.305 -3.179 -2.207) 5.789 23.963 ( 7.670 -2.692 -5.663) 9.907 27.388 ( 3.982 -0.672 5.388) 6.734 28.721 ( -12.547 6.562 -5.745) 15.280 ======================= Grid point 876 (423/429) ======================= q-point: ( 0.50 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.018 ( 20.419 -15.712 -8.179) 27.031 3.384 ( -4.623 -13.761 2.898) 14.803 3.496 ( -9.476 -11.798 -2.972) 15.421 3.762 ( -1.407 -5.237 0.599) 5.455 4.391 ( 3.560 -3.438 6.062) 7.826 4.504 ( -1.252 0.362 -6.064) 6.202 5.502 ( -0.456 -12.555 5.621) 13.763 5.540 ( 0.967 -1.895 -8.149) 8.422 5.976 ( 10.354 -8.562 -3.206) 13.813 6.435 ( 3.515 -7.179 -1.220) 8.086 6.675 ( -9.336 -16.128 -5.014) 19.298 6.904 ( 4.027 -1.891 0.306) 4.459 7.285 ( 4.400 -0.505 3.725) 5.787 7.426 ( -3.107 -10.919 2.184) 11.561 7.726 ( 5.907 -13.470 5.480) 15.696 8.101 ( 3.081 -13.091 1.911) 13.584 8.385 ( -15.378 -11.312 -1.054) 19.120 8.672 ( 5.326 -4.582 0.306) 7.033 9.197 ( -4.115 1.347 0.884) 4.420 9.310 ( -1.518 -9.492 1.951) 9.808 10.743 ( 1.026 10.310 6.507) 12.235 11.254 ( -8.267 -4.508 -4.357) 10.375 11.903 ( 4.210 15.879 1.862) 16.533 12.137 ( -1.982 32.722 -6.336) 33.388 12.588 ( 2.123 11.461 2.185) 11.858 13.164 ( -1.597 5.736 -3.169) 6.745 13.980 ( 4.006 23.806 -0.406) 24.144 14.711 ( 6.118 38.227 -2.038) 38.767 15.438 ( -5.093 -48.689 0.148) 48.954 17.996 ( -5.230 -45.629 7.492) 46.535 20.258 ( 7.501 -32.821 -8.234) 34.659 20.421 ( -2.487 -16.759 7.639) 18.585 21.934 ( -4.179 -10.010 -1.271) 10.922 24.067 ( 4.963 -5.378 -3.249) 8.007 27.439 ( 3.244 -1.693 4.296) 5.643 28.492 ( -7.751 10.114 -4.687) 13.577 ======================= Grid point 877 (424/429) ======================= q-point: ( 0.57 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.326 ( 11.383 -6.397 -2.674) 13.329 3.530 ( 3.589 -6.871 -7.939) 11.096 3.714 ( -13.786 -9.541 8.531) 18.811 3.866 ( -0.517 -11.034 -1.048) 11.095 4.471 ( -1.429 -1.174 1.659) 2.485 4.540 ( 4.181 -7.765 -2.554) 9.181 5.398 ( -4.754 8.993 0.630) 10.192 5.678 ( -0.401 1.285 -0.228) 1.366 6.154 ( 2.078 -12.288 -2.564) 12.723 6.553 ( 2.069 -3.752 -0.082) 4.286 6.853 ( -0.767 1.789 -2.147) 2.898 7.071 ( 2.494 -18.800 0.726) 18.979 7.501 ( 13.180 -15.642 2.272) 20.580 7.665 ( -13.581 -17.460 0.127) 22.120 8.180 ( 6.991 -25.037 1.128) 26.019 8.297 ( 2.622 -3.874 3.498) 5.841 8.564 ( -7.935 -15.141 -0.377) 17.099 8.855 ( 0.105 -15.060 -1.945) 15.186 9.196 ( -1.938 -4.812 1.212) 5.327 9.536 ( -1.310 -16.407 -0.323) 16.463 10.542 ( -0.261 9.341 2.351) 9.636 11.353 ( -2.598 -6.739 -1.256) 7.331 11.395 ( 1.449 36.375 1.377) 36.430 11.688 ( -0.314 13.985 -2.768) 14.259 12.407 ( 2.002 9.733 0.302) 9.941 13.020 ( -1.019 8.325 -0.815) 8.427 13.655 ( 0.882 12.491 -0.828) 12.549 14.120 ( 1.889 26.784 -0.262) 26.852 16.295 ( -2.441 -43.959 0.236) 44.027 18.583 ( -2.114 -19.569 2.204) 19.806 20.751 ( 3.757 -15.348 -4.171) 16.342 20.786 ( -0.496 -20.855 4.259) 21.291 22.210 ( -2.752 -21.926 -0.201) 22.099 24.200 ( 2.224 -6.761 -1.288) 7.233 27.502 ( 1.982 -2.613 2.542) 4.149 28.254 ( -3.443 10.922 -2.724) 11.772 ======================= Grid point 878 (425/429) ======================= q-point: ( 0.64 0.36 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 399 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.402 ( -0.000 -1.592 0.000) 1.592 3.674 ( 0.000 6.188 -0.000) 6.188 3.675 ( -0.000 -7.231 0.000) 7.231 4.156 ( 0.000 -15.411 0.000) 15.411 4.572 ( -0.000 -10.329 -0.000) 10.329 4.703 ( -0.000 -7.239 0.000) 7.239 5.215 ( -0.000 8.031 0.000) 8.031 5.537 ( -0.000 9.737 0.000) 9.737 6.434 ( -0.000 -14.104 0.000) 14.104 6.629 ( -0.000 -4.700 0.000) 4.700 6.769 ( -0.000 5.347 -0.000) 5.347 7.388 ( -0.000 -12.358 0.000) 12.358 7.867 ( 0.000 -15.346 0.000) 15.346 7.972 ( -0.000 -21.424 0.000) 21.424 8.267 ( -0.000 4.230 0.000) 4.230 8.556 ( -0.000 -6.276 0.000) 6.276 8.760 ( -0.000 -8.718 0.000) 8.718 9.180 ( -0.000 -15.413 0.000) 15.413 9.502 ( -0.000 -29.706 0.000) 29.706 9.890 ( -0.000 -17.006 0.000) 17.006 10.520 ( -0.000 -11.412 0.000) 11.412 10.784 ( -0.000 25.041 -0.000) 25.041 11.415 ( 0.000 14.942 -0.000) 14.942 11.475 ( -0.000 -4.717 0.000) 4.717 12.249 ( -0.000 7.790 0.000) 7.790 12.862 ( -0.000 7.126 0.000) 7.126 13.500 ( -0.000 5.041 -0.000) 5.041 13.715 ( -0.000 17.417 0.000) 17.417 17.035 ( -0.000 -35.562 0.000) 35.562 18.788 ( -0.000 -4.598 0.000) 4.598 20.890 ( -0.000 -0.832 -0.000) 0.832 21.139 ( -0.000 -15.158 0.000) 15.158 22.666 ( -0.000 -25.376 0.000) 25.376 24.323 ( -0.000 -5.300 0.000) 5.300 27.563 ( -0.000 -2.917 0.000) 2.917 28.041 ( -0.000 10.408 0.000) 10.408 ======================= Grid point 890 (426/429) ======================= q-point: ( 0.43 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 429 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( 12.975 -0.000 -5.771) 14.201 2.933 ( -7.323 0.000 5.010) 8.872 3.328 ( 2.373 -0.000 -13.551) 13.757 3.652 ( -0.671 0.000 8.644) 8.670 4.361 ( -0.195 0.000 0.108) 0.223 4.475 ( -0.261 0.000 0.441) 0.512 5.070 ( 3.942 -0.000 -2.925) 4.908 5.461 ( -0.194 0.000 -0.394) 0.439 5.652 ( 33.685 -0.000 -12.605) 35.966 6.277 ( -0.196 0.000 0.096) 0.218 6.386 ( -26.780 0.000 6.658) 27.595 6.875 ( 13.389 -0.000 -4.108) 14.005 7.257 ( -0.876 0.000 0.017) 0.876 7.447 ( -1.579 0.000 7.591) 7.753 7.759 ( 0.415 -0.000 -0.740) 0.848 7.791 ( -11.455 0.000 -0.469) 11.464 7.992 ( 0.666 -0.000 0.839) 1.071 8.617 ( 5.311 -0.000 2.566) 5.898 9.136 ( 0.101 -0.000 4.412) 4.414 9.237 ( -6.894 0.000 -0.712) 6.930 10.879 ( 7.733 -0.000 12.045) 14.313 11.242 ( -18.064 0.000 -10.758) 21.024 12.292 ( 3.588 -0.000 -2.017) 4.116 12.665 ( 0.597 -0.000 1.131) 1.279 13.234 ( 2.638 -0.000 -3.019) 4.009 13.379 ( -5.633 0.000 -0.382) 5.646 13.939 ( -0.473 0.000 -0.038) 0.475 15.277 ( 14.778 -0.000 -3.063) 15.092 15.933 ( -0.190 0.000 -0.026) 0.192 15.941 ( -3.532 0.000 6.120) 7.066 19.222 ( 0.013 -0.000 -0.001) 0.013 20.141 ( 0.017 -0.000 0.017) 0.024 21.801 ( -2.244 0.000 -1.411) 2.651 23.966 ( 5.335 -0.000 -4.025) 6.683 27.410 ( 2.861 -0.000 3.895) 4.832 28.711 ( -9.345 0.000 -4.186) 10.240 ======================= Grid point 891 (427/429) ======================= q-point: ( 0.50 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 784 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.768 ( 10.513 -17.417 -5.028) 20.956 3.041 ( -6.640 -13.720 5.173) 16.096 3.350 ( -0.794 -3.378 -6.334) 7.222 3.687 ( 0.070 -2.649 2.415) 3.585 4.369 ( 0.567 -1.129 1.488) 1.952 4.488 ( -0.157 -0.955 -1.129) 1.487 5.211 ( 0.689 -12.911 -0.710) 12.948 5.517 ( 0.985 -4.118 -1.251) 4.415 5.888 ( 22.064 -7.491 -5.331) 23.903 6.303 ( -8.187 -6.244 -0.885) 10.334 6.353 ( -11.961 -8.491 3.202) 15.014 6.907 ( 6.670 1.184 -1.239) 6.886 7.291 ( 1.173 -2.622 0.067) 2.873 7.421 ( -1.003 4.940 2.893) 5.812 7.625 ( -0.437 1.388 2.603) 2.982 7.862 ( -1.894 -10.105 -1.407) 10.377 8.140 ( -4.082 -9.814 0.166) 10.630 8.658 ( 3.869 -1.096 1.386) 4.253 9.183 ( -0.266 -4.264 2.279) 4.842 9.195 ( -3.699 0.736 -0.784) 3.852 10.919 ( 5.990 4.567 9.538) 12.154 11.131 ( -10.877 -1.492 -8.652) 13.979 12.182 ( 2.057 11.820 -0.865) 12.029 12.579 ( 0.104 11.746 -0.488) 11.757 12.927 ( 0.470 25.935 1.457) 25.980 13.230 ( -1.383 2.993 -2.707) 4.266 14.495 ( 5.967 -29.636 0.695) 30.239 14.632 ( -4.655 25.800 -0.480) 26.221 15.495 ( 4.693 38.134 -2.220) 38.485 16.923 ( -3.050 -63.992 4.387) 64.215 19.601 ( 1.250 -34.396 -0.930) 34.431 20.202 ( -0.200 -6.907 0.582) 6.935 21.811 ( -1.299 -2.599 -0.699) 2.988 24.008 ( 2.671 -2.671 -1.912) 4.233 27.435 ( 1.597 -0.832 2.155) 2.808 28.605 ( -4.616 6.086 -2.360) 7.995 ======================= Grid point 892 (428/429) ======================= q-point: ( 0.57 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 401 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.151 ( -0.000 -16.705 0.000) 16.705 3.345 ( -0.000 -19.661 0.000) 19.661 3.421 ( -0.000 -5.237 -0.000) 5.237 3.755 ( -0.000 -4.189 0.000) 4.189 4.426 ( -0.000 -4.704 -0.000) 4.704 4.484 ( -0.000 1.181 0.000) 1.181 5.507 ( -0.000 -16.306 -0.000) 16.306 5.526 ( -0.000 4.406 0.000) 4.406 6.043 ( -0.000 -3.580 0.000) 3.580 6.470 ( -0.000 -6.760 0.000) 6.760 6.586 ( -0.000 -22.336 0.000) 22.336 6.930 ( 0.000 -1.480 0.000) 1.480 7.356 ( 0.000 -3.477 0.000) 3.477 7.370 ( -0.000 -6.712 -0.000) 6.712 7.784 ( -0.000 -15.939 0.000) 15.939 8.144 ( -0.000 -20.050 0.000) 20.050 8.261 ( -0.000 -4.814 0.000) 4.814 8.710 ( -0.000 -3.620 0.000) 3.620 9.172 ( -0.000 0.536 0.000) 0.536 9.303 ( -0.000 -8.821 0.000) 8.821 10.762 ( -0.000 12.318 0.000) 12.318 11.197 ( -0.000 -7.415 0.000) 7.415 11.936 ( -0.000 13.700 -0.000) 13.700 12.109 ( -0.000 35.297 0.000) 35.297 12.605 ( -0.000 11.293 0.000) 11.293 13.148 ( -0.000 5.453 0.000) 5.453 14.003 ( -0.000 24.943 0.000) 24.943 14.742 ( -0.000 38.881 0.000) 38.881 15.409 ( -0.000 -48.887 0.000) 48.887 17.979 ( -0.000 -45.601 0.000) 45.601 20.288 ( -0.000 -33.931 0.000) 33.931 20.419 ( -0.000 -16.499 -0.000) 16.499 21.908 ( -0.000 -9.473 0.000) 9.473 24.089 ( -0.000 -5.312 0.000) 5.312 27.467 ( -0.000 -1.847 0.000) 1.847 28.437 ( -0.000 9.766 0.000) 9.766 ======================= Grid point 907 (429/429) ======================= q-point: ( 0.50 0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 0.00e+00 0.00e+00 Number of triplets: 218 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( 0.000 -0.000 0.000) 0.000 2.893 ( -0.000 0.000 0.000) 0.000 3.312 ( -0.000 0.000 -0.000) 0.000 3.666 ( -0.000 0.000 0.000) 0.000 4.361 ( -0.000 0.000 0.000) 0.000 4.473 ( -0.000 0.000 -0.000) 0.000 5.087 ( -0.000 0.000 0.000) 0.000 5.459 ( -0.000 0.000 0.000) 0.000 5.907 ( -0.000 0.000 0.000) 0.000 6.157 ( -0.000 0.000 0.000) 0.000 6.276 ( -0.000 0.000 0.000) 0.000 6.966 ( 0.000 -0.000 0.000) 0.000 7.252 ( -0.000 0.000 0.000) 0.000 7.444 ( -0.000 0.000 0.000) 0.000 7.714 ( -0.000 0.000 0.000) 0.000 7.760 ( -0.000 0.000 0.000) 0.000 7.997 ( -0.000 0.000 0.000) 0.000 8.661 ( -0.000 0.000 0.000) 0.000 9.145 ( -0.000 0.000 -0.000) 0.000 9.188 ( -0.000 0.000 0.000) 0.000 11.018 ( -0.000 0.000 -0.000) 0.000 11.046 ( 0.000 -0.000 0.000) 0.000 12.309 ( -0.000 0.000 0.000) 0.000 12.671 ( -0.000 0.000 0.000) 0.000 13.250 ( -0.000 0.000 0.000) 0.000 13.339 ( -0.000 0.000 0.000) 0.000 13.937 ( -0.000 0.000 0.000) 0.000 15.361 ( -0.000 0.000 -0.000) 0.000 15.927 ( -0.000 0.000 0.000) 0.000 15.931 ( -0.000 0.000 0.000) 0.000 19.222 ( -0.000 0.000 0.000) 0.000 20.141 ( -0.000 0.000 0.000) 0.000 21.786 ( -0.000 0.000 0.000) 0.000 23.989 ( -0.000 0.000 0.000) 0.000 27.434 ( -0.000 0.000 0.000) 0.000 28.648 ( -0.000 0.000 0.000) 0.000 =================== 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 3/56448 10.0 2009.961 1367.597 1375.098 -0.000 271.657 -0.000 3/56448 20.0 945.346 775.899 693.998 -0.000 30.479 -0.000 3/56448 30.0 358.159 392.348 324.828 -0.000 3.939 -0.000 3/56448 40.0 178.753 212.530 168.947 -0.000 3.298 -0.000 3/56448 50.0 105.057 129.542 100.249 -0.000 2.707 -0.000 3/56448 60.0 69.028 86.751 66.006 -0.000 2.111 -0.000 3/56448 70.0 49.210 62.573 47.057 -0.000 1.655 -0.000 3/56448 80.0 37.288 47.832 35.648 -0.000 1.325 -0.000 3/56448 90.0 29.590 38.252 28.290 -0.000 1.086 -0.000 3/56448 100.0 24.329 31.685 23.271 -0.000 0.908 -0.000 3/56448 110.0 20.564 26.980 19.687 -0.000 0.773 -0.000 3/56448 120.0 17.768 23.480 17.028 -0.000 0.668 -0.000 3/56448 130.0 15.624 20.794 14.992 -0.000 0.585 -0.000 3/56448 140.0 13.937 18.676 13.391 -0.000 0.518 -0.000 3/56448 150.0 12.580 16.968 12.104 -0.000 0.462 -0.000 3/56448 160.0 11.467 15.564 11.050 -0.000 0.416 -0.000 3/56448 170.0 10.540 14.390 10.173 -0.000 0.377 -0.000 3/56448 180.0 9.757 13.394 9.432 -0.000 0.343 -0.000 3/56448 190.0 9.087 12.537 8.799 -0.000 0.314 -0.000 3/56448 200.0 8.507 11.794 8.252 -0.000 0.289 -0.000 3/56448 210.0 8.001 11.141 7.775 -0.000 0.266 -0.000 3/56448 220.0 7.555 10.563 7.356 -0.000 0.246 -0.000 3/56448 230.0 7.160 10.047 6.985 -0.000 0.228 -0.000 3/56448 240.0 6.806 9.584 6.653 -0.000 0.212 -0.000 3/56448 250.0 6.488 9.165 6.356 -0.000 0.198 -0.000 3/56448 260.0 6.201 8.784 6.087 -0.000 0.185 -0.000 3/56448 270.0 5.940 8.436 5.843 -0.000 0.173 -0.000 3/56448 280.0 5.701 8.117 5.620 -0.000 0.162 -0.000 3/56448 290.0 5.483 7.823 5.416 -0.000 0.152 -0.000 3/56448 300.0 5.281 7.551 5.228 -0.000 0.143 -0.000 3/56448 310.0 5.095 7.299 5.054 -0.000 0.135 -0.000 3/56448 320.0 4.923 7.063 4.893 -0.000 0.127 -0.000 3/56448 330.0 4.762 6.844 4.743 -0.000 0.120 -0.000 3/56448 340.0 4.612 6.638 4.603 -0.000 0.114 -0.000 3/56448 350.0 4.473 6.445 4.472 -0.000 0.108 -0.000 3/56448 360.0 4.341 6.264 4.349 -0.000 0.102 -0.000 3/56448 370.0 4.218 6.093 4.233 -0.000 0.097 -0.000 3/56448 380.0 4.102 5.931 4.124 -0.000 0.092 -0.000 3/56448 390.0 3.992 5.778 4.021 -0.000 0.087 -0.000 3/56448 400.0 3.889 5.633 3.924 -0.000 0.083 -0.000 3/56448 410.0 3.791 5.496 3.831 -0.000 0.079 -0.000 3/56448 420.0 3.698 5.365 3.743 -0.000 0.076 -0.000 3/56448 430.0 3.609 5.240 3.659 -0.000 0.072 -0.000 3/56448 440.0 3.525 5.121 3.579 -0.000 0.069 -0.000 3/56448 450.0 3.445 5.008 3.503 -0.000 0.066 -0.000 3/56448 460.0 3.369 4.900 3.430 -0.000 0.063 -0.000 3/56448 470.0 3.296 4.796 3.361 -0.000 0.060 -0.000 3/56448 480.0 3.226 4.697 3.294 -0.000 0.058 -0.000 3/56448 490.0 3.159 4.602 3.230 -0.000 0.056 -0.000 3/56448 500.0 3.095 4.510 3.168 -0.000 0.053 -0.000 3/56448 510.0 3.034 4.423 3.109 -0.000 0.051 -0.000 3/56448 520.0 2.975 4.338 3.052 -0.000 0.049 -0.000 3/56448 530.0 2.918 4.257 2.997 -0.000 0.048 -0.000 3/56448 540.0 2.864 4.179 2.944 -0.000 0.046 -0.000 3/56448 550.0 2.811 4.104 2.894 -0.000 0.044 -0.000 3/56448 560.0 2.761 4.031 2.844 -0.000 0.043 -0.000 3/56448 570.0 2.712 3.961 2.797 -0.000 0.041 -0.000 3/56448 580.0 2.665 3.894 2.751 -0.000 0.040 -0.000 3/56448 590.0 2.620 3.828 2.707 -0.000 0.038 -0.000 3/56448 600.0 2.576 3.765 2.664 -0.000 0.037 -0.000 3/56448 610.0 2.534 3.704 2.622 -0.000 0.036 -0.000 3/56448 620.0 2.493 3.645 2.582 -0.000 0.035 -0.000 3/56448 630.0 2.453 3.588 2.543 -0.000 0.034 -0.000 3/56448 640.0 2.415 3.532 2.505 -0.000 0.033 -0.000 3/56448 650.0 2.378 3.478 2.468 -0.000 0.032 -0.000 3/56448 660.0 2.342 3.426 2.432 -0.000 0.031 -0.000 3/56448 670.0 2.307 3.376 2.398 -0.000 0.030 -0.000 3/56448 680.0 2.273 3.327 2.364 -0.000 0.029 -0.000 3/56448 690.0 2.240 3.279 2.331 -0.000 0.028 -0.000 3/56448 700.0 2.208 3.232 2.299 -0.000 0.028 -0.000 3/56448 710.0 2.177 3.187 2.268 -0.000 0.027 -0.000 3/56448 720.0 2.147 3.144 2.238 -0.000 0.026 -0.000 3/56448 730.0 2.117 3.101 2.209 -0.000 0.025 -0.000 3/56448 740.0 2.089 3.059 2.180 -0.000 0.025 -0.000 3/56448 750.0 2.061 3.019 2.152 -0.000 0.024 -0.000 3/56448 760.0 2.034 2.980 2.125 -0.000 0.024 -0.000 3/56448 770.0 2.007 2.941 2.099 -0.000 0.023 -0.000 3/56448 780.0 1.982 2.904 2.073 -0.000 0.022 -0.000 3/56448 790.0 1.957 2.868 2.048 -0.000 0.022 -0.000 3/56448 800.0 1.932 2.832 2.023 -0.000 0.021 -0.000 3/56448 810.0 1.909 2.797 1.999 -0.000 0.021 -0.000 3/56448 820.0 1.885 2.764 1.975 -0.000 0.020 -0.000 3/56448 830.0 1.863 2.731 1.953 -0.000 0.020 -0.000 3/56448 840.0 1.841 2.698 1.930 -0.000 0.020 -0.000 3/56448 850.0 1.819 2.667 1.908 -0.000 0.019 -0.000 3/56448 860.0 1.798 2.636 1.887 -0.000 0.019 -0.000 3/56448 870.0 1.777 2.606 1.866 -0.000 0.018 -0.000 3/56448 880.0 1.757 2.577 1.845 -0.000 0.018 -0.000 3/56448 890.0 1.738 2.548 1.825 -0.000 0.018 -0.000 3/56448 900.0 1.718 2.520 1.806 -0.000 0.017 -0.000 3/56448 910.0 1.699 2.493 1.787 -0.000 0.017 -0.000 3/56448 920.0 1.681 2.466 1.768 -0.000 0.017 -0.000 3/56448 930.0 1.663 2.439 1.749 -0.000 0.016 -0.000 3/56448 940.0 1.645 2.414 1.731 -0.000 0.016 -0.000 3/56448 950.0 1.628 2.388 1.714 -0.000 0.016 -0.000 3/56448 960.0 1.611 2.364 1.696 -0.000 0.015 -0.000 3/56448 970.0 1.595 2.340 1.679 -0.000 0.015 -0.000 3/56448 980.0 1.578 2.316 1.663 -0.000 0.015 -0.000 3/56448 990.0 1.563 2.293 1.646 -0.000 0.015 -0.000 3/56448 1000.0 1.547 2.270 1.630 -0.000 0.014 -0.000 3/56448 Thermal conductivity related properties were written into "kappa-m14148.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 22:38:46]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|