----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 21:25:04]------------------------- 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 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.184375180291706 0.000000000000000 0.000000000000000 b 0.000000000000000 8.605606350000000 0.000000000000000 c -1.129746999538164 0.000000000000000 5.116588096013750 Atomic positions (fractional): *1 Li 0.24903466948559 0.99211541743837 0.01889809893404 6.941 2 Li 0.75096533051441 0.49211541743837 0.48110190106596 6.941 3 Li 0.75096533051441 0.00788458256163 0.98110190106596 6.941 4 Li 0.24903466948559 0.50788458256163 0.51889809893404 6.941 *5 O 0.11465328009608 0.01367625742398 0.30568312882499 15.999 *6 O 0.86408946415881 0.83235426224536 0.20042891846309 15.999 7 O 0.13591053584119 0.33235426224536 0.29957108153691 15.999 8 O 0.13591053584119 0.16764573775464 0.79957108153691 15.999 9 O 0.86408946415881 0.66764573775464 0.70042891846309 15.999 *10 O 0.36553974502349 0.33325158154106 0.73962800469079 15.999 11 O 0.63446025497651 0.83325158154106 0.76037199530921 15.999 12 O 0.63446025497651 0.66674841845894 0.26037199530921 15.999 13 O 0.36553974502349 0.16674841845894 0.23962800469079 15.999 *14 O 0.11075848043547 0.73012817819765 0.52567748257345 15.999 15 O 0.88534671990392 0.51367625742398 0.19431687117501 15.999 16 O 0.88534671990392 0.98632374257602 0.69431687117501 15.999 *17 O 0.60619168952081 0.28614047966748 0.11165868624384 15.999 18 O 0.39380831047919 0.78614047966748 0.38834131375616 15.999 19 O 0.39380831047919 0.71385952033252 0.88834131375616 15.999 20 O 0.60619168952081 0.21385952033252 0.61165868624384 15.999 21 O 0.88924151956453 0.26987182180234 0.47432251742655 15.999 22 O 0.88924151956453 0.23012817819765 0.97432251742655 15.999 *23 O 0.62442988985319 0.50399346183568 0.76189094505453 15.999 24 O 0.11075848043547 0.76987182180235 0.02567748257345 15.999 25 O 0.62442988985319 0.99600653816432 0.26189094505453 15.999 26 O 0.37557011014681 0.49600653816432 0.23810905494547 15.999 27 O 0.37557011014681 0.00399346183568 0.73810905494547 15.999 28 O 0.11465328009608 0.48632374257602 0.80568312882499 15.999 *29 Si 0.95180291819628 0.34092054134128 0.22790508410868 28.085 *30 Si 0.55032170151172 0.33961017619355 0.80605361214277 28.085 31 Si 0.44967829848828 0.83961017619355 0.69394638785723 28.085 32 Si 0.44967829848828 0.66038982380645 0.19394638785723 28.085 33 Si 0.55032170151172 0.16038982380645 0.30605361214277 28.085 34 Si 0.04819708180372 0.84092054134128 0.27209491589132 28.085 35 Si 0.95180291819628 0.15907945865872 0.72790508410868 28.085 36 Si 0.04819708180372 0.65907945865872 0.77209491589132 28.085 *37 Ga 0.25036633635476 0.34981320067240 0.02024379077439 69.723 38 Ga 0.25036633635476 0.15018679932760 0.52024379077439 69.723 39 Ga 0.74963366364524 0.65018679932760 0.97975620922561 69.723 40 Ga 0.74963366364524 0.84981320067240 0.47975620922561 69.723 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.184375180291706 0.000000000000000 0.000000000000000 b 0.000000000000000 8.605606350000000 0.000000000000000 c -1.129746999538164 0.000000000000000 5.116588096013750 Atomic positions (fractional): *1 Li 0.24903466948559 0.99211541743837 0.01889809893404 6.941 > 1 2 Li 0.75096533051441 0.49211541743837 0.48110190106596 6.941 > 2 3 Li 0.75096533051441 0.00788458256163 0.98110190106596 6.941 > 3 4 Li 0.24903466948559 0.50788458256163 0.51889809893404 6.941 > 4 *5 O 0.11465328009608 0.01367625742398 0.30568312882499 15.999 > 5 *6 O 0.86408946415881 0.83235426224536 0.20042891846309 15.999 > 6 7 O 0.13591053584119 0.33235426224536 0.29957108153691 15.999 > 7 8 O 0.13591053584119 0.16764573775464 0.79957108153691 15.999 > 8 9 O 0.86408946415881 0.66764573775464 0.70042891846309 15.999 > 9 *10 O 0.36553974502349 0.33325158154106 0.73962800469079 15.999 > 10 11 O 0.63446025497651 0.83325158154106 0.76037199530921 15.999 > 11 12 O 0.63446025497651 0.66674841845894 0.26037199530921 15.999 > 12 13 O 0.36553974502349 0.16674841845894 0.23962800469079 15.999 > 13 *14 O 0.11075848043547 0.73012817819765 0.52567748257345 15.999 > 14 15 O 0.88534671990392 0.51367625742398 0.19431687117501 15.999 > 15 16 O 0.88534671990392 0.98632374257602 0.69431687117501 15.999 > 16 *17 O 0.60619168952081 0.28614047966748 0.11165868624384 15.999 > 17 18 O 0.39380831047919 0.78614047966748 0.38834131375616 15.999 > 18 19 O 0.39380831047919 0.71385952033252 0.88834131375616 15.999 > 19 20 O 0.60619168952081 0.21385952033252 0.61165868624384 15.999 > 20 21 O 0.88924151956453 0.26987182180234 0.47432251742655 15.999 > 21 22 O 0.88924151956453 0.23012817819765 0.97432251742655 15.999 > 22 *23 O 0.62442988985319 0.50399346183568 0.76189094505453 15.999 > 23 24 O 0.11075848043547 0.76987182180235 0.02567748257345 15.999 > 24 25 O 0.62442988985319 0.99600653816432 0.26189094505453 15.999 > 25 26 O 0.37557011014681 0.49600653816432 0.23810905494547 15.999 > 26 27 O 0.37557011014681 0.00399346183568 0.73810905494547 15.999 > 27 28 O 0.11465328009608 0.48632374257602 0.80568312882499 15.999 > 28 *29 Si 0.95180291819628 0.34092054134128 0.22790508410868 28.085 > 29 *30 Si 0.55032170151172 0.33961017619355 0.80605361214277 28.085 > 30 31 Si 0.44967829848828 0.83961017619355 0.69394638785723 28.085 > 31 32 Si 0.44967829848828 0.66038982380645 0.19394638785723 28.085 > 32 33 Si 0.55032170151172 0.16038982380645 0.30605361214277 28.085 > 33 34 Si 0.04819708180372 0.84092054134128 0.27209491589132 28.085 > 34 35 Si 0.95180291819628 0.15907945865872 0.72790508410868 28.085 > 35 36 Si 0.04819708180372 0.65907945865872 0.77209491589132 28.085 > 36 *37 Ga 0.25036633635476 0.34981320067240 0.02024379077439 69.723 > 37 38 Ga 0.25036633635476 0.15018679932760 0.52024379077439 69.723 > 38 39 Ga 0.74963366364524 0.65018679932760 0.97975620922561 69.723 > 39 40 Ga 0.74963366364524 0.84981320067240 0.47975620922561 69.723 > 40 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.184375180291706 0.000000000000000 0.000000000000000 b 0.000000000000000 8.605606350000000 0.000000000000000 c -2.259493999076328 0.000000000000000 10.233176192027500 Atomic positions (fractional): *1 Li 0.24903466948559 0.99211541743837 0.00944904946702 6.941 > 1 2 Li 0.24903466948559 0.99211541743837 0.50944904946702 6.941 > 1 3 Li 0.75096533051441 0.49211541743837 0.24055095053298 6.941 > 2 4 Li 0.75096533051441 0.49211541743837 0.74055095053298 6.941 > 2 5 Li 0.75096533051441 0.00788458256163 0.49055095053298 6.941 > 3 6 Li 0.75096533051441 0.00788458256163 0.99055095053298 6.941 > 3 7 Li 0.24903466948559 0.50788458256163 0.25944904946702 6.941 > 4 8 Li 0.24903466948559 0.50788458256163 0.75944904946702 6.941 > 4 *9 O 0.11465328009608 0.01367625742398 0.15284156441249 15.999 > 5 10 O 0.11465328009608 0.01367625742398 0.65284156441249 15.999 > 5 *11 O 0.86408946415881 0.83235426224536 0.10021445923154 15.999 > 6 12 O 0.86408946415881 0.83235426224536 0.60021445923154 15.999 > 6 13 O 0.13591053584119 0.33235426224536 0.14978554076846 15.999 > 7 14 O 0.13591053584119 0.33235426224536 0.64978554076846 15.999 > 7 15 O 0.13591053584119 0.16764573775464 0.39978554076846 15.999 > 8 16 O 0.13591053584119 0.16764573775464 0.89978554076846 15.999 > 8 17 O 0.86408946415881 0.66764573775464 0.35021445923154 15.999 > 9 18 O 0.86408946415881 0.66764573775464 0.85021445923154 15.999 > 9 *19 O 0.36553974502349 0.33325158154106 0.36981400234540 15.999 > 10 20 O 0.36553974502349 0.33325158154106 0.86981400234540 15.999 > 10 21 O 0.63446025497651 0.83325158154106 0.38018599765460 15.999 > 11 22 O 0.63446025497651 0.83325158154106 0.88018599765460 15.999 > 11 23 O 0.63446025497651 0.66674841845894 0.13018599765460 15.999 > 12 24 O 0.63446025497651 0.66674841845894 0.63018599765460 15.999 > 12 25 O 0.36553974502349 0.16674841845894 0.11981400234540 15.999 > 13 26 O 0.36553974502349 0.16674841845894 0.61981400234540 15.999 > 13 *27 O 0.11075848043547 0.73012817819765 0.26283874128673 15.999 > 14 28 O 0.11075848043547 0.73012817819765 0.76283874128673 15.999 > 14 29 O 0.88534671990392 0.51367625742398 0.09715843558751 15.999 > 15 30 O 0.88534671990392 0.51367625742398 0.59715843558751 15.999 > 15 31 O 0.88534671990392 0.98632374257602 0.34715843558750 15.999 > 16 32 O 0.88534671990392 0.98632374257602 0.84715843558751 15.999 > 16 *33 O 0.60619168952081 0.28614047966748 0.05582934312192 15.999 > 17 34 O 0.60619168952081 0.28614047966748 0.55582934312192 15.999 > 17 35 O 0.39380831047919 0.78614047966748 0.19417065687808 15.999 > 18 36 O 0.39380831047919 0.78614047966748 0.69417065687808 15.999 > 18 37 O 0.39380831047919 0.71385952033252 0.44417065687808 15.999 > 19 38 O 0.39380831047919 0.71385952033252 0.94417065687808 15.999 > 19 39 O 0.60619168952081 0.21385952033252 0.30582934312192 15.999 > 20 40 O 0.60619168952081 0.21385952033252 0.80582934312192 15.999 > 20 41 O 0.88924151956453 0.26987182180234 0.23716125871328 15.999 > 21 42 O 0.88924151956453 0.26987182180234 0.73716125871327 15.999 > 21 43 O 0.88924151956453 0.23012817819765 0.48716125871327 15.999 > 22 44 O 0.88924151956453 0.23012817819765 0.98716125871327 15.999 > 22 *45 O 0.62442988985319 0.50399346183568 0.38094547252727 15.999 > 23 46 O 0.62442988985319 0.50399346183568 0.88094547252727 15.999 > 23 47 O 0.11075848043547 0.76987182180235 0.01283874128672 15.999 > 24 48 O 0.11075848043547 0.76987182180235 0.51283874128672 15.999 > 24 49 O 0.62442988985319 0.99600653816432 0.13094547252726 15.999 > 25 50 O 0.62442988985319 0.99600653816432 0.63094547252726 15.999 > 25 51 O 0.37557011014681 0.49600653816432 0.11905452747273 15.999 > 26 52 O 0.37557011014681 0.49600653816432 0.61905452747273 15.999 > 26 53 O 0.37557011014681 0.00399346183568 0.36905452747273 15.999 > 27 54 O 0.37557011014681 0.00399346183568 0.86905452747273 15.999 > 27 55 O 0.11465328009608 0.48632374257602 0.40284156441250 15.999 > 28 56 O 0.11465328009608 0.48632374257602 0.90284156441249 15.999 > 28 *57 Si 0.95180291819628 0.34092054134128 0.11395254205434 28.085 > 29 58 Si 0.95180291819628 0.34092054134128 0.61395254205434 28.085 > 29 *59 Si 0.55032170151172 0.33961017619355 0.40302680607139 28.085 > 30 60 Si 0.55032170151172 0.33961017619355 0.90302680607139 28.085 > 30 61 Si 0.44967829848828 0.83961017619355 0.34697319392861 28.085 > 31 62 Si 0.44967829848828 0.83961017619355 0.84697319392861 28.085 > 31 63 Si 0.44967829848828 0.66038982380645 0.09697319392861 28.085 > 32 64 Si 0.44967829848828 0.66038982380645 0.59697319392861 28.085 > 32 65 Si 0.55032170151172 0.16038982380645 0.15302680607139 28.085 > 33 66 Si 0.55032170151172 0.16038982380645 0.65302680607139 28.085 > 33 67 Si 0.04819708180372 0.84092054134128 0.13604745794566 28.085 > 34 68 Si 0.04819708180372 0.84092054134128 0.63604745794566 28.085 > 34 69 Si 0.95180291819628 0.15907945865872 0.36395254205434 28.085 > 35 70 Si 0.95180291819628 0.15907945865872 0.86395254205434 28.085 > 35 71 Si 0.04819708180372 0.65907945865872 0.38604745794566 28.085 > 36 72 Si 0.04819708180372 0.65907945865872 0.88604745794566 28.085 > 36 *73 Ga 0.25036633635476 0.34981320067240 0.01012189538720 69.723 > 37 74 Ga 0.25036633635476 0.34981320067240 0.51012189538719 69.723 > 37 75 Ga 0.25036633635476 0.15018679932760 0.26012189538719 69.723 > 38 76 Ga 0.25036633635476 0.15018679932760 0.76012189538719 69.723 > 38 77 Ga 0.74963366364524 0.65018679932760 0.48987810461281 69.723 > 39 78 Ga 0.74963366364524 0.65018679932760 0.98987810461281 69.723 > 39 79 Ga 0.74963366364524 0.84981320067240 0.23987810461281 69.723 > 40 80 Ga 0.74963366364524 0.84981320067240 0.73987810461281 69.723 > 40 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1262451 0.0000000 -0.0088067 0.0000000 3.1225209 0.0000000 -0.0088067 0.0000000 3.1512096 -------------------------- Born effective charges -------------------------- 1 Li 1.1359844 0.0345369 -0.0719760 0.0227812 1.1410503 -0.0226597 -0.0734024 -0.0322989 1.1337882 2 Li 1.1359844 -0.0345369 -0.0719760 -0.0227812 1.1410503 0.0226597 -0.0734024 0.0322989 1.1337882 3 Li 1.1359844 0.0345369 -0.0719760 0.0227812 1.1410503 -0.0226597 -0.0734024 -0.0322989 1.1337882 4 Li 1.1359844 -0.0345369 -0.0719760 -0.0227812 1.1410503 0.0226597 -0.0734024 0.0322989 1.1337882 5 O -1.6384564 -0.5844203 -0.1556782 -0.5135382 -2.3012616 -0.3167703 -0.1367186 -0.3328551 -1.5326259 6 O -2.3514004 -0.1959490 -0.0308810 -0.1318696 -1.5526925 -0.2627042 -0.0504599 -0.2400732 -1.7864563 7 O -2.3514004 0.1959490 -0.0308810 0.1318696 -1.5526925 0.2627042 -0.0504599 0.2400732 -1.7864563 8 O -2.3514004 -0.1959490 -0.0308810 -0.1318696 -1.5526925 -0.2627042 -0.0504599 -0.2400732 -1.7864563 9 O -2.3514004 0.1959490 -0.0308810 0.1318696 -1.5526925 0.2627042 -0.0504599 0.2400732 -1.7864563 10 O -2.3859307 -0.1802451 -0.0045165 -0.1132313 -1.5504745 -0.2446661 -0.0218039 -0.2827443 -1.7774525 11 O -2.3859307 0.1802451 -0.0045165 0.1132313 -1.5504745 0.2446661 -0.0218039 0.2827443 -1.7774525 12 O -2.3859307 -0.1802451 -0.0045165 -0.1132313 -1.5504745 -0.2446661 -0.0218039 -0.2827443 -1.7774525 13 O -2.3859307 0.1802451 -0.0045165 0.1132313 -1.5504745 0.2446661 -0.0218039 0.2827443 -1.7774525 14 O -1.4834949 -0.0699807 0.2027423 -0.0864762 -1.6739889 0.6650113 0.2320459 0.7442943 -2.2547274 15 O -1.6384564 0.5844203 -0.1556782 0.5135382 -2.3012616 0.3167703 -0.1367186 0.3328551 -1.5326259 16 O -1.6384564 -0.5844203 -0.1556782 -0.5135382 -2.3012616 -0.3167703 -0.1367186 -0.3328551 -1.5326259 17 O -1.4494981 -0.2300236 0.1723342 -0.2004071 -1.6516470 0.6318515 0.1963069 0.6905403 -2.2806277 18 O -1.4494981 0.2300236 0.1723342 0.2004071 -1.6516470 -0.6318515 0.1963069 -0.6905403 -2.2806277 19 O -1.4494981 -0.2300236 0.1723342 -0.2004071 -1.6516470 0.6318515 0.1963069 0.6905403 -2.2806277 20 O -1.4494981 0.2300236 0.1723342 0.2004071 -1.6516470 -0.6318515 0.1963069 -0.6905403 -2.2806277 21 O -1.4834949 -0.0699807 0.2027423 -0.0864762 -1.6739889 0.6650113 0.2320459 0.7442943 -2.2547274 22 O -1.4834949 0.0699807 0.2027423 0.0864762 -1.6739889 -0.6650113 0.2320459 -0.7442943 -2.2547274 23 O -1.6473120 -0.5911909 -0.0535878 -0.5879127 -2.2229613 -0.1169449 -0.0737360 -0.2468396 -1.5026275 24 O -1.4834949 0.0699807 0.2027423 0.0864762 -1.6739889 -0.6650113 0.2320459 -0.7442943 -2.2547274 25 O -1.6473120 0.5911909 -0.0535878 0.5879127 -2.2229613 0.1169449 -0.0737360 0.2468396 -1.5026275 26 O -1.6473120 -0.5911909 -0.0535878 -0.5879127 -2.2229613 -0.1169449 -0.0737360 -0.2468396 -1.5026275 27 O -1.6473120 0.5911909 -0.0535878 0.5879127 -2.2229613 0.1169449 -0.0737360 0.2468396 -1.5026275 28 O -1.6384564 0.5844203 -0.1556782 0.5135382 -2.3012616 0.3167703 -0.1367186 0.3328551 -1.5326259 29 Si 3.2799642 -0.4027722 -0.0359077 -0.1902731 3.3113741 -0.0434066 -0.0694505 -0.0507754 3.3761662 30 Si 3.2979855 0.2976033 -0.1164787 0.2992614 3.2066308 -0.1566392 -0.0927745 0.3373620 3.3319989 31 Si 3.2979855 -0.2976033 -0.1164787 -0.2992614 3.2066308 0.1566392 -0.0927745 -0.3373620 3.3319989 32 Si 3.2979855 0.2976033 -0.1164787 0.2992614 3.2066308 -0.1566392 -0.0927745 0.3373620 3.3319989 33 Si 3.2979855 -0.2976033 -0.1164787 -0.2992614 3.2066308 0.1566392 -0.0927745 -0.3373620 3.3319989 34 Si 3.2799642 0.4027722 -0.0359077 0.1902731 3.3113741 0.0434066 -0.0694505 0.0507754 3.3761662 35 Si 3.2799642 0.4027722 -0.0359077 0.1902731 3.3113741 0.0434066 -0.0694505 0.0507754 3.3761662 36 Si 3.2799642 -0.4027722 -0.0359077 -0.1902731 3.3113741 -0.0434066 -0.0694505 -0.0507754 3.3761662 37 Ga 3.2421583 0.0095988 0.0939494 -0.0245088 3.2939704 -0.0123641 0.0899930 -0.0133371 3.2925640 38 Ga 3.2421583 -0.0095988 0.0939494 0.0245088 3.2939704 0.0123641 0.0899930 0.0133371 3.2925640 39 Ga 3.2421583 0.0095988 0.0939494 -0.0245088 3.2939704 -0.0123641 0.0899930 -0.0133371 3.2925640 40 Ga 3.2421583 -0.0095988 0.0939494 0.0245088 3.2939704 0.0123641 0.0899930 0.0133371 3.2925640 ---------------------------------------------------------------------------- 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: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3690 Number of blocks in projector: 3690 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: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 281 eigenvectors found. (1) Complementary block size: 39 (1) Compute compressed projector. (1) Use standard solver. (1) 19 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 281 eigenvectors found. (1) Complementary block size: 39 (1) Compute compressed projector. (1) Use standard solver. (1) 19 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 800 / 800 (1) 287 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 430 Use standard eigh solver. Tree of FC basis block matrices: - (3690, 3601), data: False |-- (430, 420), data: True |-- (430, 420), data: True |-- (430, 420), data: True |-- (800, 781), data: False |-- (800, 13), data: (800, 32) @ (32, 13) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (800, 780), data: False |-- (800, 19), data: (800, 39) @ (39, 19) |-- (300, 281), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 19), data: (800, 39) @ (39, 19) |-- (300, 281), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 1200 - Time: 0.995 Solver_block: 200 / 1200 - Time: 0.897 Solver_block: 300 / 1200 - Time: 0.942 Solver_block: 400 / 1200 - Time: 0.896 Solver_block: 500 / 1200 - Time: 0.901 Solver_block: 600 / 1200 - Time: 0.945 Solver_block: 700 / 1200 - Time: 0.915 Solver_block: 800 / 1200 - Time: 0.899 Solver_block: 900 / 1200 - Time: 0.899 Solver_block: 1000 / 1200 - Time: 0.907 Solver_block: 1100 / 1200 - Time: 0.909 Solver_block: 1200 / 1200 - Time: 0.928 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 11.227 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (zz) 0.00000000 (zz) Permutation basis: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3690 Number of blocks in projector: 3690 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: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 281 eigenvectors found. (1) Complementary block size: 39 (1) Compute compressed projector. (1) Use standard solver. (1) 19 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 281 eigenvectors found. (1) Complementary block size: 39 (1) Compute compressed projector. (1) Use standard solver. (1) 19 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 800 / 800 (1) 287 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 430 Use standard eigh solver. Tree of FC basis block matrices: - (3690, 3601), data: False |-- (430, 420), data: True |-- (430, 420), data: True |-- (430, 420), data: True |-- (800, 781), data: False |-- (800, 13), data: (800, 32) @ (32, 13) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (800, 780), data: False |-- (800, 19), data: (800, 39) @ (39, 19) |-- (300, 281), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 19), data: (800, 39) @ (39, 19) |-- (300, 281), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), 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 21:25:57]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:25:57]------------------------- 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 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.184375180291706 0.000000000000000 0.000000000000000 b 0.000000000000000 8.605606350000000 0.000000000000000 c -1.129746999538164 0.000000000000000 5.116588096013750 Atomic positions (fractional): 1 Li 0.24903466948559 0.99211541743837 0.01889809893404 6.941 2 Li 0.75096533051441 0.49211541743837 0.48110190106596 6.941 3 Li 0.75096533051441 0.00788458256163 0.98110190106596 6.941 4 Li 0.24903466948559 0.50788458256163 0.51889809893404 6.941 5 O 0.11465328009608 0.01367625742398 0.30568312882499 15.999 6 O 0.86408946415881 0.83235426224536 0.20042891846309 15.999 7 O 0.13591053584119 0.33235426224536 0.29957108153691 15.999 8 O 0.13591053584119 0.16764573775464 0.79957108153691 15.999 9 O 0.86408946415881 0.66764573775464 0.70042891846309 15.999 10 O 0.36553974502349 0.33325158154106 0.73962800469079 15.999 11 O 0.63446025497651 0.83325158154106 0.76037199530921 15.999 12 O 0.63446025497651 0.66674841845894 0.26037199530921 15.999 13 O 0.36553974502349 0.16674841845894 0.23962800469079 15.999 14 O 0.11075848043547 0.73012817819765 0.52567748257345 15.999 15 O 0.88534671990392 0.51367625742398 0.19431687117501 15.999 16 O 0.88534671990392 0.98632374257602 0.69431687117501 15.999 17 O 0.60619168952081 0.28614047966748 0.11165868624384 15.999 18 O 0.39380831047919 0.78614047966748 0.38834131375616 15.999 19 O 0.39380831047919 0.71385952033252 0.88834131375616 15.999 20 O 0.60619168952081 0.21385952033252 0.61165868624384 15.999 21 O 0.88924151956453 0.26987182180234 0.47432251742655 15.999 22 O 0.88924151956453 0.23012817819765 0.97432251742655 15.999 23 O 0.62442988985319 0.50399346183568 0.76189094505453 15.999 24 O 0.11075848043547 0.76987182180235 0.02567748257345 15.999 25 O 0.62442988985319 0.99600653816432 0.26189094505453 15.999 26 O 0.37557011014681 0.49600653816432 0.23810905494547 15.999 27 O 0.37557011014681 0.00399346183568 0.73810905494547 15.999 28 O 0.11465328009608 0.48632374257602 0.80568312882499 15.999 29 Si 0.95180291819628 0.34092054134128 0.22790508410868 28.085 30 Si 0.55032170151172 0.33961017619355 0.80605361214277 28.085 31 Si 0.44967829848828 0.83961017619355 0.69394638785723 28.085 32 Si 0.44967829848828 0.66038982380645 0.19394638785723 28.085 33 Si 0.55032170151172 0.16038982380645 0.30605361214277 28.085 34 Si 0.04819708180372 0.84092054134128 0.27209491589132 28.085 35 Si 0.95180291819628 0.15907945865872 0.72790508410868 28.085 36 Si 0.04819708180372 0.65907945865872 0.77209491589132 28.085 37 Ga 0.25036633635476 0.34981320067240 0.02024379077439 69.723 38 Ga 0.25036633635476 0.15018679932760 0.52024379077439 69.723 39 Ga 0.74963366364524 0.65018679932760 0.97975620922561 69.723 40 Ga 0.74963366364524 0.84981320067240 0.47975620922561 69.723 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.184375180291706 0.000000000000000 0.000000000000000 b 0.000000000000000 8.605606350000000 0.000000000000000 c -2.259493999076328 0.000000000000000 10.233176192027500 Atomic positions (fractional): 1 Li 0.24903466948559 0.99211541743837 0.00944904946702 6.941 > 1 2 Li 0.24903466948559 0.99211541743837 0.50944904946702 6.941 > 1 3 Li 0.75096533051441 0.49211541743837 0.24055095053298 6.941 > 3 4 Li 0.75096533051441 0.49211541743837 0.74055095053298 6.941 > 3 5 Li 0.75096533051441 0.00788458256163 0.49055095053298 6.941 > 5 6 Li 0.75096533051441 0.00788458256163 0.99055095053298 6.941 > 5 7 Li 0.24903466948559 0.50788458256163 0.25944904946702 6.941 > 7 8 Li 0.24903466948559 0.50788458256163 0.75944904946702 6.941 > 7 9 O 0.11465328009608 0.01367625742398 0.15284156441249 15.999 > 9 10 O 0.11465328009608 0.01367625742398 0.65284156441249 15.999 > 9 11 O 0.86408946415881 0.83235426224536 0.10021445923154 15.999 > 11 12 O 0.86408946415881 0.83235426224536 0.60021445923154 15.999 > 11 13 O 0.13591053584119 0.33235426224536 0.14978554076846 15.999 > 13 14 O 0.13591053584119 0.33235426224536 0.64978554076846 15.999 > 13 15 O 0.13591053584119 0.16764573775464 0.39978554076846 15.999 > 15 16 O 0.13591053584119 0.16764573775464 0.89978554076846 15.999 > 15 17 O 0.86408946415881 0.66764573775464 0.35021445923154 15.999 > 17 18 O 0.86408946415881 0.66764573775464 0.85021445923154 15.999 > 17 19 O 0.36553974502349 0.33325158154106 0.36981400234540 15.999 > 19 20 O 0.36553974502349 0.33325158154106 0.86981400234540 15.999 > 19 21 O 0.63446025497651 0.83325158154106 0.38018599765460 15.999 > 21 22 O 0.63446025497651 0.83325158154106 0.88018599765460 15.999 > 21 23 O 0.63446025497651 0.66674841845894 0.13018599765460 15.999 > 23 24 O 0.63446025497651 0.66674841845894 0.63018599765460 15.999 > 23 25 O 0.36553974502349 0.16674841845894 0.11981400234540 15.999 > 25 26 O 0.36553974502349 0.16674841845894 0.61981400234540 15.999 > 25 27 O 0.11075848043547 0.73012817819765 0.26283874128673 15.999 > 27 28 O 0.11075848043547 0.73012817819765 0.76283874128673 15.999 > 27 29 O 0.88534671990392 0.51367625742398 0.09715843558751 15.999 > 29 30 O 0.88534671990392 0.51367625742398 0.59715843558751 15.999 > 29 31 O 0.88534671990392 0.98632374257602 0.34715843558750 15.999 > 31 32 O 0.88534671990392 0.98632374257602 0.84715843558751 15.999 > 31 33 O 0.60619168952081 0.28614047966748 0.05582934312192 15.999 > 33 34 O 0.60619168952081 0.28614047966748 0.55582934312192 15.999 > 33 35 O 0.39380831047919 0.78614047966748 0.19417065687808 15.999 > 35 36 O 0.39380831047919 0.78614047966748 0.69417065687808 15.999 > 35 37 O 0.39380831047919 0.71385952033252 0.44417065687808 15.999 > 37 38 O 0.39380831047919 0.71385952033252 0.94417065687808 15.999 > 37 39 O 0.60619168952081 0.21385952033252 0.30582934312192 15.999 > 39 40 O 0.60619168952081 0.21385952033252 0.80582934312192 15.999 > 39 41 O 0.88924151956453 0.26987182180234 0.23716125871328 15.999 > 41 42 O 0.88924151956453 0.26987182180234 0.73716125871327 15.999 > 41 43 O 0.88924151956453 0.23012817819765 0.48716125871327 15.999 > 43 44 O 0.88924151956453 0.23012817819765 0.98716125871327 15.999 > 43 45 O 0.62442988985319 0.50399346183568 0.38094547252727 15.999 > 45 46 O 0.62442988985319 0.50399346183568 0.88094547252727 15.999 > 45 47 O 0.11075848043547 0.76987182180235 0.01283874128672 15.999 > 47 48 O 0.11075848043547 0.76987182180235 0.51283874128672 15.999 > 47 49 O 0.62442988985319 0.99600653816432 0.13094547252726 15.999 > 49 50 O 0.62442988985319 0.99600653816432 0.63094547252726 15.999 > 49 51 O 0.37557011014681 0.49600653816432 0.11905452747273 15.999 > 51 52 O 0.37557011014681 0.49600653816432 0.61905452747273 15.999 > 51 53 O 0.37557011014681 0.00399346183568 0.36905452747273 15.999 > 53 54 O 0.37557011014681 0.00399346183568 0.86905452747273 15.999 > 53 55 O 0.11465328009608 0.48632374257602 0.40284156441250 15.999 > 55 56 O 0.11465328009608 0.48632374257602 0.90284156441249 15.999 > 55 57 Si 0.95180291819628 0.34092054134128 0.11395254205434 28.085 > 57 58 Si 0.95180291819628 0.34092054134128 0.61395254205434 28.085 > 57 59 Si 0.55032170151172 0.33961017619355 0.40302680607139 28.085 > 59 60 Si 0.55032170151172 0.33961017619355 0.90302680607139 28.085 > 59 61 Si 0.44967829848828 0.83961017619355 0.34697319392861 28.085 > 61 62 Si 0.44967829848828 0.83961017619355 0.84697319392861 28.085 > 61 63 Si 0.44967829848828 0.66038982380645 0.09697319392861 28.085 > 63 64 Si 0.44967829848828 0.66038982380645 0.59697319392861 28.085 > 63 65 Si 0.55032170151172 0.16038982380645 0.15302680607139 28.085 > 65 66 Si 0.55032170151172 0.16038982380645 0.65302680607139 28.085 > 65 67 Si 0.04819708180372 0.84092054134128 0.13604745794566 28.085 > 67 68 Si 0.04819708180372 0.84092054134128 0.63604745794566 28.085 > 67 69 Si 0.95180291819628 0.15907945865872 0.36395254205434 28.085 > 69 70 Si 0.95180291819628 0.15907945865872 0.86395254205434 28.085 > 69 71 Si 0.04819708180372 0.65907945865872 0.38604745794566 28.085 > 71 72 Si 0.04819708180372 0.65907945865872 0.88604745794566 28.085 > 71 73 Ga 0.25036633635476 0.34981320067240 0.01012189538720 69.723 > 73 74 Ga 0.25036633635476 0.34981320067240 0.51012189538719 69.723 > 73 75 Ga 0.25036633635476 0.15018679932760 0.26012189538719 69.723 > 75 76 Ga 0.25036633635476 0.15018679932760 0.76012189538719 69.723 > 75 77 Ga 0.74963366364524 0.65018679932760 0.48987810461281 69.723 > 77 78 Ga 0.74963366364524 0.65018679932760 0.98987810461281 69.723 > 77 79 Ga 0.74963366364524 0.84981320067240 0.23987810461281 69.723 > 79 80 Ga 0.74963366364524 0.84981320067240 0.73987810461281 69.723 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1262451 0.0000000 -0.0088067 0.0000000 3.1225209 0.0000000 -0.0088067 0.0000000 3.1512096 -------------------------- Born effective charges -------------------------- 1 Li 1.1359844 0.0345369 -0.0719760 0.0227812 1.1410503 -0.0226597 -0.0734024 -0.0322989 1.1337882 2 Li 1.1359844 -0.0345369 -0.0719760 -0.0227812 1.1410503 0.0226597 -0.0734024 0.0322989 1.1337882 3 Li 1.1359844 0.0345369 -0.0719760 0.0227812 1.1410503 -0.0226597 -0.0734024 -0.0322989 1.1337882 4 Li 1.1359844 -0.0345369 -0.0719760 -0.0227812 1.1410503 0.0226597 -0.0734024 0.0322989 1.1337882 5 O -1.6384564 -0.5844203 -0.1556782 -0.5135382 -2.3012616 -0.3167703 -0.1367186 -0.3328551 -1.5326259 6 O -2.3514004 -0.1959490 -0.0308810 -0.1318696 -1.5526925 -0.2627042 -0.0504599 -0.2400732 -1.7864563 7 O -2.3514004 0.1959490 -0.0308810 0.1318696 -1.5526925 0.2627042 -0.0504599 0.2400732 -1.7864563 8 O -2.3514004 -0.1959490 -0.0308810 -0.1318696 -1.5526925 -0.2627042 -0.0504599 -0.2400732 -1.7864563 9 O -2.3514004 0.1959490 -0.0308810 0.1318696 -1.5526925 0.2627042 -0.0504599 0.2400732 -1.7864563 10 O -2.3859307 -0.1802451 -0.0045165 -0.1132313 -1.5504745 -0.2446661 -0.0218039 -0.2827443 -1.7774525 11 O -2.3859307 0.1802451 -0.0045165 0.1132313 -1.5504745 0.2446661 -0.0218039 0.2827443 -1.7774525 12 O -2.3859307 -0.1802451 -0.0045165 -0.1132313 -1.5504745 -0.2446661 -0.0218039 -0.2827443 -1.7774525 13 O -2.3859307 0.1802451 -0.0045165 0.1132313 -1.5504745 0.2446661 -0.0218039 0.2827443 -1.7774525 14 O -1.4834949 -0.0699807 0.2027423 -0.0864762 -1.6739889 0.6650113 0.2320459 0.7442943 -2.2547274 15 O -1.6384564 0.5844203 -0.1556782 0.5135382 -2.3012616 0.3167703 -0.1367186 0.3328551 -1.5326259 16 O -1.6384564 -0.5844203 -0.1556782 -0.5135382 -2.3012616 -0.3167703 -0.1367186 -0.3328551 -1.5326259 17 O -1.4494981 -0.2300236 0.1723342 -0.2004071 -1.6516470 0.6318515 0.1963069 0.6905403 -2.2806277 18 O -1.4494981 0.2300236 0.1723342 0.2004071 -1.6516470 -0.6318515 0.1963069 -0.6905403 -2.2806277 19 O -1.4494981 -0.2300236 0.1723342 -0.2004071 -1.6516470 0.6318515 0.1963069 0.6905403 -2.2806277 20 O -1.4494981 0.2300236 0.1723342 0.2004071 -1.6516470 -0.6318515 0.1963069 -0.6905403 -2.2806277 21 O -1.4834949 -0.0699807 0.2027423 -0.0864762 -1.6739889 0.6650113 0.2320459 0.7442943 -2.2547274 22 O -1.4834949 0.0699807 0.2027423 0.0864762 -1.6739889 -0.6650113 0.2320459 -0.7442943 -2.2547274 23 O -1.6473120 -0.5911909 -0.0535878 -0.5879127 -2.2229613 -0.1169449 -0.0737360 -0.2468396 -1.5026275 24 O -1.4834949 0.0699807 0.2027423 0.0864762 -1.6739889 -0.6650113 0.2320459 -0.7442943 -2.2547274 25 O -1.6473120 0.5911909 -0.0535878 0.5879127 -2.2229613 0.1169449 -0.0737360 0.2468396 -1.5026275 26 O -1.6473120 -0.5911909 -0.0535878 -0.5879127 -2.2229613 -0.1169449 -0.0737360 -0.2468396 -1.5026275 27 O -1.6473120 0.5911909 -0.0535878 0.5879127 -2.2229613 0.1169449 -0.0737360 0.2468396 -1.5026275 28 O -1.6384564 0.5844203 -0.1556782 0.5135382 -2.3012616 0.3167703 -0.1367186 0.3328551 -1.5326259 29 Si 3.2799642 -0.4027722 -0.0359077 -0.1902731 3.3113741 -0.0434066 -0.0694505 -0.0507754 3.3761662 30 Si 3.2979855 0.2976033 -0.1164787 0.2992614 3.2066308 -0.1566392 -0.0927745 0.3373620 3.3319989 31 Si 3.2979855 -0.2976033 -0.1164787 -0.2992614 3.2066308 0.1566392 -0.0927745 -0.3373620 3.3319989 32 Si 3.2979855 0.2976033 -0.1164787 0.2992614 3.2066308 -0.1566392 -0.0927745 0.3373620 3.3319989 33 Si 3.2979855 -0.2976033 -0.1164787 -0.2992614 3.2066308 0.1566392 -0.0927745 -0.3373620 3.3319989 34 Si 3.2799642 0.4027722 -0.0359077 0.1902731 3.3113741 0.0434066 -0.0694505 0.0507754 3.3761662 35 Si 3.2799642 0.4027722 -0.0359077 0.1902731 3.3113741 0.0434066 -0.0694505 0.0507754 3.3761662 36 Si 3.2799642 -0.4027722 -0.0359077 -0.1902731 3.3113741 -0.0434066 -0.0694505 -0.0507754 3.3761662 37 Ga 3.2421583 0.0095988 0.0939494 -0.0245088 3.2939704 -0.0123641 0.0899930 -0.0133371 3.2925640 38 Ga 3.2421583 -0.0095988 0.0939494 0.0245088 3.2939704 0.0123641 0.0899930 0.0133371 3.2925640 39 Ga 3.2421583 0.0095988 0.0939494 -0.0245088 3.2939704 -0.0123641 0.0899930 -0.0133371 3.2925640 40 Ga 3.2421583 -0.0095988 0.0939494 0.0245088 3.2939704 0.0123641 0.0899930 0.0133371 3.2925640 ---------------------------------------------------------------------------- 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] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 9, 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] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 11, 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] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 19, 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] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 27, 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] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 33, 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] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 45, 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] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 59, 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] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0022 0.0000 0.0098] [ 0.0022 0.0000 -0.0098] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (zzz) -0.00000001 (zzz) -0.00000001 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (yz) -0.00000000 (yz) 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 21:26:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:26:29]------------------------- 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 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.184375180291706 0.000000000000000 0.000000000000000 b 0.000000000000000 8.605606350000000 0.000000000000000 c -1.129746999538164 0.000000000000000 5.116588096013750 Atomic positions (fractional): 1 Li 0.24903466948559 0.99211541743837 0.01889809893404 6.941 2 Li 0.75096533051441 0.49211541743837 0.48110190106596 6.941 3 Li 0.75096533051441 0.00788458256163 0.98110190106596 6.941 4 Li 0.24903466948559 0.50788458256163 0.51889809893404 6.941 5 O 0.11465328009608 0.01367625742398 0.30568312882499 15.999 6 O 0.86408946415881 0.83235426224536 0.20042891846309 15.999 7 O 0.13591053584119 0.33235426224536 0.29957108153691 15.999 8 O 0.13591053584119 0.16764573775464 0.79957108153691 15.999 9 O 0.86408946415881 0.66764573775464 0.70042891846309 15.999 10 O 0.36553974502349 0.33325158154106 0.73962800469079 15.999 11 O 0.63446025497651 0.83325158154106 0.76037199530921 15.999 12 O 0.63446025497651 0.66674841845894 0.26037199530921 15.999 13 O 0.36553974502349 0.16674841845894 0.23962800469079 15.999 14 O 0.11075848043547 0.73012817819765 0.52567748257345 15.999 15 O 0.88534671990392 0.51367625742398 0.19431687117501 15.999 16 O 0.88534671990392 0.98632374257602 0.69431687117501 15.999 17 O 0.60619168952081 0.28614047966748 0.11165868624384 15.999 18 O 0.39380831047919 0.78614047966748 0.38834131375616 15.999 19 O 0.39380831047919 0.71385952033252 0.88834131375616 15.999 20 O 0.60619168952081 0.21385952033252 0.61165868624384 15.999 21 O 0.88924151956453 0.26987182180234 0.47432251742655 15.999 22 O 0.88924151956453 0.23012817819765 0.97432251742655 15.999 23 O 0.62442988985319 0.50399346183568 0.76189094505453 15.999 24 O 0.11075848043547 0.76987182180235 0.02567748257345 15.999 25 O 0.62442988985319 0.99600653816432 0.26189094505453 15.999 26 O 0.37557011014681 0.49600653816432 0.23810905494547 15.999 27 O 0.37557011014681 0.00399346183568 0.73810905494547 15.999 28 O 0.11465328009608 0.48632374257602 0.80568312882499 15.999 29 Si 0.95180291819628 0.34092054134128 0.22790508410868 28.085 30 Si 0.55032170151172 0.33961017619355 0.80605361214277 28.085 31 Si 0.44967829848828 0.83961017619355 0.69394638785723 28.085 32 Si 0.44967829848828 0.66038982380645 0.19394638785723 28.085 33 Si 0.55032170151172 0.16038982380645 0.30605361214277 28.085 34 Si 0.04819708180372 0.84092054134128 0.27209491589132 28.085 35 Si 0.95180291819628 0.15907945865872 0.72790508410868 28.085 36 Si 0.04819708180372 0.65907945865872 0.77209491589132 28.085 37 Ga 0.25036633635476 0.34981320067240 0.02024379077439 69.723 38 Ga 0.25036633635476 0.15018679932760 0.52024379077439 69.723 39 Ga 0.74963366364524 0.65018679932760 0.97975620922561 69.723 40 Ga 0.74963366364524 0.84981320067240 0.47975620922561 69.723 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.184375180291706 0.000000000000000 0.000000000000000 b 0.000000000000000 8.605606350000000 0.000000000000000 c -2.259493999076328 0.000000000000000 10.233176192027500 Atomic positions (fractional): 1 Li 0.24903466948559 0.99211541743837 0.00944904946702 6.941 > 1 2 Li 0.24903466948559 0.99211541743837 0.50944904946702 6.941 > 1 3 Li 0.75096533051441 0.49211541743837 0.24055095053298 6.941 > 3 4 Li 0.75096533051441 0.49211541743837 0.74055095053298 6.941 > 3 5 Li 0.75096533051441 0.00788458256163 0.49055095053298 6.941 > 5 6 Li 0.75096533051441 0.00788458256163 0.99055095053298 6.941 > 5 7 Li 0.24903466948559 0.50788458256163 0.25944904946702 6.941 > 7 8 Li 0.24903466948559 0.50788458256163 0.75944904946702 6.941 > 7 9 O 0.11465328009608 0.01367625742398 0.15284156441249 15.999 > 9 10 O 0.11465328009608 0.01367625742398 0.65284156441249 15.999 > 9 11 O 0.86408946415881 0.83235426224536 0.10021445923154 15.999 > 11 12 O 0.86408946415881 0.83235426224536 0.60021445923154 15.999 > 11 13 O 0.13591053584119 0.33235426224536 0.14978554076846 15.999 > 13 14 O 0.13591053584119 0.33235426224536 0.64978554076846 15.999 > 13 15 O 0.13591053584119 0.16764573775464 0.39978554076846 15.999 > 15 16 O 0.13591053584119 0.16764573775464 0.89978554076846 15.999 > 15 17 O 0.86408946415881 0.66764573775464 0.35021445923154 15.999 > 17 18 O 0.86408946415881 0.66764573775464 0.85021445923154 15.999 > 17 19 O 0.36553974502349 0.33325158154106 0.36981400234540 15.999 > 19 20 O 0.36553974502349 0.33325158154106 0.86981400234540 15.999 > 19 21 O 0.63446025497651 0.83325158154106 0.38018599765460 15.999 > 21 22 O 0.63446025497651 0.83325158154106 0.88018599765460 15.999 > 21 23 O 0.63446025497651 0.66674841845894 0.13018599765460 15.999 > 23 24 O 0.63446025497651 0.66674841845894 0.63018599765460 15.999 > 23 25 O 0.36553974502349 0.16674841845894 0.11981400234540 15.999 > 25 26 O 0.36553974502349 0.16674841845894 0.61981400234540 15.999 > 25 27 O 0.11075848043547 0.73012817819765 0.26283874128673 15.999 > 27 28 O 0.11075848043547 0.73012817819765 0.76283874128673 15.999 > 27 29 O 0.88534671990392 0.51367625742398 0.09715843558751 15.999 > 29 30 O 0.88534671990392 0.51367625742398 0.59715843558751 15.999 > 29 31 O 0.88534671990392 0.98632374257602 0.34715843558750 15.999 > 31 32 O 0.88534671990392 0.98632374257602 0.84715843558751 15.999 > 31 33 O 0.60619168952081 0.28614047966748 0.05582934312192 15.999 > 33 34 O 0.60619168952081 0.28614047966748 0.55582934312192 15.999 > 33 35 O 0.39380831047919 0.78614047966748 0.19417065687808 15.999 > 35 36 O 0.39380831047919 0.78614047966748 0.69417065687808 15.999 > 35 37 O 0.39380831047919 0.71385952033252 0.44417065687808 15.999 > 37 38 O 0.39380831047919 0.71385952033252 0.94417065687808 15.999 > 37 39 O 0.60619168952081 0.21385952033252 0.30582934312192 15.999 > 39 40 O 0.60619168952081 0.21385952033252 0.80582934312192 15.999 > 39 41 O 0.88924151956453 0.26987182180234 0.23716125871328 15.999 > 41 42 O 0.88924151956453 0.26987182180234 0.73716125871327 15.999 > 41 43 O 0.88924151956453 0.23012817819765 0.48716125871327 15.999 > 43 44 O 0.88924151956453 0.23012817819765 0.98716125871327 15.999 > 43 45 O 0.62442988985319 0.50399346183568 0.38094547252727 15.999 > 45 46 O 0.62442988985319 0.50399346183568 0.88094547252727 15.999 > 45 47 O 0.11075848043547 0.76987182180235 0.01283874128672 15.999 > 47 48 O 0.11075848043547 0.76987182180235 0.51283874128672 15.999 > 47 49 O 0.62442988985319 0.99600653816432 0.13094547252726 15.999 > 49 50 O 0.62442988985319 0.99600653816432 0.63094547252726 15.999 > 49 51 O 0.37557011014681 0.49600653816432 0.11905452747273 15.999 > 51 52 O 0.37557011014681 0.49600653816432 0.61905452747273 15.999 > 51 53 O 0.37557011014681 0.00399346183568 0.36905452747273 15.999 > 53 54 O 0.37557011014681 0.00399346183568 0.86905452747273 15.999 > 53 55 O 0.11465328009608 0.48632374257602 0.40284156441250 15.999 > 55 56 O 0.11465328009608 0.48632374257602 0.90284156441249 15.999 > 55 57 Si 0.95180291819628 0.34092054134128 0.11395254205434 28.085 > 57 58 Si 0.95180291819628 0.34092054134128 0.61395254205434 28.085 > 57 59 Si 0.55032170151172 0.33961017619355 0.40302680607139 28.085 > 59 60 Si 0.55032170151172 0.33961017619355 0.90302680607139 28.085 > 59 61 Si 0.44967829848828 0.83961017619355 0.34697319392861 28.085 > 61 62 Si 0.44967829848828 0.83961017619355 0.84697319392861 28.085 > 61 63 Si 0.44967829848828 0.66038982380645 0.09697319392861 28.085 > 63 64 Si 0.44967829848828 0.66038982380645 0.59697319392861 28.085 > 63 65 Si 0.55032170151172 0.16038982380645 0.15302680607139 28.085 > 65 66 Si 0.55032170151172 0.16038982380645 0.65302680607139 28.085 > 65 67 Si 0.04819708180372 0.84092054134128 0.13604745794566 28.085 > 67 68 Si 0.04819708180372 0.84092054134128 0.63604745794566 28.085 > 67 69 Si 0.95180291819628 0.15907945865872 0.36395254205434 28.085 > 69 70 Si 0.95180291819628 0.15907945865872 0.86395254205434 28.085 > 69 71 Si 0.04819708180372 0.65907945865872 0.38604745794566 28.085 > 71 72 Si 0.04819708180372 0.65907945865872 0.88604745794566 28.085 > 71 73 Ga 0.25036633635476 0.34981320067240 0.01012189538720 69.723 > 73 74 Ga 0.25036633635476 0.34981320067240 0.51012189538719 69.723 > 73 75 Ga 0.25036633635476 0.15018679932760 0.26012189538719 69.723 > 75 76 Ga 0.25036633635476 0.15018679932760 0.76012189538719 69.723 > 75 77 Ga 0.74963366364524 0.65018679932760 0.48987810461281 69.723 > 77 78 Ga 0.74963366364524 0.65018679932760 0.98987810461281 69.723 > 77 79 Ga 0.74963366364524 0.84981320067240 0.23987810461281 69.723 > 79 80 Ga 0.74963366364524 0.84981320067240 0.73987810461281 69.723 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.1262451 0.0000000 -0.0088067 0.0000000 3.1225209 0.0000000 -0.0088067 0.0000000 3.1512096 -------------------------- Born effective charges -------------------------- 1 Li 1.1359844 0.0345369 -0.0719760 0.0227812 1.1410503 -0.0226597 -0.0734024 -0.0322989 1.1337882 2 Li 1.1359844 -0.0345369 -0.0719760 -0.0227812 1.1410503 0.0226597 -0.0734024 0.0322989 1.1337882 3 Li 1.1359844 0.0345369 -0.0719760 0.0227812 1.1410503 -0.0226597 -0.0734024 -0.0322989 1.1337882 4 Li 1.1359844 -0.0345369 -0.0719760 -0.0227812 1.1410503 0.0226597 -0.0734024 0.0322989 1.1337882 5 O -1.6384564 -0.5844203 -0.1556782 -0.5135382 -2.3012616 -0.3167703 -0.1367186 -0.3328551 -1.5326259 6 O -2.3514004 -0.1959490 -0.0308810 -0.1318696 -1.5526925 -0.2627042 -0.0504599 -0.2400732 -1.7864563 7 O -2.3514004 0.1959490 -0.0308810 0.1318696 -1.5526925 0.2627042 -0.0504599 0.2400732 -1.7864563 8 O -2.3514004 -0.1959490 -0.0308810 -0.1318696 -1.5526925 -0.2627042 -0.0504599 -0.2400732 -1.7864563 9 O -2.3514004 0.1959490 -0.0308810 0.1318696 -1.5526925 0.2627042 -0.0504599 0.2400732 -1.7864563 10 O -2.3859307 -0.1802451 -0.0045165 -0.1132313 -1.5504745 -0.2446661 -0.0218039 -0.2827443 -1.7774525 11 O -2.3859307 0.1802451 -0.0045165 0.1132313 -1.5504745 0.2446661 -0.0218039 0.2827443 -1.7774525 12 O -2.3859307 -0.1802451 -0.0045165 -0.1132313 -1.5504745 -0.2446661 -0.0218039 -0.2827443 -1.7774525 13 O -2.3859307 0.1802451 -0.0045165 0.1132313 -1.5504745 0.2446661 -0.0218039 0.2827443 -1.7774525 14 O -1.4834949 -0.0699807 0.2027423 -0.0864762 -1.6739889 0.6650113 0.2320459 0.7442943 -2.2547274 15 O -1.6384564 0.5844203 -0.1556782 0.5135382 -2.3012616 0.3167703 -0.1367186 0.3328551 -1.5326259 16 O -1.6384564 -0.5844203 -0.1556782 -0.5135382 -2.3012616 -0.3167703 -0.1367186 -0.3328551 -1.5326259 17 O -1.4494981 -0.2300236 0.1723342 -0.2004071 -1.6516470 0.6318515 0.1963069 0.6905403 -2.2806277 18 O -1.4494981 0.2300236 0.1723342 0.2004071 -1.6516470 -0.6318515 0.1963069 -0.6905403 -2.2806277 19 O -1.4494981 -0.2300236 0.1723342 -0.2004071 -1.6516470 0.6318515 0.1963069 0.6905403 -2.2806277 20 O -1.4494981 0.2300236 0.1723342 0.2004071 -1.6516470 -0.6318515 0.1963069 -0.6905403 -2.2806277 21 O -1.4834949 -0.0699807 0.2027423 -0.0864762 -1.6739889 0.6650113 0.2320459 0.7442943 -2.2547274 22 O -1.4834949 0.0699807 0.2027423 0.0864762 -1.6739889 -0.6650113 0.2320459 -0.7442943 -2.2547274 23 O -1.6473120 -0.5911909 -0.0535878 -0.5879127 -2.2229613 -0.1169449 -0.0737360 -0.2468396 -1.5026275 24 O -1.4834949 0.0699807 0.2027423 0.0864762 -1.6739889 -0.6650113 0.2320459 -0.7442943 -2.2547274 25 O -1.6473120 0.5911909 -0.0535878 0.5879127 -2.2229613 0.1169449 -0.0737360 0.2468396 -1.5026275 26 O -1.6473120 -0.5911909 -0.0535878 -0.5879127 -2.2229613 -0.1169449 -0.0737360 -0.2468396 -1.5026275 27 O -1.6473120 0.5911909 -0.0535878 0.5879127 -2.2229613 0.1169449 -0.0737360 0.2468396 -1.5026275 28 O -1.6384564 0.5844203 -0.1556782 0.5135382 -2.3012616 0.3167703 -0.1367186 0.3328551 -1.5326259 29 Si 3.2799642 -0.4027722 -0.0359077 -0.1902731 3.3113741 -0.0434066 -0.0694505 -0.0507754 3.3761662 30 Si 3.2979855 0.2976033 -0.1164787 0.2992614 3.2066308 -0.1566392 -0.0927745 0.3373620 3.3319989 31 Si 3.2979855 -0.2976033 -0.1164787 -0.2992614 3.2066308 0.1566392 -0.0927745 -0.3373620 3.3319989 32 Si 3.2979855 0.2976033 -0.1164787 0.2992614 3.2066308 -0.1566392 -0.0927745 0.3373620 3.3319989 33 Si 3.2979855 -0.2976033 -0.1164787 -0.2992614 3.2066308 0.1566392 -0.0927745 -0.3373620 3.3319989 34 Si 3.2799642 0.4027722 -0.0359077 0.1902731 3.3113741 0.0434066 -0.0694505 0.0507754 3.3761662 35 Si 3.2799642 0.4027722 -0.0359077 0.1902731 3.3113741 0.0434066 -0.0694505 0.0507754 3.3761662 36 Si 3.2799642 -0.4027722 -0.0359077 -0.1902731 3.3113741 -0.0434066 -0.0694505 -0.0507754 3.3761662 37 Ga 3.2421583 0.0095988 0.0939494 -0.0245088 3.2939704 -0.0123641 0.0899930 -0.0133371 3.2925640 38 Ga 3.2421583 -0.0095988 0.0939494 0.0245088 3.2939704 0.0123641 0.0899930 0.0133371 3.2925640 39 Ga 3.2421583 0.0095988 0.0939494 -0.0245088 3.2939704 -0.0123641 0.0899930 -0.0133371 3.2925640 40 Ga 3.2421583 -0.0095988 0.0939494 0.0245088 3.2939704 0.0123641 0.0899930 0.0133371 3.2925640 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (zzz) -0.00000001 (zzz) -0.00000001 (zzz) Max drift of fc2: 0.00000000 (zz) 0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): 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 ... [ 6 6 10 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.56, Number of G-points: 285, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/128) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 2.299 ( 0.000 0.000 0.000) 0.000 2.600 ( 0.000 0.000 0.000) 0.000 3.364 ( 0.000 0.000 0.000) 0.000 3.805 ( 0.000 0.000 0.000) 0.000 3.834 ( 0.000 0.000 0.000) 0.000 4.034 ( 0.000 0.000 0.000) 0.000 4.087 ( 0.000 0.000 0.000) 0.000 4.267 ( 0.000 0.000 0.000) 0.000 4.442 ( 0.000 0.000 0.000) 0.000 4.748 ( 0.000 0.000 0.000) 0.000 4.931 ( 0.000 0.000 0.000) 0.000 5.054 ( 0.000 0.000 0.000) 0.000 5.192 ( 0.000 0.000 0.000) 0.000 5.253 ( 0.000 0.000 0.000) 0.000 5.266 ( 0.000 0.000 0.000) 0.000 5.700 ( 0.000 0.000 0.000) 0.000 5.906 ( 0.000 0.000 0.000) 0.000 6.132 ( 0.000 0.000 0.000) 0.000 6.314 ( 0.000 0.000 0.000) 0.000 6.413 ( 0.000 0.000 0.000) 0.000 6.576 ( 0.000 0.000 0.000) 0.000 6.729 ( 0.000 0.000 0.000) 0.000 7.062 ( 0.000 0.000 0.000) 0.000 7.161 ( 0.000 0.000 0.000) 0.000 7.209 ( 0.000 0.000 0.000) 0.000 7.410 ( 0.000 0.000 0.000) 0.000 7.565 ( 0.000 0.000 0.000) 0.000 7.776 ( 0.000 0.000 0.000) 0.000 7.936 ( 0.000 0.000 0.000) 0.000 8.229 ( 0.000 0.000 0.000) 0.000 8.368 ( 0.000 0.000 0.000) 0.000 8.455 ( 0.000 0.000 0.000) 0.000 8.679 ( 0.000 0.000 0.000) 0.000 8.745 ( 0.000 0.000 0.000) 0.000 8.796 ( 0.000 0.000 0.000) 0.000 9.022 ( 0.000 0.000 0.000) 0.000 9.036 ( 0.000 0.000 0.000) 0.000 9.090 ( 0.000 0.000 0.000) 0.000 9.164 ( 0.000 0.000 0.000) 0.000 9.214 ( 0.000 0.000 0.000) 0.000 9.282 ( 0.000 0.000 0.000) 0.000 9.324 ( 0.000 0.000 0.000) 0.000 9.327 ( 0.000 0.000 0.000) 0.000 9.743 ( 0.000 0.000 0.000) 0.000 9.769 ( 0.000 0.000 0.000) 0.000 9.838 ( 0.000 0.000 0.000) 0.000 10.319 ( 0.000 0.000 0.000) 0.000 10.413 ( 0.000 0.000 0.000) 0.000 10.531 ( 0.000 0.000 0.000) 0.000 10.658 ( 0.000 0.000 0.000) 0.000 10.664 ( 0.000 0.000 0.000) 0.000 10.692 ( 0.000 0.000 0.000) 0.000 10.789 ( 0.000 0.000 0.000) 0.000 11.025 ( 0.000 0.000 0.000) 0.000 11.285 ( 0.000 0.000 0.000) 0.000 11.336 ( 0.000 0.000 0.000) 0.000 11.401 ( 0.000 0.000 0.000) 0.000 11.531 ( 0.000 0.000 0.000) 0.000 11.561 ( 0.000 0.000 0.000) 0.000 11.660 ( 0.000 0.000 0.000) 0.000 11.771 ( 0.000 0.000 0.000) 0.000 12.066 ( 0.000 0.000 0.000) 0.000 12.124 ( 0.000 0.000 0.000) 0.000 12.272 ( 0.000 0.000 0.000) 0.000 12.723 ( 0.000 0.000 0.000) 0.000 12.811 ( 0.000 0.000 0.000) 0.000 12.880 ( 0.000 0.000 0.000) 0.000 12.950 ( 0.000 0.000 0.000) 0.000 12.958 ( 0.000 0.000 0.000) 0.000 13.563 ( 0.000 0.000 0.000) 0.000 13.715 ( 0.000 0.000 0.000) 0.000 13.872 ( 0.000 0.000 0.000) 0.000 14.354 ( 0.000 0.000 0.000) 0.000 14.705 ( 0.000 0.000 0.000) 0.000 14.950 ( 0.000 0.000 0.000) 0.000 15.294 ( 0.000 0.000 0.000) 0.000 15.463 ( 0.000 0.000 0.000) 0.000 15.549 ( 0.000 0.000 0.000) 0.000 15.669 ( 0.000 0.000 0.000) 0.000 15.832 ( 0.000 0.000 0.000) 0.000 15.855 ( 0.000 0.000 0.000) 0.000 15.922 ( 0.000 0.000 0.000) 0.000 16.189 ( 0.000 0.000 0.000) 0.000 16.658 ( 0.000 0.000 0.000) 0.000 16.954 ( 0.000 0.000 0.000) 0.000 18.781 ( 0.000 0.000 0.000) 0.000 19.386 ( 0.000 0.000 0.000) 0.000 19.976 ( 0.000 0.000 0.000) 0.000 20.006 ( 0.000 0.000 0.000) 0.000 22.801 ( 0.000 0.000 0.000) 0.000 23.026 ( 0.000 0.000 0.000) 0.000 23.100 ( 0.000 0.000 0.000) 0.000 23.440 ( 0.000 0.000 0.000) 0.000 24.232 ( 0.000 0.000 0.000) 0.000 24.477 ( 0.000 0.000 0.000) 0.000 25.099 ( 0.000 0.000 0.000) 0.000 25.158 ( 0.000 0.000 0.000) 0.000 25.417 ( 0.000 0.000 0.000) 0.000 25.574 ( 0.000 0.000 0.000) 0.000 27.826 ( 0.000 0.000 0.000) 0.000 28.684 ( 0.000 0.000 0.000) 0.000 28.932 ( 0.000 0.000 0.000) 0.000 29.471 ( 0.000 0.000 0.000) 0.000 29.480 ( 0.000 0.000 0.000) 0.000 29.784 ( 0.000 0.000 0.000) 0.000 29.875 ( 0.000 0.000 0.000) 0.000 30.048 ( 0.000 0.000 0.000) 0.000 30.067 ( 0.000 0.000 0.000) 0.000 30.194 ( 0.000 0.000 0.000) 0.000 30.343 ( 0.000 0.000 0.000) 0.000 30.670 ( 0.000 0.000 0.000) 0.000 30.935 ( 0.000 0.000 0.000) 0.000 31.079 ( 0.000 0.000 0.000) 0.000 31.520 ( 0.000 0.000 0.000) 0.000 31.819 ( 0.000 0.000 0.000) 0.000 32.539 ( 0.000 0.000 0.000) 0.000 33.482 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/128) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.700 ( 36.738 0.000 6.595) 37.325 0.755 ( 41.956 0.000 -4.689) 42.217 1.562 ( 82.237 0.000 6.604) 82.502 2.338 ( 2.991 0.000 2.972) 4.217 2.586 ( -2.445 0.000 0.694) 2.542 3.304 ( -5.304 0.000 -7.624) 9.288 3.582 ( -18.596 0.000 4.259) 19.077 3.791 ( -4.677 0.000 3.616) 5.912 4.029 ( -0.092 0.000 6.472) 6.473 4.250 ( -1.181 0.000 -1.882) 2.222 4.279 ( 13.385 0.000 -8.910) 16.079 4.444 ( 0.647 0.000 -2.852) 2.924 4.714 ( -19.163 0.000 1.422) 19.216 4.792 ( 1.001 0.000 3.225) 3.377 4.999 ( -4.513 0.000 -4.194) 6.161 5.219 ( 2.197 0.000 4.037) 4.596 5.238 ( -2.449 0.000 -0.389) 2.480 5.348 ( 7.167 0.000 -3.319) 7.898 5.612 ( -6.908 0.000 2.666) 7.404 5.885 ( -2.724 0.000 2.357) 3.602 6.169 ( 5.027 0.000 -5.965) 7.801 6.349 ( -1.357 0.000 -1.839) 2.286 6.400 ( -1.307 0.000 0.014) 1.307 6.645 ( -2.621 0.000 -2.721) 3.778 6.815 ( 7.205 0.000 5.639) 9.149 7.048 ( -8.472 0.000 -5.800) 10.268 7.140 ( 6.601 0.000 4.168) 7.807 7.270 ( 6.422 0.000 -1.081) 6.512 7.410 ( 0.686 0.000 -9.384) 9.409 7.587 ( 0.946 0.000 -2.942) 3.090 7.753 ( -0.974 0.000 -1.948) 2.178 7.927 ( -0.685 0.000 -1.333) 1.499 8.217 ( -1.299 0.000 -0.812) 1.532 8.453 ( 1.150 0.000 -1.766) 2.107 8.648 ( 1.377 0.000 -2.338) 2.713 8.673 ( -1.871 0.000 2.811) 3.376 8.702 ( -4.067 0.000 2.073) 4.565 8.807 ( -0.967 0.000 5.958) 6.036 8.959 ( -7.612 0.000 -10.559) 13.017 9.075 ( 2.341 0.000 2.641) 3.529 9.097 ( 4.659 0.000 -0.606) 4.698 9.203 ( -3.925 0.000 -6.454) 7.554 9.224 ( 2.570 0.000 -1.098) 2.795 9.351 ( 1.880 0.000 5.208) 5.537 9.462 ( 4.665 0.000 10.234) 11.247 9.629 ( -8.884 0.000 6.233) 10.852 9.826 ( 2.996 0.000 -6.153) 6.844 9.866 ( 3.868 0.000 0.764) 3.942 10.310 ( 0.362 0.000 -1.286) 1.336 10.404 ( 5.232 0.000 -24.653) 25.202 10.411 ( -2.920 0.000 -0.316) 2.937 10.506 ( -15.122 0.000 6.677) 16.530 10.566 ( 6.040 0.000 -1.692) 6.272 10.760 ( -1.538 0.000 1.164) 1.929 10.768 ( 6.694 0.000 3.905) 7.749 10.865 ( -2.968 0.000 23.986) 24.169 11.272 ( -2.711 0.000 6.159) 6.729 11.337 ( -0.107 0.000 0.367) 0.382 11.395 ( 4.248 0.000 -3.784) 5.689 11.533 ( 0.708 0.000 -4.117) 4.178 11.551 ( -1.551 0.000 1.608) 2.234 11.668 ( 2.230 0.000 -6.684) 7.046 11.725 ( -6.197 0.000 3.831) 7.285 12.076 ( 11.003 0.000 -44.676) 46.011 12.084 ( 3.009 0.000 -3.037) 4.275 12.158 ( 1.389 0.000 7.997) 8.117 12.517 ( 10.703 0.000 -32.917) 34.613 12.561 ( -9.382 0.000 3.316) 9.951 12.794 ( -1.899 0.000 -0.218) 1.912 12.861 ( -7.200 0.000 2.817) 7.731 12.998 ( -11.174 0.000 57.609) 58.683 13.113 ( 13.766 0.000 -1.911) 13.898 13.584 ( 2.075 0.000 -1.440) 2.525 13.634 ( -6.133 0.000 -18.550) 19.537 13.845 ( -2.265 0.000 -1.585) 2.765 14.369 ( 1.441 0.000 0.242) 1.461 14.711 ( 0.653 0.000 -0.291) 0.715 14.956 ( 0.686 0.000 -0.263) 0.735 15.306 ( -2.467 0.000 2.058) 3.213 15.436 ( -1.982 0.000 -3.396) 3.932 15.581 ( 1.994 0.000 4.417) 4.846 15.617 ( -3.743 0.000 -1.602) 4.071 15.860 ( 0.708 0.000 -1.118) 1.323 15.886 ( 3.487 0.000 4.165) 5.432 16.011 ( -5.464 0.000 6.156) 8.231 16.162 ( -2.674 0.000 -0.563) 2.732 16.659 ( 0.174 0.000 -0.225) 0.284 16.971 ( 1.460 0.000 0.892) 1.711 19.092 ( -6.806 0.000 17.649) 18.916 19.312 ( -5.753 0.000 -5.912) 8.249 19.979 ( 2.388 0.000 0.279) 2.405 20.098 ( 5.865 0.000 1.635) 6.088 22.793 ( -0.657 0.000 -0.343) 0.741 23.027 ( -0.217 0.000 0.658) 0.693 23.097 ( -0.530 0.000 1.222) 1.332 23.430 ( -1.518 0.000 2.853) 3.232 24.242 ( 2.340 0.000 -6.175) 6.603 24.464 ( -0.720 0.000 -2.700) 2.794 25.189 ( 2.886 0.000 1.681) 3.339 25.563 ( -1.921 0.000 2.783) 3.382 25.621 ( 20.428 0.000 4.463) 20.910 27.709 ( -12.226 0.000 -2.689) 12.518 28.036 ( 8.865 0.000 -28.144) 29.507 28.791 ( -0.101 0.000 -13.332) 13.332 28.974 ( 4.308 0.000 1.129) 4.453 29.467 ( -1.458 0.000 -1.241) 1.915 29.480 ( 1.230 0.000 -1.723) 2.116 29.821 ( -10.763 0.000 33.020) 34.730 29.903 ( -0.224 0.000 6.530) 6.534 30.055 ( -0.612 0.000 -1.951) 2.045 30.165 ( -1.653 0.000 -3.192) 3.594 30.190 ( -4.914 0.000 25.497) 25.967 30.345 ( -0.825 0.000 2.707) 2.830 30.876 ( -3.781 0.000 -6.773) 7.757 31.072 ( -0.760 0.000 0.241) 0.798 31.550 ( 2.889 0.000 0.276) 2.902 31.825 ( 0.590 0.000 0.578) 0.826 32.133 ( 18.635 0.000 -27.500) 33.219 32.511 ( -2.711 0.000 -0.667) 2.792 33.451 ( -7.360 0.000 2.188) 7.679 ======================= Grid point 2 (3/128) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.371 ( 33.671 0.000 5.478) 34.114 1.469 ( 37.859 0.000 -3.466) 38.018 2.348 ( -5.090 0.000 2.842) 5.830 2.459 ( -13.731 0.000 1.194) 13.783 3.001 ( 70.485 0.000 4.706) 70.642 3.112 ( -9.664 0.000 -6.470) 11.630 3.316 ( -10.350 0.000 1.113) 10.410 3.760 ( 1.311 0.000 6.111) 6.250 4.063 ( 1.229 0.000 3.384) 3.600 4.193 ( -5.788 0.000 -8.926) 10.639 4.370 ( -15.186 0.000 6.168) 16.391 4.435 ( 6.056 0.000 -6.577) 8.940 4.443 ( 0.322 0.000 -4.162) 4.174 4.666 ( -15.982 0.000 2.935) 16.249 4.983 ( 2.562 0.000 1.247) 2.850 5.131 ( -6.218 0.000 -0.545) 6.241 5.313 ( 2.279 0.000 2.279) 3.223 5.441 ( 4.172 0.000 -1.724) 4.514 5.595 ( 3.572 0.000 2.945) 4.630 5.836 ( -3.119 0.000 1.509) 3.465 6.155 ( -16.365 0.000 6.268) 17.524 6.247 ( 5.763 0.000 -6.410) 8.620 6.371 ( -2.033 0.000 1.158) 2.340 6.516 ( -12.439 0.000 -5.288) 13.516 6.822 ( -3.217 0.000 -1.985) 3.780 7.044 ( 8.181 0.000 -4.004) 9.108 7.262 ( 3.189 0.000 3.892) 5.031 7.405 ( 2.012 0.000 -3.483) 4.022 7.413 ( 9.071 0.000 -0.513) 9.085 7.602 ( 0.972 0.000 -1.423) 1.723 7.762 ( 2.964 0.000 -2.600) 3.942 7.901 ( -1.453 0.000 -1.286) 1.941 8.177 ( -2.495 0.000 -0.424) 2.531 8.508 ( 5.024 0.000 -0.947) 5.112 8.553 ( -9.257 0.000 0.284) 9.261 8.676 ( 2.157 0.000 -2.070) 2.990 8.710 ( 1.462 0.000 5.248) 5.448 8.819 ( -3.255 0.000 -5.203) 6.138 8.836 ( 1.664 0.000 3.183) 3.591 9.082 ( -1.619 0.000 -5.367) 5.605 9.118 ( -1.490 0.000 1.861) 2.384 9.161 ( 0.870 0.000 1.229) 1.506 9.321 ( 7.837 0.000 -4.488) 9.031 9.388 ( 0.159 0.000 2.496) 2.501 9.504 ( -7.284 0.000 7.314) 10.322 9.515 ( -0.836 0.000 3.460) 3.560 9.832 ( 2.271 0.000 -9.371) 9.642 9.994 ( 6.526 0.000 7.852) 10.210 10.172 ( -20.528 0.000 11.958) 23.757 10.318 ( 0.618 0.000 -3.433) 3.488 10.349 ( -1.491 0.000 -1.907) 2.421 10.447 ( 4.019 0.000 -12.708) 13.328 10.659 ( 3.324 0.000 -2.006) 3.882 10.741 ( -0.760 0.000 -0.566) 0.948 10.902 ( -0.307 0.000 9.354) 9.359 10.964 ( 12.248 0.000 6.780) 13.999 11.244 ( -3.115 0.000 7.555) 8.172 11.333 ( -0.273 0.000 -1.076) 1.111 11.448 ( 2.535 0.000 -1.327) 2.862 11.474 ( -6.849 0.000 -4.612) 8.257 11.523 ( -2.278 0.000 -0.452) 2.323 11.605 ( -5.599 0.000 3.958) 6.856 11.672 ( 1.165 0.000 -7.925) 8.010 12.121 ( 9.249 0.000 -24.306) 26.006 12.166 ( 6.945 0.000 -3.585) 7.815 12.211 ( -0.370 0.000 10.143) 10.150 12.480 ( -1.937 0.000 5.901) 6.211 12.588 ( 7.719 0.000 -17.759) 19.364 12.702 ( -10.426 0.000 1.845) 10.588 12.740 ( -4.239 0.000 2.502) 4.922 13.041 ( -3.266 0.000 27.816) 28.007 13.333 ( 11.029 0.000 -2.956) 11.419 13.432 ( -7.555 0.000 -11.510) 13.768 13.590 ( -2.076 0.000 0.425) 2.119 13.802 ( -0.948 0.000 -1.924) 2.145 14.399 ( 1.418 0.000 0.336) 1.457 14.722 ( 0.626 0.000 -0.310) 0.699 14.968 ( 0.688 0.000 -0.315) 0.757 15.268 ( -1.646 0.000 -0.626) 1.761 15.382 ( -1.863 0.000 -3.467) 3.936 15.552 ( -2.662 0.000 -0.224) 2.672 15.632 ( 1.364 0.000 3.964) 4.192 15.868 ( 0.554 0.000 -1.488) 1.588 15.928 ( -4.716 0.000 3.047) 5.614 15.964 ( 3.252 0.000 3.267) 4.609 16.099 ( -3.535 0.000 -0.919) 3.652 16.662 ( 0.169 0.000 -0.200) 0.262 17.002 ( 1.324 0.000 0.816) 1.555 19.045 ( -3.909 0.000 9.891) 10.636 19.180 ( -4.766 0.000 -7.005) 8.473 20.040 ( 3.177 0.000 0.262) 3.188 20.193 ( 3.525 0.000 1.287) 3.753 22.779 ( -0.625 0.000 -0.366) 0.724 23.019 ( -0.948 0.000 1.159) 1.497 23.096 ( 0.005 0.000 0.731) 0.731 23.417 ( -1.046 0.000 2.614) 2.816 24.259 ( 1.921 0.000 -5.684) 6.000 24.438 ( -0.696 0.000 -2.692) 2.781 25.264 ( 4.166 0.000 1.051) 4.297 25.527 ( -3.120 0.000 3.166) 4.445 26.128 ( 30.506 0.000 6.732) 31.240 27.369 ( -22.734 0.000 -5.165) 23.314 28.093 ( 5.191 0.000 -9.477) 10.806 28.726 ( -2.583 0.000 -4.271) 4.991 29.089 ( 7.324 0.000 1.779) 7.537 29.402 ( -5.198 0.000 -1.827) 5.510 29.498 ( 1.547 0.000 -2.422) 2.874 29.756 ( -6.895 0.000 16.848) 18.205 29.919 ( 0.303 0.000 1.319) 1.353 30.039 ( -0.148 0.000 -2.180) 2.185 30.137 ( 0.312 0.000 -3.300) 3.314 30.201 ( -1.133 0.000 7.348) 7.435 30.328 ( -2.034 0.000 2.773) 3.439 30.787 ( -2.587 0.000 -5.090) 5.710 31.059 ( -0.629 0.000 0.217) 0.666 31.607 ( 2.636 0.000 0.196) 2.643 31.844 ( 1.125 0.000 0.786) 1.372 32.395 ( 15.858 0.000 -6.967) 17.321 32.450 ( -3.151 0.000 -0.794) 3.249 33.287 ( -10.205 0.000 0.655) 10.226 ======================= Grid point 3 (4/128) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 64 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( 0.000 0.000 0.000) 0.000 2.058 ( 0.000 0.000 -0.000) 0.000 2.088 ( -0.000 0.000 0.000) 0.000 2.171 ( 0.000 0.000 0.000) 0.000 3.018 ( 0.000 0.000 0.000) 0.000 3.210 ( 0.000 0.000 0.000) 0.000 3.888 ( 0.000 0.000 0.000) 0.000 3.970 ( -0.000 0.000 -0.000) 0.000 4.003 ( -0.000 0.000 0.000) 0.000 4.130 ( -0.000 0.000 0.000) 0.000 4.158 ( 0.000 0.000 0.000) 0.000 4.284 ( 0.000 0.000 0.000) 0.000 4.438 ( 0.000 0.000 0.000) 0.000 4.507 ( 0.000 0.000 0.000) 0.000 5.027 ( 0.000 0.000 0.000) 0.000 5.059 ( 0.000 0.000 0.000) 0.000 5.328 ( 0.000 0.000 -0.000) 0.000 5.478 ( 0.000 0.000 -0.000) 0.000 5.586 ( 0.000 0.000 0.000) 0.000 5.806 ( 0.000 0.000 0.000) 0.000 6.187 ( 0.000 0.000 0.000) 0.000 6.193 ( -0.000 0.000 -0.000) 0.000 6.301 ( 0.000 0.000 0.000) 0.000 6.344 ( 0.000 0.000 -0.000) 0.000 6.808 ( 0.000 0.000 -0.000) 0.000 7.119 ( 0.000 0.000 -0.000) 0.000 7.291 ( 0.000 0.000 0.000) 0.000 7.426 ( 0.000 0.000 -0.000) 0.000 7.519 ( 0.000 0.000 0.000) 0.000 7.606 ( 0.000 0.000 0.000) 0.000 7.795 ( 0.000 0.000 -0.000) 0.000 7.879 ( 0.000 0.000 0.000) 0.000 8.147 ( 0.000 0.000 0.000) 0.000 8.448 ( 0.000 0.000 0.000) 0.000 8.568 ( 0.000 0.000 0.000) 0.000 8.693 ( 0.000 0.000 0.000) 0.000 8.748 ( 0.000 0.000 0.000) 0.000 8.781 ( 0.000 0.000 -0.000) 0.000 8.865 ( 0.000 0.000 -0.000) 0.000 9.049 ( 0.000 0.000 0.000) 0.000 9.099 ( 0.000 0.000 0.000) 0.000 9.175 ( 0.000 0.000 0.000) 0.000 9.386 ( 0.000 0.000 -0.000) 0.000 9.423 ( -0.000 0.000 0.000) 0.000 9.427 ( 0.000 0.000 -0.000) 0.000 9.511 ( 0.000 0.000 0.000) 0.000 9.900 ( 0.000 0.000 -0.000) 0.000 9.910 ( -0.000 0.000 0.000) 0.000 10.081 ( 0.000 0.000 0.000) 0.000 10.308 ( 0.000 0.000 -0.000) 0.000 10.346 ( 0.000 0.000 -0.000) 0.000 10.461 ( 0.000 0.000 -0.000) 0.000 10.676 ( 0.000 0.000 0.000) 0.000 10.732 ( 0.000 0.000 0.000) 0.000 10.920 ( 0.000 0.000 0.000) 0.000 11.213 ( -0.000 0.000 -0.000) 0.000 11.229 ( 0.000 0.000 0.000) 0.000 11.244 ( 0.000 0.000 0.000) 0.000 11.356 ( 0.000 0.000 0.000) 0.000 11.470 ( 0.000 0.000 0.000) 0.000 11.492 ( 0.000 0.000 -0.000) 0.000 11.575 ( 0.000 0.000 -0.000) 0.000 11.661 ( 0.000 0.000 -0.000) 0.000 12.184 ( 0.000 0.000 -0.000) 0.000 12.211 ( 0.000 0.000 0.000) 0.000 12.242 ( 0.000 0.000 -0.000) 0.000 12.535 ( -0.000 0.000 -0.000) 0.000 12.536 ( 0.000 0.000 0.000) 0.000 12.635 ( 0.000 0.000 -0.000) 0.000 12.690 ( -0.000 0.000 0.000) 0.000 13.077 ( 0.000 0.000 0.000) 0.000 13.328 ( 0.000 0.000 -0.000) 0.000 13.463 ( -0.000 0.000 0.000) 0.000 13.533 ( 0.000 0.000 -0.000) 0.000 13.794 ( 0.000 0.000 0.000) 0.000 14.414 ( 0.000 0.000 -0.000) 0.000 14.728 ( 0.000 0.000 -0.000) 0.000 14.975 ( 0.000 0.000 0.000) 0.000 15.251 ( 0.000 0.000 -0.000) 0.000 15.356 ( 0.000 0.000 -0.000) 0.000 15.526 ( 0.000 0.000 0.000) 0.000 15.653 ( 0.000 0.000 -0.000) 0.000 15.864 ( 0.000 0.000 0.000) 0.000 15.893 ( 0.000 0.000 0.000) 0.000 16.030 ( -0.000 0.000 -0.000) 0.000 16.034 ( 0.000 0.000 0.000) 0.000 16.663 ( 0.000 0.000 0.000) 0.000 17.017 ( 0.000 0.000 0.000) 0.000 19.033 ( 0.000 0.000 0.000) 0.000 19.115 ( 0.000 0.000 -0.000) 0.000 20.072 ( 0.000 0.000 0.000) 0.000 20.228 ( 0.000 0.000 -0.000) 0.000 22.772 ( 0.000 0.000 -0.000) 0.000 23.011 ( 0.000 0.000 -0.000) 0.000 23.099 ( 0.000 0.000 0.000) 0.000 23.413 ( 0.000 0.000 0.000) 0.000 24.265 ( 0.000 0.000 -0.000) 0.000 24.425 ( 0.000 0.000 0.000) 0.000 25.314 ( 0.000 0.000 0.000) 0.000 25.497 ( 0.000 0.000 0.000) 0.000 26.587 ( 0.000 0.000 0.000) 0.000 26.990 ( -0.000 0.000 -0.000) 0.000 28.126 ( 0.000 0.000 0.000) 0.000 28.689 ( 0.000 0.000 -0.000) 0.000 29.207 ( 0.000 0.000 -0.000) 0.000 29.303 ( 0.000 0.000 -0.000) 0.000 29.509 ( 0.000 0.000 0.000) 0.000 29.724 ( 0.000 0.000 -0.000) 0.000 29.924 ( 0.000 0.000 0.000) 0.000 30.033 ( 0.000 0.000 0.000) 0.000 30.138 ( 0.000 0.000 0.000) 0.000 30.206 ( 0.000 0.000 0.000) 0.000 30.310 ( 0.000 0.000 0.000) 0.000 30.753 ( 0.000 0.000 0.000) 0.000 31.053 ( 0.000 0.000 -0.000) 0.000 31.633 ( 0.000 0.000 -0.000) 0.000 31.860 ( 0.000 0.000 0.000) 0.000 32.415 ( 0.000 0.000 -0.000) 0.000 32.555 ( 0.000 0.000 0.000) 0.000 33.167 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 7 (5/128) ======================= q-point: ( 0.00 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.703 ( 0.000 36.782 0.000) 36.782 0.878 ( 0.000 43.945 0.000) 43.945 1.433 ( 0.000 71.567 0.000) 71.567 2.302 ( 0.000 1.579 0.000) 1.579 2.874 ( 0.000 21.560 0.000) 21.560 3.421 ( 0.000 4.377 0.000) 4.377 3.732 ( 0.000 -4.938 0.000) 4.938 3.912 ( 0.000 6.041 0.000) 6.041 4.002 ( 0.000 -13.233 0.000) 13.233 4.121 ( 0.000 5.550 0.000) 5.550 4.156 ( 0.000 -5.295 0.000) 5.295 4.403 ( 0.000 8.364 0.000) 8.364 4.862 ( 0.000 -3.744 0.000) 3.744 4.971 ( 0.000 11.236 0.000) 11.236 5.067 ( 0.000 -12.386 0.000) 12.386 5.108 ( 0.000 1.985 0.000) 1.985 5.259 ( 0.000 -0.520 0.000) 0.520 5.704 ( 0.000 1.711 0.000) 1.711 5.806 ( 0.000 -9.220 0.000) 9.220 5.972 ( 0.000 6.651 0.000) 6.651 6.168 ( 0.000 -10.817 0.000) 10.817 6.221 ( 0.000 4.931 0.000) 4.931 6.398 ( 0.000 -4.583 0.000) 4.583 6.553 ( 0.000 -1.584 0.000) 1.584 6.701 ( 0.000 -3.136 0.000) 3.136 6.953 ( 0.000 -11.935 0.000) 11.935 6.986 ( 0.000 -10.601 0.000) 10.601 7.353 ( 0.000 -7.485 0.000) 7.485 7.572 ( 0.000 10.683 0.000) 10.683 7.612 ( 0.000 6.205 0.000) 6.205 7.777 ( 0.000 0.831 0.000) 0.831 7.914 ( 0.000 1.605 0.000) 1.605 8.281 ( 0.000 3.900 0.000) 3.900 8.448 ( 0.000 3.911 0.000) 3.911 8.470 ( 0.000 0.610 0.000) 0.610 8.717 ( 0.000 -1.964 0.000) 1.964 8.782 ( 0.000 0.287 0.000) 0.287 9.015 ( 0.000 -3.102 0.000) 3.102 9.068 ( 0.000 -1.745 0.000) 1.745 9.080 ( 0.000 -4.951 0.000) 4.951 9.102 ( 0.000 1.260 0.000) 1.260 9.135 ( 0.000 7.225 0.000) 7.225 9.281 ( 0.000 3.833 0.000) 3.833 9.302 ( 0.000 1.871 0.000) 1.871 9.391 ( 0.000 5.111 0.000) 5.111 9.523 ( 0.000 4.397 0.000) 4.397 9.707 ( 0.000 -3.170 0.000) 3.170 9.719 ( 0.000 -2.850 0.000) 2.850 9.904 ( 0.000 5.028 0.000) 5.028 10.296 ( 0.000 -5.441 0.000) 5.441 10.360 ( 0.000 -4.525 0.000) 4.525 10.572 ( 0.000 1.455 0.000) 1.455 10.597 ( 0.000 -3.509 0.000) 3.509 10.696 ( 0.000 0.146 0.000) 0.146 10.746 ( 0.000 3.234 0.000) 3.234 10.825 ( 0.000 5.417 0.000) 5.417 10.966 ( 0.000 -5.327 0.000) 5.327 11.269 ( 0.000 -3.255 0.000) 3.255 11.371 ( 0.000 3.301 0.000) 3.301 11.450 ( 0.000 3.394 0.000) 3.394 11.469 ( 0.000 -8.187 0.000) 8.187 11.612 ( 0.000 -5.292 0.000) 5.292 11.680 ( 0.000 -7.303 0.000) 7.303 11.850 ( 0.000 -8.203 0.000) 8.203 11.926 ( 0.000 -9.496 0.000) 9.496 12.125 ( 0.000 -12.774 0.000) 12.774 12.349 ( 0.000 1.121 0.000) 1.121 12.723 ( 0.000 -0.680 0.000) 0.680 12.973 ( 0.000 13.169 0.000) 13.169 12.976 ( 0.000 4.960 0.000) 4.960 13.036 ( 0.000 8.618 0.000) 8.618 13.536 ( 0.000 5.410 0.000) 5.410 13.554 ( 0.000 -0.396 0.000) 0.396 13.768 ( 0.000 5.046 0.000) 5.046 14.255 ( 0.000 -8.779 0.000) 8.779 14.492 ( 0.000 -5.221 0.000) 5.221 14.784 ( 0.000 8.967 0.000) 8.967 15.255 ( 0.000 -3.727 0.000) 3.727 15.310 ( 0.000 0.541 0.000) 0.541 15.461 ( 0.000 -0.372 0.000) 0.372 15.517 ( 0.000 -1.555 0.000) 1.555 15.706 ( 0.000 1.879 0.000) 1.879 15.798 ( 0.000 -1.799 0.000) 1.799 15.965 ( 0.000 2.382 0.000) 2.382 15.996 ( 0.000 10.899 0.000) 10.899 16.654 ( 0.000 -0.873 0.000) 0.873 16.893 ( 0.000 -5.662 0.000) 5.662 16.969 ( 0.000 -2.809 0.000) 2.809 18.810 ( 0.000 3.068 0.000) 3.068 19.338 ( 0.000 -4.781 0.000) 4.781 19.970 ( 0.000 -0.542 0.000) 0.542 19.999 ( 0.000 -0.676 0.000) 0.676 22.823 ( 0.000 1.975 0.000) 1.975 23.080 ( 0.000 -2.042 0.000) 2.042 23.134 ( 0.000 2.609 0.000) 2.609 23.421 ( 0.000 -1.965 0.000) 1.965 24.417 ( 0.000 0.501 0.000) 0.501 24.475 ( 0.000 -0.278 0.000) 0.278 25.106 ( 0.000 0.816 0.000) 0.816 25.194 ( 0.000 3.559 0.000) 3.559 25.370 ( 0.000 -4.277 0.000) 4.277 25.565 ( 0.000 -1.481 0.000) 1.481 27.873 ( 0.000 4.856 0.000) 4.856 28.606 ( 0.000 -7.507 0.000) 7.507 29.065 ( 0.000 10.528 0.000) 10.528 29.480 ( 0.000 0.951 0.000) 0.951 29.505 ( 0.000 2.050 0.000) 2.050 29.780 ( 0.000 -0.551 0.000) 0.551 29.873 ( 0.000 -0.137 0.000) 0.137 30.005 ( 0.000 -3.375 0.000) 3.375 30.064 ( 0.000 -0.242 0.000) 0.242 30.224 ( 0.000 1.501 0.000) 1.501 30.626 ( 0.000 -3.598 0.000) 3.598 30.662 ( 0.000 3.561 0.000) 3.561 30.942 ( 0.000 1.440 0.000) 1.440 31.508 ( 0.000 -1.644 0.000) 1.644 31.608 ( 0.000 3.429 0.000) 3.429 32.371 ( 0.000 -14.670 0.000) 14.670 33.623 ( 0.000 12.244 0.000) 12.244 34.480 ( 0.000 -4.835 0.000) 4.835 ======================= Grid point 8 (6/128) ======================= q-point: ( 0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.057 ( 24.707 28.898 5.735) 38.450 1.314 ( 30.128 36.039 4.969) 47.236 1.946 ( 56.347 40.745 -0.720) 69.539 2.350 ( 3.671 2.635 3.934) 5.991 2.881 ( 0.032 24.300 -1.317) 24.336 3.365 ( -5.685 5.158 -6.692) 10.184 3.553 ( -15.846 -1.278 4.282) 16.464 3.787 ( -7.592 -6.770 -2.204) 10.408 4.080 ( 0.460 6.374 9.184) 11.189 4.136 ( 3.089 -11.117 0.599) 11.554 4.230 ( 6.995 1.158 -6.136) 9.377 4.427 ( 1.615 2.941 -1.853) 3.833 4.805 ( -10.958 5.959 -1.067) 12.519 4.923 ( -9.693 -3.370 -0.541) 10.277 4.986 ( -0.079 7.386 2.802) 7.900 5.135 ( 3.772 -6.558 6.603) 10.041 5.263 ( 0.612 2.727 -1.048) 2.985 5.599 ( -11.902 4.298 0.884) 12.685 5.708 ( -7.198 17.111 -3.399) 18.872 5.830 ( 2.753 -6.638 -5.378) 8.975 6.132 ( -2.684 -4.947 3.125) 6.437 6.248 ( 2.317 -2.964 -4.238) 5.667 6.428 ( -2.092 -1.152 5.908) 6.372 6.663 ( -2.387 -2.696 -1.104) 3.766 6.699 ( 9.978 -5.518 0.398) 11.409 6.902 ( -3.300 -10.403 -2.058) 11.106 7.094 ( 7.078 -8.695 -1.561) 11.320 7.303 ( -1.787 -8.198 -9.144) 12.410 7.461 ( -5.160 8.954 3.312) 10.853 7.653 ( 1.135 7.850 -3.334) 8.604 7.750 ( -1.040 -0.469 -1.285) 1.718 7.910 ( 0.275 1.347 -3.441) 3.705 8.256 ( -1.887 2.900 -2.669) 4.369 8.466 ( 1.795 0.680 -1.682) 2.552 8.556 ( 3.426 -2.591 2.008) 4.742 8.654 ( -5.024 -1.702 1.793) 5.600 8.795 ( -0.975 0.073 4.043) 4.159 8.851 ( -4.460 5.689 -5.122) 8.860 8.986 ( -4.927 2.399 -5.578) 7.820 9.091 ( 1.790 0.017 3.453) 3.889 9.147 ( 2.889 4.711 3.692) 6.646 9.216 ( 5.466 1.131 -1.231) 5.716 9.283 ( -5.095 6.906 -4.244) 9.574 9.351 ( 1.476 -0.130 2.960) 3.310 9.453 ( 4.260 -0.177 6.407) 7.696 9.622 ( -5.348 0.039 4.402) 6.927 9.758 ( 3.401 -5.730 -6.843) 9.551 9.934 ( 6.460 0.544 0.161) 6.484 9.968 ( 21.698 -17.845 -3.258) 28.281 10.285 ( -1.653 -6.676 4.881) 8.433 10.397 ( 1.294 -3.117 -1.765) 3.809 10.544 ( -3.960 0.576 1.530) 4.284 10.603 ( -7.236 3.243 7.522) 10.930 10.670 ( 3.287 -3.127 1.237) 4.702 10.760 ( -0.937 -1.724 12.053) 12.211 10.854 ( 5.811 1.744 2.104) 6.421 11.019 ( 7.146 -10.207 -9.727) 15.807 11.256 ( 0.197 -6.000 -3.456) 6.927 11.376 ( 0.098 -0.174 -2.087) 2.097 11.423 ( -2.980 -4.268 7.648) 9.251 11.542 ( 4.535 1.068 -6.642) 8.113 11.589 ( 0.742 -6.483 -7.694) 10.088 11.659 ( -4.295 -8.977 0.273) 9.956 11.858 ( 0.299 -4.805 -0.613) 4.854 11.913 ( 1.345 -13.767 2.764) 14.106 12.184 ( 4.801 -9.170 -2.821) 10.728 12.311 ( -1.718 -0.254 0.076) 1.738 12.669 ( -3.677 3.411 0.793) 5.078 12.879 ( -4.094 7.917 -3.115) 9.441 12.988 ( -1.768 5.226 -16.437) 17.338 13.163 ( 10.361 5.428 -0.544) 11.709 13.317 ( -17.581 10.747 29.067) 35.630 13.623 ( -2.137 3.322 4.221) 5.781 13.694 ( -1.298 5.534 -15.920) 16.904 14.202 ( -6.172 -0.454 0.383) 6.200 14.444 ( -2.184 7.769 -3.027) 8.619 14.686 ( -3.475 5.160 -7.955) 10.099 15.191 ( -5.041 14.817 -2.868) 15.911 15.240 ( -1.914 -4.971 0.308) 5.336 15.440 ( -1.594 0.334 -1.690) 2.347 15.513 ( -0.124 -4.839 2.224) 5.327 15.671 ( -3.396 3.510 -0.629) 4.924 15.765 ( 0.770 -3.617 -2.711) 4.585 15.965 ( -1.805 -0.293 3.426) 3.883 16.021 ( 1.292 10.468 4.429) 11.439 16.440 ( -13.706 10.944 -4.334) 18.067 16.759 ( -3.574 9.386 2.230) 10.288 16.929 ( 1.080 -3.848 1.314) 4.207 18.930 ( 0.660 -9.732 11.683) 15.220 19.259 ( -6.380 -5.307 -5.481) 9.945 19.973 ( 2.278 -0.221 0.082) 2.290 20.075 ( 5.208 -1.876 2.144) 5.936 22.815 ( -0.736 2.097 -0.086) 2.224 23.071 ( -1.984 -0.157 3.030) 3.625 23.090 ( -0.575 2.739 -1.404) 3.131 23.412 ( -1.439 -1.901 2.555) 3.494 24.290 ( -0.494 3.858 -6.272) 7.381 24.461 ( -0.704 -0.399 -2.927) 3.037 25.219 ( 2.441 3.061 1.760) 4.293 25.533 ( 3.056 -2.487 3.245) 5.104 25.613 ( 17.259 -1.257 4.103) 17.785 26.558 ( 79.706 -69.292 7.796) 105.902 27.758 ( -12.127 4.973 -2.833) 13.410 28.554 ( -5.511 -10.685 0.157) 12.024 29.106 ( 3.956 9.192 0.507) 10.020 29.447 ( -2.579 -0.123 -1.085) 2.801 29.536 ( 1.899 3.195 1.413) 3.977 29.743 ( -4.646 -1.891 7.603) 9.109 29.893 ( 1.620 -0.127 -1.354) 2.115 30.006 ( 0.413 -2.733 -1.478) 3.135 30.075 ( 0.730 -2.322 1.725) 2.983 30.228 ( 0.904 3.214 -1.707) 3.750 30.526 ( -4.743 3.990 4.344) 7.568 30.798 ( 5.134 0.391 -3.108) 6.015 31.042 ( 10.853 -3.757 1.112) 11.538 31.484 ( -2.944 -0.617 1.973) 3.597 31.643 ( 4.078 1.943 -0.892) 4.604 32.346 ( -2.579 -14.324 -0.401) 14.560 33.479 ( -22.812 26.159 -10.162) 36.165 33.712 ( -35.579 31.146 -6.822) 47.775 ======================= Grid point 9 (7/128) ======================= q-point: ( 0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( 29.239 19.703 3.981) 35.482 1.850 ( 28.733 32.221 0.861) 43.180 2.405 ( -2.870 6.757 6.728) 9.958 2.747 ( -8.909 23.932 -4.619) 25.951 3.108 ( 38.246 9.911 6.679) 40.070 3.165 ( 7.657 7.523 -8.510) 13.698 3.324 ( -9.804 1.962 0.343) 10.004 3.735 ( 4.064 -6.947 -1.037) 8.115 4.115 ( 0.138 5.517 5.312) 7.660 4.165 ( 0.173 -5.232 1.759) 5.522 4.331 ( 5.077 -2.120 -4.916) 7.378 4.378 ( -9.612 -0.139 3.441) 10.211 4.563 ( -7.049 12.933 -4.327) 15.351 4.715 ( -14.859 -0.004 0.463) 14.866 5.033 ( 3.433 3.841 0.681) 5.196 5.212 ( -6.415 7.440 0.282) 9.828 5.245 ( 3.306 -5.749 2.631) 7.134 5.505 ( 2.512 0.635 3.543) 4.390 5.663 ( -0.065 11.458 -0.200) 11.460 5.834 ( -0.571 -1.558 -4.599) 4.889 6.064 ( -8.299 -6.492 0.856) 10.571 6.261 ( -12.154 -1.269 8.935) 15.138 6.279 ( 3.251 -2.485 -3.973) 5.704 6.621 ( -7.493 3.736 -6.432) 10.558 6.772 ( 0.932 -4.738 -0.269) 4.836 6.928 ( 8.749 -9.015 -2.449) 12.799 7.185 ( 2.827 -8.955 0.152) 9.392 7.279 ( 1.579 -11.356 -4.865) 12.454 7.438 ( 0.748 1.278 2.763) 3.135 7.657 ( 2.128 3.312 -2.939) 4.913 7.742 ( -0.739 -2.612 -0.319) 2.733 7.902 ( 0.277 2.734 -2.746) 3.885 8.212 ( -1.147 2.648 -3.436) 4.487 8.499 ( -5.215 -4.678 -0.824) 7.054 8.524 ( 0.610 1.630 0.892) 1.956 8.623 ( 2.463 -3.165 -2.260) 4.603 8.779 ( -1.848 -3.021 0.948) 3.666 8.815 ( 0.331 7.234 1.992) 7.510 8.918 ( -0.979 7.570 -2.506) 8.034 9.106 ( -0.893 0.763 4.419) 4.572 9.170 ( -3.894 6.598 -0.834) 7.707 9.238 ( 3.480 5.543 2.637) 7.056 9.347 ( 6.679 1.933 -1.678) 7.153 9.359 ( 0.119 -1.159 -0.313) 1.207 9.484 ( -2.079 0.594 2.442) 3.262 9.562 ( -2.843 3.004 2.810) 5.000 9.781 ( 4.108 -3.481 -7.953) 9.604 10.048 ( 4.143 2.486 9.341) 10.516 10.133 ( -7.538 -1.767 4.046) 8.736 10.278 ( 3.707 -10.645 -5.323) 12.465 10.369 ( -0.925 1.484 -6.716) 6.940 10.413 ( -3.451 2.026 3.419) 5.264 10.602 ( 0.475 -4.428 2.470) 5.093 10.701 ( 0.495 -3.017 -2.404) 3.889 10.906 ( 7.232 -6.152 17.997) 20.348 10.935 ( 2.528 1.079 2.487) 3.707 11.098 ( 1.716 -9.596 -0.033) 9.748 11.289 ( 6.380 -10.155 -9.379) 15.225 11.321 ( -6.606 -13.209 -1.302) 14.826 11.391 ( -0.805 -0.760 -3.348) 3.527 11.494 ( -4.720 -9.433 -0.514) 10.560 11.522 ( -5.176 -3.835 -0.141) 6.444 11.669 ( 5.079 -0.808 -6.779) 8.509 11.898 ( 4.157 -4.899 -3.332) 7.238 11.955 ( -0.063 -13.418 7.918) 15.580 12.189 ( -0.557 -4.254 -3.261) 5.389 12.398 ( 9.308 -6.638 -1.650) 11.551 12.636 ( -1.247 5.588 4.129) 7.059 12.773 ( -6.004 3.260 -1.866) 7.082 12.819 ( -8.443 3.701 -11.797) 14.972 13.196 ( -4.220 11.848 14.430) 19.142 13.365 ( 7.003 3.926 5.350) 9.648 13.514 ( -5.467 8.423 -3.833) 10.748 13.664 ( -0.025 4.989 -5.795) 7.647 14.096 ( -3.974 11.390 -1.001) 12.105 14.436 ( 1.105 8.560 -0.910) 8.679 14.640 ( -0.108 -5.596 -3.690) 6.704 15.134 ( -1.471 11.523 -0.825) 11.646 15.208 ( -1.268 -4.170 -0.495) 4.386 15.405 ( -1.086 3.392 -1.865) 4.020 15.525 ( 0.447 -7.789 2.074) 8.073 15.607 ( -2.917 1.389 -1.401) 3.522 15.791 ( 1.841 -1.741 1.166) 2.790 15.921 ( -3.659 0.331 2.091) 4.228 16.076 ( 2.831 8.535 3.030) 9.489 16.262 ( -6.227 11.324 -1.887) 13.060 16.733 ( -0.840 6.806 0.669) 6.890 16.957 ( 1.150 -4.407 0.970) 4.656 18.943 ( -1.917 -8.862 8.553) 12.464 19.115 ( -5.584 -6.437 -6.757) 10.876 20.033 ( 3.196 -0.457 0.190) 3.234 20.164 ( 3.319 -2.601 1.452) 4.459 22.800 ( -0.665 2.146 -0.156) 2.252 23.045 ( -1.766 0.958 2.162) 2.951 23.091 ( 0.462 0.846 -0.342) 1.023 23.398 ( -1.045 -1.936 2.364) 3.229 24.283 ( 1.412 2.304 -5.482) 6.112 24.436 ( -0.541 -0.317 -2.880) 2.948 25.285 ( 3.592 2.139 1.198) 4.348 25.516 ( -2.686 -1.189 3.002) 4.201 26.136 ( 31.924 1.063 6.924) 32.684 27.411 ( -20.646 1.509 -6.047) 21.566 27.529 ( 29.245 -42.436 0.258) 51.538 28.421 ( -8.644 -19.156 0.490) 21.022 29.196 ( 5.293 6.238 0.910) 8.231 29.384 ( -3.671 -0.781 -1.511) 4.046 29.564 ( 0.418 4.479 1.145) 4.642 29.697 ( -3.012 -2.561 5.324) 6.631 29.911 ( 0.671 -0.234 -0.337) 0.786 30.009 ( 0.496 -2.366 -1.387) 2.787 30.101 ( 1.138 -2.658 1.985) 3.507 30.243 ( 1.606 5.351 -2.814) 6.255 30.481 ( -2.315 7.045 3.278) 8.108 30.829 ( 0.744 5.601 -1.686) 5.897 31.205 ( 3.279 5.512 0.811) 6.464 31.455 ( 0.643 -10.770 1.130) 10.849 31.730 ( 4.655 1.122 0.057) 4.788 32.285 ( -3.454 -13.679 -0.464) 14.116 32.981 ( -12.717 35.625 -7.973) 38.657 33.422 ( -10.557 11.032 -0.264) 15.272 ======================= Grid point 10 (8/128) ======================= q-point: (-0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 0.000 15.959 0.000) 15.959 2.222 ( 0.000 13.640 0.000) 13.640 2.342 ( 0.000 22.258 0.000) 22.258 2.447 ( -0.000 26.883 -0.000) 26.883 3.053 ( 0.000 2.988 0.000) 2.988 3.211 ( 0.000 0.979 0.000) 0.979 3.829 ( -0.000 -7.107 -0.000) 7.107 3.837 ( 0.000 -1.514 0.000) 1.514 4.125 ( 0.000 0.370 0.000) 0.370 4.184 ( 0.000 2.143 -0.000) 2.143 4.299 ( -0.000 10.057 -0.000) 10.057 4.354 ( 0.000 -1.578 0.000) 1.578 4.395 ( 0.000 10.416 0.000) 10.416 4.518 ( 0.000 2.196 0.000) 2.196 5.081 ( 0.000 4.271 0.000) 4.271 5.132 ( -0.000 6.915 -0.000) 6.915 5.279 ( 0.000 -5.031 0.000) 5.031 5.529 ( 0.000 0.423 0.000) 0.423 5.661 ( 0.000 10.597 0.000) 10.597 5.790 ( 0.000 -0.132 0.000) 0.132 5.993 ( 0.000 -9.824 0.000) 9.824 6.166 ( 0.000 -2.800 0.000) 2.800 6.371 ( 0.000 1.963 0.000) 1.963 6.424 ( 0.000 3.694 0.000) 3.694 6.805 ( 0.000 -0.718 0.000) 0.718 7.017 ( 0.000 -8.488 -0.000) 8.488 7.219 ( 0.000 -8.868 -0.000) 8.868 7.267 ( 0.000 -12.919 -0.000) 12.919 7.471 ( 0.000 -2.402 0.000) 2.402 7.691 ( 0.000 5.859 -0.000) 5.859 7.719 ( 0.000 -10.749 0.000) 10.749 7.897 ( 0.000 3.890 0.000) 3.890 8.195 ( 0.000 3.703 0.000) 3.703 8.407 ( 0.000 -4.298 0.000) 4.298 8.561 ( 0.000 0.917 -0.000) 0.917 8.654 ( 0.000 -3.503 0.000) 3.503 8.756 ( 0.000 -6.815 0.000) 6.815 8.831 ( 0.000 7.036 0.000) 7.036 8.905 ( -0.000 10.006 -0.000) 10.006 9.098 ( 0.000 2.924 0.000) 2.924 9.139 ( 0.000 5.682 -0.000) 5.682 9.280 ( 0.000 8.074 0.000) 8.074 9.355 ( 0.000 -3.043 0.000) 3.043 9.420 ( -0.000 0.446 0.000) 0.446 9.449 ( 0.000 1.411 -0.000) 1.411 9.542 ( 0.000 3.792 0.000) 3.792 9.883 ( 0.000 -1.782 -0.000) 1.782 9.915 ( -0.000 2.459 0.000) 2.459 10.158 ( 0.000 6.027 0.000) 6.027 10.282 ( 0.000 -6.862 -0.000) 6.862 10.348 ( 0.000 3.028 -0.000) 3.028 10.422 ( 0.000 -3.187 0.000) 3.187 10.606 ( 0.000 -6.532 0.000) 6.532 10.698 ( 0.000 -2.832 -0.000) 2.832 10.958 ( 0.000 2.887 0.000) 2.887 11.093 ( 0.000 -8.696 -0.000) 8.696 11.098 ( -0.000 -13.939 0.000) 13.939 11.171 ( 0.000 -7.734 0.000) 7.734 11.338 ( 0.000 -2.565 0.000) 2.565 11.416 ( 0.000 -20.605 -0.000) 20.605 11.431 ( -0.000 -0.717 0.000) 0.717 11.460 ( 0.000 -5.497 0.000) 5.497 11.702 ( 0.000 3.407 -0.000) 3.407 11.932 ( 0.000 -7.619 0.000) 7.619 11.975 ( 0.000 -12.491 0.000) 12.491 12.182 ( 0.000 -7.124 -0.000) 7.124 12.533 ( 0.000 -7.180 0.000) 7.180 12.643 ( -0.000 6.195 -0.000) 6.195 12.653 ( 0.000 5.163 0.000) 5.163 12.707 ( 0.000 0.522 0.000) 0.522 13.192 ( 0.000 11.496 0.000) 11.496 13.443 ( 0.000 10.074 -0.000) 10.074 13.462 ( 0.000 2.443 0.000) 2.443 13.642 ( 0.000 6.506 -0.000) 6.506 14.059 ( 0.000 12.905 0.000) 12.905 14.448 ( 0.000 8.444 0.000) 8.444 14.633 ( 0.000 -8.477 0.000) 8.477 15.119 ( 0.000 9.312 0.000) 9.312 15.195 ( 0.000 -4.122 -0.000) 4.122 15.392 ( 0.000 5.377 -0.000) 5.377 15.542 ( 0.000 -11.079 -0.000) 11.079 15.566 ( 0.000 3.109 0.000) 3.109 15.822 ( 0.000 0.639 0.000) 0.639 15.878 ( 0.000 -0.241 0.000) 0.241 16.128 ( 0.000 5.675 0.000) 5.675 16.183 ( 0.000 12.901 0.000) 12.901 16.727 ( 0.000 6.131 0.000) 6.131 16.971 ( 0.000 -4.565 0.000) 4.565 18.948 ( 0.000 -7.864 0.000) 7.864 19.040 ( 0.000 -7.375 -0.000) 7.375 20.065 ( 0.000 -0.501 0.000) 0.501 20.198 ( 0.000 -2.765 -0.000) 2.765 22.793 ( 0.000 2.160 -0.000) 2.160 23.032 ( 0.000 0.910 -0.000) 0.910 23.096 ( 0.000 0.679 -0.000) 0.679 23.393 ( 0.000 -1.990 0.000) 1.990 24.285 ( 0.000 2.003 -0.000) 2.003 24.424 ( 0.000 -0.194 0.000) 0.194 25.329 ( 0.000 1.506 0.000) 1.506 25.490 ( 0.000 -0.739 0.000) 0.739 26.612 ( 0.000 2.716 0.000) 2.716 27.030 ( -0.000 4.043 -0.000) 4.043 27.823 ( 0.000 -25.816 0.000) 25.816 28.311 ( 0.000 -28.887 0.000) 28.887 29.283 ( 0.000 3.262 -0.000) 3.262 29.313 ( 0.000 0.691 0.000) 0.691 29.567 ( 0.000 4.706 0.000) 4.706 29.680 ( 0.000 -2.338 -0.000) 2.338 29.916 ( 0.000 -0.260 -0.000) 0.260 30.011 ( 0.000 -2.380 0.000) 2.380 30.119 ( 0.000 -2.356 0.000) 2.356 30.255 ( 0.000 6.207 0.000) 6.207 30.466 ( 0.000 8.968 -0.000) 8.968 30.831 ( 0.000 8.254 0.000) 8.254 31.212 ( 0.000 13.147 0.000) 13.147 31.481 ( 0.000 -17.496 0.000) 17.496 31.777 ( 0.000 1.601 0.000) 1.601 32.246 ( 0.000 -13.748 0.000) 13.748 32.887 ( 0.000 24.048 0.000) 24.048 33.306 ( 0.000 10.581 0.000) 10.581 ======================= Grid point 14 (9/128) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( 0.000 36.063 0.000) 36.063 1.677 ( 0.000 38.218 0.000) 38.218 2.287 ( 0.000 -4.407 0.000) 4.407 2.727 ( 0.000 57.605 0.000) 57.605 2.992 ( 0.000 -20.305 0.000) 20.305 3.523 ( 0.000 11.308 0.000) 11.308 3.649 ( 0.000 -3.954 0.000) 3.954 3.873 ( 0.000 9.706 0.000) 9.706 4.029 ( 0.000 5.103 0.000) 5.103 4.257 ( 0.000 3.945 0.000) 3.945 4.311 ( 0.000 15.442 0.000) 15.442 4.442 ( 0.000 -4.708 0.000) 4.708 4.767 ( 0.000 -16.261 0.000) 16.261 4.827 ( 0.000 -0.245 0.000) 0.245 5.045 ( 0.000 -9.414 0.000) 9.414 5.073 ( 0.000 -3.082 0.000) 3.082 5.276 ( 0.000 5.025 0.000) 5.025 5.613 ( 0.000 -9.365 0.000) 9.365 5.775 ( 0.000 4.643 0.000) 4.643 5.968 ( 0.000 -8.790 0.000) 8.790 6.117 ( 0.000 7.089 0.000) 7.089 6.288 ( 0.000 -4.915 0.000) 4.915 6.304 ( 0.000 2.944 0.000) 2.944 6.506 ( 0.000 -4.717 0.000) 4.717 6.635 ( 0.000 -1.094 0.000) 1.094 6.678 ( 0.000 -10.880 0.000) 10.880 6.841 ( 0.000 -4.805 0.000) 4.805 7.126 ( 0.000 -14.817 0.000) 14.817 7.672 ( 0.000 2.037 0.000) 2.037 7.758 ( 0.000 5.763 0.000) 5.763 7.899 ( 0.000 9.524 0.000) 9.524 7.999 ( 0.000 4.458 0.000) 4.458 8.299 ( 0.000 -0.524 0.000) 0.524 8.446 ( 0.000 -3.494 0.000) 3.494 8.500 ( 0.000 2.512 0.000) 2.512 8.657 ( 0.000 -3.620 0.000) 3.620 8.840 ( 0.000 3.805 0.000) 3.805 8.922 ( 0.000 -5.589 0.000) 5.589 8.977 ( 0.000 -3.598 0.000) 3.598 9.015 ( 0.000 -2.669 0.000) 2.669 9.217 ( 0.000 7.652 0.000) 7.652 9.304 ( 0.000 7.839 0.000) 7.839 9.366 ( 0.000 5.501 0.000) 5.501 9.381 ( 0.000 6.472 0.000) 6.472 9.445 ( 0.000 0.408 0.000) 0.408 9.608 ( 0.000 3.964 0.000) 3.964 9.636 ( 0.000 -4.236 0.000) 4.236 9.675 ( 0.000 -1.651 0.000) 1.651 10.030 ( 0.000 7.110 0.000) 7.110 10.201 ( 0.000 -3.640 0.000) 3.640 10.276 ( 0.000 -3.774 0.000) 3.774 10.557 ( 0.000 -12.735 0.000) 12.735 10.567 ( 0.000 0.841 0.000) 0.841 10.608 ( 0.000 -0.639 0.000) 0.639 10.811 ( 0.000 2.202 0.000) 2.202 10.892 ( 0.000 1.883 0.000) 1.883 10.979 ( 0.000 5.443 0.000) 5.443 11.082 ( 0.000 -8.549 0.000) 8.549 11.322 ( 0.000 -7.286 0.000) 7.286 11.414 ( 0.000 -1.177 0.000) 1.177 11.489 ( 0.000 0.270 0.000) 0.270 11.535 ( 0.000 0.818 0.000) 0.818 11.582 ( 0.000 -0.308 0.000) 0.308 11.716 ( 0.000 -5.857 0.000) 5.857 11.736 ( 0.000 -10.831 0.000) 10.831 11.852 ( 0.000 -13.927 0.000) 13.927 12.436 ( 0.000 7.077 0.000) 7.077 12.680 ( 0.000 -3.824 0.000) 3.824 13.067 ( 0.000 4.655 0.000) 4.655 13.159 ( 0.000 4.687 0.000) 4.687 13.282 ( 0.000 14.108 0.000) 14.108 13.588 ( 0.000 5.606 0.000) 5.606 13.591 ( 0.000 -0.566 0.000) 0.566 13.898 ( 0.000 8.357 0.000) 8.357 14.042 ( 0.000 -12.788 0.000) 12.788 14.322 ( 0.000 -11.266 0.000) 11.266 14.969 ( 0.000 7.408 0.000) 7.408 15.165 ( 0.000 -5.093 0.000) 5.093 15.386 ( 0.000 6.627 0.000) 6.627 15.451 ( 0.000 -0.419 0.000) 0.419 15.531 ( 0.000 4.679 0.000) 4.679 15.759 ( 0.000 3.125 0.000) 3.125 15.778 ( 0.000 -0.697 0.000) 0.697 15.963 ( 0.000 -3.581 0.000) 3.581 16.210 ( 0.000 10.569 0.000) 10.569 16.581 ( 0.000 -7.615 0.000) 7.615 16.801 ( 0.000 -1.788 0.000) 1.788 16.898 ( 0.000 -4.240 0.000) 4.240 18.902 ( 0.000 6.320 0.000) 6.320 19.211 ( 0.000 -7.969 0.000) 7.969 19.962 ( 0.000 -0.140 0.000) 0.140 19.982 ( 0.000 -0.938 0.000) 0.938 22.877 ( 0.000 3.440 0.000) 3.440 23.025 ( 0.000 -3.509 0.000) 3.509 23.202 ( 0.000 4.185 0.000) 4.185 23.367 ( 0.000 -3.567 0.000) 3.567 24.431 ( 0.000 0.875 0.000) 0.875 24.466 ( 0.000 -0.689 0.000) 0.689 25.134 ( 0.000 2.186 0.000) 2.186 25.277 ( 0.000 -4.889 0.000) 4.889 25.287 ( 0.000 5.761 0.000) 5.761 25.508 ( 0.000 -4.310 0.000) 4.310 28.008 ( 0.000 8.864 0.000) 8.864 28.422 ( 0.000 -10.896 0.000) 10.896 29.321 ( 0.000 14.287 0.000) 14.287 29.513 ( 0.000 2.767 0.000) 2.767 29.533 ( 0.000 0.314 0.000) 0.314 29.752 ( 0.000 -2.887 0.000) 2.887 29.873 ( 0.000 0.259 0.000) 0.259 29.940 ( 0.000 -3.135 0.000) 3.135 30.064 ( 0.000 0.413 0.000) 0.413 30.193 ( 0.000 -4.948 0.000) 4.948 30.592 ( 0.000 1.153 0.000) 1.153 30.701 ( 0.000 -0.652 0.000) 0.652 31.036 ( 0.000 8.939 0.000) 8.939 31.435 ( 0.000 -6.444 0.000) 6.444 31.698 ( 0.000 5.789 0.000) 5.789 32.068 ( 0.000 -14.814 0.000) 14.814 33.885 ( 0.000 13.833 0.000) 13.833 34.345 ( 0.000 -8.993 0.000) 8.993 ======================= Grid point 15 (10/128) ======================= q-point: ( 0.17 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( 17.017 28.819 6.531) 34.099 1.952 ( 26.442 30.641 2.948) 40.580 2.379 ( 7.856 -1.705 4.248) 9.092 2.897 ( 19.804 48.294 -1.781) 52.227 3.120 ( 12.857 -16.680 1.425) 21.108 3.466 ( -6.265 8.796 -9.831) 14.604 3.538 ( -9.161 1.674 3.841) 10.073 3.706 ( -12.656 13.017 -6.516) 19.289 4.087 ( 2.067 0.958 2.122) 3.114 4.267 ( -0.005 4.898 1.904) 5.255 4.318 ( 0.127 11.240 2.930) 11.617 4.390 ( -4.153 -5.727 1.512) 7.234 4.719 ( -5.932 -14.943 5.738) 17.071 4.905 ( 4.883 3.194 -4.750) 7.524 4.972 ( -4.762 -7.250 1.436) 8.792 5.114 ( 3.790 -1.476 -0.206) 4.072 5.323 ( 4.060 5.805 3.765) 8.022 5.644 ( 1.329 -7.379 -1.348) 7.618 5.719 ( -4.175 5.092 0.815) 6.635 5.969 ( -0.671 -5.865 -1.455) 6.080 6.014 ( -5.543 10.691 -5.220) 13.125 6.270 ( 0.444 2.781 -0.596) 2.878 6.376 ( -1.095 -2.593 7.019) 7.562 6.524 ( 1.321 -6.288 9.131) 11.165 6.638 ( 6.106 -7.335 -10.653) 14.303 6.684 ( -4.948 -10.801 8.708) 14.730 6.898 ( 6.860 -6.418 -7.953) 12.309 7.093 ( -0.441 -11.474 -9.550) 14.935 7.550 ( -9.775 1.742 2.615) 10.267 7.729 ( -7.139 -2.710 -1.897) 7.869 7.855 ( -0.638 10.742 -2.724) 11.101 7.998 ( -0.552 4.887 -2.590) 5.559 8.266 ( -1.517 -0.321 -5.893) 6.094 8.436 ( 0.588 -3.740 -2.703) 4.652 8.540 ( 2.007 0.196 -0.427) 2.061 8.626 ( -3.119 -1.923 -0.446) 3.691 8.821 ( -3.138 3.261 5.085) 6.807 8.927 ( 0.719 -0.332 -0.988) 1.266 8.982 ( 0.996 0.405 1.620) 1.945 9.101 ( 5.524 -0.205 6.759) 8.731 9.237 ( -0.480 5.352 3.938) 6.662 9.256 ( -0.139 1.274 3.091) 3.346 9.388 ( -0.023 4.424 -3.389) 5.573 9.416 ( -0.299 4.423 -0.966) 4.537 9.476 ( 7.078 4.924 -1.318) 8.722 9.638 ( -0.865 0.602 1.204) 1.600 9.660 ( 5.192 -2.125 -5.314) 7.727 9.746 ( 8.620 -3.267 0.520) 9.233 10.053 ( 2.747 3.765 0.381) 4.676 10.204 ( -1.251 -1.670 4.907) 5.332 10.291 ( 1.888 -5.404 -0.844) 5.786 10.545 ( -3.835 -2.832 -0.248) 4.774 10.582 ( 2.081 -6.815 -1.110) 7.211 10.608 ( 0.060 -2.385 4.530) 5.120 10.806 ( -9.012 6.803 6.406) 12.982 10.874 ( 4.095 -2.318 -2.722) 5.436 10.958 ( 0.098 5.128 1.565) 5.362 11.058 ( -0.953 -10.714 -1.863) 10.916 11.284 ( -5.383 -5.268 6.505) 9.952 11.358 ( -6.950 -12.236 2.245) 14.250 11.451 ( -2.589 0.520 -1.456) 3.016 11.532 ( -3.759 -2.104 -1.468) 4.551 11.588 ( 2.707 3.104 -6.035) 7.306 11.720 ( 3.194 -6.902 0.300) 7.611 11.765 ( 5.684 -4.957 -1.556) 7.701 11.963 ( 9.223 -11.967 -6.524) 16.457 12.397 ( -3.505 7.460 0.695) 8.271 12.661 ( -1.337 -3.627 -0.752) 3.938 13.000 ( -7.516 4.269 2.541) 9.009 13.074 ( -8.068 2.374 -6.408) 10.573 13.341 ( 6.115 11.447 -3.347) 13.402 13.504 ( -6.358 9.843 16.817) 20.497 13.658 ( 3.330 0.053 -5.183) 6.161 13.848 ( -2.451 10.227 -7.968) 13.195 14.043 ( -0.278 -11.709 1.226) 11.776 14.343 ( 2.005 -11.570 0.606) 11.758 14.913 ( -4.550 10.436 -4.075) 12.092 15.150 ( -1.360 -4.537 -0.143) 4.738 15.358 ( -2.453 3.041 -3.517) 5.257 15.393 ( -5.163 -2.317 -2.324) 6.117 15.549 ( 1.537 8.037 1.192) 8.269 15.721 ( -4.106 1.361 -2.361) 4.928 15.771 ( 1.348 2.842 0.527) 3.189 15.942 ( -1.374 -2.923 -0.022) 3.230 16.222 ( 0.252 9.940 3.384) 10.503 16.527 ( -3.943 -0.647 -1.763) 4.368 16.812 ( 0.599 -2.426 2.877) 3.811 16.899 ( -1.128 -0.463 3.568) 3.771 18.851 ( -4.818 1.562 2.520) 5.657 19.120 ( -7.734 -8.523 -4.393) 12.319 19.977 ( 2.279 0.661 0.407) 2.408 20.035 ( 3.896 -2.101 1.829) 4.790 22.870 ( -0.699 3.524 0.340) 3.609 23.021 ( -0.794 -3.507 1.501) 3.896 23.180 ( -1.561 5.013 0.216) 5.255 23.358 ( -1.263 -3.615 1.868) 4.261 24.362 ( -1.706 3.306 -5.683) 6.792 24.446 ( -0.780 -1.142 -3.592) 3.849 25.300 ( 1.430 5.008 1.993) 5.577 25.482 ( 3.322 -2.895 3.059) 5.365 25.574 ( 22.604 -1.953 4.718) 23.174 25.795 ( 53.519 -19.391 8.884) 57.613 27.896 ( -11.881 9.087 -2.727) 15.204 28.332 ( -9.503 -12.097 -1.447) 15.451 29.303 ( -1.119 9.835 -0.307) 9.903 29.452 ( -4.279 0.315 -0.152) 4.293 29.594 ( 2.929 2.797 2.159) 4.589 29.715 ( -2.622 -1.749 -0.798) 3.251 29.894 ( 1.482 0.172 -0.700) 1.648 29.945 ( 0.384 -2.998 0.579) 3.077 30.072 ( 1.284 1.581 0.686) 2.149 30.230 ( 2.791 -3.394 0.768) 4.461 30.588 ( 0.510 4.065 -0.247) 4.104 30.797 ( 8.820 -3.627 -0.751) 9.566 31.054 ( 1.938 7.570 0.660) 7.842 31.442 ( -0.060 -5.392 1.975) 5.742 31.717 ( 2.331 5.358 0.108) 5.844 32.056 ( -1.226 -13.774 -0.046) 13.828 33.779 ( -10.756 12.356 -2.602) 16.587 34.036 ( -26.515 3.410 -6.663) 27.551 ======================= Grid point 16 (11/128) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( 22.439 22.620 3.942) 32.104 2.449 ( 23.712 20.212 3.888) 31.399 2.532 ( 4.404 9.788 6.491) 12.543 3.140 ( -11.449 9.010 -7.282) 16.287 3.305 ( -0.482 5.162 6.798) 8.549 3.408 ( -14.604 11.628 -7.167) 19.996 3.461 ( 19.631 -5.165 0.839) 20.316 3.557 ( 20.915 21.327 -8.509) 31.060 4.101 ( -0.585 -3.912 1.588) 4.263 4.214 ( -6.107 2.412 4.000) 7.689 4.332 ( 1.024 1.765 -1.806) 2.725 4.391 ( 1.399 2.446 6.135) 6.751 4.612 ( -7.826 -8.989 5.025) 12.934 4.767 ( -9.762 0.390 -2.359) 10.050 5.068 ( 7.330 2.083 -2.359) 7.977 5.183 ( 4.240 0.052 -2.944) 5.163 5.387 ( -3.451 10.017 4.742) 11.607 5.548 ( -3.700 4.363 1.476) 5.908 5.767 ( 4.637 -2.320 -0.405) 5.200 5.915 ( -0.843 11.270 -2.086) 11.493 5.967 ( -3.685 -4.309 2.251) 6.100 6.204 ( -13.496 -1.565 1.880) 13.716 6.306 ( 2.767 3.065 0.638) 4.178 6.570 ( -6.355 -8.316 4.385) 11.347 6.659 ( 7.829 -5.987 -1.969) 10.050 6.760 ( 5.802 -9.026 -4.468) 11.623 6.974 ( 3.495 -9.454 -1.186) 10.149 7.058 ( 0.171 -9.167 -7.212) 11.665 7.417 ( -4.737 -2.655 3.026) 6.217 7.569 ( -6.931 -8.260 -4.346) 11.626 7.820 ( -1.861 6.802 -2.370) 7.439 7.973 ( -1.040 2.135 -1.752) 2.952 8.228 ( 0.712 -0.293 -6.800) 6.843 8.382 ( -6.081 -5.941 -0.929) 8.552 8.574 ( 2.014 -0.553 -2.099) 2.961 8.586 ( 0.309 1.848 0.235) 1.888 8.764 ( -4.400 3.342 2.784) 6.187 8.923 ( -0.757 -0.554 -0.514) 1.070 9.041 ( 3.836 7.508 4.285) 9.458 9.216 ( 2.136 9.392 2.484) 9.947 9.225 ( -0.827 -1.304 8.249) 8.393 9.303 ( 2.560 2.412 3.576) 5.016 9.395 ( 0.073 4.534 -2.375) 5.119 9.430 ( 1.973 2.743 2.096) 3.976 9.527 ( -0.092 4.596 -7.917) 9.155 9.621 ( 1.472 3.021 0.589) 3.412 9.764 ( 7.475 0.980 -6.623) 10.035 9.933 ( 10.774 -7.482 -3.676) 13.622 10.143 ( 4.956 -1.258 6.013) 7.893 10.167 ( -5.909 0.765 6.534) 8.843 10.339 ( 4.549 -7.536 -5.160) 10.204 10.432 ( -6.613 0.102 0.832) 6.666 10.552 ( -7.839 -0.257 7.533) 10.875 10.630 ( -1.623 -13.008 7.496) 15.101 10.694 ( -0.863 -0.248 -2.990) 3.122 10.956 ( 2.003 -3.888 -0.927) 4.470 10.981 ( 3.320 -0.328 -0.455) 3.367 11.043 ( -1.282 -8.051 -1.183) 8.237 11.155 ( -6.940 -8.660 -1.884) 11.256 11.255 ( -4.042 -10.142 3.926) 11.602 11.408 ( -1.878 -0.085 1.680) 2.521 11.460 ( -3.950 -2.725 -1.223) 4.952 11.609 ( 2.748 0.108 -4.252) 5.064 11.831 ( 6.831 -1.791 -0.142) 7.063 11.870 ( 6.102 -2.501 -1.440) 6.750 12.052 ( 1.254 -8.561 -4.583) 9.792 12.376 ( 2.836 4.498 -0.443) 5.335 12.644 ( -0.076 -4.315 -0.234) 4.322 12.839 ( -10.088 2.968 2.432) 10.793 12.868 ( -10.294 1.667 -3.588) 11.028 13.432 ( 4.381 10.650 -2.815) 11.855 13.498 ( -0.865 10.644 8.039) 13.367 13.680 ( 0.186 1.738 3.371) 3.797 13.784 ( -0.592 13.110 -9.274) 16.070 14.040 ( -0.418 -10.108 0.743) 10.144 14.390 ( 2.220 -12.605 1.444) 12.881 14.810 ( -3.821 14.778 -4.927) 16.040 15.130 ( -0.425 -3.377 0.519) 3.443 15.248 ( -5.643 -0.210 -4.960) 7.516 15.328 ( -1.875 -7.055 -0.431) 7.313 15.576 ( 0.795 9.232 0.383) 9.274 15.652 ( -2.466 2.459 -1.236) 3.695 15.816 ( 2.801 2.923 1.904) 4.474 15.918 ( -1.684 -1.073 0.540) 2.069 16.238 ( 0.103 8.707 2.439) 9.042 16.461 ( -2.505 6.687 -0.811) 7.187 16.838 ( 0.526 -0.647 4.002) 4.088 16.884 ( -1.084 1.147 0.244) 1.597 18.791 ( -2.579 -4.750 3.870) 6.648 18.954 ( -7.060 -9.293 -5.353) 12.840 20.033 ( 2.909 0.626 0.383) 3.000 20.107 ( 2.855 -2.937 1.349) 4.313 22.858 ( -0.702 3.637 0.294) 3.716 23.010 ( -0.997 -3.359 1.539) 3.827 23.162 ( -0.601 4.980 0.247) 5.022 23.343 ( -0.996 -3.670 1.752) 4.187 24.337 ( 0.640 2.952 -4.906) 5.762 24.422 ( -0.207 -1.159 -3.401) 3.599 25.342 ( 2.072 3.596 1.557) 4.433 25.480 ( -1.600 -2.635 2.547) 3.999 26.186 ( 35.811 4.792 7.439) 36.888 26.758 ( 43.940 -29.613 6.575) 53.394 27.560 ( -22.609 9.359 -4.756) 24.927 28.072 ( -17.779 -16.735 -2.573) 24.552 29.297 ( 0.553 4.090 0.018) 4.128 29.374 ( -3.677 -0.543 -0.607) 3.766 29.633 ( 0.167 2.397 4.011) 4.675 29.675 ( -0.960 -0.308 -2.928) 3.097 29.911 ( 0.604 0.242 0.023) 0.651 29.955 ( 0.462 -2.502 0.133) 2.548 30.111 ( 1.971 3.008 1.181) 3.785 30.275 ( 1.751 -2.001 0.104) 2.661 30.612 ( 1.868 7.441 -0.638) 7.698 30.949 ( 6.843 -0.999 -0.243) 6.920 31.115 ( 4.082 0.087 0.566) 4.122 31.432 ( -2.075 -0.813 1.962) 2.969 31.788 ( 4.846 3.929 0.499) 6.259 32.027 ( -1.900 -10.963 0.120) 11.128 33.475 ( -17.863 15.786 -5.564) 24.480 33.614 ( -14.160 6.941 -2.579) 15.979 ======================= Grid point 17 (12/128) ======================= q-point: (-0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( -0.000 18.731 0.000) 18.731 2.504 ( 0.000 12.994 0.000) 12.994 2.753 ( 0.000 16.105 0.000) 16.105 2.955 ( 0.000 11.448 0.000) 11.448 3.175 ( 0.000 17.955 0.000) 17.955 3.284 ( 0.000 6.840 -0.000) 6.840 3.685 ( 0.000 -7.196 0.000) 7.196 3.826 ( 0.000 -1.597 0.000) 1.597 4.159 ( -0.000 2.687 0.000) 2.687 4.183 ( 0.000 2.637 0.000) 2.637 4.285 ( 0.000 -1.641 -0.000) 1.641 4.412 ( 0.000 -4.250 0.000) 4.250 4.545 ( 0.000 8.777 0.000) 8.777 4.638 ( 0.000 -1.723 0.000) 1.723 5.153 ( 0.000 3.295 -0.000) 3.295 5.225 ( 0.000 1.709 -0.000) 1.709 5.318 ( -0.000 12.439 0.000) 12.439 5.505 ( 0.000 -0.637 -0.000) 0.637 5.816 ( 0.000 2.258 0.000) 2.258 5.901 ( 0.000 3.153 0.000) 3.153 5.918 ( 0.000 9.397 0.000) 9.397 6.090 ( 0.000 -3.838 -0.000) 3.838 6.415 ( 0.000 2.292 -0.000) 2.292 6.420 ( -0.000 -2.867 0.000) 2.867 6.730 ( 0.000 -6.755 0.000) 6.755 6.827 ( 0.000 -11.185 -0.000) 11.185 7.003 ( 0.000 -10.130 0.000) 10.130 7.036 ( 0.000 -9.373 -0.000) 9.373 7.403 ( 0.000 -4.948 0.000) 4.948 7.481 ( 0.000 -11.551 -0.000) 11.551 7.798 ( 0.000 5.172 0.000) 5.172 7.955 ( 0.000 0.816 -0.000) 0.816 8.239 ( 0.000 0.361 -0.000) 0.361 8.290 ( -0.000 -6.345 0.000) 6.345 8.589 ( 0.000 0.175 -0.000) 0.175 8.601 ( 0.000 -1.103 0.000) 1.103 8.721 ( 0.000 5.095 -0.000) 5.095 8.911 ( 0.000 -0.552 0.000) 0.552 9.122 ( -0.000 10.516 -0.000) 10.516 9.169 ( 0.000 4.380 0.000) 4.380 9.304 ( 0.000 9.589 0.000) 9.589 9.306 ( -0.000 -0.364 -0.000) 0.364 9.432 ( 0.000 5.539 0.000) 5.539 9.453 ( 0.000 -0.721 0.000) 0.721 9.453 ( -0.000 3.889 -0.000) 3.889 9.655 ( 0.000 7.365 0.000) 7.365 9.859 ( 0.000 -2.545 -0.000) 2.545 10.012 ( -0.000 7.385 0.000) 7.385 10.099 ( 0.000 -7.193 -0.000) 7.193 10.221 ( 0.000 -3.266 -0.000) 3.266 10.361 ( 0.000 -2.835 0.000) 2.835 10.409 ( 0.000 1.978 -0.000) 1.978 10.464 ( -0.000 -5.462 0.000) 5.462 10.601 ( -0.000 -22.306 0.000) 22.306 10.692 ( 0.000 -3.535 -0.000) 3.535 10.950 ( 0.000 -10.026 -0.000) 10.026 11.014 ( 0.000 -3.338 -0.000) 3.338 11.022 ( 0.000 1.712 0.000) 1.712 11.115 ( 0.000 -8.450 0.000) 8.450 11.225 ( 0.000 -9.135 0.000) 9.135 11.393 ( -0.000 -2.526 -0.000) 2.526 11.412 ( 0.000 -2.567 0.000) 2.567 11.633 ( 0.000 0.901 0.000) 0.901 11.899 ( 0.000 1.502 0.000) 1.502 11.968 ( 0.000 2.827 -0.000) 2.827 12.000 ( 0.000 -11.006 0.000) 11.006 12.441 ( 0.000 -0.682 -0.000) 0.682 12.647 ( 0.000 -5.295 0.000) 5.295 12.736 ( -0.000 3.155 -0.000) 3.155 12.737 ( 0.000 2.440 0.000) 2.440 13.467 ( 0.000 15.454 0.000) 15.454 13.506 ( 0.000 4.883 0.000) 4.883 13.699 ( 0.000 -0.391 -0.000) 0.391 13.753 ( 0.000 17.671 0.000) 17.671 14.037 ( 0.000 -9.328 0.000) 9.328 14.417 ( 0.000 -13.689 -0.000) 13.689 14.762 ( 0.000 16.549 0.000) 16.549 15.146 ( 0.000 -0.062 0.000) 0.062 15.163 ( -0.000 -4.566 -0.000) 4.566 15.310 ( 0.000 -9.079 -0.000) 9.079 15.583 ( 0.000 8.807 -0.000) 8.807 15.626 ( 0.000 2.849 -0.000) 2.849 15.867 ( -0.000 2.569 -0.000) 2.569 15.885 ( 0.000 0.575 0.000) 0.575 16.244 ( 0.000 7.794 0.000) 7.794 16.435 ( 0.000 9.479 0.000) 9.479 16.855 ( 0.000 5.349 -0.000) 5.349 16.871 ( 0.000 -3.875 0.000) 3.875 18.785 ( 0.000 -7.092 -0.000) 7.092 18.864 ( 0.000 -9.416 0.000) 9.416 20.063 ( 0.000 0.480 0.000) 0.480 20.137 ( 0.000 -3.115 0.000) 3.115 22.851 ( 0.000 3.672 -0.000) 3.672 23.002 ( 0.000 -3.199 0.000) 3.199 23.157 ( 0.000 4.751 -0.000) 4.751 23.338 ( 0.000 -3.715 0.000) 3.715 24.334 ( 0.000 2.730 -0.000) 2.730 24.413 ( 0.000 -1.022 0.000) 1.022 25.369 ( 0.000 2.530 0.000) 2.530 25.466 ( 0.000 -1.813 0.000) 1.813 26.703 ( 0.000 7.090 0.000) 7.090 27.122 ( -0.000 1.743 0.000) 1.743 27.346 ( 0.000 -16.745 0.000) 16.745 27.784 ( 0.000 -23.512 0.000) 23.512 29.318 ( 0.000 0.858 0.000) 0.858 29.324 ( 0.000 0.389 -0.000) 0.389 29.642 ( 0.000 2.431 -0.000) 2.431 29.658 ( 0.000 -0.145 0.000) 0.145 29.916 ( 0.000 0.287 -0.000) 0.287 29.960 ( 0.000 -2.301 0.000) 2.301 30.133 ( 0.000 3.200 0.000) 3.200 30.292 ( 0.000 -1.810 0.000) 1.810 30.631 ( 0.000 8.748 -0.000) 8.748 31.016 ( 0.000 3.684 0.000) 3.684 31.164 ( 0.000 -7.365 0.000) 7.365 31.406 ( 0.000 3.688 0.000) 3.688 31.850 ( 0.000 3.976 0.000) 3.976 32.001 ( 0.000 -9.356 0.000) 9.356 33.288 ( 0.000 15.746 0.000) 15.746 33.471 ( 0.000 5.177 -0.000) 5.177 ======================= Grid point 21 (13/128) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 64 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( 0.000 -23.613 0.000) 23.613 2.022 ( 0.000 23.613 0.000) 23.613 2.376 ( 0.000 -35.031 0.000) 35.031 2.376 ( 0.000 35.031 0.000) 35.031 3.517 ( 0.000 -14.880 0.000) 14.880 3.517 ( 0.000 14.880 0.000) 14.880 3.874 ( 0.000 -27.087 0.000) 27.087 3.874 ( 0.000 27.087 0.000) 27.087 4.115 ( 0.000 -10.503 0.000) 10.503 4.115 ( 0.000 10.503 0.000) 10.503 4.451 ( 0.000 -8.039 0.000) 8.039 4.451 ( 0.000 8.039 0.000) 8.039 4.740 ( 0.000 -18.950 0.000) 18.950 4.740 ( 0.000 18.950 0.000) 18.950 4.926 ( 0.000 -8.600 0.000) 8.600 4.926 ( 0.000 8.600 0.000) 8.600 5.433 ( 0.000 -9.541 0.000) 9.541 5.433 ( 0.000 9.541 0.000) 9.541 5.852 ( 0.000 -3.735 0.000) 3.735 5.852 ( 0.000 3.735 0.000) 3.735 6.214 ( 0.000 -3.679 0.000) 3.679 6.214 ( 0.000 3.679 0.000) 3.679 6.365 ( 0.000 -5.150 0.000) 5.150 6.365 ( 0.000 5.150 0.000) 5.150 6.656 ( 0.000 -2.343 0.000) 2.343 6.656 ( 0.000 2.343 0.000) 2.343 6.847 ( 0.000 -10.365 0.000) 10.365 6.847 ( 0.000 10.365 0.000) 10.365 7.749 ( 0.000 -5.103 0.000) 5.103 7.749 ( 0.000 5.103 0.000) 5.103 8.027 ( 0.000 -2.351 0.000) 2.351 8.027 ( 0.000 2.351 0.000) 2.351 8.349 ( 0.000 -5.107 0.000) 5.107 8.349 ( 0.000 5.107 0.000) 5.107 8.578 ( 0.000 -5.148 0.000) 5.148 8.578 ( 0.000 5.148 0.000) 5.148 8.844 ( 0.000 -0.280 0.000) 0.280 8.844 ( 0.000 0.280 0.000) 0.280 8.983 ( 0.000 -1.582 0.000) 1.582 8.983 ( 0.000 1.582 0.000) 1.582 9.336 ( 0.000 -4.057 0.000) 4.057 9.336 ( 0.000 4.057 0.000) 4.057 9.456 ( 0.000 -1.112 0.000) 1.112 9.456 ( 0.000 1.112 0.000) 1.112 9.527 ( 0.000 -6.863 0.000) 6.863 9.527 ( 0.000 6.863 0.000) 6.863 9.658 ( 0.000 -0.766 0.000) 0.766 9.658 ( 0.000 0.766 0.000) 0.766 10.152 ( 0.000 -3.994 0.000) 3.994 10.152 ( 0.000 3.994 0.000) 3.994 10.267 ( 0.000 -8.024 0.000) 8.024 10.267 ( 0.000 8.024 0.000) 8.024 10.602 ( 0.000 -1.462 0.000) 1.462 10.602 ( 0.000 1.462 0.000) 1.462 10.867 ( 0.000 -5.885 0.000) 5.885 10.867 ( 0.000 5.885 0.000) 5.885 11.054 ( 0.000 -9.604 0.000) 9.604 11.054 ( 0.000 9.604 0.000) 9.604 11.301 ( 0.000 -8.157 0.000) 8.157 11.301 ( 0.000 8.157 0.000) 8.157 11.522 ( 0.000 -5.697 0.000) 5.697 11.522 ( 0.000 5.697 0.000) 5.697 11.627 ( 0.000 -4.258 0.000) 4.258 11.627 ( 0.000 4.258 0.000) 4.258 11.651 ( 0.000 -0.626 0.000) 0.626 11.651 ( 0.000 0.626 0.000) 0.626 12.577 ( 0.000 -6.676 0.000) 6.676 12.577 ( 0.000 6.676 0.000) 6.676 13.154 ( 0.000 -3.724 0.000) 3.724 13.154 ( 0.000 3.724 0.000) 3.724 13.506 ( 0.000 -8.236 0.000) 8.236 13.506 ( 0.000 8.236 0.000) 8.236 13.784 ( 0.000 -13.029 0.000) 13.029 13.784 ( 0.000 13.029 0.000) 13.029 14.092 ( 0.000 -11.550 0.000) 11.550 14.092 ( 0.000 11.550 0.000) 11.550 15.072 ( 0.000 -4.472 0.000) 4.472 15.072 ( 0.000 4.472 0.000) 4.472 15.445 ( 0.000 -0.550 0.000) 0.550 15.445 ( 0.000 0.550 0.000) 0.550 15.720 ( 0.000 -8.405 0.000) 8.405 15.720 ( 0.000 8.405 0.000) 8.405 15.834 ( 0.000 -6.356 0.000) 6.356 15.834 ( 0.000 6.356 0.000) 6.356 16.403 ( 0.000 -9.619 0.000) 9.619 16.403 ( 0.000 9.619 0.000) 9.619 16.822 ( 0.000 -3.102 0.000) 3.102 16.822 ( 0.000 3.102 0.000) 3.102 19.048 ( 0.000 -8.405 0.000) 8.405 19.048 ( 0.000 8.405 0.000) 8.405 19.967 ( 0.000 -0.596 0.000) 0.596 19.967 ( 0.000 0.596 0.000) 0.596 22.950 ( 0.000 -4.009 0.000) 4.009 22.950 ( 0.000 4.009 0.000) 4.009 23.288 ( 0.000 -4.428 0.000) 4.428 23.288 ( 0.000 4.428 0.000) 4.428 24.449 ( 0.000 -0.959 0.000) 0.959 24.449 ( 0.000 0.959 0.000) 0.959 25.192 ( 0.000 -3.729 0.000) 3.729 25.192 ( 0.000 3.729 0.000) 3.729 25.405 ( 0.000 -6.064 0.000) 6.064 25.405 ( 0.000 6.064 0.000) 6.064 28.205 ( 0.000 -11.067 0.000) 11.067 28.205 ( 0.000 11.067 0.000) 11.067 29.507 ( 0.000 -3.545 0.000) 3.545 29.507 ( 0.000 3.545 0.000) 3.545 29.635 ( 0.000 -9.248 0.000) 9.248 29.635 ( 0.000 9.248 0.000) 9.248 29.890 ( 0.000 -1.740 0.000) 1.740 29.890 ( 0.000 1.740 0.000) 1.740 30.096 ( 0.000 -3.471 0.000) 3.471 30.096 ( 0.000 3.471 0.000) 3.471 30.650 ( 0.000 -3.734 0.000) 3.734 30.650 ( 0.000 3.734 0.000) 3.734 31.252 ( 0.000 -11.716 0.000) 11.716 31.252 ( 0.000 11.716 0.000) 11.716 31.837 ( 0.000 -9.034 0.000) 9.034 31.837 ( 0.000 9.034 0.000) 9.034 34.139 ( 0.000 -12.089 0.000) 12.089 34.139 ( 0.000 12.089 0.000) 12.089 ======================= Grid point 23 (14/128) ======================= q-point: ( 0.17 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( 9.473 -18.096 5.494) 21.151 2.113 ( 9.473 18.096 5.494) 21.151 2.602 ( 21.117 -28.670 0.143) 35.608 2.602 ( 21.117 28.670 0.143) 35.608 3.454 ( -6.201 -7.790 -1.860) 10.129 3.454 ( -6.201 7.790 -1.860) 10.129 3.890 ( 0.961 -20.862 -1.202) 20.919 3.890 ( 0.961 20.862 -1.202) 20.919 4.065 ( -2.931 -14.896 -1.763) 15.283 4.065 ( -2.931 14.896 -1.763) 15.283 4.418 ( -3.867 -9.728 4.653) 11.456 4.418 ( -3.867 9.728 4.653) 11.456 4.698 ( -4.355 -17.425 0.652) 17.973 4.698 ( -4.355 17.425 0.652) 17.973 5.018 ( 8.983 -7.561 -4.701) 12.647 5.018 ( 8.983 7.561 -4.701) 12.647 5.479 ( 3.211 -8.949 7.648) 12.202 5.479 ( 3.211 8.949 7.648) 12.202 5.830 ( -1.345 -5.805 -1.458) 6.135 5.830 ( -1.345 5.805 -1.458) 6.135 6.238 ( 0.951 -7.750 -2.151) 8.099 6.238 ( 0.951 7.750 -2.151) 8.099 6.434 ( 4.414 -8.421 -1.838) 9.684 6.434 ( 4.414 8.421 -1.838) 9.684 6.512 ( -9.026 -6.493 7.315) 13.309 6.512 ( -9.026 6.493 7.315) 13.309 6.910 ( 4.979 -6.438 -7.474) 11.050 6.910 ( 4.979 6.438 -7.474) 11.050 7.624 ( -10.889 -6.325 -2.218) 12.786 7.624 ( -10.889 6.325 -2.218) 12.786 8.008 ( -2.648 -4.052 -1.179) 4.982 8.008 ( -2.648 4.052 -1.179) 4.982 8.332 ( -0.555 -6.102 -6.355) 8.827 8.332 ( -0.555 6.102 -6.355) 8.827 8.574 ( -0.037 -3.254 0.325) 3.271 8.574 ( -0.037 3.254 0.325) 3.271 8.864 ( 0.398 -2.456 3.440) 4.245 8.864 ( 0.398 2.456 3.440) 4.245 9.060 ( 5.733 -3.859 5.774) 9.005 9.060 ( 5.733 3.859 5.774) 9.005 9.288 ( -2.874 -1.007 4.035) 5.055 9.288 ( -2.874 1.007 4.035) 5.055 9.445 ( 0.554 -1.627 -1.970) 2.614 9.445 ( 0.554 1.627 -1.970) 2.614 9.626 ( 2.647 -3.826 -1.661) 4.940 9.626 ( 2.647 3.826 -1.661) 4.940 9.667 ( 7.097 -4.053 -3.817) 9.020 9.667 ( 7.097 4.053 -3.817) 9.020 10.127 ( -2.266 -6.817 2.655) 7.658 10.127 ( -2.266 6.817 2.655) 7.658 10.315 ( 3.182 -8.748 -1.106) 9.374 10.315 ( 3.182 8.748 -1.106) 9.374 10.588 ( -1.188 -1.305 0.099) 1.768 10.588 ( -1.188 1.305 0.099) 1.768 10.896 ( 2.541 -4.969 1.562) 5.796 10.896 ( 2.541 4.969 1.562) 5.796 10.985 ( -9.241 -8.386 3.356) 12.923 10.985 ( -9.241 8.386 3.356) 12.923 11.204 ( -7.395 -3.030 4.761) 9.303 11.204 ( -7.395 3.030 4.761) 9.303 11.500 ( -2.938 -3.152 0.382) 4.325 11.500 ( -2.938 3.152 0.382) 4.325 11.620 ( 2.345 -1.845 -2.554) 3.928 11.620 ( 2.345 1.845 -2.554) 3.928 11.776 ( 10.602 -6.387 -7.281) 14.360 11.776 ( 10.602 6.387 -7.281) 14.360 12.549 ( -2.381 -7.415 -0.576) 7.809 12.549 ( -2.381 7.415 -0.576) 7.809 13.067 ( -9.307 -2.459 1.701) 9.775 13.067 ( -9.307 2.459 1.701) 9.775 13.534 ( 3.083 -7.051 -1.445) 7.830 13.534 ( 3.083 7.051 -1.445) 7.830 13.787 ( 0.124 -12.891 0.612) 12.906 13.787 ( 0.124 12.891 0.612) 12.906 14.091 ( 0.491 -13.430 -1.664) 13.542 14.091 ( 0.491 13.430 -1.664) 13.542 15.052 ( -1.880 -5.434 0.020) 5.750 15.052 ( -1.880 5.434 0.020) 5.750 15.381 ( -5.327 -0.446 -4.722) 7.132 15.381 ( -5.327 0.446 -4.722) 7.132 15.704 ( -1.284 -4.634 -0.875) 4.888 15.704 ( -1.284 4.634 -0.875) 4.888 15.847 ( 1.245 -5.522 0.814) 5.719 15.847 ( 1.245 5.522 0.814) 5.719 16.412 ( 0.308 -9.410 2.063) 9.638 16.412 ( 0.308 9.410 2.063) 9.638 16.839 ( 0.906 -4.223 3.342) 5.461 16.839 ( 0.906 4.223 3.342) 5.461 18.953 ( -8.237 -7.881 -2.309) 11.631 18.953 ( -8.237 7.881 -2.309) 11.631 19.999 ( 2.876 -1.557 1.084) 3.445 19.999 ( 2.876 1.557 1.084) 3.445 22.946 ( -0.693 -4.067 0.870) 4.216 22.946 ( -0.693 4.067 0.870) 4.216 23.276 ( -1.258 -4.715 1.052) 4.992 23.276 ( -1.258 4.715 1.052) 4.992 24.415 ( -1.192 -2.164 -4.603) 5.224 24.415 ( -1.192 2.164 -4.603) 5.224 25.402 ( 0.882 -5.173 2.338) 5.745 25.402 ( 0.882 5.173 2.338) 5.745 25.590 ( 35.101 -4.477 6.646) 36.004 25.590 ( 35.101 4.477 6.646) 36.004 28.099 ( -11.222 -11.587 -2.375) 16.305 28.099 ( -11.222 11.587 -2.375) 16.305 29.434 ( -5.517 -3.147 0.022) 6.351 29.434 ( -5.517 3.147 0.022) 6.351 29.659 ( 1.309 -3.853 -1.119) 4.220 29.659 ( 1.309 3.853 -1.119) 4.220 29.904 ( 0.974 -1.130 0.764) 1.676 29.904 ( 0.974 1.130 0.764) 1.676 30.136 ( 3.303 -4.913 1.680) 6.154 30.136 ( 3.303 4.913 1.680) 6.154 30.691 ( 4.508 -6.053 -1.216) 7.645 30.691 ( 4.508 6.053 -1.216) 7.645 31.265 ( 1.130 -11.810 1.275) 11.933 31.265 ( 1.130 11.810 1.275) 11.933 31.846 ( 0.986 -8.176 0.370) 8.244 31.846 ( 0.986 8.176 0.370) 8.244 33.977 ( -15.309 -7.612 -3.661) 17.485 33.977 ( -15.309 7.612 -3.661) 17.485 ======================= Grid point 25 (15/128) ======================= q-point: ( 0.33 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( 15.926 -13.393 6.238) 21.724 2.384 ( 15.926 13.393 6.238) 21.724 2.961 ( 11.714 -21.373 -3.433) 24.613 2.961 ( 11.714 21.373 -3.433) 24.613 3.333 ( -2.354 -3.084 2.510) 4.621 3.333 ( -2.354 3.084 2.510) 4.621 3.820 ( -6.342 -10.643 -7.118) 14.289 3.820 ( -6.342 10.643 -7.118) 14.289 4.109 ( 6.957 -15.844 3.522) 17.659 4.109 ( 6.957 15.844 3.522) 17.659 4.362 ( -3.989 -7.792 2.393) 9.075 4.362 ( -3.989 7.792 2.393) 9.075 4.617 ( -4.292 -10.964 1.993) 11.941 4.617 ( -4.292 10.964 1.993) 11.941 5.153 ( 7.849 -4.502 -6.297) 11.024 5.153 ( 7.849 4.502 -6.297) 11.024 5.551 ( -2.024 -5.040 7.018) 8.874 5.551 ( -2.024 5.040 7.018) 8.874 5.829 ( 2.391 -7.142 3.169) 8.171 5.829 ( 2.391 7.142 3.169) 8.171 6.138 ( -7.755 -7.951 -3.244) 11.571 6.138 ( -7.755 7.951 -3.244) 11.571 6.399 ( -0.328 -7.042 0.871) 7.103 6.399 ( -0.328 7.042 0.871) 7.103 6.603 ( 6.402 -2.611 1.448) 7.064 6.603 ( 6.402 2.611 1.448) 7.064 6.931 ( 0.481 -3.730 -5.350) 6.540 6.931 ( 0.481 3.730 -5.350) 6.540 7.424 ( -8.189 -4.796 -2.286) 9.761 7.424 ( -8.189 4.796 -2.286) 9.761 7.937 ( -3.161 -4.816 -2.590) 6.316 7.937 ( -3.161 4.816 -2.590) 6.316 8.275 ( -2.950 -4.870 -3.996) 6.956 8.275 ( -2.950 4.870 -3.996) 6.956 8.587 ( 1.042 -1.312 -0.441) 1.732 8.587 ( 1.042 1.312 -0.441) 1.732 8.857 ( -1.982 -4.571 2.853) 5.741 8.857 ( -1.982 4.571 2.853) 5.741 9.170 ( 2.962 -4.178 6.256) 8.085 9.170 ( 2.962 4.178 6.256) 8.085 9.337 ( 5.379 -0.562 0.936) 5.489 9.337 ( 5.379 0.562 0.936) 5.489 9.439 ( -0.841 -0.230 1.440) 1.683 9.439 ( -0.841 0.230 1.440) 1.683 9.616 ( 0.531 -4.670 -4.386) 6.428 9.616 ( 0.531 4.670 -4.386) 6.428 9.859 ( 11.921 -11.429 -3.066) 16.797 9.859 ( 11.921 11.429 -3.066) 16.797 10.096 ( -1.537 -7.331 0.765) 7.529 10.096 ( -1.537 7.331 0.765) 7.529 10.331 ( -0.833 -7.408 -0.422) 7.467 10.331 ( -0.833 7.408 -0.422) 7.467 10.539 ( -7.629 -1.201 5.930) 9.737 10.539 ( -7.629 1.201 5.930) 9.737 10.807 ( -6.774 -9.775 -0.257) 11.896 10.807 ( -6.774 9.775 -0.257) 11.896 10.959 ( 3.308 -2.550 0.637) 4.225 10.959 ( 3.308 2.550 0.637) 4.225 11.125 ( -3.794 -4.010 3.126) 6.344 11.125 ( -3.794 4.010 3.126) 6.344 11.419 ( -4.225 -1.350 -1.414) 4.655 11.419 ( -4.225 1.350 -1.414) 4.655 11.704 ( 6.032 -8.268 -0.607) 10.253 11.704 ( 6.032 8.268 -0.607) 10.253 11.912 ( 6.401 -5.445 -5.177) 9.870 11.912 ( 6.401 5.445 -5.177) 9.870 12.513 ( -0.665 -8.091 -0.806) 8.158 12.513 ( -0.665 8.091 -0.806) 8.158 12.877 ( -10.630 -0.828 1.586) 10.779 12.877 ( -10.630 0.828 1.586) 10.779 13.588 ( 2.897 -5.410 -1.258) 6.264 13.588 ( 2.897 5.410 -1.258) 6.264 13.789 ( -0.278 -13.065 0.694) 13.086 13.789 ( -0.278 13.065 0.694) 13.086 14.102 ( 1.152 -16.140 -0.852) 16.203 14.102 ( 1.152 16.140 -0.852) 16.203 15.018 ( -1.477 -7.903 -0.176) 8.042 15.018 ( -1.477 7.903 -0.176) 8.042 15.256 ( -5.104 -2.336 -4.244) 7.037 15.256 ( -5.104 2.336 -4.244) 7.037 15.675 ( -1.248 -1.094 -0.586) 1.760 15.675 ( -1.248 1.094 -0.586) 1.760 15.877 ( 1.255 -2.941 0.964) 3.340 15.877 ( 1.255 2.941 0.964) 3.340 16.423 ( 0.079 -8.862 1.512) 8.991 16.423 ( 0.079 8.862 1.512) 8.991 16.869 ( 0.703 -3.754 3.000) 4.856 16.869 ( 0.703 3.754 3.000) 4.856 18.799 ( -6.399 -5.306 -1.902) 8.528 18.799 ( -6.399 5.306 -1.902) 8.528 20.058 ( 2.689 -1.996 0.872) 3.460 20.058 ( 2.689 1.996 0.872) 3.460 22.935 ( -0.765 -4.127 0.856) 4.284 22.935 ( -0.765 4.127 0.856) 4.284 23.259 ( -0.885 -4.852 1.013) 5.035 23.259 ( -0.885 4.852 1.013) 5.035 24.389 ( 0.156 -2.281 -4.135) 4.725 24.389 ( 0.156 2.281 -4.135) 4.725 25.416 ( 0.108 -3.783 2.012) 4.286 25.416 ( 0.108 3.783 2.012) 4.286 26.354 ( 40.940 -13.517 7.847) 43.822 26.354 ( 40.940 13.517 7.847) 43.822 27.780 ( -21.885 -13.296 -4.342) 25.973 27.780 ( -21.885 13.296 -4.342) 25.973 29.353 ( -2.976 -1.826 -0.192) 3.497 29.353 ( -2.976 1.826 -0.192) 3.497 29.664 ( -0.060 -1.015 -0.507) 1.136 29.664 ( -0.060 1.015 -0.507) 1.136 29.922 ( 0.617 -1.016 0.376) 1.247 29.922 ( 0.617 1.016 0.376) 1.247 30.197 ( 2.154 -5.136 1.433) 5.751 30.197 ( 2.154 5.136 1.433) 5.751 30.780 ( 4.806 -9.936 -1.090) 11.091 30.780 ( 4.806 9.936 -1.090) 11.091 31.299 ( 1.682 -11.291 1.294) 11.489 31.299 ( 1.682 11.291 1.294) 11.489 31.878 ( 2.141 -5.471 0.762) 5.925 31.878 ( 2.141 5.471 0.762) 5.925 33.651 ( -15.785 -3.338 -3.783) 16.571 33.651 ( -15.785 3.338 -3.783) 16.571 ======================= Grid point 27 (16/128) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 64 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.611 ( 0.000 -4.506 -0.000) 4.506 2.611 ( 0.000 4.506 0.000) 4.506 2.940 ( 0.000 -5.318 0.000) 5.318 2.940 ( 0.000 5.318 0.000) 5.318 3.422 ( 0.000 -3.850 -0.000) 3.850 3.422 ( 0.000 3.850 0.000) 3.850 3.702 ( 0.000 -11.003 0.000) 11.003 3.702 ( 0.000 11.003 0.000) 11.003 4.235 ( 0.000 -5.121 0.000) 5.121 4.235 ( 0.000 5.121 0.000) 5.121 4.297 ( 0.000 -7.456 0.000) 7.456 4.297 ( 0.000 7.456 0.000) 7.456 4.579 ( 0.000 -1.301 0.000) 1.301 4.579 ( 0.000 1.301 0.000) 1.301 5.231 ( 0.000 -3.083 -0.000) 3.083 5.231 ( 0.000 3.083 -0.000) 3.083 5.493 ( 0.000 -2.879 -0.000) 2.879 5.493 ( 0.000 2.879 -0.000) 2.879 5.891 ( 0.000 -4.124 0.000) 4.124 5.891 ( 0.000 4.124 0.000) 4.124 6.058 ( 0.000 -1.323 0.000) 1.323 6.058 ( 0.000 1.323 0.000) 1.323 6.396 ( 0.000 -3.316 0.000) 3.316 6.396 ( 0.000 3.316 0.000) 3.316 6.666 ( 0.000 -2.137 0.000) 2.137 6.666 ( 0.000 2.137 -0.000) 2.137 6.920 ( 0.000 -1.732 0.000) 1.732 6.920 ( 0.000 1.732 -0.000) 1.732 7.344 ( 0.000 -1.308 -0.000) 1.308 7.344 ( 0.000 1.308 0.000) 1.308 7.901 ( 0.000 -5.318 -0.000) 5.318 7.901 ( 0.000 5.318 -0.000) 5.318 8.231 ( 0.000 -0.008 0.000) 0.008 8.231 ( 0.000 0.008 -0.000) 0.008 8.595 ( 0.000 -0.312 0.000) 0.312 8.595 ( 0.000 0.312 0.000) 0.312 8.844 ( 0.000 -5.540 0.000) 5.540 8.844 ( 0.000 5.540 0.000) 5.540 9.218 ( 0.000 -0.172 -0.000) 0.172 9.218 ( 0.000 0.172 0.000) 0.172 9.367 ( 0.000 -3.994 -0.000) 3.994 9.367 ( 0.000 3.994 -0.000) 3.994 9.461 ( 0.000 -1.113 0.000) 1.113 9.461 ( 0.000 1.113 -0.000) 1.113 9.617 ( 0.000 -11.323 -0.000) 11.323 9.617 ( 0.000 11.323 0.000) 11.323 9.964 ( 0.000 -17.058 -0.000) 17.058 9.964 ( 0.000 17.058 0.000) 17.058 10.124 ( 0.000 -2.509 0.000) 2.509 10.124 ( 0.000 2.509 -0.000) 2.509 10.301 ( -0.000 -0.950 0.000) 0.950 10.301 ( 0.000 0.950 -0.000) 0.950 10.428 ( -0.000 -0.431 0.000) 0.431 10.428 ( 0.000 0.431 0.000) 0.431 10.763 ( 0.000 -7.456 0.000) 7.456 10.763 ( 0.000 7.456 -0.000) 7.456 11.000 ( 0.000 -0.910 0.000) 0.910 11.000 ( 0.000 0.910 0.000) 0.910 11.089 ( 0.000 -3.291 0.000) 3.291 11.089 ( 0.000 3.291 0.000) 3.291 11.374 ( 0.000 -0.654 -0.000) 0.654 11.374 ( 0.000 0.654 -0.000) 0.654 11.770 ( 0.000 -10.776 0.000) 10.776 11.770 ( 0.000 10.776 0.000) 10.776 11.958 ( 0.000 -2.829 -0.000) 2.829 11.958 ( 0.000 2.829 -0.000) 2.829 12.515 ( 0.000 -6.963 -0.000) 6.963 12.515 ( 0.000 6.963 0.000) 6.963 12.765 ( 0.000 -0.125 0.000) 0.125 12.765 ( 0.000 0.125 0.000) 0.125 13.613 ( 0.000 -4.541 0.000) 4.541 13.613 ( 0.000 4.541 -0.000) 4.541 13.786 ( 0.000 -13.423 -0.000) 13.423 13.786 ( 0.000 13.423 0.000) 13.423 14.114 ( 0.000 -17.100 0.000) 17.100 14.114 ( 0.000 17.100 0.000) 17.100 15.004 ( 0.000 -9.815 0.000) 9.815 15.004 ( 0.000 9.815 -0.000) 9.815 15.196 ( 0.000 -4.376 0.000) 4.376 15.196 ( 0.000 4.376 -0.000) 4.376 15.662 ( 0.000 -0.014 -0.000) 0.014 15.662 ( 0.000 0.014 -0.000) 0.014 15.891 ( 0.000 -0.136 0.000) 0.136 15.891 ( 0.000 0.136 0.000) 0.136 16.427 ( 0.000 -8.612 0.000) 8.612 16.427 ( 0.000 8.612 0.000) 8.612 16.882 ( 0.000 -2.409 0.000) 2.409 16.882 ( 0.000 2.409 0.000) 2.409 18.734 ( 0.000 -2.565 -0.000) 2.565 18.734 ( 0.000 2.565 0.000) 2.565 20.087 ( 0.000 -1.984 0.000) 1.984 20.087 ( 0.000 1.984 0.000) 1.984 22.929 ( 0.000 -4.128 -0.000) 4.128 22.929 ( 0.000 4.128 0.000) 4.128 23.253 ( 0.000 -4.846 -0.000) 4.846 23.253 ( 0.000 4.846 0.000) 4.846 24.383 ( 0.000 -2.150 -0.000) 2.150 24.383 ( 0.000 2.150 0.000) 2.150 25.421 ( 0.000 -2.644 0.000) 2.644 25.421 ( 0.000 2.644 -0.000) 2.644 26.903 ( 0.000 -13.755 0.000) 13.755 26.903 ( 0.000 13.755 0.000) 13.755 27.420 ( 0.000 -14.130 -0.000) 14.130 27.420 ( 0.000 14.130 0.000) 14.130 29.326 ( 0.000 -0.132 -0.000) 0.132 29.326 ( 0.000 0.132 0.000) 0.132 29.661 ( 0.000 -0.064 0.000) 0.064 29.661 ( 0.000 0.064 0.000) 0.064 29.928 ( 0.000 -1.021 -0.000) 1.021 29.928 ( 0.000 1.021 0.000) 1.021 30.219 ( 0.000 -4.898 -0.000) 4.898 30.219 ( 0.000 4.898 0.000) 4.898 30.825 ( 0.000 -11.668 0.000) 11.668 30.825 ( 0.000 11.668 -0.000) 11.668 31.320 ( 0.000 -10.430 0.000) 10.430 31.320 ( 0.000 10.430 0.000) 10.430 31.906 ( 0.000 -2.221 0.000) 2.221 31.906 ( 0.000 2.221 -0.000) 2.221 33.482 ( 0.000 -4.404 0.000) 4.404 33.482 ( 0.000 4.404 -0.000) 4.404 ======================= Grid point 49 (17/128) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.680 ( 19.051 0.000 37.466) 42.032 0.741 ( -13.434 0.000 37.799) 40.115 1.339 ( -14.468 0.000 68.859) 70.362 2.638 ( -0.035 0.000 4.109) 4.109 2.904 ( -9.715 0.000 46.213) 47.223 3.610 ( -8.383 0.000 23.660) 25.101 3.906 ( 2.519 0.000 7.133) 7.565 4.121 ( 6.873 0.000 20.352) 21.481 4.272 ( -9.459 0.000 37.590) 38.762 4.291 ( -1.282 0.000 2.000) 2.376 4.422 ( -3.845 0.000 -1.908) 4.293 4.442 ( -18.965 0.000 25.899) 32.101 4.838 ( 2.534 0.000 9.539) 9.870 4.942 ( 4.263 0.000 0.911) 4.359 5.131 ( -4.074 0.000 4.949) 6.410 5.211 ( 3.326 0.000 -0.039) 3.326 5.214 ( -5.922 0.000 -3.525) 6.892 5.346 ( -1.059 0.000 8.419) 8.485 5.653 ( 2.490 0.000 -16.533) 16.720 5.690 ( 4.029 0.000 -0.257) 4.037 6.271 ( -3.307 0.000 4.201) 5.347 6.397 ( -9.792 0.000 -7.830) 12.538 6.432 ( -2.308 0.000 2.877) 3.688 6.597 ( 3.679 0.000 1.448) 3.954 6.809 ( 2.141 0.000 5.631) 6.024 7.093 ( 4.048 0.000 2.502) 4.759 7.159 ( -5.915 0.000 0.393) 5.928 7.172 ( -0.203 0.000 -3.109) 3.116 7.482 ( -12.045 0.000 1.678) 12.162 7.624 ( -9.496 0.000 0.506) 9.509 7.720 ( 0.181 0.000 -5.717) 5.720 7.863 ( -0.015 0.000 -6.591) 6.591 8.099 ( 0.718 0.000 -10.564) 10.588 8.312 ( 8.540 0.000 -7.489) 11.359 8.366 ( -0.596 0.000 -8.437) 8.458 8.656 ( 4.487 0.000 -7.129) 8.423 8.720 ( 8.838 0.000 -7.639) 11.682 8.798 ( -1.884 0.000 3.418) 3.903 8.834 ( -3.999 0.000 -10.017) 10.785 9.007 ( 5.837 0.000 -5.000) 7.686 9.044 ( -1.876 0.000 1.294) 2.279 9.160 ( 12.395 0.000 -0.901) 12.427 9.226 ( -3.574 0.000 -0.625) 3.629 9.310 ( -2.443 0.000 6.430) 6.879 9.438 ( 1.247 0.000 5.842) 5.973 9.492 ( 6.880 0.000 3.008) 7.509 9.698 ( 8.197 0.000 -1.125) 8.273 9.846 ( -0.984 0.000 5.581) 5.667 9.908 ( -8.424 0.000 9.229) 12.495 10.231 ( -0.121 0.000 -7.244) 7.245 10.374 ( 2.399 0.000 -4.308) 4.931 10.510 ( -1.845 0.000 -2.996) 3.518 10.552 ( 7.362 0.000 -9.263) 11.833 10.707 ( 4.653 0.000 -6.623) 8.094 10.727 ( 3.653 0.000 2.363) 4.351 10.933 ( 7.233 0.000 1.903) 7.479 11.182 ( -2.673 0.000 -9.663) 10.026 11.296 ( -8.200 0.000 -1.008) 8.262 11.308 ( 0.961 0.000 -3.412) 3.545 11.343 ( 5.261 0.000 1.851) 5.577 11.431 ( -0.072 0.000 -7.242) 7.242 11.548 ( 0.216 0.000 -0.704) 0.736 11.740 ( -11.966 0.000 7.478) 14.110 11.866 ( 3.276 0.000 5.678) 6.555 11.962 ( 5.825 0.000 -3.548) 6.821 12.039 ( -3.406 0.000 -1.613) 3.769 12.524 ( -6.413 0.000 14.365) 15.731 12.719 ( 3.944 0.000 0.018) 3.944 12.914 ( -1.382 0.000 2.416) 2.783 12.926 ( -2.764 0.000 3.389) 4.373 12.979 ( 2.507 0.000 2.271) 3.383 13.532 ( -2.176 0.000 -2.885) 3.613 13.773 ( -4.157 0.000 16.503) 17.019 13.911 ( -2.327 0.000 3.889) 4.532 14.278 ( 2.942 0.000 -6.195) 6.858 14.597 ( -3.531 0.000 -6.912) 7.761 14.912 ( 0.574 0.000 -3.916) 3.958 15.270 ( -9.442 0.000 5.516) 10.935 15.379 ( -2.065 0.000 -8.451) 8.700 15.612 ( 2.290 0.000 5.981) 6.404 15.652 ( -1.891 0.000 -0.131) 1.896 15.747 ( -6.074 0.000 -1.423) 6.238 15.849 ( 5.125 0.000 -1.262) 5.278 16.012 ( -5.378 0.000 9.738) 11.124 16.204 ( -1.352 0.000 1.165) 1.785 16.556 ( 1.851 0.000 -8.866) 9.058 16.853 ( 3.121 0.000 -8.660) 9.205 16.949 ( -54.939 0.000 4.148) 55.095 19.156 ( 29.471 0.000 2.987) 29.622 19.290 ( -4.533 0.000 -8.755) 9.859 19.977 ( -1.009 0.000 1.963) 2.208 20.110 ( 1.058 0.000 5.969) 6.062 22.671 ( 2.913 0.000 -13.738) 14.044 22.853 ( 4.926 0.000 -17.896) 18.562 22.995 ( 2.441 0.000 -9.340) 9.654 23.228 ( 6.911 0.000 -17.973) 19.256 24.355 ( -8.154 0.000 9.442) 12.475 24.530 ( -4.861 0.000 4.816) 6.842 25.132 ( 41.743 0.000 -2.427) 41.814 25.259 ( 0.093 0.000 9.987) 9.987 25.372 ( 6.600 0.000 -4.369) 7.915 25.673 ( 1.288 0.000 9.448) 9.535 27.786 ( -1.681 0.000 -4.115) 4.445 28.474 ( 4.469 0.000 -18.728) 19.254 28.956 ( 0.832 0.000 2.297) 2.443 29.478 ( -1.124 0.000 -0.079) 1.126 29.545 ( -3.049 0.000 6.226) 6.933 29.847 ( -2.992 0.000 -2.920) 4.181 30.168 ( -7.628 0.000 13.093) 15.153 30.207 ( -4.454 0.000 1.079) 4.583 30.254 ( 2.336 0.000 15.491) 15.666 30.386 ( 2.847 0.000 4.457) 5.288 30.605 ( 21.509 0.000 4.856) 22.050 30.944 ( -1.816 0.000 1.918) 2.641 31.142 ( -1.089 0.000 6.335) 6.428 31.507 ( 0.637 0.000 -1.113) 1.282 31.881 ( -0.839 0.000 6.101) 6.158 32.475 ( 0.650 0.000 -6.161) 6.195 33.117 ( -32.272 0.000 -3.322) 32.443 33.541 ( -6.029 0.000 -8.495) 10.417 ======================= Grid point 50 (18/128) ======================= q-point: ( 0.17 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.999 ( 22.614 0.000 25.730) 34.256 1.429 ( 17.150 0.000 48.021) 50.992 1.910 ( 57.715 0.000 31.671) 65.833 2.643 ( -2.244 0.000 5.223) 5.685 2.884 ( -11.831 0.000 37.002) 38.847 3.530 ( -11.904 0.000 30.393) 32.641 3.918 ( -4.419 0.000 8.769) 9.820 4.041 ( -22.716 0.000 34.257) 41.104 4.227 ( -6.266 0.000 -0.715) 6.307 4.292 ( -3.629 0.000 17.531) 17.902 4.374 ( 0.124 0.000 -3.458) 3.460 4.401 ( 2.741 0.000 22.690) 22.855 4.781 ( -17.186 0.000 4.785) 17.840 4.942 ( -0.592 0.000 11.722) 11.737 5.079 ( -2.852 0.000 13.559) 13.856 5.242 ( 1.261 0.000 1.648) 2.076 5.244 ( 7.488 0.000 -6.293) 9.781 5.361 ( -2.356 0.000 11.611) 11.848 5.652 ( 4.712 0.000 -18.007) 18.613 5.656 ( -5.239 0.000 2.449) 5.784 6.240 ( -1.855 0.000 5.284) 5.600 6.280 ( 1.959 0.000 -6.111) 6.417 6.408 ( -0.856 0.000 0.425) 0.956 6.691 ( 0.914 0.000 3.694) 3.805 6.922 ( -3.109 0.000 2.320) 3.879 6.983 ( -10.523 0.000 3.410) 11.062 7.202 ( 7.624 0.000 -3.897) 8.562 7.246 ( 6.479 0.000 4.686) 7.996 7.257 ( -2.399 0.000 -6.066) 6.524 7.590 ( 1.716 0.000 2.850) 3.326 7.673 ( -0.980 0.000 -5.573) 5.659 7.842 ( 0.626 0.000 -6.296) 6.327 8.081 ( 1.718 0.000 -11.146) 11.278 8.333 ( 3.443 0.000 -9.854) 10.438 8.476 ( 7.322 0.000 -12.246) 14.268 8.669 ( -0.394 0.000 -7.651) 7.661 8.727 ( -2.920 0.000 -4.726) 5.555 8.783 ( 2.206 0.000 -6.640) 6.997 8.784 ( -1.171 0.000 1.315) 1.760 9.048 ( -1.648 0.000 -3.679) 4.031 9.113 ( 6.159 0.000 1.968) 6.466 9.202 ( 0.698 0.000 4.810) 4.860 9.294 ( -2.292 0.000 4.840) 5.355 9.443 ( -1.515 0.000 0.927) 1.776 9.569 ( 1.286 0.000 1.054) 1.662 9.569 ( 19.408 0.000 -18.551) 26.848 9.757 ( -6.888 0.000 4.537) 8.248 9.911 ( 14.087 0.000 -3.011) 14.405 9.931 ( 7.189 0.000 6.149) 9.460 10.221 ( 2.030 0.000 -5.967) 6.303 10.330 ( -4.652 0.000 -7.784) 9.068 10.542 ( 5.665 0.000 -1.123) 5.776 10.567 ( -1.790 0.000 -4.886) 5.203 10.723 ( -1.433 0.000 -4.174) 4.413 10.844 ( 8.095 0.000 2.763) 8.554 10.925 ( -3.656 0.000 -5.583) 6.674 11.172 ( -2.896 0.000 -9.868) 10.284 11.251 ( 9.266 0.000 -9.496) 13.268 11.285 ( -1.310 0.000 -6.796) 6.922 11.400 ( -0.448 0.000 -6.748) 6.763 11.452 ( 5.214 0.000 4.550) 6.920 11.539 ( -1.024 0.000 -0.848) 1.330 11.653 ( 1.137 0.000 4.086) 4.242 11.899 ( -7.934 0.000 9.340) 12.255 11.999 ( 4.590 0.000 -4.586) 6.489 12.107 ( 10.316 0.000 -1.348) 10.404 12.436 ( -7.288 0.000 6.258) 9.606 12.626 ( -6.123 0.000 2.540) 6.629 12.872 ( -3.504 0.000 0.748) 3.583 12.958 ( -7.080 0.000 5.998) 9.279 13.093 ( 12.152 0.000 0.929) 12.187 13.515 ( 2.426 0.000 -5.250) 5.783 13.734 ( -8.545 0.000 24.653) 26.092 13.875 ( -3.154 0.000 4.379) 5.397 14.305 ( 2.842 0.000 -6.655) 7.236 14.403 ( -19.656 0.000 7.325) 20.976 14.913 ( 1.366 0.000 -4.087) 4.309 14.934 ( -28.615 0.000 31.041) 42.218 15.314 ( -0.800 0.000 -8.436) 8.474 15.489 ( -15.208 0.000 15.830) 21.952 15.605 ( -3.055 0.000 0.242) 3.065 15.704 ( 1.359 0.000 7.940) 8.055 15.916 ( -4.882 0.000 8.983) 10.224 15.935 ( 4.438 0.000 -0.839) 4.516 16.158 ( -3.579 0.000 -0.694) 3.646 16.179 ( -16.730 0.000 11.136) 20.097 16.552 ( 1.612 0.000 -8.768) 8.915 16.886 ( 3.821 0.000 -8.045) 8.907 19.135 ( -7.175 0.000 -9.978) 12.290 19.274 ( -3.562 0.000 1.534) 3.878 19.970 ( 1.302 0.000 0.576) 1.424 20.150 ( 2.443 0.000 3.980) 4.670 22.662 ( 2.197 0.000 -13.496) 13.674 22.875 ( 5.161 0.000 -16.824) 17.598 22.989 ( 1.152 0.000 -10.811) 10.872 23.269 ( 4.633 0.000 -15.871) 16.534 24.267 ( -4.174 0.000 6.619) 7.825 24.469 ( -2.865 0.000 2.411) 3.745 25.319 ( 1.312 0.000 11.109) 11.186 25.641 ( 24.464 0.000 -2.412) 24.583 25.712 ( -2.116 0.000 11.707) 11.896 26.534 ( 74.498 0.000 -56.920) 93.754 27.636 ( -11.107 0.000 -6.280) 12.760 28.452 ( 1.784 0.000 -21.804) 21.877 29.021 ( 4.859 0.000 3.493) 5.984 29.451 ( -1.464 0.000 -0.102) 1.468 29.500 ( -4.300 0.000 4.101) 5.942 29.792 ( -1.396 0.000 -3.991) 4.228 30.104 ( -4.989 0.000 10.333) 11.475 30.130 ( -3.467 0.000 -0.536) 3.508 30.304 ( -2.524 0.000 18.110) 18.285 30.434 ( -0.181 0.000 6.611) 6.613 30.768 ( -2.167 0.000 13.253) 13.429 31.141 ( -1.914 0.000 6.667) 6.937 31.155 ( 7.651 0.000 9.935) 12.540 31.539 ( 3.077 0.000 -1.327) 3.351 31.893 ( -0.584 0.000 6.163) 6.190 32.300 ( -35.043 0.000 20.962) 40.834 32.440 ( -1.517 0.000 -6.193) 6.376 33.369 ( -7.392 0.000 -10.242) 12.631 ======================= Grid point 51 (19/128) ======================= q-point: ( 0.33 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( 30.295 0.000 15.141) 33.868 1.894 ( 14.386 0.000 42.434) 44.806 2.548 ( -12.697 0.000 7.685) 14.842 2.713 ( -20.108 0.000 23.442) 30.885 3.063 ( 45.743 0.000 14.459) 47.974 3.530 ( 3.528 0.000 36.346) 36.517 3.805 ( -16.674 0.000 39.194) 42.593 3.871 ( -1.725 0.000 3.172) 3.610 4.060 ( -10.579 0.000 -3.986) 11.305 4.260 ( -5.908 0.000 13.584) 14.813 4.365 ( -1.301 0.000 1.176) 1.754 4.529 ( -0.009 0.000 14.247) 14.247 4.559 ( -7.807 0.000 9.233) 12.091 4.840 ( -13.551 0.000 17.521) 22.150 5.123 ( 0.450 0.000 11.434) 11.443 5.237 ( -8.184 0.000 13.016) 15.375 5.338 ( 5.462 0.000 -7.859) 9.571 5.362 ( -0.805 0.000 5.448) 5.507 5.661 ( 2.683 0.000 4.765) 5.468 5.668 ( 4.041 0.000 -14.730) 15.274 6.228 ( -9.446 0.000 -0.856) 9.485 6.250 ( 0.853 0.000 3.368) 3.475 6.415 ( 1.174 0.000 1.848) 2.190 6.422 ( -20.600 0.000 -2.001) 20.697 6.760 ( -3.403 0.000 -3.808) 5.107 7.047 ( 9.082 0.000 3.577) 9.761 7.312 ( -0.055 0.000 0.570) 0.572 7.351 ( 6.295 0.000 -1.286) 6.425 7.358 ( 9.269 0.000 -4.387) 10.255 7.638 ( 1.600 0.000 4.268) 4.558 7.699 ( 4.463 0.000 -2.831) 5.285 7.833 ( 0.808 0.000 -4.759) 4.827 8.077 ( 2.954 0.000 -8.103) 8.624 8.414 ( 8.633 0.000 -7.936) 11.727 8.541 ( 5.282 0.000 -9.740) 11.080 8.570 ( -7.789 0.000 0.247) 7.793 8.678 ( 0.559 0.000 -9.000) 9.017 8.793 ( 2.270 0.000 -6.065) 6.476 8.793 ( 0.813 0.000 2.214) 2.359 8.987 ( -1.333 0.000 -3.658) 3.893 9.146 ( -5.003 0.000 -1.405) 5.197 9.232 ( -0.199 0.000 4.707) 4.711 9.318 ( 4.982 0.000 2.692) 5.662 9.413 ( -1.804 0.000 -1.873) 2.601 9.566 ( -2.106 0.000 3.144) 3.784 9.621 ( -2.656 0.000 -7.442) 7.902 9.701 ( -1.443 0.000 8.075) 8.203 10.101 ( 7.265 0.000 -0.273) 7.270 10.130 ( 9.373 0.000 -11.611) 14.922 10.185 ( -5.337 0.000 -9.749) 11.114 10.249 ( 3.004 0.000 -3.468) 4.588 10.425 ( -13.187 0.000 9.523) 16.266 10.648 ( 5.263 0.000 -0.118) 5.264 10.694 ( 2.495 0.000 -5.081) 5.661 10.888 ( 4.234 0.000 -16.315) 16.856 11.035 ( 11.362 0.000 -1.175) 11.423 11.045 ( -6.743 0.000 -13.075) 14.711 11.223 ( -1.850 0.000 -9.561) 9.738 11.338 ( -3.114 0.000 -5.099) 5.974 11.344 ( 6.727 0.000 -11.738) 13.529 11.501 ( -2.457 0.000 -1.791) 3.041 11.609 ( 10.219 0.000 -2.354) 10.487 11.735 ( -9.799 0.000 5.145) 11.068 11.759 ( 5.852 0.000 9.253) 10.948 12.106 ( 6.569 0.000 -1.549) 6.749 12.237 ( -0.263 0.000 -0.199) 0.330 12.388 ( 6.036 0.000 -4.590) 7.583 12.588 ( -0.361 0.000 3.959) 3.975 12.783 ( -13.668 0.000 5.806) 14.850 12.804 ( -4.048 0.000 -0.088) 4.049 13.301 ( 10.219 0.000 0.858) 10.255 13.547 ( 1.865 0.000 -4.518) 4.888 13.692 ( -9.305 0.000 38.686) 39.789 13.847 ( -1.778 0.000 5.825) 6.091 14.044 ( -22.425 0.000 31.569) 38.723 14.362 ( 4.421 0.000 -4.230) 6.119 14.715 ( -7.772 0.000 8.627) 11.611 14.926 ( 1.727 0.000 -4.012) 4.368 15.298 ( 2.225 0.000 -5.000) 5.473 15.372 ( -5.156 0.000 9.920) 11.180 15.552 ( -2.540 0.000 0.061) 2.541 15.726 ( -2.164 0.000 6.542) 6.890 15.911 ( -0.340 0.000 5.294) 5.305 16.002 ( 3.311 0.000 -0.325) 3.327 16.026 ( -7.318 0.000 7.356) 10.376 16.077 ( -4.419 0.000 -2.480) 5.068 16.547 ( 1.888 0.000 -9.310) 9.499 16.915 ( 2.715 0.000 -8.501) 8.924 18.977 ( -5.470 0.000 -9.462) 10.929 19.221 ( -2.663 0.000 4.308) 5.065 20.015 ( 3.030 0.000 -1.506) 3.384 20.197 ( 1.326 0.000 0.095) 1.329 22.649 ( 2.418 0.000 -13.408) 13.624 22.900 ( 4.295 0.000 -14.805) 15.415 22.950 ( 0.322 0.000 -13.385) 13.389 23.263 ( 1.740 0.000 -15.257) 15.356 24.269 ( 1.511 0.000 5.498) 5.702 24.460 ( 0.581 0.000 3.959) 4.001 25.382 ( 0.651 0.000 10.410) 10.431 25.683 ( -6.253 0.000 12.027) 13.555 26.158 ( 30.889 0.000 -3.715) 31.111 27.045 ( -1.105 0.000 -31.182) 31.202 27.547 ( 16.526 0.000 -21.727) 27.297 28.366 ( 0.141 0.000 -27.422) 27.422 29.149 ( 7.018 0.000 4.184) 8.170 29.412 ( -6.749 0.000 2.399) 7.163 29.430 ( -0.592 0.000 -0.763) 0.966 29.762 ( -0.523 0.000 -2.627) 2.678 30.059 ( -4.088 0.000 7.790) 8.798 30.099 ( 0.603 0.000 -0.472) 0.766 30.324 ( -3.088 0.000 17.576) 17.845 30.431 ( -3.241 0.000 7.673) 8.329 30.778 ( -8.002 0.000 29.680) 30.740 31.049 ( -18.105 0.000 31.245) 36.112 31.129 ( -2.159 0.000 6.829) 7.162 31.591 ( 2.821 0.000 -2.018) 3.468 31.905 ( -0.822 0.000 5.552) 5.612 32.248 ( 15.540 0.000 -8.193) 17.568 32.386 ( -1.236 0.000 -5.299) 5.442 33.175 ( -8.376 0.000 -11.639) 14.339 ======================= Grid point 52 (20/128) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.067 ( -20.010 0.000 23.769) 31.071 2.147 ( 23.158 0.000 9.858) 25.169 2.220 ( -26.084 0.000 11.960) 28.695 2.556 ( 0.948 0.000 31.915) 31.929 3.408 ( -1.785 0.000 33.761) 33.809 3.601 ( -14.554 0.000 28.440) 31.947 3.771 ( -8.614 0.000 -5.802) 10.386 4.024 ( 9.574 0.000 -1.422) 9.679 4.122 ( -22.041 0.000 12.094) 25.141 4.221 ( 28.675 0.000 10.867) 30.665 4.352 ( -1.807 0.000 9.574) 9.743 4.377 ( -15.788 0.000 24.950) 29.526 4.539 ( -0.141 0.000 8.185) 8.186 4.755 ( -3.114 0.000 22.447) 22.662 5.127 ( -8.055 0.000 12.593) 14.949 5.177 ( 0.872 0.000 8.099) 8.146 5.314 ( -6.088 0.000 2.645) 6.638 5.379 ( 2.983 0.000 -8.783) 9.276 5.614 ( -2.399 0.000 3.384) 4.148 5.682 ( 3.137 0.000 -10.413) 10.875 6.057 ( -14.747 0.000 -5.584) 15.769 6.287 ( 2.068 0.000 0.096) 2.071 6.300 ( 14.941 0.000 5.063) 15.776 6.457 ( 1.178 0.000 6.545) 6.650 6.786 ( 4.018 0.000 -2.068) 4.519 7.194 ( 3.422 0.000 6.756) 7.574 7.264 ( -3.482 0.000 -2.554) 4.318 7.401 ( 1.089 0.000 -0.900) 1.413 7.465 ( 1.840 0.000 -4.813) 5.152 7.677 ( 0.344 0.000 5.364) 5.375 7.722 ( 1.240 0.000 -7.217) 7.323 7.848 ( 2.078 0.000 -2.626) 3.349 8.133 ( 3.191 0.000 0.235) 3.199 8.471 ( -0.904 0.000 0.484) 1.025 8.508 ( 1.880 0.000 -5.280) 5.605 8.586 ( 4.304 0.000 -8.815) 9.810 8.656 ( -0.532 0.000 -7.509) 7.528 8.798 ( 0.809 0.000 -0.017) 0.809 8.800 ( -1.314 0.000 -6.434) 6.567 9.024 ( 6.504 0.000 -2.706) 7.044 9.042 ( -0.150 0.000 -6.545) 6.547 9.225 ( -3.283 0.000 3.628) 4.893 9.377 ( 0.148 0.000 -2.338) 2.342 9.386 ( -0.071 0.000 2.541) 2.542 9.520 ( -4.514 0.000 1.371) 4.718 9.605 ( -1.937 0.000 2.921) 3.505 9.699 ( 4.293 0.000 -1.055) 4.421 9.986 ( -7.694 0.000 -8.016) 11.111 10.096 ( -6.973 0.000 3.007) 7.594 10.225 ( 4.173 0.000 -9.071) 9.985 10.325 ( 5.483 0.000 1.281) 5.631 10.370 ( 4.950 0.000 -1.433) 5.154 10.707 ( 0.961 0.000 0.265) 0.997 10.736 ( 2.794 0.000 -3.588) 4.547 10.813 ( -9.150 0.000 -23.313) 25.044 10.944 ( 5.725 0.000 -7.215) 9.210 11.019 ( -10.090 0.000 -12.974) 16.435 11.216 ( 4.474 0.000 -6.806) 8.145 11.389 ( 8.494 0.000 2.710) 8.916 11.407 ( 4.376 0.000 -10.406) 11.288 11.456 ( 0.495 0.000 -3.156) 3.195 11.632 ( -3.906 0.000 3.704) 5.383 11.753 ( 6.117 0.000 -1.911) 6.409 11.885 ( 2.052 0.000 6.604) 6.915 12.180 ( -0.751 0.000 -7.297) 7.335 12.199 ( 4.452 0.000 -3.335) 5.563 12.537 ( 8.311 0.000 -0.599) 8.333 12.547 ( -12.404 0.000 3.891) 13.000 12.625 ( 1.586 0.000 4.929) 5.178 12.729 ( -3.925 0.000 1.143) 4.088 13.468 ( 7.633 0.000 -0.180) 7.636 13.511 ( -4.701 0.000 -1.449) 4.920 13.700 ( -10.925 0.000 48.396) 49.614 13.861 ( 0.341 0.000 6.339) 6.348 13.909 ( -3.157 0.000 27.853) 28.031 14.434 ( 3.328 0.000 7.277) 8.002 14.652 ( -0.877 0.000 -2.778) 2.914 14.939 ( 1.203 0.000 -3.760) 3.948 15.352 ( 4.548 0.000 -0.661) 4.595 15.353 ( -1.418 0.000 8.856) 8.969 15.524 ( -0.251 0.000 -0.648) 0.695 15.688 ( -4.235 0.000 4.903) 6.479 15.916 ( -1.511 0.000 4.869) 5.098 15.961 ( -2.987 0.000 7.198) 7.793 15.981 ( -4.560 0.000 -4.580) 6.463 16.061 ( 3.254 0.000 0.957) 3.392 16.546 ( 2.277 0.000 -9.857) 10.117 16.913 ( 1.093 0.000 -9.412) 9.475 18.872 ( -1.951 0.000 -9.105) 9.312 19.223 ( 0.942 0.000 4.179) 4.284 20.045 ( 0.597 0.000 -1.525) 1.638 20.192 ( -1.305 0.000 -2.659) 2.962 22.645 ( 3.170 0.000 -13.566) 13.932 22.883 ( 0.434 0.000 -13.263) 13.270 22.936 ( 4.433 0.000 -15.445) 16.068 23.221 ( 0.983 0.000 -16.407) 16.437 24.348 ( 3.745 0.000 7.340) 8.241 24.511 ( 1.969 0.000 7.512) 7.766 25.413 ( -2.336 0.000 9.224) 9.515 25.598 ( -6.886 0.000 9.748) 11.935 26.414 ( -13.884 0.000 -16.108) 21.266 26.922 ( 17.959 0.000 -8.275) 19.774 27.738 ( 8.017 0.000 -29.224) 30.303 28.284 ( 6.259 0.000 -31.871) 32.480 29.213 ( -5.595 0.000 0.622) 5.629 29.365 ( 4.381 0.000 5.915) 7.361 29.427 ( 0.730 0.000 -0.973) 1.216 29.753 ( 0.093 0.000 1.079) 1.083 30.015 ( -3.754 0.000 5.712) 6.836 30.140 ( 3.376 0.000 0.464) 3.408 30.333 ( -3.278 0.000 15.986) 16.319 30.387 ( -4.634 0.000 7.291) 8.639 30.629 ( -19.412 0.000 36.089) 40.979 31.035 ( 0.639 0.000 26.530) 26.538 31.121 ( -1.730 0.000 6.713) 6.932 31.611 ( 0.199 0.000 -2.649) 2.657 31.901 ( -1.869 0.000 4.828) 5.177 32.371 ( 1.904 0.000 -4.231) 4.640 32.480 ( 9.137 0.000 -6.656) 11.304 33.044 ( 2.061 0.000 -11.667) 11.847 ======================= Grid point 53 (21/128) ======================= q-point: (-0.33 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.607 ( -34.808 0.000 24.743) 42.706 1.694 ( -35.788 0.000 18.008) 40.063 2.503 ( 10.639 0.000 5.549) 11.999 2.712 ( -12.050 0.000 25.826) 28.499 3.040 ( -49.699 0.000 19.541) 53.403 3.529 ( 2.253 0.000 31.089) 31.171 3.683 ( 1.701 0.000 -1.157) 2.057 3.821 ( -11.428 0.000 39.926) 41.530 4.215 ( 9.582 0.000 -7.000) 11.866 4.249 ( -7.643 0.000 26.683) 27.757 4.399 ( 3.333 0.000 10.251) 10.779 4.591 ( 2.416 0.000 9.455) 9.758 4.673 ( 12.185 0.000 5.193) 13.245 4.811 ( -4.431 0.000 27.019) 27.380 5.032 ( -5.160 0.000 7.268) 8.914 5.230 ( 1.366 0.000 0.266) 1.392 5.256 ( -1.236 0.000 5.513) 5.650 5.381 ( 0.851 0.000 -7.759) 7.805 5.538 ( -7.296 0.000 -2.402) 7.681 5.695 ( 2.311 0.000 -8.688) 8.990 6.055 ( 15.409 0.000 -2.259) 15.574 6.314 ( 1.068 0.000 -1.471) 1.818 6.489 ( -2.055 0.000 10.818) 11.011 6.607 ( 13.202 0.000 4.069) 13.815 6.821 ( -0.141 0.000 -2.108) 2.113 7.177 ( -4.562 0.000 -4.588) 6.470 7.187 ( -5.881 0.000 9.614) 11.270 7.382 ( -6.722 0.000 -3.222) 7.455 7.471 ( 6.408 0.000 2.675) 6.943 7.683 ( -2.510 0.000 6.077) 6.575 7.716 ( 0.832 0.000 -8.761) 8.800 7.873 ( 2.038 0.000 -3.332) 3.906 8.154 ( -0.283 0.000 0.689) 0.745 8.454 ( -3.096 0.000 -5.688) 6.476 8.534 ( 5.347 0.000 -4.568) 7.033 8.611 ( 1.301 0.000 -6.333) 6.465 8.617 ( 2.185 0.000 -3.755) 4.344 8.680 ( -4.865 0.000 -12.182) 13.117 8.895 ( 8.309 0.000 2.031) 8.554 9.080 ( -2.906 0.000 -3.955) 4.908 9.108 ( 5.309 0.000 -0.263) 5.315 9.213 ( 4.598 0.000 2.387) 5.180 9.381 ( -0.219 0.000 -3.245) 3.252 9.391 ( -2.568 0.000 -2.367) 3.492 9.399 ( -7.684 0.000 -2.238) 8.003 9.467 ( -5.924 0.000 6.658) 8.911 9.869 ( -1.787 0.000 -3.216) 3.679 9.903 ( 13.727 0.000 -15.300) 20.556 10.041 ( -2.213 0.000 10.421) 10.653 10.249 ( 2.551 0.000 -7.052) 7.499 10.394 ( 0.742 0.000 1.302) 1.498 10.447 ( -2.814 0.000 -21.691) 21.873 10.528 ( -2.634 0.000 -12.067) 12.351 10.681 ( -4.022 0.000 -2.074) 4.525 10.771 ( 2.033 0.000 -2.063) 2.896 10.784 ( -7.412 0.000 -10.917) 13.195 11.045 ( 7.228 0.000 -3.630) 8.088 11.279 ( 5.067 0.000 -7.022) 8.659 11.405 ( -0.236 0.000 -8.873) 8.876 11.406 ( -0.135 0.000 -1.958) 1.963 11.577 ( 0.743 0.000 -1.521) 1.693 11.639 ( 7.226 0.000 5.258) 8.937 11.778 ( -6.744 0.000 -0.962) 6.812 11.863 ( 0.856 0.000 -7.484) 7.533 12.150 ( -3.327 0.000 -2.484) 4.152 12.209 ( -3.639 0.000 -0.611) 3.690 12.419 ( -0.425 0.000 1.698) 1.751 12.585 ( -4.860 0.000 11.200) 12.209 12.711 ( 6.249 0.000 2.071) 6.583 12.766 ( 7.561 0.000 0.801) 7.603 13.363 ( -10.391 0.000 -0.971) 10.437 13.573 ( 3.273 0.000 -0.199) 3.280 13.690 ( -6.758 0.000 35.331) 35.971 13.895 ( 0.365 0.000 6.595) 6.605 14.108 ( 9.574 0.000 13.093) 16.220 14.630 ( 5.036 0.000 18.408) 19.085 14.675 ( 13.010 0.000 27.916) 30.799 14.937 ( 0.252 0.000 -3.649) 3.658 15.378 ( -0.144 0.000 10.424) 10.425 15.428 ( 2.475 0.000 0.967) 2.657 15.551 ( 4.190 0.000 -1.232) 4.367 15.629 ( -3.865 0.000 5.450) 6.681 15.879 ( -4.053 0.000 -5.866) 7.130 15.899 ( -2.143 0.000 3.820) 4.380 15.973 ( 1.016 0.000 7.625) 7.692 16.130 ( 3.440 0.000 2.308) 4.142 16.550 ( 2.478 0.000 -10.029) 10.331 16.884 ( 0.195 0.000 -9.978) 9.980 18.825 ( 0.336 0.000 -9.368) 9.374 19.282 ( 3.755 0.000 1.838) 4.181 20.023 ( -2.437 0.000 -0.105) 2.439 20.135 ( -3.239 0.000 -3.371) 4.675 22.654 ( 3.727 0.000 -13.885) 14.377 22.848 ( 2.529 0.000 -16.444) 16.638 22.959 ( 3.942 0.000 -11.645) 12.294 23.182 ( 2.717 0.000 -18.388) 18.587 24.436 ( 1.088 0.000 10.444) 10.501 24.570 ( 0.180 0.000 9.829) 9.831 25.347 ( -7.974 0.000 8.949) 11.986 25.562 ( -0.436 0.000 6.196) 6.212 25.913 ( -26.064 0.000 -14.326) 29.742 27.225 ( 5.537 0.000 -39.253) 39.641 27.575 ( -2.613 0.000 -24.277) 24.418 28.355 ( 11.641 0.000 -25.005) 27.582 29.077 ( -7.395 0.000 0.276) 7.400 29.450 ( 2.151 0.000 -0.884) 2.326 29.492 ( 4.334 0.000 7.277) 8.470 29.793 ( 3.404 0.000 7.194) 7.958 29.969 ( -3.310 0.000 3.257) 4.644 30.209 ( 3.215 0.000 2.961) 4.371 30.334 ( -3.348 0.000 4.165) 5.344 30.335 ( -3.376 0.000 14.647) 15.031 30.446 ( -14.320 0.000 26.366) 30.004 31.122 ( -1.085 0.000 6.492) 6.582 31.145 ( -2.140 0.000 21.901) 22.006 31.579 ( -2.187 0.000 -2.749) 3.513 31.884 ( -1.965 0.000 5.140) 5.503 32.413 ( 4.022 0.000 -4.377) 5.945 32.585 ( 7.979 0.000 14.145) 16.240 33.160 ( 12.415 0.000 -11.427) 16.873 ======================= Grid point 54 (22/128) ======================= q-point: (-0.17 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.053 ( -39.138 0.000 24.162) 45.995 1.115 ( -36.064 0.000 27.188) 45.164 1.807 ( -61.589 0.000 36.205) 71.442 2.615 ( 1.515 0.000 3.669) 3.970 2.886 ( -9.061 0.000 46.255) 47.134 3.653 ( -4.019 0.000 20.934) 21.316 3.787 ( 7.185 0.000 3.263) 7.891 3.891 ( 3.592 0.000 32.974) 33.170 4.251 ( -5.637 0.000 32.802) 33.283 4.285 ( 1.203 0.000 0.665) 1.374 4.472 ( -0.171 0.000 1.004) 1.018 4.697 ( -18.453 0.000 30.901) 35.991 4.751 ( 11.330 0.000 4.944) 12.361 4.806 ( 0.207 0.000 4.792) 4.797 5.097 ( 7.543 0.000 2.548) 7.962 5.166 ( -3.062 0.000 -0.420) 3.091 5.305 ( 1.339 0.000 7.319) 7.440 5.338 ( -3.304 0.000 -5.131) 6.102 5.551 ( 8.708 0.000 -2.943) 9.192 5.685 ( 0.843 0.000 -11.011) 11.043 6.309 ( -1.460 0.000 0.462) 1.531 6.326 ( 12.706 0.000 -2.637) 12.977 6.468 ( -4.034 0.000 8.725) 9.613 6.712 ( -6.992 0.000 -3.950) 8.030 6.776 ( 1.448 0.000 4.254) 4.494 7.083 ( -3.043 0.000 -1.727) 3.499 7.177 ( 0.863 0.000 7.134) 7.186 7.249 ( -5.974 0.000 -2.966) 6.670 7.586 ( 0.024 0.000 6.804) 6.804 7.649 ( 0.386 0.000 2.378) 2.409 7.708 ( 2.649 0.000 -7.551) 8.002 7.883 ( 0.782 0.000 -5.361) 5.417 8.136 ( -0.776 0.000 -5.055) 5.114 8.396 ( -1.164 0.000 -7.020) 7.116 8.547 ( -6.698 0.000 -10.037) 12.067 8.590 ( 5.086 0.000 -7.018) 8.667 8.618 ( 3.827 0.000 -10.558) 11.230 8.727 ( 7.023 0.000 2.401) 7.422 8.964 ( -3.494 0.000 -9.173) 9.816 8.997 ( -1.334 0.000 -6.424) 6.561 9.134 ( -4.962 0.000 2.478) 5.546 9.256 ( -4.675 0.000 -2.227) 5.178 9.301 ( -3.094 0.000 -0.818) 3.200 9.318 ( 6.297 0.000 4.026) 7.474 9.379 ( 2.621 0.000 3.798) 4.615 9.552 ( 7.984 0.000 -0.821) 8.027 9.651 ( -32.372 0.000 -37.439) 49.494 9.862 ( -0.574 0.000 1.594) 1.694 10.005 ( -6.708 0.000 10.786) 12.702 10.258 ( 0.790 0.000 -5.410) 5.468 10.370 ( -1.244 0.000 -3.656) 3.862 10.378 ( 13.384 0.000 -10.944) 17.289 10.577 ( -3.945 0.000 -3.079) 5.004 10.621 ( 7.137 0.000 -4.255) 8.309 10.698 ( -0.607 0.000 -2.811) 2.875 10.812 ( 3.910 0.000 -0.515) 3.944 11.166 ( 6.569 0.000 -0.666) 6.603 11.306 ( 0.558 0.000 -3.126) 3.175 11.341 ( -2.303 0.000 -8.778) 9.075 11.431 ( 3.600 0.000 -6.822) 7.714 11.539 ( -14.713 0.000 -6.674) 16.156 11.555 ( -1.126 0.000 -0.616) 1.283 11.778 ( 4.820 0.000 4.232) 6.414 11.871 ( 0.108 0.000 -1.502) 1.506 11.999 ( -11.023 0.000 1.820) 11.172 12.115 ( -5.048 0.000 0.325) 5.058 12.529 ( 10.517 0.000 0.592) 10.533 12.556 ( -4.499 0.000 16.498) 17.100 12.853 ( 7.772 0.000 1.570) 7.929 12.887 ( 3.620 0.000 2.741) 4.540 13.138 ( -13.582 0.000 0.110) 13.582 13.583 ( -1.586 0.000 -1.030) 1.891 13.742 ( -1.410 0.000 22.178) 22.223 13.919 ( -0.592 0.000 5.317) 5.350 14.236 ( 4.737 0.000 -5.819) 7.503 14.645 ( 0.259 0.000 -4.783) 4.790 14.923 ( -0.010 0.000 -3.723) 3.723 15.301 ( 6.119 0.000 4.722) 7.729 15.434 ( -0.760 0.000 -3.975) 4.047 15.554 ( 3.875 0.000 11.721) 12.345 15.641 ( 4.062 0.000 0.190) 4.067 15.746 ( 15.900 0.000 11.129) 19.408 15.806 ( -0.606 0.000 -4.370) 4.412 15.971 ( 9.128 0.000 23.903) 25.587 16.159 ( 43.788 0.000 62.502) 76.315 16.192 ( 1.797 0.000 2.611) 3.170 16.555 ( 2.359 0.000 -9.622) 9.907 16.852 ( 1.042 0.000 -9.691) 9.747 18.786 ( -0.987 0.000 -4.008) 4.128 19.341 ( 1.795 0.000 -3.277) 3.736 19.981 ( -1.334 0.000 0.703) 1.508 20.069 ( -2.311 0.000 1.350) 2.676 22.666 ( 3.696 0.000 -13.980) 14.460 22.842 ( 4.226 0.000 -18.110) 18.597 22.982 ( 2.986 0.000 -8.909) 9.396 23.183 ( 5.843 0.000 -19.482) 20.339 24.445 ( -5.230 0.000 11.449) 12.587 24.581 ( -3.247 0.000 8.806) 9.385 25.258 ( -4.514 0.000 8.376) 9.515 25.478 ( -14.490 0.000 -9.736) 17.458 25.607 ( 2.026 0.000 6.706) 7.005 26.285 ( -74.042 0.000 -85.947) 113.442 27.717 ( 10.135 0.000 -2.161) 10.363 28.444 ( 7.570 0.000 -19.790) 21.189 28.975 ( -3.733 0.000 1.088) 3.888 29.482 ( 1.118 0.000 -0.921) 1.448 29.555 ( -0.619 0.000 7.478) 7.504 29.910 ( -2.729 0.000 1.659) 3.194 29.993 ( 13.935 0.000 10.158) 17.245 30.259 ( -1.741 0.000 6.354) 6.588 30.280 ( -10.062 0.000 15.495) 18.475 30.317 ( 2.265 0.000 -0.360) 2.293 30.374 ( -1.483 0.000 17.466) 17.529 31.077 ( -9.792 0.000 4.772) 10.893 31.132 ( -0.705 0.000 6.286) 6.326 31.527 ( -1.958 0.000 -1.872) 2.709 31.876 ( -1.315 0.000 5.705) 5.854 32.463 ( 3.159 0.000 -5.361) 6.222 33.072 ( 32.034 0.000 29.644) 43.646 33.317 ( 10.114 0.000 -9.245) 13.702 ======================= Grid point 55 (23/128) ======================= q-point: ( 0.00 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.026 ( 13.219 29.357 26.490) 41.693 1.261 ( -3.460 37.255 26.110) 45.625 1.864 ( -13.920 47.884 45.485) 67.494 2.753 ( -2.586 8.557 17.914) 20.021 3.028 ( -7.364 11.513 29.286) 32.318 3.642 ( -7.061 0.574 19.309) 20.568 3.980 ( -1.074 4.817 10.706) 11.788 4.016 ( -2.577 -8.321 14.736) 17.118 4.172 ( 0.683 -9.829 11.521) 15.159 4.236 ( -5.104 -1.798 25.444) 26.013 4.401 ( -0.445 3.619 13.693) 14.171 4.518 ( -14.495 6.424 17.132) 23.342 4.860 ( -0.258 -9.145 2.972) 9.619 4.931 ( 5.624 1.661 -5.356) 7.942 5.084 ( 4.178 -7.036 0.324) 8.189 5.151 ( 1.965 7.711 10.159) 12.904 5.317 ( -1.714 -1.700 4.720) 5.302 5.635 ( -0.008 15.465 -13.304) 20.400 5.671 ( -1.390 2.742 -2.875) 4.209 5.763 ( -2.701 8.992 -5.599) 10.932 6.145 ( -0.282 -9.821 0.904) 9.866 6.318 ( -3.409 -4.100 0.605) 5.366 6.374 ( 1.742 -4.735 -3.241) 5.996 6.529 ( 0.829 -6.602 3.545) 7.539 6.800 ( 6.750 -1.182 2.838) 7.417 6.938 ( -3.428 -10.799 2.729) 11.654 7.042 ( -4.910 -5.306 3.992) 8.258 7.377 ( -11.883 -8.979 0.182) 14.894 7.441 ( 3.314 12.666 -3.698) 13.605 7.719 ( -2.520 8.245 1.254) 8.712 7.753 ( -3.323 0.941 -1.083) 3.620 7.836 ( -2.106 0.556 -6.600) 6.950 8.152 ( 1.217 3.507 -12.046) 12.605 8.324 ( 5.180 -0.375 -9.838) 11.124 8.365 ( -1.035 -0.226 -8.942) 9.004 8.682 ( 3.317 -0.441 -7.215) 7.953 8.715 ( 2.611 0.856 -5.552) 6.195 8.863 ( 0.406 3.593 -9.256) 9.937 8.979 ( -7.734 9.514 -2.955) 12.612 9.022 ( 1.807 1.848 -4.262) 4.984 9.119 ( 2.997 3.475 0.974) 4.691 9.156 ( 10.729 4.448 -2.811) 11.950 9.274 ( -0.939 0.522 2.068) 2.330 9.314 ( -3.127 2.867 -0.588) 4.283 9.443 ( 2.638 -0.390 7.179) 7.658 9.487 ( 5.877 0.872 0.038) 5.942 9.671 ( 5.023 -2.797 0.402) 5.763 9.759 ( -4.776 -4.525 1.556) 6.761 9.950 ( -0.381 2.082 4.378) 4.863 10.240 ( 1.675 0.168 -4.928) 5.207 10.334 ( 2.516 -2.292 -5.725) 6.660 10.525 ( -1.274 2.119 -3.077) 3.947 10.618 ( 4.029 2.757 -5.001) 6.989 10.631 ( 3.778 -7.034 -2.296) 8.308 10.714 ( 4.832 -0.518 1.124) 4.988 10.882 ( 3.814 -0.249 -0.217) 3.828 11.068 ( -6.371 -4.866 0.698) 8.047 11.256 ( -4.019 -6.060 0.680) 7.303 11.309 ( 5.089 -2.535 -4.289) 7.122 11.357 ( 0.418 1.285 0.527) 1.450 11.555 ( -2.135 1.726 -0.102) 2.747 11.661 ( -4.447 3.384 -0.476) 5.608 11.728 ( 1.453 -6.562 0.417) 6.734 11.792 ( -4.142 5.985 -1.568) 7.446 11.879 ( 1.842 -4.632 0.671) 5.029 12.120 ( 2.613 4.628 -2.644) 5.937 12.273 ( -4.073 -17.401 11.319) 21.154 12.749 ( -2.053 -0.538 2.789) 3.504 12.973 ( 4.958 3.645 -0.818) 6.208 12.980 ( -4.786 6.287 2.908) 8.420 13.067 ( -0.901 8.680 0.083) 8.727 13.507 ( -0.085 -4.252 -0.394) 4.271 13.572 ( -3.534 -6.706 4.083) 8.610 14.049 ( -3.158 3.898 9.528) 10.768 14.202 ( 3.600 -7.611 -6.869) 10.866 14.553 ( 0.031 -8.912 -2.893) 9.370 14.896 ( -7.929 6.568 6.784) 12.330 15.291 ( -2.758 0.596 2.967) 4.095 15.380 ( -1.404 -1.164 -5.152) 5.465 15.558 ( 0.360 -5.609 4.496) 7.198 15.615 ( -8.313 -6.410 12.449) 16.284 15.709 ( 0.454 -4.224 -2.450) 4.904 15.788 ( -7.392 -2.028 8.984) 11.809 15.973 ( 3.424 4.813 -0.253) 5.912 16.122 ( 0.198 1.468 9.155) 9.274 16.538 ( -4.174 1.664 -8.601) 9.704 16.800 ( 2.476 -4.508 -7.317) 8.943 16.950 ( -7.277 -2.567 -1.437) 7.849 18.982 ( 12.472 -7.192 10.715) 17.947 19.246 ( -4.179 -4.302 -8.301) 10.241 19.972 ( -0.772 -0.178 1.648) 1.828 20.069 ( 1.589 -2.282 6.034) 6.644 22.698 ( 3.040 2.441 -13.125) 13.691 22.897 ( 4.932 1.236 -18.218) 18.914 23.016 ( 1.967 2.180 -10.184) 10.599 23.219 ( 6.559 -0.986 -17.411) 18.631 24.464 ( -12.066 5.446 5.173) 14.213 24.530 ( -5.312 0.008 5.072) 7.344 25.120 ( 26.836 -0.407 -0.671) 26.847 25.293 ( 0.775 3.203 9.453) 10.011 25.336 ( 5.983 -3.274 -3.275) 7.566 25.657 ( 1.185 -1.863 9.077) 9.342 27.786 ( -1.212 2.325 -6.134) 6.671 28.413 ( 3.272 -5.990 -17.459) 18.746 29.071 ( 0.877 10.588 1.181) 10.689 29.490 ( -0.974 1.341 0.225) 1.672 29.562 ( -1.696 1.361 5.389) 5.811 29.838 ( -2.547 -0.849 -3.205) 4.181 30.078 ( -3.442 -6.002 9.860) 12.046 30.161 ( 5.850 -9.079 14.575) 18.141 30.260 ( -4.841 0.373 14.755) 15.533 30.326 ( -3.365 0.640 12.626) 13.083 30.635 ( 10.543 3.481 2.702) 11.426 30.827 ( -9.692 -8.299 10.546) 16.553 31.034 ( -1.506 -1.074 10.638) 10.798 31.495 ( 2.358 -0.972 -0.880) 2.698 31.723 ( -3.009 -1.542 10.781) 11.299 32.323 ( 0.512 -13.127 -4.595) 13.918 33.473 ( -1.459 14.148 -14.730) 20.476 33.920 ( -9.531 19.486 -32.551) 39.117 ======================= Grid point 56 (24/128) ======================= q-point: ( 0.17 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.424 ( 14.936 30.778 20.516) 39.891 1.706 ( 23.219 23.748 34.017) 47.542 2.207 ( 39.221 32.666 30.002) 59.207 2.797 ( -0.234 12.200 13.301) 18.050 2.976 ( -11.097 9.934 25.261) 29.325 3.586 ( -10.790 4.503 28.521) 30.824 3.816 ( -10.721 -15.565 3.759) 19.270 3.990 ( -16.150 -1.131 31.390) 35.319 4.212 ( 1.070 -0.318 5.574) 5.685 4.278 ( -1.473 -0.339 14.598) 14.676 4.392 ( -4.737 7.047 15.697) 17.846 4.461 ( 0.483 1.135 8.913) 8.998 4.802 ( -9.725 2.514 3.380) 10.599 4.963 ( -5.150 -2.644 5.090) 7.709 5.091 ( 0.113 0.248 4.869) 4.876 5.182 ( -1.407 -0.678 3.310) 3.660 5.360 ( 4.659 3.612 10.795) 12.300 5.550 ( -6.231 11.914 -1.484) 13.526 5.605 ( 0.340 4.366 -9.328) 10.305 5.695 ( -0.947 1.494 -1.618) 2.397 6.167 ( 1.255 -8.317 -1.862) 8.615 6.252 ( -2.198 1.028 2.997) 3.856 6.425 ( 5.531 0.223 -6.302) 8.387 6.632 ( 3.253 -5.401 4.020) 7.477 6.844 ( -5.052 -8.315 0.130) 9.731 6.888 ( -7.493 -3.492 10.295) 13.203 7.123 ( 4.245 -10.521 0.789) 11.372 7.143 ( 0.198 -9.283 -4.527) 10.330 7.426 ( -1.053 13.604 -5.521) 14.720 7.653 ( -4.792 1.893 -1.194) 5.289 7.720 ( 1.030 2.087 -0.664) 2.420 7.809 ( 2.449 2.624 -3.994) 5.369 8.106 ( -0.598 0.879 -10.828) 10.880 8.357 ( 4.188 0.485 -7.938) 8.988 8.411 ( 6.350 -2.993 -13.109) 14.870 8.654 ( -3.456 -2.195 -2.326) 4.709 8.712 ( 1.122 1.848 -7.422) 7.730 8.862 ( 0.159 5.687 -6.595) 8.710 8.885 ( -2.952 7.751 1.144) 8.373 9.085 ( 5.484 2.639 -4.260) 7.429 9.177 ( 1.542 5.759 0.121) 5.963 9.235 ( -1.437 2.350 0.402) 2.784 9.287 ( 1.906 -0.344 5.006) 5.367 9.436 ( -3.270 -1.053 1.341) 3.688 9.458 ( 13.326 -6.536 -8.596) 17.152 9.594 ( 4.514 0.380 -0.913) 4.621 9.669 ( -3.191 -5.172 2.118) 6.436 9.822 ( 9.383 -5.265 -0.631) 10.778 10.004 ( 5.602 3.098 1.655) 6.612 10.260 ( 3.120 2.081 -6.499) 7.504 10.326 ( -1.248 -0.885 -5.331) 5.546 10.496 ( -1.126 -0.191 -1.875) 2.195 10.632 ( 1.130 -1.842 -4.490) 4.983 10.670 ( -0.612 -2.980 -2.184) 3.745 10.831 ( 6.844 0.517 0.770) 6.907 10.897 ( -2.098 -2.011 1.640) 3.337 11.015 ( 2.388 -5.746 -11.234) 12.843 11.181 ( -4.977 -4.401 8.075) 10.457 11.301 ( -1.257 1.079 -6.814) 7.012 11.430 ( 3.916 -2.254 1.388) 4.727 11.517 ( -1.547 -0.398 -1.120) 1.950 11.597 ( -0.774 -3.881 5.891) 7.097 11.663 ( -6.984 6.959 -5.907) 11.493 11.791 ( 1.353 -5.549 1.744) 5.972 11.965 ( 6.369 -5.084 -0.911) 8.200 12.160 ( 3.547 6.479 -0.708) 7.420 12.243 ( -2.811 -17.263 6.810) 18.769 12.679 ( -3.848 1.612 1.604) 4.470 12.877 ( -6.680 4.524 1.850) 8.277 12.972 ( -7.146 1.348 3.898) 8.251 13.165 ( 9.744 5.368 -0.501) 11.136 13.465 ( -3.563 -2.943 -1.096) 4.749 13.554 ( 0.378 -4.264 2.071) 4.755 14.000 ( -6.580 0.266 13.103) 14.665 14.239 ( 2.705 -7.834 -4.953) 9.655 14.532 ( -0.873 -2.865 -6.608) 7.255 14.676 ( -19.341 8.081 20.899) 29.600 15.205 ( -5.702 7.383 0.858) 9.368 15.342 ( -1.802 -1.120 1.248) 2.462 15.438 ( -10.342 2.923 10.722) 15.181 15.583 ( -0.862 -7.856 7.022) 10.572 15.648 ( -3.323 -0.052 -1.246) 3.550 15.809 ( 2.612 -2.056 6.232) 7.063 16.023 ( 1.384 -0.403 1.054) 1.785 16.111 ( -3.257 6.332 4.676) 8.519 16.368 ( -9.017 8.389 -3.823) 12.896 16.720 ( -5.819 11.798 -3.936) 13.731 16.853 ( 3.130 -3.187 -7.532) 8.757 19.074 ( -5.964 -7.824 -2.896) 10.256 19.128 ( -1.905 -9.079 -1.391) 9.380 19.973 ( 1.154 0.441 0.883) 1.518 20.127 ( 2.532 -2.121 3.495) 4.809 22.691 ( 2.087 2.738 -12.901) 13.352 22.906 ( 4.547 1.608 -17.473) 18.127 22.998 ( 0.598 1.568 -9.751) 9.894 23.256 ( 4.393 -1.331 -15.413) 16.082 24.303 ( -5.570 3.105 5.755) 8.590 24.464 ( -3.043 -0.540 2.467) 3.954 25.349 ( 0.988 3.030 10.987) 11.440 25.623 ( 24.655 -1.435 -0.606) 24.705 25.697 ( -0.706 -1.824 10.278) 10.463 26.212 ( 68.309 -24.394 -26.547) 77.239 27.632 ( -12.131 2.049 -7.635) 14.479 28.344 ( -2.578 -9.325 -19.297) 21.586 29.128 ( 4.321 9.014 2.175) 10.230 29.456 ( -2.749 0.758 0.649) 2.924 29.548 ( -1.892 3.929 2.574) 5.064 29.785 ( -1.499 -0.724 -3.350) 3.741 30.032 ( -4.168 -3.495 7.109) 8.951 30.198 ( -2.851 0.160 9.291) 9.720 30.307 ( -1.679 0.463 15.693) 15.790 30.331 ( -2.117 -7.585 15.718) 17.580 30.726 ( -5.855 -4.697 15.688) 17.391 30.887 ( 7.948 -6.092 9.924) 14.099 31.108 ( 7.628 -3.608 6.492) 10.647 31.542 ( 0.992 0.103 2.341) 2.544 31.710 ( -1.854 0.361 9.122) 9.315 32.295 ( -1.402 -12.506 -4.511) 13.369 33.136 ( -26.663 37.530 -18.607) 49.655 33.506 ( -11.780 12.421 -14.208) 22.246 ======================= Grid point 57 (25/128) ======================= q-point: ( 0.33 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 20.574 20.844 15.648) 33.206 2.179 ( 16.612 26.482 34.821) 46.795 2.735 ( -11.978 17.505 3.131) 21.440 2.828 ( -16.033 10.340 25.263) 31.657 3.167 ( 40.153 11.693 12.361) 43.610 3.502 ( -5.196 -2.308 30.269) 30.798 3.745 ( 0.005 -8.930 10.952) 14.131 3.817 ( -12.144 -1.165 29.253) 31.695 4.211 ( -3.944 7.786 3.506) 9.406 4.273 ( -3.616 0.194 7.675) 8.487 4.370 ( -6.437 3.314 8.991) 11.544 4.485 ( -0.512 -1.178 6.442) 6.569 4.631 ( -7.057 7.867 13.623) 17.242 4.847 ( -12.422 -0.974 15.403) 19.812 5.124 ( 0.655 -0.212 7.978) 8.008 5.199 ( 2.754 -6.642 -4.518) 8.492 5.318 ( -11.268 3.594 9.965) 15.466 5.575 ( 2.207 14.606 0.562) 14.782 5.631 ( 6.176 -0.132 -0.242) 6.182 5.717 ( 2.376 3.666 -1.637) 4.665 6.113 ( -9.015 -5.000 2.819) 10.687 6.256 ( -1.480 -2.510 0.119) 2.916 6.396 ( -14.460 -2.711 0.903) 14.739 6.466 ( -2.385 3.147 -3.639) 5.370 6.734 ( -0.162 -2.181 -3.678) 4.279 6.960 ( 8.645 -7.657 4.657) 12.452 7.200 ( 4.678 -11.631 2.208) 12.729 7.239 ( 1.753 -8.533 -0.425) 8.722 7.435 ( 3.626 4.697 -3.157) 6.722 7.603 ( 0.821 0.565 -2.258) 2.469 7.725 ( 1.082 -4.848 -1.681) 5.244 7.875 ( 2.957 7.111 1.474) 7.841 8.083 ( 3.480 -0.505 -8.325) 9.037 8.423 ( 4.936 -1.865 -6.022) 8.006 8.475 ( 6.711 -1.841 -10.319) 12.446 8.547 ( -6.432 -1.076 1.061) 6.607 8.713 ( 1.782 0.394 -6.790) 7.031 8.814 ( -1.856 6.644 -4.975) 8.505 8.872 ( 1.021 4.975 -1.234) 5.226 9.077 ( -2.262 7.711 -6.935) 10.615 9.154 ( -5.612 -0.764 -1.977) 5.999 9.247 ( 4.057 3.728 -0.352) 5.521 9.366 ( 1.414 1.658 2.112) 3.035 9.408 ( 1.152 0.671 1.326) 1.881 9.552 ( -0.029 -2.139 4.998) 5.437 9.576 ( -1.444 -2.963 -6.335) 7.141 9.667 ( 0.357 -0.846 2.945) 3.085 10.018 ( 11.124 -9.012 -6.613) 15.770 10.132 ( 6.613 1.957 -3.614) 7.786 10.224 ( -2.395 2.729 -10.135) 10.765 10.327 ( 1.960 5.360 -1.179) 5.828 10.392 ( -11.745 -2.158 7.321) 14.007 10.621 ( 0.921 -4.544 -5.620) 7.286 10.663 ( 3.008 -2.467 -1.490) 4.166 10.867 ( -0.216 -2.289 -11.293) 11.525 10.920 ( -0.277 -7.721 -11.339) 13.720 11.012 ( 6.863 -1.063 -4.154) 8.093 11.188 ( -0.377 -4.221 2.816) 5.088 11.255 ( 0.713 -2.684 -3.335) 4.340 11.395 ( -10.122 -6.528 -1.749) 12.171 11.477 ( -1.464 -1.406 -1.227) 2.372 11.586 ( 4.322 0.713 4.254) 6.106 11.672 ( 3.348 -3.448 7.553) 8.952 11.812 ( 1.662 2.863 -3.712) 4.973 12.071 ( 5.340 -3.990 -4.244) 7.902 12.144 ( -6.189 -9.985 8.616) 14.569 12.332 ( 10.662 -3.223 -2.398) 11.393 12.667 ( 1.823 2.575 0.548) 3.202 12.746 ( -8.878 1.402 1.385) 9.094 12.814 ( -9.737 0.972 2.803) 10.179 13.332 ( 7.482 2.109 2.399) 8.136 13.407 ( -3.992 -5.096 8.726) 10.865 13.566 ( -0.049 -0.128 -1.622) 1.628 13.944 ( -5.854 -0.521 17.852) 18.795 14.213 ( -6.243 -3.634 6.455) 9.688 14.455 ( -2.184 15.659 3.220) 16.135 14.565 ( -0.847 -3.745 3.984) 5.533 15.143 ( -1.465 8.851 0.564) 8.989 15.316 ( -3.723 -3.791 10.048) 11.366 15.370 ( -0.132 9.964 -0.834) 9.999 15.586 ( -3.194 -2.676 -0.234) 4.174 15.593 ( -0.636 -5.785 5.943) 8.318 15.872 ( 1.235 -1.035 5.504) 5.735 15.987 ( -6.160 -2.163 5.270) 8.390 16.108 ( 1.971 7.480 -1.151) 7.820 16.228 ( -5.193 11.711 -1.889) 12.949 16.646 ( -0.800 8.553 -7.095) 11.142 16.876 ( 2.404 -3.830 -7.989) 9.180 18.921 ( -6.002 -5.287 -7.946) 11.275 19.110 ( -1.121 -10.109 4.138) 10.981 20.014 ( 2.676 0.062 -1.046) 2.874 20.172 ( 1.202 -2.408 0.102) 2.693 22.677 ( 2.199 2.744 -12.885) 13.356 22.922 ( 4.482 0.242 -16.691) 17.284 22.956 ( -0.361 2.252 -10.741) 10.981 23.249 ( 1.671 -1.447 -14.840) 15.003 24.291 ( 1.270 2.103 5.124) 5.683 24.455 ( 0.693 -0.608 3.864) 3.972 25.405 ( 0.169 2.271 10.412) 10.658 25.668 ( -5.853 -1.611 11.786) 13.257 26.170 ( 32.052 1.462 -3.511) 32.277 26.976 ( 19.111 -10.378 -32.538) 39.136 27.393 ( 0.641 -8.124 -7.573) 11.124 28.174 ( -6.348 -16.004 -22.368) 28.227 29.234 ( 5.904 5.890 3.155) 8.917 29.398 ( -4.128 -0.233 1.401) 4.366 29.507 ( -2.628 6.258 -0.798) 6.834 29.761 ( -0.305 0.011 -1.168) 1.208 29.995 ( -2.753 -2.636 5.598) 6.773 30.203 ( -0.120 2.493 6.072) 6.564 30.311 ( -4.030 -1.900 15.362) 15.995 30.341 ( -3.851 -3.938 16.009) 16.930 30.695 ( -5.947 -3.629 19.670) 20.867 30.995 ( 0.289 2.330 17.569) 17.725 31.283 ( 4.476 -2.127 5.672) 7.532 31.495 ( -5.717 -2.490 4.606) 7.752 31.773 ( 4.330 0.492 4.277) 6.106 32.244 ( -2.168 -11.843 -3.434) 12.520 32.760 ( -4.363 31.295 -13.393) 34.319 33.283 ( -7.659 8.607 -13.334) 17.622 ======================= Grid point 58 (26/128) ======================= q-point: (-0.50 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.129 ( -7.758 11.991 14.875) 20.621 2.409 ( -3.724 18.832 9.677) 21.498 2.487 ( -19.081 21.291 15.457) 32.501 2.745 ( 10.280 19.964 29.387) 36.984 3.415 ( -6.042 1.871 28.606) 29.296 3.547 ( -8.597 -2.965 24.018) 25.682 3.831 ( -0.890 2.120 -0.444) 2.342 3.999 ( 2.452 -4.987 19.116) 19.907 4.161 ( 0.958 1.068 -5.420) 5.606 4.199 ( -5.006 2.978 5.886) 8.281 4.298 ( -7.938 -2.795 15.688) 17.803 4.544 ( -4.053 13.833 10.818) 18.023 4.555 ( 3.113 1.814 16.064) 16.463 4.735 ( -4.837 -2.374 22.362) 23.002 5.157 ( -3.052 1.375 7.122) 7.870 5.197 ( -1.083 -3.040 -2.533) 4.103 5.223 ( -0.837 -1.192 4.720) 4.939 5.531 ( -8.621 9.345 2.966) 13.056 5.615 ( 0.165 6.234 -3.719) 7.261 5.756 ( 3.773 4.681 -0.954) 6.087 6.050 ( 2.406 -10.048 4.627) 11.321 6.095 ( -7.925 2.230 -6.021) 10.200 6.412 ( 1.846 -1.175 4.591) 5.086 6.473 ( 8.621 1.043 2.656) 9.081 6.757 ( 2.159 -1.621 -4.549) 5.290 7.078 ( -0.206 -8.667 4.480) 9.759 7.213 ( -1.046 -7.152 -0.261) 7.233 7.295 ( 4.696 -10.189 2.359) 11.464 7.445 ( -2.486 -2.456 -1.295) 3.727 7.654 ( 4.878 3.675 -2.514) 6.605 7.752 ( 0.002 -4.579 1.682) 4.878 7.900 ( 0.898 5.964 0.414) 6.045 8.168 ( 6.063 2.356 -1.355) 6.644 8.426 ( -0.424 -4.710 -0.989) 4.831 8.503 ( 0.737 0.303 -3.707) 3.791 8.550 ( 3.097 -1.878 -8.545) 9.281 8.704 ( 0.489 0.619 -6.713) 6.759 8.792 ( 0.768 3.947 -2.561) 4.767 8.888 ( 1.575 6.455 -3.282) 7.411 9.021 ( -0.230 1.813 -9.120) 9.301 9.065 ( 0.319 1.022 -2.843) 3.038 9.259 ( -2.400 2.427 -2.137) 4.028 9.375 ( 1.641 0.177 -1.352) 2.134 9.399 ( -3.448 1.206 1.968) 4.149 9.540 ( -1.840 0.663 -0.683) 2.072 9.602 ( -0.732 1.968 4.860) 5.294 9.707 ( 7.628 1.150 -1.940) 7.955 10.007 ( -7.676 1.649 -4.713) 9.157 10.112 ( -8.173 1.878 -0.641) 8.411 10.232 ( 2.944 -0.394 -10.497) 10.909 10.277 ( 6.987 -4.097 -0.873) 8.147 10.393 ( 1.205 0.793 1.139) 1.838 10.621 ( -2.736 -7.502 -8.483) 11.650 10.695 ( 0.530 -4.825 -2.761) 5.584 10.733 ( -1.786 -2.872 -12.914) 13.350 10.910 ( 0.642 -3.075 -5.828) 6.620 11.046 ( -6.592 -2.390 -7.293) 10.117 11.171 ( 9.273 -5.446 -7.603) 13.170 11.279 ( -0.639 -6.479 -1.110) 6.605 11.358 ( 6.009 -3.737 5.221) 8.793 11.454 ( -0.173 -1.589 -0.588) 1.703 11.697 ( 2.369 -1.849 6.589) 7.241 11.744 ( 4.232 -1.710 -2.066) 5.010 11.808 ( -3.816 1.881 5.403) 6.877 12.044 ( -1.891 -8.580 -2.854) 9.237 12.158 ( 0.988 -7.745 1.870) 8.029 12.482 ( 1.615 -1.924 -2.646) 3.648 12.613 ( -1.726 2.636 2.510) 4.029 12.695 ( -2.958 0.543 2.129) 3.685 12.729 ( 4.529 3.852 -0.267) 5.951 13.378 ( -4.157 -9.401 20.225) 22.687 13.468 ( 5.594 1.620 0.371) 5.836 13.519 ( -4.832 1.090 -0.003) 4.954 13.937 ( -3.080 2.955 18.869) 19.346 14.141 ( -3.225 1.334 5.654) 6.644 14.468 ( 0.951 0.399 2.487) 2.692 14.618 ( 4.903 7.324 4.658) 9.969 15.143 ( 0.750 9.964 0.692) 10.016 15.307 ( -1.613 -0.895 11.367) 11.516 15.394 ( 2.529 6.160 -0.191) 6.661 15.532 ( -2.596 -4.531 -0.190) 5.225 15.616 ( 0.705 -2.195 5.595) 6.051 15.893 ( -2.141 -1.097 1.224) 2.700 15.899 ( -3.757 -0.688 8.029) 8.891 16.090 ( -3.361 6.408 -4.292) 8.413 16.207 ( 3.277 11.828 1.672) 12.387 16.619 ( 1.148 6.358 -8.755) 10.881 16.871 ( 0.852 -4.065 -8.950) 9.867 18.814 ( -2.359 -5.228 -7.388) 9.353 19.133 ( 1.963 -8.652 3.983) 9.725 20.041 ( 0.483 -0.268 -1.341) 1.450 20.166 ( -1.331 -2.415 -2.342) 3.618 22.671 ( 2.916 2.534 -13.060) 13.620 22.895 ( 0.432 0.048 -13.910) 13.917 22.948 ( 4.213 2.151 -14.156) 14.925 23.209 ( 1.079 -1.248 -15.989) 16.074 24.367 ( 3.738 1.851 7.211) 8.330 24.508 ( 2.166 -0.362 7.363) 7.684 25.427 ( -2.650 1.443 9.191) 9.674 25.589 ( -6.520 -0.903 9.584) 11.627 26.438 ( -14.110 2.555 -16.202) 21.636 26.948 ( 17.914 2.248 -10.205) 20.739 27.536 ( 1.103 -17.725 -22.357) 28.552 28.032 ( 6.683 -20.372 -22.162) 30.836 29.293 ( -5.050 4.465 0.302) 6.747 29.372 ( 3.972 0.337 5.309) 6.639 29.474 ( 0.376 5.680 -2.013) 6.038 29.760 ( 0.151 0.764 2.056) 2.199 29.970 ( -2.358 -2.271 4.243) 5.359 30.218 ( -2.950 -4.327 10.321) 11.574 30.302 ( -1.539 3.209 9.728) 10.359 30.334 ( -3.381 -0.489 14.091) 14.499 30.645 ( -8.477 1.482 19.273) 21.107 31.053 ( -3.545 3.443 21.057) 21.629 31.299 ( -2.365 12.685 9.031) 15.750 31.454 ( -0.572 -16.267 -2.360) 16.447 31.824 ( -1.520 0.729 4.390) 4.703 32.217 ( 1.269 -12.446 -2.801) 12.820 32.796 ( 9.796 22.365 -8.374) 25.812 33.175 ( 3.471 9.962 -12.546) 16.392 ======================= Grid point 59 (27/128) ======================= q-point: (-0.33 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -29.833 17.602 20.052) 40.025 1.967 ( -32.828 22.190 10.778) 41.064 2.636 ( 5.587 10.485 16.703) 20.497 2.951 ( -12.828 23.624 17.189) 31.908 3.204 ( -36.195 14.895 20.478) 44.173 3.466 ( 5.023 -3.021 21.352) 22.142 3.726 ( -3.252 5.974 18.148) 19.380 3.947 ( -10.815 5.480 29.841) 32.210 4.125 ( 3.088 -11.718 4.640) 12.976 4.243 ( -0.834 -0.958 10.178) 10.256 4.277 ( 1.088 -5.858 6.026) 8.475 4.597 ( 1.410 8.035 11.755) 14.308 4.750 ( 8.229 -1.100 5.431) 9.921 4.787 ( 0.386 -2.484 19.791) 19.950 5.081 ( -7.430 1.045 5.637) 9.385 5.145 ( -2.662 -4.683 -4.360) 6.930 5.273 ( 2.051 2.460 4.852) 5.814 5.449 ( -0.058 6.782 0.082) 6.783 5.629 ( 1.596 12.454 -3.345) 12.994 5.843 ( 2.150 8.638 -2.272) 9.187 6.061 ( 10.956 0.233 -4.076) 11.692 6.129 ( 2.546 -12.165 1.694) 12.543 6.427 ( -2.521 -5.377 8.225) 10.145 6.647 ( 4.906 -6.598 -3.017) 8.758 6.759 ( -0.604 -1.332 -0.492) 1.543 7.022 ( -4.234 -6.871 4.273) 9.132 7.203 ( -0.976 -6.136 2.727) 6.785 7.359 ( -0.942 -0.089 -4.040) 4.149 7.436 ( 3.604 -6.890 10.107) 12.752 7.709 ( -1.743 4.678 2.207) 5.459 7.720 ( 1.074 0.229 -3.402) 3.575 7.927 ( 0.972 4.450 -0.603) 4.594 8.217 ( -0.283 4.593 -1.360) 4.798 8.453 ( 0.936 0.425 -6.072) 6.158 8.489 ( -1.136 -4.820 -5.618) 7.489 8.515 ( 1.727 -1.145 -6.810) 7.118 8.695 ( 0.997 1.186 -7.163) 7.328 8.793 ( 3.310 7.859 -4.283) 9.542 8.933 ( 4.345 4.039 -0.890) 5.999 9.038 ( 3.400 -3.741 -4.038) 6.470 9.096 ( 0.803 -0.693 -1.983) 2.249 9.235 ( 3.164 1.874 0.126) 3.680 9.314 ( -4.422 -2.676 -4.224) 6.675 9.414 ( -1.591 2.866 2.400) 4.063 9.474 ( 0.631 3.288 -5.033) 6.045 9.533 ( -9.043 6.234 4.763) 11.972 9.861 ( 3.427 0.460 -3.343) 4.809 9.906 ( 2.588 -0.303 -5.997) 6.539 10.023 ( -4.106 -2.514 -4.263) 6.430 10.135 ( -5.941 -10.229 -13.605) 18.029 10.328 ( -2.764 -3.043 -3.406) 5.339 10.435 ( 8.282 -1.321 -6.198) 10.429 10.528 ( 0.291 4.687 -6.150) 7.738 10.649 ( -4.885 -3.953 1.380) 6.434 10.715 ( -1.426 -5.219 -3.376) 6.378 10.829 ( -1.290 0.885 -7.421) 7.585 11.039 ( 5.135 -1.757 -2.570) 6.005 11.272 ( 0.981 -7.999 -5.931) 10.006 11.294 ( 5.964 -0.556 -6.718) 9.001 11.424 ( -1.224 -3.317 5.027) 6.146 11.538 ( 7.669 -6.083 2.871) 10.201 11.676 ( -6.882 -9.420 4.184) 12.393 11.738 ( -0.769 9.196 -6.271) 11.157 11.813 ( 1.895 -2.660 2.541) 4.138 12.011 ( -3.820 -8.906 6.569) 11.708 12.142 ( -1.497 -4.987 -1.501) 5.419 12.394 ( -7.036 -2.346 0.278) 7.422 12.628 ( 1.592 3.263 4.012) 5.411 12.785 ( 8.426 0.315 -1.458) 8.557 12.834 ( 7.078 8.964 -1.843) 11.569 13.382 ( -9.025 2.720 0.736) 9.454 13.416 ( -2.202 -14.030 24.113) 27.984 13.557 ( 3.264 0.643 1.569) 3.679 13.981 ( 0.001 5.553 15.371) 16.343 14.135 ( 1.097 -3.633 -1.380) 4.039 14.508 ( 2.329 -7.888 2.033) 8.472 14.781 ( 7.966 10.378 16.032) 20.693 15.179 ( 3.659 8.964 1.585) 9.810 15.359 ( 2.015 2.637 16.345) 16.679 15.440 ( 1.033 2.447 2.450) 3.614 15.501 ( -0.237 -5.760 0.877) 5.831 15.656 ( 1.044 2.388 4.210) 4.952 15.849 ( -1.610 -3.040 4.586) 5.733 15.894 ( -0.698 0.878 1.213) 1.652 16.013 ( -2.677 8.382 -2.228) 9.077 16.314 ( 7.581 11.235 3.706) 14.052 16.613 ( 2.237 5.703 -9.743) 11.508 16.840 ( 0.025 -4.198 -9.527) 10.411 18.772 ( 0.533 -4.037 -6.202) 7.419 19.209 ( 4.652 -7.172 1.758) 8.727 20.019 ( -2.368 -0.287 -0.062) 2.386 20.112 ( -3.101 -2.083 -2.741) 4.633 22.677 ( 3.526 2.329 -13.354) 14.006 22.862 ( 2.722 0.699 -15.941) 16.187 22.971 ( 3.981 1.538 -11.802) 12.550 23.174 ( 2.808 -0.854 -17.818) 18.058 24.456 ( 1.440 1.955 10.358) 10.639 24.570 ( 0.328 -0.064 9.857) 9.863 25.364 ( -7.381 1.670 8.630) 11.477 25.553 ( -0.908 -0.968 6.228) 6.368 25.920 ( -27.374 0.857 -14.255) 30.875 26.968 ( -28.012 -28.807 -45.020) 60.344 27.458 ( 15.661 -0.363 -1.550) 15.742 28.202 ( 15.053 -11.776 -17.387) 25.838 29.182 ( -5.968 8.092 -0.470) 10.065 29.445 ( 2.203 -0.450 1.951) 2.977 29.517 ( 3.063 2.718 3.086) 5.128 29.793 ( 1.995 0.328 6.897) 7.187 29.941 ( -2.145 -1.864 1.847) 3.389 30.182 ( -5.212 -7.852 12.475) 15.635 30.311 ( -3.887 0.788 15.337) 15.841 30.347 ( -0.025 4.447 6.691) 8.034 30.557 ( -7.455 6.879 13.148) 16.606 31.040 ( -5.124 -1.138 16.455) 17.272 31.249 ( -8.929 -0.867 3.923) 9.791 31.453 ( 1.155 -7.010 2.011) 7.383 31.773 ( -4.638 -0.523 4.733) 6.647 32.259 ( 3.848 -12.676 -2.930) 13.568 33.058 ( 23.569 28.683 0.545) 37.128 33.299 ( 13.057 11.736 -11.919) 21.219 ======================= Grid point 60 (28/128) ======================= q-point: (-0.17 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.275 ( -34.888 20.814 18.143) 44.492 1.436 ( -25.869 29.641 19.517) 43.917 2.251 ( -44.493 38.986 30.595) 66.600 2.737 ( -2.873 9.062 19.851) 22.010 3.045 ( -7.942 14.191 27.453) 31.908 3.677 ( -0.034 1.717 16.131) 16.222 3.787 ( 5.716 2.545 16.745) 17.875 3.973 ( 1.177 5.702 22.280) 23.028 4.156 ( -3.093 -16.830 13.905) 22.049 4.245 ( -5.793 -3.390 20.992) 22.039 4.347 ( 3.102 1.853 2.167) 4.213 4.669 ( -3.821 -0.867 19.566) 19.955 4.799 ( -0.968 4.203 5.179) 6.740 4.906 ( 3.601 -8.618 -4.131) 10.213 4.993 ( 0.951 -4.373 2.915) 5.341 5.101 ( -1.434 4.267 6.672) 8.049 5.302 ( 0.578 -0.459 2.778) 2.875 5.565 ( 10.307 9.611 -0.977) 14.126 5.646 ( 2.514 15.158 -7.123) 16.936 5.830 ( -1.442 9.356 -3.913) 10.243 6.150 ( -0.806 -12.123 4.226) 12.863 6.273 ( 9.513 -5.009 -5.066) 11.885 6.393 ( -3.150 -6.719 3.549) 8.226 6.600 ( -6.339 -9.199 -1.231) 11.239 6.738 ( 0.054 -4.904 -0.095) 4.905 6.970 ( -3.787 -7.603 3.675) 9.255 7.193 ( -7.045 -1.437 6.894) 9.961 7.350 ( 5.137 7.154 -4.874) 10.066 7.500 ( -3.026 -9.265 8.848) 13.164 7.707 ( 2.658 5.381 -1.969) 6.316 7.752 ( 2.563 3.620 0.097) 4.436 7.905 ( -2.361 3.340 -3.740) 5.542 8.181 ( -0.542 3.005 -8.163) 8.716 8.386 ( -3.624 -1.807 -11.421) 12.118 8.432 ( -1.904 -0.742 -3.921) 4.421 8.575 ( 6.618 -0.569 -6.900) 9.578 8.704 ( 2.546 2.875 -5.852) 7.000 8.909 ( 10.297 8.704 -2.610) 13.733 8.954 ( -2.510 -0.438 -9.607) 9.940 9.022 ( -0.442 2.714 -4.476) 5.253 9.120 ( -0.444 -3.474 3.530) 4.972 9.258 ( -3.339 0.734 2.405) 4.180 9.313 ( 1.372 1.274 -2.553) 3.166 9.351 ( -4.682 4.196 -0.437) 6.302 9.381 ( -0.860 1.187 0.131) 1.472 9.548 ( 2.104 -0.118 -5.124) 5.541 9.596 ( -17.153 -2.935 -16.437) 23.937 9.851 ( -3.436 -3.417 1.408) 5.046 9.947 ( -0.863 -0.523 4.198) 4.318 10.205 ( 5.639 -2.412 -2.303) 6.552 10.302 ( 3.107 0.208 -9.387) 9.890 10.538 ( 4.036 1.493 -5.033) 6.622 10.554 ( 3.963 2.056 -1.888) 4.847 10.574 ( -0.830 -2.777 0.075) 2.899 10.674 ( -0.472 -3.626 -2.311) 4.326 10.828 ( 2.293 2.731 -3.277) 4.843 11.125 ( 2.141 -3.122 3.289) 5.015 11.255 ( 0.814 -6.297 -6.995) 9.447 11.315 ( -1.274 -4.824 -2.107) 5.416 11.392 ( -4.231 -4.803 2.770) 6.975 11.585 ( -1.615 1.716 -2.032) 3.112 11.664 ( 4.256 -5.063 3.697) 7.577 11.708 ( 0.599 8.998 -10.447) 13.801 11.832 ( -0.500 -5.764 2.357) 6.247 11.955 ( -7.133 -4.377 8.506) 11.933 12.102 ( -0.866 1.246 -3.133) 3.482 12.298 ( -4.012 -10.158 7.554) 13.279 12.698 ( 3.759 3.679 4.285) 6.784 12.910 ( 4.230 1.564 -0.686) 4.561 12.945 ( 6.814 8.240 -4.562) 11.625 13.196 ( -10.927 6.803 1.743) 12.989 13.483 ( -0.666 -14.258 16.129) 21.538 13.596 ( 0.248 -0.448 1.102) 1.215 14.036 ( -0.182 5.734 10.680) 12.124 14.162 ( 3.385 -7.353 -5.765) 9.938 14.550 ( 1.367 -9.830 -0.230) 9.927 14.928 ( 0.853 6.209 8.046) 10.200 15.275 ( 3.148 -2.595 2.658) 4.869 15.419 ( -0.586 -1.779 -4.033) 4.446 15.524 ( 1.580 -2.219 4.348) 5.131 15.593 ( 5.606 -10.912 28.200) 30.753 15.675 ( 0.758 3.004 0.086) 3.099 15.873 ( -2.588 -1.522 3.140) 4.344 15.894 ( 5.241 7.233 -0.404) 8.941 16.020 ( 3.407 5.283 9.544) 11.428 16.550 ( 10.798 3.362 1.747) 11.444 16.658 ( 14.481 9.238 -0.086) 17.177 16.810 ( 1.496 -3.694 -8.555) 9.438 18.783 ( 3.027 0.849 0.782) 3.239 19.284 ( 2.639 -5.626 -3.088) 6.939 19.979 ( -1.329 -0.121 0.850) 1.583 20.052 ( -2.387 -1.464 1.659) 3.254 22.689 ( 3.628 2.283 -13.436) 14.103 22.867 ( 5.194 1.194 -17.262) 18.066 22.997 ( 3.688 1.786 -9.744) 10.571 23.177 ( 5.630 -0.680 -18.777) 19.615 24.489 ( -1.939 3.507 11.095) 11.797 24.584 ( -3.224 0.224 9.162) 9.716 25.284 ( -4.044 2.561 7.848) 9.192 25.451 ( -15.444 -2.262 -8.483) 17.765 25.598 ( 1.177 -1.244 5.917) 6.160 25.883 ( -65.358 -26.206 -40.524) 81.244 27.719 ( 10.709 2.674 -3.975) 11.732 28.363 ( 9.695 -6.947 -16.487) 20.349 29.092 ( -3.349 10.241 -0.085) 10.775 29.484 ( 1.438 0.562 0.275) 1.568 29.562 ( -0.355 0.655 5.746) 5.794 29.882 ( -0.228 -1.486 4.560) 4.802 29.936 ( 5.458 -3.777 6.838) 9.530 30.140 ( -4.721 -6.519 11.117) 13.725 30.294 ( -4.952 -1.553 16.675) 17.464 30.350 ( -3.849 3.469 11.048) 12.203 30.521 ( 0.910 8.919 3.412) 9.593 30.995 ( -9.515 -9.346 12.545) 18.310 31.060 ( -7.969 -1.027 4.578) 9.248 31.474 ( 0.600 -2.427 0.055) 2.501 31.733 ( -2.776 -1.571 8.707) 9.273 32.309 ( 2.819 -13.101 -3.867) 13.947 33.445 ( 9.432 11.063 -11.205) 18.355 33.673 ( 37.303 27.758 -9.960) 47.553 ======================= Grid point 61 (29/128) ======================= q-point: ( 0.00 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 6.374 36.089 19.430) 41.480 1.981 ( -4.102 35.637 26.017) 44.314 2.793 ( -6.755 11.851 33.155) 35.851 2.884 ( -5.278 27.342 24.540) 37.117 3.050 ( -0.436 -15.602 8.135) 17.601 3.599 ( -7.765 4.514 1.022) 9.040 3.997 ( -11.918 8.831 16.582) 22.249 4.052 ( -4.482 2.850 32.321) 32.755 4.180 ( -0.546 0.809 11.927) 11.967 4.238 ( 3.403 4.580 5.851) 8.173 4.437 ( 2.265 0.218 4.609) 5.141 4.567 ( -0.833 -13.713 11.244) 17.753 4.686 ( -4.545 7.912 8.727) 12.626 4.852 ( 5.403 -8.510 -9.626) 13.938 4.975 ( 0.162 -6.584 7.883) 10.272 5.193 ( -1.473 -7.733 7.323) 10.752 5.388 ( 2.107 10.965 11.354) 15.925 5.670 ( -5.840 -1.739 1.663) 6.317 5.756 ( 0.152 4.210 -1.571) 4.496 5.948 ( 1.675 -5.616 0.477) 5.880 6.046 ( -6.590 7.295 -5.042) 11.048 6.247 ( 1.010 -3.639 -2.511) 4.535 6.359 ( 3.943 1.577 0.892) 4.339 6.389 ( 4.439 -4.876 -1.412) 6.744 6.651 ( 8.748 -8.373 -1.508) 12.203 6.834 ( -3.761 -2.719 10.033) 11.055 6.931 ( -8.015 -4.767 7.480) 11.955 7.138 ( -13.377 -13.581 2.360) 19.208 7.650 ( 3.407 6.567 -1.333) 7.517 7.782 ( -0.199 3.195 0.118) 3.204 7.845 ( -7.625 4.136 -7.913) 11.742 7.944 ( 0.332 8.900 -2.468) 9.241 8.157 ( 0.763 -2.983 -12.626) 12.996 8.287 ( -1.702 -4.455 -11.060) 12.044 8.373 ( 3.215 3.553 -8.549) 9.800 8.640 ( 0.251 -3.682 -2.535) 4.478 8.792 ( 4.436 5.441 -5.687) 9.035 8.899 ( 2.866 0.726 -5.142) 5.932 8.959 ( 1.486 -7.141 0.839) 7.342 9.078 ( 4.178 2.220 -6.250) 7.839 9.210 ( 3.312 2.535 5.515) 6.914 9.286 ( 0.910 5.252 -1.128) 5.449 9.310 ( -3.212 7.729 -5.292) 9.903 9.396 ( -2.942 5.460 -1.306) 6.338 9.450 ( 4.357 1.615 4.194) 6.259 9.520 ( 0.794 0.723 -6.111) 6.204 9.609 ( 1.027 -2.091 -1.184) 2.613 9.688 ( -0.131 -4.293 -0.009) 4.295 10.022 ( -0.812 6.197 -0.703) 6.289 10.223 ( 3.512 -1.482 0.582) 3.856 10.281 ( -0.555 -3.449 -3.412) 4.883 10.459 ( 0.385 -10.099 -6.195) 11.854 10.570 ( -1.898 0.362 -1.574) 2.492 10.624 ( 3.078 -0.861 3.759) 4.934 10.803 ( 8.415 8.437 -5.882) 13.289 10.905 ( -0.272 1.084 -0.060) 1.119 10.990 ( -2.934 -3.834 7.433) 8.863 11.079 ( 1.647 -4.128 0.198) 4.449 11.258 ( 7.261 -3.426 -5.216) 9.574 11.350 ( 0.666 -3.223 -1.863) 3.782 11.538 ( -2.188 -4.083 2.094) 5.084 11.650 ( -1.003 -1.374 3.348) 3.756 11.686 ( -3.293 -4.113 2.670) 5.907 11.748 ( -5.836 -4.660 8.850) 11.580 11.760 ( 0.057 -3.419 5.884) 6.805 11.977 ( -11.052 -10.962 10.360) 18.699 12.338 ( 3.169 13.042 -7.422) 15.337 12.694 ( -1.636 -4.993 0.918) 5.334 13.069 ( 5.988 5.862 -0.890) 8.427 13.141 ( -4.987 9.733 -3.336) 11.434 13.255 ( -3.895 8.790 -4.903) 10.792 13.359 ( 7.489 -7.726 1.135) 10.820 13.590 ( -2.424 4.809 -7.098) 8.910 13.993 ( 2.060 -11.878 -5.241) 13.145 14.082 ( -4.206 0.360 6.753) 7.964 14.328 ( -1.097 -11.745 0.284) 11.799 15.088 ( -4.808 7.938 10.257) 13.833 15.256 ( -0.384 -4.227 6.873) 8.078 15.352 ( -2.439 1.416 -4.843) 5.604 15.449 ( -2.890 -3.777 -0.918) 4.844 15.587 ( -0.334 5.027 7.299) 8.869 15.734 ( -1.064 3.162 0.267) 3.346 15.833 ( -3.557 2.103 3.788) 5.606 15.940 ( -0.048 -5.186 -1.686) 5.454 16.271 ( 2.317 9.983 4.976) 11.393 16.576 ( -3.049 -0.280 -0.145) 3.065 16.700 ( 5.350 -3.506 -8.434) 10.585 16.862 ( 4.851 -5.832 -3.218) 8.240 18.939 ( 1.085 1.596 3.842) 4.299 19.137 ( -3.397 -6.524 -6.405) 9.753 19.975 ( -0.217 0.583 2.049) 2.141 20.029 ( 1.135 -1.957 4.448) 4.990 22.759 ( 3.109 3.626 -12.219) 13.119 22.885 ( 4.220 -2.042 -14.202) 14.956 23.073 ( 3.088 3.405 -12.291) 13.122 23.189 ( 5.671 -2.106 -15.950) 17.059 24.520 ( -10.058 1.133 6.520) 12.039 24.530 ( -6.729 0.005 5.932) 8.971 25.130 ( 14.767 1.516 -0.832) 14.868 25.253 ( 7.693 -4.320 -2.491) 9.168 25.385 ( 0.061 5.488 9.457) 10.934 25.597 ( 0.891 -4.292 8.815) 9.844 27.890 ( -0.494 7.821 -9.907) 12.631 28.260 ( 1.473 -9.389 -14.878) 17.654 29.321 ( -0.265 14.011 -0.152) 14.015 29.529 ( -1.544 2.566 0.481) 3.033 29.581 ( 1.181 0.393 4.510) 4.679 29.798 ( -2.107 -4.610 -4.187) 6.574 29.959 ( 0.805 -4.261 13.521) 14.200 30.026 ( -1.196 -5.032 10.773) 11.950 30.265 ( -3.242 0.824 16.653) 16.986 30.341 ( -3.415 -0.917 12.885) 13.361 30.680 ( 0.572 0.591 8.051) 8.092 30.739 ( -4.231 -1.347 4.569) 6.371 31.094 ( -0.496 7.189 6.137) 9.465 31.442 ( 2.308 -5.367 0.782) 5.895 31.758 ( -1.129 3.847 6.104) 7.304 32.055 ( 0.150 -12.843 -1.166) 12.897 33.729 ( 0.560 12.455 -15.273) 19.716 34.059 ( -2.603 -1.630 -24.782) 24.971 ======================= Grid point 62 (30/128) ======================= q-point: ( 0.17 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( 12.444 29.565 20.766) 38.213 2.208 ( 19.817 27.263 24.201) 41.493 2.903 ( -0.672 -3.600 37.107) 37.288 3.016 ( 15.270 42.218 16.962) 47.992 3.146 ( 5.768 -10.972 2.766) 12.700 3.449 ( -8.208 1.810 0.460) 8.417 3.779 ( -18.049 9.827 20.746) 29.202 4.006 ( -14.680 2.617 35.117) 38.152 4.185 ( -2.263 -5.705 4.714) 7.739 4.318 ( 0.782 5.067 5.344) 7.406 4.435 ( -2.990 -2.340 10.916) 11.557 4.571 ( -3.680 5.930 13.294) 15.015 4.752 ( 7.158 -3.265 0.882) 7.917 4.914 ( -0.935 -5.276 2.806) 6.048 4.978 ( -1.055 -9.729 4.420) 10.738 5.104 ( -8.583 -6.684 5.079) 12.006 5.519 ( 5.031 11.213 13.550) 18.293 5.615 ( -1.623 4.133 -2.380) 5.038 5.736 ( -1.236 3.277 0.673) 3.566 5.881 ( -4.679 13.166 -5.199) 14.909 6.013 ( 3.177 -7.123 3.666) 8.619 6.265 ( 0.599 0.336 0.269) 0.738 6.447 ( 4.406 0.895 -6.475) 7.883 6.497 ( 6.339 -8.362 6.004) 12.090 6.679 ( -3.553 -7.331 -1.778) 8.338 6.806 ( -14.513 -4.988 8.789) 17.685 6.914 ( 4.400 -11.104 5.271) 13.056 6.953 ( 2.122 -5.444 0.163) 5.846 7.571 ( -7.693 -1.067 -0.697) 7.797 7.642 ( -9.724 -2.004 -7.638) 12.527 7.782 ( -0.557 8.111 -5.606) 9.876 7.960 ( 2.437 8.412 0.450) 8.770 8.072 ( -2.464 -3.264 -11.833) 12.520 8.288 ( 4.254 -5.007 -9.012) 11.152 8.430 ( 5.326 2.354 -7.746) 9.691 8.608 ( -2.581 -3.061 -1.735) 4.363 8.807 ( -0.469 6.955 -5.568) 8.921 8.956 ( 2.226 1.391 -2.541) 3.653 8.986 ( 0.913 2.290 -0.295) 2.483 9.164 ( 7.570 2.780 -6.136) 10.133 9.225 ( -1.677 4.638 -4.819) 6.895 9.274 ( 5.428 1.508 3.285) 6.521 9.334 ( 1.102 4.466 -2.673) 5.320 9.396 ( 2.461 0.769 -1.054) 2.786 9.437 ( -2.544 0.390 -3.799) 4.588 9.577 ( 1.669 -2.399 0.082) 2.923 9.617 ( 3.675 -0.114 0.944) 3.796 9.757 ( 4.913 -2.193 -0.094) 5.381 10.027 ( 3.141 0.527 -2.204) 3.873 10.261 ( 0.623 -1.837 -5.441) 5.776 10.295 ( 2.879 -1.463 1.222) 3.453 10.442 ( 1.040 -10.592 -8.727) 13.764 10.517 ( -2.183 -0.105 -2.138) 3.057 10.666 ( -0.748 -2.419 2.397) 3.487 10.878 ( -2.430 3.173 5.629) 6.904 10.928 ( 6.666 3.887 -4.153) 8.763 10.998 ( -0.324 1.805 -1.491) 2.364 11.058 ( -6.117 -1.254 10.578) 12.284 11.304 ( -2.388 -2.260 -7.502) 8.191 11.351 ( 0.041 -5.537 2.967) 6.282 11.494 ( -2.935 -2.370 0.589) 3.818 11.567 ( -3.567 0.805 6.555) 7.506 11.641 ( -8.082 -1.496 7.100) 10.861 11.747 ( 3.639 -4.021 -0.115) 5.424 11.812 ( 2.180 -9.370 7.636) 12.283 11.887 ( 1.177 -15.287 0.294) 15.335 12.345 ( 0.486 10.290 -3.644) 10.927 12.653 ( -2.298 -4.230 -0.019) 4.814 12.991 ( -8.949 6.251 -2.355) 11.167 13.051 ( -8.932 4.577 1.244) 10.113 13.279 ( 7.807 6.927 -2.518) 10.736 13.490 ( 6.512 -3.197 -4.081) 8.323 13.521 ( -1.004 7.715 -7.070) 10.512 13.980 ( -2.226 -3.626 0.337) 4.268 14.041 ( -2.131 -8.047 4.344) 9.389 14.322 ( 1.065 -11.846 -2.876) 12.237 14.983 ( -9.590 13.714 9.988) 19.489 15.253 ( -2.689 -1.664 5.138) 6.033 15.278 ( -3.955 -0.845 -0.624) 4.092 15.387 ( -2.714 -8.518 0.883) 8.983 15.609 ( -0.568 8.158 5.936) 10.105 15.693 ( -3.063 3.072 0.089) 4.339 15.828 ( 1.366 2.358 4.555) 5.308 15.946 ( 0.467 -4.617 0.168) 4.644 16.297 ( -1.123 9.966 3.450) 10.606 16.511 ( -3.432 5.534 -0.072) 6.512 16.761 ( 4.249 -3.522 -6.878) 8.819 16.863 ( -1.852 0.743 -5.830) 6.162 18.912 ( -4.602 -4.993 3.583) 7.678 18.998 ( -7.336 -6.156 -6.605) 11.634 19.990 ( 1.236 1.327 1.300) 2.231 20.077 ( 2.155 -2.822 2.675) 4.446 22.758 ( 2.188 3.939 -12.090) 12.902 22.896 ( 3.350 -2.251 -14.358) 14.914 23.063 ( 1.404 4.492 -11.380) 12.315 23.217 ( 3.700 -2.786 -14.218) 14.953 24.365 ( -6.088 2.980 4.488) 8.129 24.446 ( -3.721 -1.249 2.761) 4.798 25.429 ( 0.343 5.006 10.657) 11.779 25.607 ( 25.971 0.192 2.318) 26.075 25.636 ( 2.879 -4.263 8.131) 9.621 25.830 ( 50.204 -13.766 -4.351) 52.239 27.734 ( -11.778 7.901 -11.607) 18.327 28.137 ( -7.828 -11.419 -16.673) 21.672 29.312 ( -0.452 9.002 1.078) 9.077 29.473 ( -4.428 0.448 0.623) 4.494 29.627 ( 1.506 4.015 2.313) 4.872 29.761 ( -0.635 -1.998 -0.738) 2.222 29.977 ( -2.480 -2.086 8.512) 9.108 30.064 ( -1.772 -7.600 15.844) 17.662 30.297 ( -1.128 1.317 16.589) 16.679 30.347 ( -1.273 1.249 9.946) 10.104 30.676 ( -2.512 0.018 9.532) 9.858 30.825 ( 8.724 -4.608 3.617) 10.508 31.127 ( 1.106 7.055 7.144) 10.101 31.499 ( 2.252 -5.613 3.729) 7.105 31.774 ( 0.511 4.792 5.838) 7.570 32.046 ( -0.475 -11.354 -0.713) 11.386 33.566 ( -11.531 12.744 -18.466) 25.227 33.725 ( -17.366 6.480 -21.532) 28.412 ======================= Grid point 63 (31/128) ======================= q-point: ( 0.33 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.294 ( 11.599 24.991 16.599) 32.166 2.687 ( 18.235 22.112 23.553) 37.097 2.974 ( -9.239 0.638 26.227) 27.814 3.148 ( -6.148 20.722 2.947) 21.815 3.361 ( -2.261 -12.358 6.315) 14.061 3.511 ( 23.775 17.813 7.932) 30.748 3.635 ( -0.588 3.829 19.089) 19.478 3.836 ( -18.101 3.803 34.335) 39.000 4.168 ( -0.055 -8.151 3.297) 8.793 4.309 ( -2.454 5.323 4.885) 7.630 4.443 ( -5.024 2.172 13.979) 15.012 4.560 ( -1.984 2.691 11.677) 12.146 4.775 ( -9.561 -2.761 11.118) 14.922 4.808 ( -9.529 1.279 10.635) 14.337 5.008 ( 6.340 -7.112 -6.497) 11.532 5.081 ( 3.385 -4.177 0.902) 5.451 5.450 ( -10.063 9.013 3.064) 13.853 5.683 ( 2.602 4.521 8.011) 9.560 5.770 ( 2.866 4.829 1.851) 5.913 5.867 ( 2.049 10.037 -2.452) 10.533 6.059 ( -2.269 -1.568 6.287) 6.865 6.236 ( -16.765 -1.072 1.115) 16.836 6.302 ( 0.937 -3.134 -0.622) 3.330 6.530 ( -4.027 4.987 -3.729) 7.415 6.683 ( 4.988 -3.921 2.898) 6.975 6.785 ( 6.669 -10.023 5.456) 13.217 6.997 ( 1.227 -7.751 3.476) 8.583 7.028 ( 3.235 -10.918 2.824) 11.732 7.453 ( -4.843 -3.139 -1.927) 6.085 7.498 ( -1.839 -8.729 0.034) 8.921 7.759 ( 1.477 6.060 -4.106) 7.467 7.964 ( -0.912 -1.343 -0.284) 1.648 8.072 ( 5.540 3.136 -6.696) 9.239 8.319 ( 1.601 -6.646 -5.627) 8.854 8.472 ( 2.389 0.672 -6.034) 6.524 8.561 ( -0.711 -0.285 -2.596) 2.707 8.750 ( -3.003 5.174 -3.254) 6.810 8.930 ( -2.002 1.000 -0.961) 2.436 9.017 ( 3.101 9.874 -6.909) 12.444 9.153 ( -3.049 2.128 -5.456) 6.602 9.227 ( 0.923 7.985 -10.133) 12.934 9.321 ( -2.655 -2.947 -1.932) 4.412 9.360 ( 1.699 5.264 -6.233) 8.334 9.440 ( 7.119 0.519 6.137) 9.413 9.528 ( 4.821 0.647 2.049) 5.278 9.549 ( 1.521 -0.172 -4.441) 4.697 9.698 ( 2.202 3.296 1.261) 4.160 9.852 ( 7.885 -6.023 -2.954) 10.352 10.128 ( 7.695 -4.210 -4.549) 9.881 10.231 ( -0.768 -4.473 -7.853) 9.070 10.335 ( -0.532 -1.505 3.577) 3.917 10.380 ( -4.998 -2.975 -4.801) 7.542 10.504 ( 2.814 -2.231 -8.223) 8.973 10.634 ( -1.172 -1.330 -2.051) 2.710 10.797 ( -14.286 -3.397 5.441) 15.660 10.885 ( -0.514 4.351 1.356) 4.586 11.019 ( 1.355 0.066 -1.411) 1.957 11.073 ( -0.739 -5.582 3.709) 6.743 11.153 ( -8.717 -5.179 3.228) 10.641 11.313 ( -2.297 -1.253 1.845) 3.202 11.441 ( -2.848 -1.986 0.139) 3.475 11.590 ( 1.178 -1.233 7.503) 7.694 11.599 ( -0.123 -4.263 6.993) 8.191 11.825 ( 6.353 -3.723 -3.378) 8.101 11.907 ( 4.040 -7.214 7.662) 11.273 11.948 ( 3.799 -7.880 -5.723) 10.454 12.360 ( 3.050 5.218 0.319) 6.053 12.630 ( -0.055 -5.475 -0.939) 5.555 12.808 ( -9.472 4.330 -2.169) 10.639 12.873 ( -9.273 2.554 0.408) 9.627 13.407 ( 4.884 7.436 1.868) 9.090 13.483 ( 0.577 8.542 -3.985) 9.443 13.574 ( 3.635 0.269 -5.515) 6.611 13.961 ( -0.569 1.686 5.031) 5.336 14.021 ( -1.883 -11.218 2.811) 11.717 14.334 ( 1.775 -11.051 -5.579) 12.506 14.883 ( -4.890 15.837 10.314) 19.522 15.192 ( -2.467 -0.048 -1.819) 3.066 15.260 ( -1.486 -2.688 10.966) 11.388 15.359 ( -1.500 -9.626 3.119) 10.230 15.616 ( -0.819 8.775 4.618) 9.949 15.648 ( -1.738 3.413 1.145) 3.997 15.878 ( 1.480 1.293 3.949) 4.411 15.941 ( -1.788 -2.234 2.100) 3.549 16.267 ( -2.586 9.457 -0.266) 9.808 16.464 ( -1.822 9.582 0.938) 9.798 16.772 ( -0.992 -1.268 -9.959) 10.088 16.808 ( 0.725 2.085 -5.866) 6.268 18.807 ( -6.102 -5.135 -3.336) 8.645 18.901 ( -1.727 -9.838 2.331) 10.256 20.024 ( 1.980 1.116 -0.553) 2.339 20.115 ( 1.133 -3.151 -0.018) 3.349 22.745 ( 1.911 4.050 -12.146) 12.945 22.891 ( 2.212 -2.734 -13.807) 14.248 23.038 ( 1.210 5.044 -12.058) 13.126 23.206 ( 1.506 -3.034 -13.819) 14.228 24.341 ( 1.004 2.881 4.380) 5.337 24.434 ( 0.882 -1.540 3.723) 4.125 25.466 ( -1.146 3.840 10.453) 11.195 25.620 ( -4.713 -3.253 11.192) 12.572 26.226 ( 35.021 4.789 -3.477) 35.518 26.655 ( 39.413 -17.893 -14.953) 45.795 27.398 ( -17.840 6.404 -9.753) 21.316 27.853 ( -15.082 -15.896 -17.618) 28.117 29.325 ( 1.145 3.504 2.658) 4.545 29.395 ( -4.035 -0.391 1.248) 4.241 29.637 ( -0.896 6.343 0.992) 6.483 29.764 ( 0.268 -0.005 1.834) 1.853 29.961 ( -2.320 -0.885 6.000) 6.494 30.078 ( -3.495 -7.902 15.302) 17.573 30.335 ( -2.376 1.353 16.103) 16.334 30.367 ( -0.455 2.706 8.320) 8.761 30.689 ( -0.727 2.826 9.192) 9.644 31.002 ( 7.632 -8.877 4.491) 12.539 31.183 ( 1.196 5.323 7.736) 9.466 31.519 ( -2.984 -2.340 6.845) 7.825 31.835 ( 3.666 4.405 4.378) 7.212 32.031 ( -1.468 -8.287 0.513) 8.432 33.233 ( -10.512 16.836 -17.659) 26.567 33.424 ( -8.206 4.601 -16.087) 18.636 ======================= Grid point 64 (32/128) ======================= q-point: (-0.50 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( -5.423 20.107 12.232) 24.153 2.763 ( -9.038 12.457 18.017) 23.695 2.862 ( -18.541 19.243 5.462) 27.275 3.177 ( 12.194 17.591 21.492) 30.332 3.441 ( 2.055 -6.596 27.850) 28.695 3.602 ( -11.967 15.094 16.377) 25.284 3.761 ( -0.225 -10.987 10.981) 15.535 3.859 ( 8.400 -3.219 3.294) 9.580 4.224 ( 2.025 -0.445 -1.221) 2.406 4.265 ( -14.564 6.332 9.682) 18.600 4.323 ( -4.775 6.985 14.665) 16.931 4.589 ( -5.140 1.230 14.435) 15.372 4.635 ( -5.265 -8.891 17.304) 20.155 4.744 ( -1.799 1.461 9.190) 9.477 5.104 ( 5.911 0.793 -8.587) 10.455 5.154 ( 2.470 -1.838 0.973) 3.229 5.337 ( -2.793 8.686 3.961) 9.947 5.618 ( -9.864 2.252 7.994) 12.894 5.805 ( 1.050 1.827 -0.501) 2.166 5.873 ( 0.240 7.252 -3.545) 8.076 5.952 ( -2.549 5.268 6.254) 8.565 6.138 ( -0.077 0.624 2.093) 2.186 6.394 ( 5.123 -3.751 -0.392) 6.362 6.428 ( -5.783 3.805 1.630) 7.111 6.736 ( 1.879 -1.965 0.441) 2.754 6.896 ( -0.778 -11.238 5.104) 12.367 7.021 ( 0.337 -9.452 2.308) 9.736 7.101 ( 6.047 -8.724 5.146) 11.796 7.390 ( -2.067 -2.924 1.094) 3.744 7.552 ( 4.202 -9.831 5.559) 12.050 7.806 ( 3.454 5.783 0.416) 6.749 7.972 ( 1.445 0.680 1.245) 2.025 8.185 ( 9.057 0.015 -3.467) 9.698 8.300 ( -0.624 -6.963 -2.006) 7.273 8.499 ( 2.903 -0.454 -6.779) 7.388 8.540 ( -0.288 -0.839 -6.023) 6.088 8.702 ( -0.819 3.809 -1.364) 4.128 8.913 ( 0.915 -2.119 -3.789) 4.437 9.001 ( -2.023 10.655 -8.242) 13.621 9.085 ( -0.898 1.619 -4.994) 5.326 9.167 ( -2.094 11.977 -9.836) 15.639 9.276 ( -0.124 0.573 -4.975) 5.010 9.377 ( -0.851 -0.106 -4.181) 4.268 9.450 ( -1.807 2.195 -0.144) 2.847 9.538 ( 2.200 1.226 1.025) 2.719 9.695 ( -2.231 5.945 1.483) 6.521 9.736 ( 10.514 -0.308 -3.755) 11.168 9.995 ( 6.573 -3.989 -4.621) 8.971 10.099 ( -5.769 -6.611 -9.429) 12.880 10.178 ( -9.061 3.548 3.907) 10.486 10.301 ( 1.219 3.318 -4.224) 5.508 10.366 ( 5.405 -3.240 -4.044) 7.488 10.487 ( -2.438 -8.298 -9.897) 13.143 10.597 ( -4.489 -4.997 5.828) 8.893 10.651 ( -0.119 -3.866 -1.791) 4.262 10.826 ( -4.070 -6.057 -5.416) 9.087 10.944 ( 0.175 -1.478 -1.868) 2.388 11.090 ( 1.486 -1.565 1.112) 2.428 11.163 ( 1.362 -5.293 6.169) 8.242 11.316 ( 0.589 -1.916 3.457) 3.996 11.407 ( -0.887 -2.958 1.655) 3.504 11.562 ( -5.443 -11.036 10.723) 16.322 11.684 ( 3.147 0.990 4.436) 5.528 11.930 ( -0.236 2.555 -2.576) 3.636 11.944 ( 2.835 -0.486 1.369) 3.186 11.995 ( 3.287 -6.232 1.563) 7.217 12.434 ( 1.352 -0.957 0.465) 1.721 12.630 ( 0.949 -5.985 -1.537) 6.252 12.685 ( -1.368 4.284 -1.893) 4.880 12.782 ( 0.870 0.165 1.782) 1.990 13.424 ( -2.227 11.117 1.687) 11.463 13.536 ( 3.921 4.298 0.856) 5.880 13.575 ( -0.876 4.037 -4.970) 6.463 13.980 ( 0.958 -7.883 -4.850) 9.305 14.011 ( -1.222 -0.359 12.895) 12.958 14.338 ( 1.155 -9.764 -5.105) 11.079 14.892 ( 0.967 12.615 9.500) 15.822 15.168 ( -0.311 -2.150 1.385) 2.577 15.304 ( 1.330 -1.859 10.841) 11.080 15.361 ( 0.277 -6.604 4.408) 7.945 15.616 ( -1.400 9.466 4.596) 10.616 15.650 ( 1.249 2.937 3.075) 4.432 15.894 ( -3.264 0.807 2.215) 4.026 15.907 ( -0.724 0.549 3.693) 3.803 16.215 ( -1.889 8.487 -3.685) 9.443 16.457 ( 0.482 10.036 2.011) 10.247 16.703 ( -0.816 -0.087 -11.732) 11.760 16.801 ( 0.798 -0.678 -7.509) 7.581 18.721 ( -1.561 -2.821 -2.684) 4.195 18.927 ( 3.043 -11.288 3.587) 12.229 20.042 ( 0.096 0.521 -1.262) 1.368 20.112 ( -1.082 -2.839 -1.833) 3.548 22.735 ( 2.418 3.783 -12.293) 13.088 22.868 ( 1.589 -2.413 -13.351) 13.660 23.020 ( 2.555 4.504 -13.458) 14.420 23.171 ( 1.345 -2.697 -14.977) 15.278 24.413 ( 3.600 2.596 6.964) 8.258 24.494 ( 2.659 -1.205 7.061) 7.641 25.466 ( -3.439 2.435 9.117) 10.044 25.562 ( -5.585 -1.942 9.271) 10.996 26.521 ( -14.198 6.373 -16.856) 22.942 26.929 ( 5.595 -8.385 -20.505) 22.849 27.261 ( 1.503 -3.873 -5.405) 6.817 27.649 ( 12.012 -17.682 -11.176) 24.122 29.342 ( -2.090 1.388 1.779) 3.076 29.372 ( 1.933 -0.260 4.150) 4.585 29.619 ( -0.957 7.752 -0.158) 7.812 29.776 ( -0.050 0.350 3.784) 3.800 29.940 ( -2.248 -0.752 3.788) 4.469 30.064 ( -4.227 -7.368 13.269) 15.755 30.336 ( -4.267 1.172 15.563) 16.180 30.393 ( -0.979 1.565 9.429) 9.608 30.706 ( -1.550 5.480 8.274) 10.045 31.095 ( -0.616 -10.928 5.068) 12.061 31.205 ( -2.579 4.182 7.296) 8.796 31.468 ( -4.106 2.148 6.021) 7.597 31.884 ( -2.067 3.559 3.216) 5.224 32.003 ( -0.350 -7.515 0.419) 7.535 33.166 ( 9.558 14.446 -11.687) 20.895 33.331 ( 5.926 4.954 -13.497) 15.551 ======================= Grid point 65 (33/128) ======================= q-point: (-0.33 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( -25.537 22.813 17.620) 38.510 2.469 ( -24.286 28.857 2.996) 37.836 2.789 ( -3.889 1.039 26.640) 26.942 3.314 ( -9.313 -0.732 4.793) 10.499 3.410 ( -14.518 11.764 13.164) 22.858 3.669 ( 1.458 5.581 22.318) 23.051 3.712 ( 2.086 1.645 19.289) 19.471 3.932 ( -10.643 14.511 20.416) 27.215 4.093 ( 4.689 -0.934 5.430) 7.235 4.231 ( -1.914 0.001 4.908) 5.268 4.286 ( -3.680 5.236 10.785) 12.541 4.529 ( -5.299 -11.408 10.129) 16.150 4.686 ( -0.199 -3.831 18.025) 18.429 4.818 ( 5.441 0.144 2.932) 6.182 5.084 ( -5.028 2.809 -3.405) 6.691 5.134 ( -2.942 -0.720 -1.814) 3.530 5.352 ( 0.171 6.922 3.097) 7.585 5.600 ( 4.002 6.971 4.685) 9.304 5.818 ( -1.889 -7.566 5.088) 9.311 5.922 ( 7.478 0.783 -0.609) 7.544 5.993 ( 2.573 10.871 4.120) 11.907 6.131 ( 0.514 4.158 -4.631) 6.245 6.347 ( -3.867 0.119 1.784) 4.261 6.443 ( 1.656 -9.561 -3.594) 10.347 6.691 ( -7.565 -6.133 1.593) 9.868 6.866 ( -3.904 -12.812 3.923) 13.956 7.082 ( 4.123 -3.224 8.755) 10.200 7.240 ( 4.480 -9.036 7.615) 12.638 7.395 ( 1.905 2.133 3.843) 4.791 7.644 ( 4.240 -6.164 3.396) 8.216 7.859 ( 1.958 7.379 1.362) 7.755 8.004 ( 0.929 1.877 0.069) 2.095 8.259 ( 0.818 0.727 -5.395) 5.505 8.370 ( 5.357 -4.835 -1.955) 7.477 8.487 ( -1.112 -1.410 -8.885) 9.064 8.517 ( 2.855 1.182 -6.549) 7.242 8.710 ( 1.925 2.414 -1.638) 3.495 8.882 ( -0.446 -1.116 -8.869) 8.950 8.978 ( 2.102 0.788 -1.871) 2.923 9.079 ( 1.178 6.034 -2.926) 6.808 9.083 ( -2.511 2.561 -7.027) 7.890 9.278 ( -3.783 0.251 -2.833) 4.733 9.296 ( 2.852 3.112 -4.289) 6.018 9.483 ( 1.280 1.931 0.906) 2.488 9.527 ( -0.783 3.330 -7.421) 8.172 9.657 ( -3.935 5.289 3.443) 7.437 9.761 ( -6.118 -8.113 -10.059) 14.298 9.920 ( -11.409 1.498 -5.099) 12.587 10.034 ( 0.217 8.663 1.086) 8.734 10.094 ( 4.911 0.207 -2.814) 5.664 10.316 ( -0.428 0.218 -6.214) 6.232 10.396 ( 4.708 -5.334 -7.663) 10.456 10.490 ( 2.280 -6.874 -1.423) 7.381 10.545 ( -1.314 -6.408 6.655) 9.332 10.675 ( 2.646 2.087 -4.830) 5.890 10.824 ( 4.770 -0.781 -8.365) 9.661 10.977 ( 3.669 -3.091 -1.688) 5.086 11.091 ( -1.739 -6.982 0.880) 7.249 11.220 ( 1.092 -6.972 3.052) 7.688 11.296 ( -4.638 -9.476 8.008) 13.245 11.455 ( 5.060 -1.353 3.877) 6.517 11.532 ( -0.588 -4.918 4.727) 6.847 11.728 ( 0.088 -1.265 4.715) 4.882 11.853 ( -6.904 -5.053 1.516) 8.689 11.937 ( -3.508 4.587 6.117) 8.412 12.104 ( 5.580 -1.256 0.715) 5.765 12.365 ( -6.512 2.463 0.012) 6.963 12.647 ( 1.657 -3.865 0.109) 4.206 12.778 ( 10.118 1.443 -3.908) 10.942 12.909 ( 10.600 -2.089 0.116) 10.805 13.373 ( -4.413 8.981 3.442) 10.582 13.492 ( -5.791 6.726 -0.553) 8.893 13.613 ( 3.445 4.396 -1.363) 5.749 13.966 ( 0.737 -11.667 -6.217) 13.240 14.064 ( 0.479 3.189 12.258) 12.676 14.340 ( 0.688 -9.513 -1.840) 9.713 14.974 ( 3.515 7.094 8.859) 11.882 15.181 ( 0.860 -3.888 1.834) 4.385 15.372 ( 2.026 -1.376 4.723) 5.321 15.415 ( 2.609 -0.834 7.193) 7.696 15.599 ( -2.473 9.354 4.837) 10.817 15.712 ( 2.769 3.065 5.665) 7.011 15.845 ( -2.582 1.181 6.187) 6.808 15.913 ( 0.595 -0.115 0.354) 0.702 16.177 ( -0.418 9.123 -3.976) 9.960 16.499 ( 3.019 5.628 3.205) 7.146 16.657 ( 1.341 -2.542 -12.964) 13.279 16.777 ( 0.345 -0.749 -8.348) 8.388 18.735 ( 3.741 1.388 -0.412) 4.012 19.029 ( 6.397 -10.541 1.979) 12.488 20.017 ( -2.197 0.273 -0.305) 2.235 20.068 ( -2.589 -2.214 -1.722) 3.817 22.736 ( 3.146 3.468 -12.487) 13.336 22.852 ( 2.815 -1.725 -13.804) 14.193 23.024 ( 3.788 3.575 -13.356) 14.336 23.146 ( 3.031 -2.075 -16.450) 16.855 24.501 ( 1.682 2.364 10.188) 10.593 24.564 ( 0.768 -0.692 9.940) 9.994 25.409 ( -5.797 2.928 7.875) 10.207 25.523 ( -1.930 -2.131 6.521) 7.127 25.960 ( -31.249 3.810 -14.737) 34.759 26.419 ( -40.053 -23.214 -25.086) 52.654 27.551 ( 21.263 7.938 -4.404) 23.120 27.964 ( 19.705 -12.290 -11.389) 25.866 29.322 ( -1.047 5.583 1.934) 6.000 29.432 ( 2.715 -1.061 4.241) 5.146 29.605 ( -0.573 6.291 -0.780) 6.365 29.799 ( 0.545 -0.565 6.357) 6.406 29.909 ( -2.216 -0.888 1.220) 2.681 30.038 ( -3.804 -6.527 11.280) 13.576 30.311 ( -5.203 0.768 15.854) 16.704 30.397 ( -3.478 -0.725 12.341) 12.842 30.694 ( -3.179 7.353 7.463) 10.949 31.018 ( -8.994 -7.705 5.799) 13.187 31.155 ( -5.068 3.768 5.717) 8.519 31.435 ( -1.719 -1.647 1.985) 3.100 31.812 ( -4.869 3.270 2.978) 6.578 32.023 ( 1.547 -9.968 -0.236) 10.090 33.434 ( 20.337 11.587 -9.199) 25.149 33.520 ( 20.366 8.343 -11.197) 24.694 ======================= Grid point 66 (34/128) ======================= q-point: (-0.17 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.785 ( -22.958 30.278 16.053) 41.250 2.098 ( -18.070 35.278 16.298) 42.857 2.803 ( -8.080 -5.832 37.984) 39.270 3.030 ( -19.053 22.361 10.357) 31.150 3.149 ( -13.325 3.528 8.642) 16.270 3.698 ( -3.735 -5.272 7.044) 9.558 3.918 ( 2.723 14.790 26.467) 30.441 3.975 ( 5.534 10.501 19.708) 23.006 4.165 ( -3.050 5.418 14.801) 16.054 4.213 ( -3.154 -0.086 9.607) 10.111 4.346 ( 6.095 -1.341 -0.011) 6.241 4.508 ( 0.021 -14.767 10.469) 18.101 4.735 ( -3.308 -1.149 16.112) 16.488 4.864 ( -0.487 -1.264 -7.661) 7.780 4.972 ( -4.092 0.464 0.585) 4.159 5.127 ( 3.238 -5.646 3.690) 7.482 5.352 ( -1.370 7.520 6.892) 10.292 5.713 ( 4.986 6.952 0.965) 8.610 5.778 ( -6.818 -11.677 10.694) 17.239 5.955 ( -1.331 5.215 -3.900) 6.647 6.072 ( 3.596 4.796 0.090) 5.996 6.206 ( 8.202 3.727 -5.596) 10.606 6.312 ( 0.287 0.847 -0.944) 1.300 6.399 ( -4.726 -11.266 -2.056) 12.388 6.585 ( -2.326 -9.011 -0.324) 9.312 6.821 ( -1.717 -9.035 6.755) 11.411 7.103 ( -8.824 -4.873 11.836) 15.547 7.281 ( -4.527 -11.473 8.622) 15.049 7.505 ( 9.426 8.088 -0.823) 12.447 7.747 ( 5.243 -0.118 -0.191) 5.248 7.895 ( 1.977 8.098 1.226) 8.426 7.987 ( -2.488 2.507 -5.069) 6.179 8.208 ( -1.510 1.524 -12.262) 12.448 8.379 ( 0.094 1.840 -7.793) 8.008 8.398 ( -3.828 -3.986 -8.167) 9.861 8.601 ( 5.048 0.764 -2.834) 5.840 8.744 ( 2.712 1.561 -3.465) 4.669 8.891 ( 4.052 -3.990 -7.409) 9.340 8.963 ( -2.812 -3.944 -6.214) 7.880 9.046 ( 1.928 -1.807 -1.686) 3.135 9.113 ( 2.981 6.283 1.427) 7.099 9.252 ( 1.720 -1.080 1.385) 2.458 9.358 ( 4.604 3.010 -2.513) 6.047 9.418 ( -5.234 6.300 -4.186) 9.198 9.526 ( -5.258 5.261 -5.154) 9.049 9.546 ( -2.918 1.231 0.506) 3.207 9.591 ( -2.980 3.897 -5.547) 7.405 9.764 ( -5.635 -3.867 -1.367) 6.970 10.035 ( -0.049 6.498 -0.851) 6.554 10.163 ( 2.849 -2.648 -0.210) 3.895 10.308 ( 0.367 -1.065 -4.342) 4.486 10.456 ( 3.407 -6.436 -6.873) 10.013 10.526 ( 3.893 -0.404 3.009) 4.937 10.589 ( 2.193 -2.356 -0.874) 3.335 10.704 ( 3.954 6.457 -5.525) 9.373 10.877 ( 3.723 2.232 -5.424) 6.947 11.035 ( -0.488 -7.711 6.254) 9.941 11.061 ( -1.886 -6.901 1.402) 7.290 11.175 ( 0.408 -5.803 -1.513) 6.011 11.321 ( 2.713 -6.652 -0.296) 7.190 11.548 ( -0.156 -4.641 3.263) 5.675 11.583 ( 5.680 -2.655 4.253) 7.576 11.736 ( -3.777 -6.312 0.788) 7.398 11.744 ( -1.748 -3.758 5.413) 6.817 11.869 ( -8.177 4.302 10.757) 14.180 12.121 ( -7.422 -8.676 9.043) 14.564 12.300 ( 2.739 13.410 -7.088) 15.413 12.687 ( 1.733 -4.849 1.316) 5.315 12.942 ( 8.775 3.107 -3.771) 10.043 13.110 ( 12.056 2.456 -9.521) 15.558 13.302 ( -5.236 1.120 8.820) 10.318 13.372 ( -6.693 9.158 -0.341) 11.348 13.638 ( 0.135 3.640 -4.076) 5.466 13.969 ( 2.377 -11.742 -5.690) 13.263 14.103 ( -1.204 2.150 8.511) 8.860 14.343 ( -0.501 -10.580 1.145) 10.653 15.067 ( 1.885 4.384 9.619) 10.738 15.216 ( 1.881 -4.319 3.253) 5.725 15.398 ( -0.515 2.698 -1.119) 2.966 15.468 ( 0.511 -1.214 2.354) 2.698 15.578 ( -1.966 5.641 6.940) 9.157 15.744 ( -0.591 3.378 1.897) 3.920 15.857 ( -0.890 -0.586 6.742) 6.826 15.946 ( 1.562 -2.444 0.229) 2.910 16.191 ( 3.360 10.785 1.207) 11.360 16.578 ( 2.840 -3.693 3.471) 5.810 16.656 ( 3.900 -1.673 -11.703) 12.448 16.771 ( 3.773 -1.877 -6.338) 7.611 18.841 ( 6.709 5.171 2.490) 8.829 19.141 ( 4.557 -8.572 -2.055) 9.924 19.981 ( -1.400 0.358 1.099) 1.815 20.021 ( -1.918 -1.558 1.646) 2.969 22.747 ( 3.510 3.429 -12.500) 13.428 22.862 ( 4.272 -1.644 -14.080) 14.805 23.049 ( 4.530 3.174 -12.601) 13.762 23.154 ( 5.168 -1.751 -17.054) 17.905 24.548 ( -0.662 2.289 10.728) 10.989 24.587 ( -2.852 -0.035 10.008) 10.406 25.344 ( -6.192 2.894 3.430) 7.647 25.421 ( -16.535 0.251 -4.624) 17.172 25.517 ( -32.453 -10.263 -10.494) 35.618 25.559 ( -9.653 -4.456 0.760) 10.658 27.828 ( 11.209 7.960 -7.618) 15.717 28.200 ( 11.230 -9.542 -13.059) 19.690 29.319 ( 0.049 11.680 0.801) 11.708 29.502 ( 2.918 0.687 3.296) 4.455 29.583 ( -1.735 2.190 0.817) 2.911 29.842 ( 0.236 -6.340 1.114) 6.441 29.881 ( -0.264 1.321 6.878) 7.009 30.023 ( -2.565 -5.554 10.101) 11.809 30.279 ( -5.284 0.339 16.546) 17.372 30.368 ( -5.227 -1.795 14.252) 15.286 30.666 ( -2.388 5.982 6.629) 9.243 30.859 ( -10.026 -5.087 5.754) 12.629 31.100 ( -2.935 6.010 5.654) 8.758 31.420 ( 0.051 -4.808 -0.423) 4.827 31.765 ( -2.276 3.639 4.961) 6.561 32.047 ( 1.153 -12.326 -0.835) 12.408 33.674 ( 11.298 11.533 -12.648) 20.509 33.929 ( 23.615 2.313 -15.699) 28.452 ======================= Grid point 67 (35/128) ======================= q-point: ( 0.00 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( 2.901 -35.657 19.540) 40.764 2.383 ( 2.901 35.657 19.540) 40.764 2.579 ( -7.308 -24.334 27.075) 37.129 2.579 ( -7.308 24.334 27.075) 37.129 3.569 ( -1.031 -17.626 0.925) 17.680 3.569 ( -1.031 17.626 0.925) 17.680 4.094 ( -6.997 -4.913 21.815) 23.431 4.094 ( -6.997 4.913 21.815) 23.431 4.243 ( -8.516 -14.807 16.635) 23.843 4.243 ( -8.516 14.807 16.635) 23.843 4.416 ( 9.108 -6.813 -5.286) 12.542 4.416 ( 9.108 6.813 -5.286) 12.542 4.785 ( -3.525 -7.600 5.683) 10.123 4.785 ( -3.525 7.600 5.683) 10.123 4.958 ( -0.841 -14.986 8.920) 17.460 4.958 ( -0.841 14.986 8.920) 17.460 5.593 ( 2.204 -7.881 11.625) 14.216 5.593 ( 2.204 7.881 11.625) 14.216 5.835 ( -2.704 -4.377 -1.230) 5.289 5.835 ( -2.704 4.377 -1.230) 5.289 6.156 ( 0.799 -5.081 -3.800) 6.395 6.156 ( 0.799 5.081 -3.800) 6.395 6.341 ( 1.983 -2.653 -0.610) 3.368 6.341 ( 1.983 2.653 -0.610) 3.368 6.723 ( 7.043 -9.926 2.178) 12.364 6.723 ( 7.043 9.926 2.178) 12.364 6.924 ( -14.569 -6.233 8.735) 18.094 6.924 ( -14.569 6.233 8.735) 18.094 7.747 ( -4.220 -5.018 -0.575) 6.582 7.747 ( -4.220 5.018 -0.575) 6.582 7.986 ( 2.762 -6.782 -5.746) 9.308 7.986 ( 2.762 6.782 -5.746) 9.308 8.168 ( -2.757 -6.162 -12.373) 14.095 8.168 ( -2.757 6.162 -12.373) 14.095 8.516 ( 1.256 -9.119 -5.086) 10.517 8.516 ( 1.256 9.119 -5.086) 10.517 8.838 ( 4.090 -3.329 -1.334) 5.440 8.838 ( 4.090 3.329 -1.334) 5.440 9.008 ( 4.656 -7.300 -3.403) 9.303 9.008 ( 4.656 7.300 -3.403) 9.303 9.302 ( 4.821 -3.237 -0.153) 5.809 9.302 ( 4.821 3.237 -0.153) 5.809 9.449 ( -3.795 -3.378 -1.888) 5.420 9.449 ( -3.795 3.378 -1.888) 5.420 9.495 ( -0.400 -3.215 -4.196) 5.301 9.495 ( -0.400 3.215 -4.196) 5.301 9.610 ( -0.495 -1.588 -1.182) 2.040 9.610 ( -0.495 1.588 -1.182) 2.040 10.178 ( 2.123 -7.075 -0.757) 7.425 10.178 ( 2.123 7.075 -0.757) 7.425 10.251 ( -1.548 -4.349 -1.512) 4.858 10.251 ( -1.548 4.349 -1.512) 4.858 10.587 ( -0.056 -2.283 0.749) 2.403 10.587 ( -0.056 2.283 0.749) 2.403 10.888 ( 2.768 -3.979 -0.814) 4.915 10.888 ( 2.768 3.979 -0.814) 4.915 11.076 ( 1.523 -6.497 4.144) 7.856 11.076 ( 1.523 6.497 4.144) 7.856 11.223 ( 7.192 -6.122 -5.122) 10.744 11.223 ( 7.192 6.122 -5.122) 10.744 11.507 ( 0.052 -3.728 -0.114) 3.730 11.507 ( 0.052 3.728 -0.114) 3.730 11.695 ( -2.073 -3.160 4.487) 5.867 11.695 ( -2.073 3.160 4.487) 5.867 11.819 ( -12.631 -5.914 13.717) 19.562 11.819 ( -12.631 5.914 13.717) 19.562 12.556 ( 0.163 -9.253 -2.410) 9.563 12.556 ( 0.163 9.253 -2.410) 9.563 13.196 ( 4.017 -6.739 2.231) 8.156 13.196 ( 4.017 6.739 2.231) 8.156 13.313 ( -1.295 -3.607 -11.344) 11.974 13.313 ( -1.295 3.607 -11.344) 11.974 13.752 ( 0.714 -11.663 -5.365) 12.857 13.752 ( 0.714 11.663 -5.365) 12.857 14.144 ( -2.918 -6.474 2.928) 7.681 14.144 ( -2.918 6.474 2.928) 7.681 15.179 ( -0.628 -3.477 9.695) 10.319 15.179 ( -0.628 3.477 9.695) 10.319 15.398 ( -4.345 -2.235 -5.362) 7.254 15.398 ( -4.345 2.235 -5.362) 7.254 15.732 ( -1.161 -6.214 0.876) 6.382 15.732 ( -1.161 6.214 0.876) 6.382 15.852 ( -0.297 -1.351 2.926) 3.237 15.852 ( -0.297 1.351 2.926) 3.237 16.458 ( 1.527 -9.083 4.640) 10.314 16.458 ( 1.527 9.083 4.640) 10.314 16.746 ( 4.578 -5.588 -6.528) 9.736 16.746 ( 4.578 5.588 -6.528) 9.736 19.014 ( -2.198 -5.598 -2.386) 6.470 19.014 ( -2.198 5.598 -2.386) 6.470 19.995 ( 0.425 -1.444 3.092) 3.439 19.995 ( 0.425 1.444 3.092) 3.439 22.830 ( 3.456 -3.461 -12.308) 13.245 22.830 ( 3.456 3.461 -12.308) 13.245 23.138 ( 4.462 -3.127 -14.109) 15.124 23.138 ( 4.462 3.127 -14.109) 15.124 24.529 ( -8.049 -0.150 6.607) 10.415 24.529 ( -8.049 0.150 6.607) 10.415 25.177 ( 9.780 -3.305 -1.621) 10.450 25.177 ( 9.780 3.305 -1.621) 10.450 25.497 ( 0.494 -5.795 9.046) 10.755 25.497 ( 0.494 5.795 9.046) 10.755 28.067 ( 0.244 -10.010 -12.386) 15.927 28.067 ( 0.244 10.010 -12.386) 15.927 29.533 ( -2.543 -4.778 1.328) 5.573 29.533 ( -2.543 4.778 1.328) 5.573 29.643 ( 1.790 -8.835 -0.787) 9.049 29.643 ( 1.790 8.835 -0.787) 9.049 29.951 ( -0.751 -2.462 9.904) 10.233 29.951 ( -0.751 2.462 9.904) 10.233 30.298 ( -2.880 -2.525 16.253) 16.698 30.298 ( -2.880 2.525 16.253) 16.698 30.707 ( -2.706 -2.083 5.751) 6.688 30.707 ( -2.706 2.083 5.751) 6.688 31.281 ( 1.073 -10.472 3.029) 10.954 31.281 ( 1.073 10.472 3.029) 10.954 31.861 ( -0.190 -7.163 2.598) 7.622 31.861 ( -0.190 7.163 2.598) 7.622 33.943 ( -0.187 -9.201 -18.568) 20.724 33.943 ( -0.187 9.201 -18.568) 20.724 ======================= Grid point 69 (36/128) ======================= q-point: ( 0.17 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.564 ( 4.837 -23.259 25.495) 34.848 2.564 ( 4.837 23.259 25.495) 34.848 2.725 ( 12.813 -18.178 17.371) 28.220 2.725 ( 12.813 18.178 17.371) 28.220 3.557 ( -1.908 -7.061 5.038) 8.881 3.557 ( -1.908 7.061 5.038) 8.881 3.987 ( -11.802 -11.283 13.532) 21.206 3.987 ( -11.802 11.283 13.532) 21.206 4.198 ( -2.942 -17.999 18.315) 25.847 4.198 ( -2.942 17.999 18.315) 25.847 4.510 ( 0.468 -9.594 2.255) 9.866 4.510 ( 0.468 9.594 2.255) 9.866 4.778 ( -0.763 -3.060 7.175) 7.837 4.778 ( -0.763 3.060 7.175) 7.837 4.955 ( -1.390 -10.535 5.683) 12.051 4.955 ( -1.390 10.535 5.683) 12.051 5.668 ( 1.054 -1.168 4.940) 5.185 5.668 ( 1.054 1.168 4.940) 5.185 5.837 ( 2.654 -8.494 3.986) 9.751 5.837 ( 2.654 8.494 3.986) 9.751 6.169 ( -0.069 -13.716 -1.562) 13.805 6.169 ( -0.069 13.716 -1.562) 13.805 6.392 ( 3.001 -3.891 -0.612) 4.951 6.392 ( 3.001 3.891 -0.612) 4.951 6.686 ( -7.986 -6.005 4.353) 10.899 6.686 ( -7.986 6.005 4.353) 10.899 6.864 ( 3.117 -4.332 5.415) 7.603 6.864 ( 3.117 4.332 5.415) 7.603 7.571 ( -11.348 -2.984 -3.582) 12.269 7.571 ( -11.348 2.984 -3.582) 12.269 7.942 ( -3.956 -6.703 -6.881) 10.388 7.942 ( -3.956 6.703 -6.881) 10.388 8.157 ( 4.073 -8.197 -7.554) 11.868 8.157 ( 4.073 8.197 -7.554) 11.868 8.519 ( 1.087 -5.965 -4.425) 7.506 8.519 ( 1.087 5.965 -4.425) 7.506 8.896 ( 1.416 -3.178 -1.422) 3.759 8.896 ( 1.416 3.178 -1.422) 3.759 9.104 ( 7.312 -6.906 -3.926) 10.797 9.104 ( 7.312 6.906 -3.926) 10.797 9.318 ( -3.753 -4.328 -0.888) 5.797 9.318 ( -3.753 4.328 -0.888) 5.797 9.411 ( 3.167 -3.050 -0.921) 4.492 9.411 ( 3.167 3.050 -0.921) 4.492 9.480 ( 1.809 -6.316 -8.869) 11.037 9.480 ( 1.809 6.316 -8.869) 11.037 9.670 ( 5.351 -5.380 2.918) 8.130 9.670 ( 5.351 5.380 2.918) 8.130 10.140 ( -3.105 -10.858 -3.542) 11.836 10.140 ( -3.105 10.858 -3.542) 11.836 10.293 ( 4.258 -1.931 -2.403) 5.256 10.293 ( 4.258 1.931 -2.403) 5.256 10.564 ( -1.889 -4.846 0.658) 5.243 10.564 ( -1.889 4.846 0.658) 5.243 10.949 ( 3.269 -4.317 1.193) 5.545 10.949 ( 3.269 4.317 1.193) 5.545 11.066 ( -6.008 -8.277 5.932) 11.823 11.066 ( -6.008 8.277 5.932) 11.823 11.275 ( -1.663 -4.807 0.405) 5.103 11.275 ( -1.663 4.807 0.405) 5.103 11.535 ( 0.762 -9.337 -0.193) 9.370 11.535 ( 0.762 9.337 -0.193) 9.370 11.608 ( -6.139 -2.918 5.827) 8.953 11.608 ( -6.139 2.918 5.827) 8.953 11.751 ( 2.716 -3.006 3.915) 5.634 11.751 ( 2.716 3.006 3.915) 5.634 12.527 ( -1.976 -8.263 -1.423) 8.614 12.527 ( -1.976 8.263 -1.423) 8.614 13.081 ( -10.635 -1.856 -1.763) 10.938 13.081 ( -10.635 1.856 -1.763) 10.938 13.406 ( 9.187 -5.459 -5.883) 12.199 13.406 ( 9.187 5.459 -5.883) 12.199 13.741 ( 0.595 -13.783 -5.823) 14.974 13.741 ( 0.595 13.783 -5.823) 14.974 14.113 ( -1.082 -8.910 1.702) 9.135 14.113 ( -1.082 8.910 1.702) 9.135 15.171 ( -4.862 -6.689 10.742) 13.556 15.171 ( -4.862 6.689 10.742) 13.556 15.290 ( -3.841 -1.795 -4.346) 6.072 15.290 ( -3.841 1.795 -4.346) 6.072 15.712 ( -1.669 -2.323 1.264) 3.127 15.712 ( -1.669 2.323 1.264) 3.127 15.875 ( 1.463 -2.593 2.484) 3.878 15.875 ( 1.463 2.593 2.484) 3.878 16.479 ( -1.114 -7.933 4.312) 9.097 16.479 ( -1.114 7.933 4.312) 9.097 16.796 ( 3.393 -5.812 -7.129) 9.804 16.796 ( 3.393 5.812 -7.129) 9.804 18.900 ( -7.719 -3.086 -1.967) 8.543 18.900 ( -7.719 3.086 -1.967) 8.543 20.026 ( 1.613 -2.342 1.888) 3.413 20.026 ( 1.613 2.342 1.888) 3.413 22.835 ( 2.552 -3.787 -12.344) 13.161 22.835 ( 2.552 3.787 -12.344) 13.161 23.149 ( 2.658 -4.099 -12.802) 13.702 23.149 ( 2.658 4.099 -12.802) 13.702 24.414 ( -4.957 -2.094 3.453) 6.394 24.414 ( -4.957 2.094 3.453) 6.394 25.534 ( 0.220 -5.543 10.315) 11.712 25.534 ( 0.220 5.543 10.315) 11.712 25.657 ( 36.721 -5.076 0.277) 37.071 25.657 ( 36.721 5.076 0.277) 37.071 27.919 ( -10.642 -10.775 -14.279) 20.814 27.919 ( -10.642 10.775 -14.279) 20.814 29.444 ( -5.167 -4.099 0.118) 6.596 29.444 ( -5.167 4.099 0.118) 6.596 29.703 ( 2.278 -3.746 2.713) 5.156 29.703 ( 2.278 3.746 2.713) 5.156 29.972 ( -1.476 -2.067 9.783) 10.108 29.972 ( -1.476 2.067 9.783) 10.108 30.334 ( -0.636 -2.047 14.603) 14.759 30.334 ( -0.636 2.047 14.603) 14.759 30.725 ( 2.242 -4.590 4.948) 7.112 30.725 ( 2.242 4.590 4.948) 7.112 31.324 ( 1.713 -11.290 4.917) 12.432 31.324 ( 1.713 11.290 4.917) 12.432 31.880 ( 1.034 -6.393 3.189) 7.219 31.880 ( 1.034 6.393 3.189) 7.219 33.734 ( -12.418 -4.700 -19.784) 23.827 33.734 ( -12.418 4.700 -19.784) 23.827 ======================= Grid point 71 (37/128) ======================= q-point: ( 0.33 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.750 ( 4.163 -20.348 19.599) 28.557 2.750 ( 4.163 20.348 19.599) 28.557 3.048 ( 12.089 -15.826 16.392) 25.794 3.048 ( 12.089 15.826 16.392) 25.794 3.525 ( -3.940 -12.500 5.612) 14.257 3.525 ( -3.940 12.500 5.612) 14.257 3.831 ( -9.770 -11.946 14.252) 21.007 3.831 ( -9.770 11.946 14.252) 21.007 4.273 ( 2.931 -18.965 14.649) 24.142 4.273 ( 2.931 18.965 14.649) 24.142 4.482 ( -4.848 -9.242 9.352) 14.014 4.482 ( -4.848 9.242 9.352) 14.014 4.732 ( -7.749 -0.534 10.378) 12.963 4.732 ( -7.749 0.534 10.378) 12.963 5.020 ( 7.000 -3.150 -3.083) 8.272 5.020 ( 7.000 3.150 -3.083) 8.272 5.643 ( -5.630 -8.893 0.589) 10.541 5.643 ( -5.630 8.893 0.589) 10.541 5.897 ( 0.839 -6.717 2.301) 7.149 5.897 ( 0.839 6.717 2.301) 7.149 6.101 ( -3.787 -6.543 0.857) 7.608 6.101 ( -3.787 6.543 0.857) 7.608 6.478 ( 3.442 -14.287 8.680) 17.068 6.478 ( 3.442 14.287 8.680) 17.068 6.651 ( 0.075 -4.970 2.804) 5.707 6.651 ( 0.075 4.970 2.804) 5.707 6.914 ( 1.185 -0.978 3.007) 3.377 6.914 ( 1.185 0.978 3.007) 3.377 7.396 ( -5.067 -0.207 -0.563) 5.102 7.396 ( -5.067 0.207 -0.563) 5.102 7.874 ( 0.108 -5.615 -4.310) 7.079 7.874 ( 0.108 5.615 -4.310) 7.079 8.186 ( 1.643 -6.811 -4.205) 8.171 8.186 ( 1.643 6.811 -4.205) 8.171 8.516 ( 0.824 -3.330 -5.271) 6.289 8.516 ( 0.824 3.330 -5.271) 6.289 8.870 ( -2.459 -5.565 -2.534) 6.590 8.870 ( -2.459 5.565 -2.534) 6.590 9.169 ( 0.031 -3.518 -5.911) 6.879 9.169 ( 0.031 3.518 -5.911) 6.879 9.290 ( 2.907 -2.508 -3.990) 5.537 9.290 ( 2.907 2.508 -3.990) 5.537 9.473 ( -0.530 -6.262 -5.802) 8.553 9.473 ( -0.530 6.262 -5.802) 8.553 9.508 ( 7.591 -1.926 0.382) 7.841 9.508 ( 7.591 1.926 0.382) 7.841 9.792 ( 6.706 -4.948 -2.271) 8.638 9.792 ( 6.706 4.948 -2.271) 8.638 10.072 ( -1.525 -5.633 -4.218) 7.201 10.072 ( -1.525 5.633 -4.218) 7.201 10.335 ( 1.150 -1.369 -2.040) 2.712 10.335 ( 1.150 1.369 -2.040) 2.712 10.558 ( 1.604 -5.141 -1.743) 5.661 10.558 ( 1.604 5.141 -1.743) 5.661 10.848 ( -17.613 -8.243 5.415) 20.186 10.848 ( -17.613 8.243 5.415) 20.186 11.011 ( 1.493 -4.821 1.979) 5.421 11.011 ( 1.493 4.821 1.979) 5.421 11.240 ( -3.497 -9.019 7.748) 12.394 11.240 ( -3.497 9.019 7.748) 12.394 11.432 ( -5.608 -3.144 2.920) 7.061 11.432 ( -5.608 3.144 2.920) 7.061 11.699 ( 7.622 -8.329 -0.417) 11.298 11.699 ( 7.622 8.329 -0.417) 11.298 11.863 ( 7.161 -2.377 0.365) 7.554 11.863 ( 7.161 2.377 0.365) 7.554 12.493 ( -0.881 -7.748 -0.429) 7.810 12.493 ( -0.881 7.748 -0.429) 7.810 12.877 ( -9.944 -2.028 -1.833) 10.313 12.877 ( -9.944 2.028 -1.833) 10.313 13.532 ( 6.229 -4.211 -2.784) 8.018 13.532 ( 6.229 4.211 -2.784) 8.018 13.726 ( 0.291 -14.696 -5.671) 15.755 13.726 ( 0.291 14.696 -5.671) 15.755 14.118 ( 0.798 -10.347 1.086) 10.435 14.118 ( 0.798 10.347 1.086) 10.435 15.108 ( -4.560 -8.664 5.298) 11.132 15.108 ( -4.560 8.664 5.298) 11.132 15.252 ( -0.764 -2.845 5.383) 6.137 15.252 ( -0.764 2.845 5.383) 6.137 15.689 ( -1.223 -0.987 1.851) 2.428 15.689 ( -1.223 0.987 1.851) 2.428 15.907 ( 0.537 -1.455 2.503) 2.945 15.907 ( 0.537 1.455 2.503) 2.945 16.459 ( -2.222 -8.529 1.797) 8.995 16.459 ( -2.222 8.529 1.797) 8.995 16.803 ( 0.869 -3.938 -8.712) 9.600 16.803 ( 0.869 3.938 -8.712) 9.600 18.774 ( -4.734 -2.525 0.212) 5.369 18.774 ( -4.734 2.525 0.212) 5.369 20.059 ( 1.406 -2.430 -0.275) 2.821 20.059 ( 1.406 2.430 -0.275) 2.821 22.825 ( 1.851 -3.930 -12.335) 13.078 22.825 ( 1.851 3.930 -12.335) 13.078 23.133 ( 1.344 -4.481 -12.766) 13.596 23.133 ( 1.344 4.481 -12.766) 13.596 24.395 ( 0.958 -2.494 3.840) 4.678 24.395 ( 0.958 2.494 3.840) 4.678 25.546 ( -2.958 -4.221 10.667) 11.847 25.546 ( -2.958 4.221 10.667) 11.847 26.374 ( 38.509 -10.852 -5.707) 40.414 26.374 ( 38.509 10.852 -5.707) 40.414 27.581 ( -19.025 -11.993 -14.055) 26.520 27.581 ( -19.025 11.993 -14.055) 26.520 29.375 ( -2.610 -1.756 1.642) 3.549 29.375 ( -2.610 1.756 1.642) 3.549 29.735 ( 0.021 -3.416 3.797) 5.108 29.735 ( 0.021 3.416 3.797) 5.108 29.974 ( -2.237 -2.737 8.447) 9.157 29.974 ( -2.237 2.737 8.447) 9.157 30.370 ( -1.851 -1.686 13.569) 13.798 30.370 ( -1.851 1.686 13.569) 13.798 30.805 ( 3.624 -8.854 3.774) 10.284 30.805 ( 3.624 8.854 3.774) 10.284 31.372 ( 0.596 -10.791 6.358) 12.539 31.372 ( 0.596 10.791 6.358) 12.539 31.922 ( 1.544 -4.368 3.739) 5.953 31.922 ( 1.544 4.368 3.739) 5.953 33.431 ( -9.552 -4.336 -17.665) 20.545 33.431 ( -9.552 4.336 -17.665) 20.545 ======================= Grid point 73 (38/128) ======================= q-point: (-0.50 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.787 ( -9.072 -9.645 14.988) 19.999 2.787 ( -9.072 9.645 14.988) 19.999 3.213 ( -2.893 -15.624 14.756) 21.684 3.213 ( -2.893 15.624 14.756) 21.684 3.472 ( -3.666 -15.538 9.950) 18.811 3.472 ( -3.666 15.538 9.950) 18.811 3.833 ( 5.387 -2.874 10.473) 12.123 3.833 ( 5.387 2.874 10.473) 12.123 4.329 ( -6.173 -8.874 12.345) 16.409 4.329 ( -6.173 8.874 12.345) 16.409 4.434 ( -5.008 -6.514 13.624) 15.910 4.434 ( -5.008 6.514 13.624) 15.910 4.642 ( -4.122 -6.710 8.715) 11.747 4.642 ( -4.122 6.710 8.715) 11.747 5.133 ( 5.942 -0.423 -5.855) 8.352 5.133 ( 5.942 0.423 -5.855) 8.352 5.538 ( -3.231 -10.236 2.241) 10.966 5.538 ( -3.231 10.236 2.241) 10.966 5.858 ( -4.726 -2.975 -1.381) 5.752 5.858 ( -4.726 2.975 -1.381) 5.752 6.108 ( 2.264 -3.714 4.842) 6.509 6.108 ( 2.264 3.714 4.842) 6.509 6.474 ( -5.587 -7.549 6.713) 11.544 6.474 ( -5.587 7.549 6.713) 11.544 6.688 ( -0.295 -1.642 1.864) 2.501 6.688 ( -0.295 1.642 1.864) 2.501 6.971 ( 4.625 -3.587 4.711) 7.513 6.971 ( 4.625 3.587 4.711) 7.513 7.393 ( 2.559 -4.619 5.210) 7.418 7.393 ( 2.559 4.619 5.210) 7.418 7.914 ( 3.841 -5.293 0.674) 6.574 7.914 ( 3.841 5.293 0.674) 6.574 8.208 ( 3.546 -2.628 -2.677) 5.162 8.208 ( 3.546 2.628 -2.677) 5.162 8.511 ( 1.158 -1.503 -7.211) 7.456 8.511 ( 1.158 1.503 -7.211) 7.456 8.818 ( -1.432 -6.416 -3.298) 7.355 8.818 ( -1.432 6.416 -3.298) 7.355 9.110 ( -2.638 -0.528 -6.804) 7.317 9.110 ( -2.638 0.528 -6.804) 7.317 9.318 ( 0.359 -3.485 -8.974) 9.634 9.318 ( 0.359 3.485 -8.974) 9.634 9.419 ( -1.575 -5.483 -2.223) 6.123 9.419 ( -1.575 5.483 -2.223) 6.123 9.623 ( 2.674 -7.419 0.888) 7.936 9.623 ( 2.674 7.419 0.888) 7.936 9.847 ( 3.138 -10.948 -8.412) 14.159 9.847 ( 3.138 10.948 -8.412) 14.159 10.117 ( 6.203 -10.108 -2.553) 12.131 10.117 ( 6.203 10.108 -2.553) 12.131 10.334 ( 0.109 -3.099 -2.331) 3.879 10.334 ( 0.109 3.099 -2.331) 3.879 10.479 ( -14.081 -5.720 6.848) 16.670 10.479 ( -14.081 5.720 6.848) 16.670 10.671 ( 3.690 -5.956 -5.722) 9.046 10.671 ( 3.690 5.956 -5.722) 9.046 11.028 ( -0.528 -5.488 0.719) 5.560 11.028 ( -0.528 5.488 0.719) 5.560 11.191 ( -5.178 -8.371 9.060) 13.378 11.191 ( -5.178 8.371 9.060) 13.378 11.408 ( 1.158 -3.634 3.022) 4.866 11.408 ( 1.158 3.634 3.022) 4.866 11.792 ( 0.897 -8.526 2.332) 8.885 11.792 ( 0.897 8.526 2.332) 8.885 11.978 ( 4.764 -1.901 1.270) 5.284 11.978 ( 4.764 1.901 1.270) 5.284 12.496 ( 0.899 -6.547 -1.184) 6.714 12.496 ( 0.899 6.547 -1.184) 6.714 12.755 ( -1.295 -2.662 -0.765) 3.058 12.755 ( -1.295 2.662 -0.765) 3.058 13.596 ( 1.158 -0.639 -1.632) 2.100 13.596 ( 1.158 0.639 -1.632) 2.100 13.711 ( 1.054 -14.544 -5.362) 15.537 13.711 ( 1.054 14.544 -5.362) 15.537 14.141 ( 0.866 -9.559 2.008) 9.806 14.141 ( 0.866 9.559 2.008) 9.806 15.069 ( -1.641 -7.197 3.589) 8.208 15.069 ( -1.641 7.197 3.589) 8.208 15.299 ( 2.457 -2.128 9.397) 9.943 15.299 ( 2.457 2.128 9.397) 9.943 15.691 ( 0.394 -0.685 3.387) 3.478 15.691 ( 0.394 0.685 3.387) 3.478 15.908 ( -1.534 -0.467 2.348) 2.843 15.908 ( -1.534 0.467 2.348) 2.843 16.420 ( -1.886 -10.466 -1.530) 10.744 16.420 ( -1.886 10.466 -1.530) 10.744 16.767 ( -0.438 -4.906 -9.610) 10.799 16.767 ( -0.438 4.906 -9.610) 10.799 18.748 ( 1.477 -5.974 1.916) 6.445 18.748 ( 1.477 5.974 1.916) 6.445 20.065 ( -0.501 -1.858 -1.479) 2.427 20.065 ( -0.501 1.858 -1.479) 2.427 22.809 ( 1.984 -3.619 -12.347) 13.018 22.809 ( 1.984 3.619 -12.347) 13.018 23.105 ( 1.793 -4.055 -13.955) 14.643 23.105 ( 1.793 4.055 -13.955) 14.643 24.460 ( 3.213 -2.187 6.877) 7.900 24.460 ( 3.213 2.187 6.877) 7.900 25.516 ( -4.464 -2.623 9.100) 10.470 25.516 ( -4.464 2.623 9.100) 10.470 26.695 ( -11.468 -11.677 -19.099) 25.152 26.695 ( -11.468 11.677 -19.099) 25.152 27.367 ( 13.026 -11.158 -4.939) 17.849 27.367 ( 13.026 11.158 -4.939) 17.849 29.362 ( 0.038 -0.757 2.914) 3.011 29.362 ( 0.038 0.757 2.914) 3.011 29.741 ( -0.782 -4.373 3.559) 5.692 29.741 ( -0.782 4.373 3.559) 5.692 29.960 ( -2.662 -3.212 6.855) 8.025 29.960 ( -2.662 3.212 6.855) 8.025 30.374 ( -3.674 -2.360 13.911) 14.580 30.374 ( -3.674 2.360 13.911) 14.580 30.859 ( 0.456 -10.290 3.482) 10.873 30.859 ( 0.456 10.290 3.482) 10.873 31.377 ( -3.075 -9.208 5.890) 11.354 31.377 ( -3.075 9.208 5.890) 11.354 31.933 ( -2.168 -1.668 2.595) 3.770 31.933 ( -2.168 1.668 2.595) 3.770 33.343 ( 7.926 -4.027 -13.370) 16.056 33.343 ( 7.926 4.027 -13.370) 16.056 ======================= Grid point 75 (39/128) ======================= q-point: (-0.33 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -18.218 -17.892 21.434) 33.338 2.589 ( -18.218 17.892 21.434) 33.338 3.037 ( -17.231 -26.447 4.211) 31.845 3.037 ( -17.231 26.447 4.211) 31.845 3.529 ( 2.505 -7.955 11.086) 13.873 3.529 ( 2.505 7.955 11.086) 13.873 4.024 ( 8.343 -6.119 10.654) 14.851 4.024 ( 8.343 6.119 10.654) 14.851 4.188 ( -12.561 -9.557 22.191) 27.232 4.188 ( -12.561 9.557 22.191) 27.232 4.402 ( -2.852 -6.028 5.589) 8.701 4.402 ( -2.852 6.028 5.589) 8.701 4.678 ( 2.782 -7.394 9.639) 12.463 4.678 ( 2.782 7.394 9.639) 12.463 5.125 ( -4.071 -1.105 -7.185) 8.332 5.125 ( -4.071 1.105 -7.185) 8.332 5.542 ( -1.379 -11.120 6.271) 12.841 5.542 ( -1.379 11.120 6.271) 12.841 5.811 ( 1.995 -6.572 1.640) 7.061 5.811 ( 1.995 6.572 1.640) 7.061 6.179 ( 3.199 -1.110 1.019) 3.536 6.179 ( 3.199 1.110 1.019) 3.536 6.403 ( -3.568 -3.641 1.210) 5.240 6.403 ( -3.568 3.641 1.210) 5.240 6.611 ( -6.392 -5.255 2.001) 8.513 6.611 ( -6.392 5.255 2.001) 8.513 7.098 ( 3.301 -4.802 10.225) 11.769 7.098 ( 3.301 4.802 10.225) 11.769 7.496 ( 6.479 -7.839 5.350) 11.492 7.496 ( 6.479 7.839 5.350) 11.492 7.972 ( 2.148 -4.171 0.119) 4.693 7.972 ( 2.148 4.171 0.119) 4.693 8.303 ( 5.832 -3.116 -2.064) 6.926 8.303 ( 5.832 3.116 -2.064) 6.926 8.484 ( -0.034 -1.965 -9.489) 9.691 8.484 ( -0.034 1.965 -9.489) 9.691 8.803 ( 0.962 -5.522 -3.164) 6.437 8.803 ( 0.962 5.522 -3.164) 6.437 9.029 ( -3.176 -3.569 -6.958) 8.441 9.029 ( -3.176 3.569 -6.958) 8.441 9.235 ( -3.082 -4.544 -5.545) 7.803 9.235 ( -3.082 4.544 -5.545) 7.803 9.415 ( 1.302 -6.578 -4.367) 8.003 9.415 ( 1.302 6.578 -4.367) 8.003 9.635 ( -0.152 -4.579 -1.056) 4.701 9.635 ( -0.152 4.579 -1.056) 4.701 9.832 ( -4.469 -11.160 -5.588) 13.257 9.832 ( -4.469 11.160 -5.588) 13.257 10.110 ( -3.055 -3.875 -0.666) 4.979 10.110 ( -3.055 3.875 -0.666) 4.979 10.338 ( -0.477 -5.440 -0.115) 5.462 10.338 ( -0.477 5.440 -0.115) 5.462 10.424 ( 7.455 -1.665 -2.373) 7.998 10.424 ( 7.455 1.665 -2.373) 7.998 10.759 ( 6.852 -5.611 -4.904) 10.123 10.759 ( 6.852 5.611 -4.904) 10.123 10.997 ( -2.750 -4.004 1.033) 4.966 10.997 ( -2.750 4.004 1.033) 4.966 11.150 ( -2.550 -2.718 7.087) 8.007 11.150 ( -2.550 2.718 7.087) 8.007 11.467 ( 3.227 -2.047 2.263) 4.441 11.467 ( 3.227 2.047 2.263) 4.441 11.757 ( -4.853 -3.751 4.806) 7.792 11.757 ( -4.853 3.751 4.806) 7.792 12.030 ( -1.273 -5.014 6.111) 8.006 12.030 ( -1.273 5.014 6.111) 8.006 12.502 ( 1.256 -9.175 -1.982) 9.471 12.502 ( 1.256 9.175 -1.982) 9.471 12.840 ( 9.566 -3.887 -1.612) 10.450 12.840 ( 9.566 3.887 -1.612) 10.450 13.551 ( -4.238 -3.624 -3.335) 6.497 13.551 ( -4.238 3.624 -3.335) 6.497 13.731 ( 2.503 -9.957 -3.787) 10.943 13.731 ( 2.503 9.957 -3.787) 10.943 14.163 ( 0.195 -7.656 4.057) 8.666 14.163 ( 0.195 7.656 4.057) 8.666 15.078 ( 1.004 -5.283 3.654) 6.502 15.078 ( 1.004 5.283 3.654) 6.502 15.394 ( 3.498 -1.710 6.922) 7.942 15.394 ( 3.498 1.710 6.922) 7.942 15.727 ( 1.229 -2.896 5.368) 6.222 15.727 ( 1.229 2.896 5.368) 6.222 15.878 ( -2.401 -2.500 2.152) 4.080 15.878 ( -2.401 2.500 2.152) 4.080 16.388 ( -0.226 -11.721 -3.205) 12.153 16.388 ( -0.226 11.721 -3.205) 12.153 16.723 ( 0.015 -5.490 -8.860) 10.423 16.723 ( 0.015 5.490 -8.860) 10.423 18.836 ( 6.737 -8.480 2.160) 11.044 18.836 ( 6.737 8.480 2.160) 11.044 20.033 ( -2.205 -1.333 -0.911) 2.733 20.033 ( -2.205 1.333 -0.911) 2.733 22.803 ( 2.891 -3.198 -12.467) 13.191 22.803 ( 2.891 3.198 -12.467) 13.191 23.093 ( 3.374 -3.302 -14.896) 15.626 23.093 ( 3.374 3.302 -14.896) 15.626 24.541 ( 1.337 -1.685 10.049) 10.277 24.541 ( 1.337 1.685 10.049) 10.277 25.471 ( -3.673 -3.155 7.106) 8.599 25.471 ( -3.673 3.155 7.106) 8.599 26.095 ( -36.544 -10.983 -17.273) 41.886 26.095 ( -36.544 10.983 -17.273) 41.886 27.737 ( 21.662 -10.948 -7.374) 25.367 27.737 ( 21.662 10.948 -7.374) 25.367 29.398 ( 2.412 -2.606 3.685) 5.118 29.398 ( 2.412 2.606 3.685) 5.118 29.734 ( -1.394 -5.933 1.351) 6.243 29.734 ( -1.394 5.933 1.351) 6.243 29.937 ( -2.537 -3.673 6.549) 7.925 29.937 ( -2.537 3.673 6.549) 7.925 30.350 ( -5.249 -2.977 14.964) 16.135 30.350 ( -5.249 2.977 14.964) 16.135 30.844 ( -4.096 -8.405 5.265) 10.730 30.844 ( -4.096 8.405 5.265) 10.730 31.316 ( -4.619 -9.346 3.069) 10.867 31.316 ( -4.619 9.346 3.069) 10.867 31.889 ( -2.674 -4.752 1.737) 5.723 31.889 ( -2.674 4.752 1.737) 5.723 33.571 ( 19.854 -2.707 -11.250) 22.979 33.571 ( 19.854 2.707 -11.250) 22.979 ======================= Grid point 77 (40/128) ======================= q-point: (-0.17 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( -12.133 -28.487 22.655) 38.366 2.383 ( -12.133 28.487 22.655) 38.366 2.734 ( -18.005 -24.982 15.674) 34.554 2.734 ( -18.005 24.982 15.674) 34.554 3.580 ( 0.102 -12.506 1.386) 12.583 3.580 ( 0.102 12.506 1.386) 12.583 4.104 ( -6.502 -5.678 28.151) 29.445 4.104 ( -6.502 5.678 28.151) 29.445 4.210 ( 6.172 -9.750 7.850) 13.957 4.210 ( 6.172 9.750 7.850) 13.957 4.370 ( -3.106 -4.415 4.187) 6.832 4.370 ( -3.106 4.415 4.187) 6.832 4.780 ( 2.779 -6.463 8.801) 11.268 4.780 ( 2.779 6.463 8.801) 11.268 4.987 ( -6.045 -3.812 -3.074) 7.780 4.987 ( -6.045 3.812 -3.074) 7.780 5.538 ( -1.483 -10.905 11.118) 15.644 5.538 ( -1.483 10.905 11.118) 15.644 5.870 ( 0.537 -8.398 2.329) 8.731 5.870 ( 0.537 8.398 2.329) 8.731 6.185 ( -1.045 -8.833 -6.299) 10.899 6.185 ( -1.045 8.833 -6.299) 10.899 6.353 ( -2.058 -4.024 -2.293) 5.068 6.353 ( -2.058 4.024 -2.293) 5.068 6.588 ( 3.580 -13.035 6.194) 14.869 6.588 ( 3.580 13.035 6.194) 14.869 7.102 ( -7.910 -5.495 11.294) 14.843 7.102 ( -7.910 5.495 11.294) 14.843 7.669 ( 9.450 -7.949 2.483) 12.596 7.669 ( 9.450 7.949 2.483) 12.596 7.987 ( 0.364 -1.648 -4.699) 4.992 7.987 ( 0.364 1.648 -4.699) 4.992 8.290 ( -3.865 -5.784 -9.995) 12.177 8.290 ( -3.865 5.784 -9.995) 12.177 8.497 ( 3.461 -8.878 -4.726) 10.636 8.497 ( 3.461 8.878 -4.726) 10.636 8.804 ( 0.733 -5.179 -3.499) 6.293 8.804 ( 0.733 5.179 -3.499) 6.293 8.970 ( 0.754 -4.623 -5.589) 7.292 8.970 ( 0.754 4.623 -5.589) 7.292 9.223 ( 2.772 -3.099 0.196) 4.163 9.223 ( 2.772 3.099 0.196) 4.163 9.433 ( 2.658 -4.452 -3.543) 6.280 9.433 ( 2.658 4.452 -3.543) 6.280 9.594 ( -4.219 -5.278 -4.055) 7.881 9.594 ( -4.219 5.278 -4.055) 7.881 9.684 ( -6.674 -4.307 -2.008) 8.193 9.684 ( -6.674 4.307 -2.008) 8.193 10.120 ( 2.930 -2.385 -0.126) 3.780 10.120 ( 2.930 2.385 -0.126) 3.780 10.310 ( -2.459 -4.687 -1.401) 5.475 10.310 ( -2.459 4.687 -1.401) 5.475 10.546 ( 5.031 -1.694 -1.732) 5.584 10.546 ( 5.031 1.694 -1.732) 5.584 10.850 ( 3.952 -5.756 -4.500) 8.307 10.850 ( 3.952 5.756 -4.500) 8.307 10.993 ( 3.437 -2.883 2.367) 5.072 10.993 ( 3.437 2.883 2.367) 5.072 11.153 ( 0.917 -6.515 1.983) 6.871 11.153 ( 0.917 6.515 1.983) 6.871 11.510 ( 0.478 -1.818 0.343) 1.911 11.510 ( 0.478 1.818 0.343) 1.911 11.708 ( -2.388 -1.965 5.996) 6.747 11.708 ( -2.388 1.965 5.996) 6.747 11.971 ( -8.806 -6.404 11.388) 15.755 11.971 ( -8.806 6.404 11.388) 15.755 12.535 ( 2.772 -10.299 -2.464) 10.947 12.535 ( 2.772 10.299 -2.464) 10.947 13.030 ( 11.344 -5.626 -2.625) 12.931 13.030 ( 11.344 5.626 -2.625) 12.931 13.438 ( -6.004 -4.626 -5.301) 9.249 13.438 ( -6.004 4.626 -5.301) 9.249 13.753 ( 1.452 -9.190 -4.117) 10.174 13.753 ( 1.452 9.190 -4.117) 10.174 14.172 ( -1.451 -6.142 4.488) 7.744 14.172 ( -1.451 6.142 4.488) 7.744 15.129 ( 2.114 -3.647 5.954) 7.295 15.129 ( 2.114 3.647 5.954) 7.295 15.448 ( 0.258 -1.401 0.276) 1.451 15.448 ( 0.258 1.401 0.276) 1.451 15.751 ( -1.053 -6.738 2.911) 7.415 15.751 ( -1.053 6.738 2.911) 7.415 15.854 ( -1.193 -2.343 3.230) 4.165 15.854 ( -1.193 2.343 3.230) 4.165 16.402 ( 2.488 -10.841 0.469) 11.133 16.402 ( 2.488 10.841 0.469) 11.133 16.708 ( 2.218 -3.979 -7.319) 8.621 16.708 ( 2.218 3.979 -7.319) 8.621 18.974 ( 6.398 -8.153 0.248) 10.367 18.974 ( 6.398 8.153 0.248) 10.367 19.995 ( -1.555 -1.101 1.384) 2.355 19.995 ( -1.555 1.101 1.384) 2.355 22.813 ( 3.657 -3.162 -12.434) 13.341 22.813 ( 3.657 3.162 -12.434) 13.341 23.109 ( 4.801 -2.831 -14.957) 15.962 23.109 ( 4.801 2.831 -14.957) 15.962 24.578 ( -1.845 -0.929 10.517) 10.718 24.578 ( -1.845 0.929 10.517) 10.718 25.390 ( -22.885 -3.264 -7.169) 24.203 25.390 ( -22.885 3.264 -7.169) 24.203 25.477 ( -6.164 -4.346 3.770) 8.432 25.477 ( -6.164 4.346 3.770) 8.432 28.007 ( 11.468 -10.013 -10.176) 18.313 28.007 ( 11.468 10.013 -10.176) 18.313 29.477 ( 4.351 -3.995 3.847) 7.049 29.477 ( 4.351 3.995 3.847) 7.049 29.690 ( -3.223 -8.450 -2.297) 9.331 29.690 ( -3.223 8.450 -2.297) 9.331 29.931 ( -1.372 -3.764 8.444) 9.346 29.931 ( -1.372 3.764 8.444) 9.346 30.312 ( -5.484 -2.901 16.250) 17.394 30.312 ( -5.484 2.901 16.250) 17.394 30.767 ( -6.047 -4.806 6.352) 10.001 30.767 ( -6.047 4.806 6.352) 10.001 31.270 ( -1.209 -9.842 1.739) 10.067 31.270 ( -1.209 9.842 1.739) 10.067 31.863 ( -1.091 -6.787 2.169) 7.208 31.863 ( -1.091 6.787 2.169) 7.208 33.864 ( 15.333 -7.510 -14.245) 22.235 33.864 ( 15.333 7.510 -14.245) 22.235 ======================= Grid point 91 (41/128) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.453 ( 14.551 0.000 40.932) 43.442 1.477 ( -11.391 0.000 37.542) 39.232 2.601 ( -10.465 0.000 57.868) 58.807 2.767 ( -0.217 0.000 9.172) 9.174 3.612 ( -9.108 0.000 26.403) 27.930 4.095 ( 5.722 0.000 11.497) 12.842 4.212 ( -5.801 0.000 26.986) 27.602 4.316 ( -1.206 0.000 -0.237) 1.229 4.375 ( -8.146 0.000 -2.661) 8.569 4.400 ( -6.111 0.000 3.628) 7.107 4.931 ( -4.474 0.000 14.227) 14.914 4.951 ( 3.833 0.000 -0.983) 3.957 5.063 ( -4.655 0.000 28.179) 28.561 5.134 ( -1.425 0.000 -3.948) 4.198 5.161 ( -3.719 0.000 17.084) 17.484 5.360 ( -3.007 0.000 34.228) 34.359 5.397 ( -7.357 0.000 -7.663) 10.623 5.521 ( -3.193 0.000 25.986) 26.181 5.609 ( -4.604 0.000 28.995) 29.358 5.766 ( 6.623 0.000 10.903) 12.757 6.236 ( 2.159 0.000 -6.109) 6.479 6.282 ( -8.968 0.000 0.095) 8.969 6.492 ( -6.522 0.000 1.633) 6.723 6.612 ( 2.245 0.000 0.997) 2.457 6.907 ( 8.284 0.000 4.039) 9.216 7.048 ( 0.561 0.000 -6.036) 6.062 7.199 ( 6.326 0.000 4.696) 7.878 7.204 ( -9.017 0.000 5.266) 10.443 7.503 ( -13.934 0.000 -0.691) 13.951 7.557 ( 4.362 0.000 -10.083) 10.986 7.669 ( -4.026 0.000 5.726) 7.000 7.736 ( -0.230 0.000 -5.483) 5.488 7.856 ( -3.095 0.000 -14.361) 14.690 8.119 ( -2.224 0.000 -12.294) 12.494 8.215 ( 1.029 0.000 -4.589) 4.703 8.432 ( 3.863 0.000 -10.996) 11.655 8.607 ( 5.794 0.000 -3.245) 6.641 8.739 ( -0.254 0.000 -3.840) 3.848 8.808 ( -2.320 0.000 -3.384) 4.102 8.884 ( 9.711 0.000 -6.379) 11.619 9.058 ( 1.748 0.000 0.344) 1.782 9.151 ( 5.510 0.000 0.224) 5.515 9.253 ( -1.570 0.000 0.278) 1.594 9.381 ( 1.700 0.000 0.290) 1.724 9.388 ( -0.877 0.000 -4.869) 4.947 9.539 ( 5.577 0.000 1.233) 5.712 9.692 ( 5.567 0.000 -0.607) 5.600 9.989 ( -0.075 0.000 0.892) 0.895 10.039 ( -7.511 0.000 2.244) 7.839 10.148 ( 0.211 0.000 3.172) 3.179 10.194 ( -1.409 0.000 -13.480) 13.554 10.380 ( 7.662 0.000 -6.154) 9.827 10.456 ( 4.637 0.000 -2.257) 5.157 10.587 ( 0.109 0.000 -3.708) 3.709 10.727 ( 5.159 0.000 -2.669) 5.808 10.771 ( 6.890 0.000 -13.810) 15.433 11.122 ( -2.140 0.000 0.855) 2.304 11.157 ( 0.137 0.000 -11.728) 11.729 11.295 ( -3.171 0.000 3.898) 5.025 11.351 ( -1.644 0.000 -1.218) 2.046 11.494 ( 2.457 0.000 11.068) 11.338 11.523 ( 1.386 0.000 -2.439) 2.805 11.839 ( 2.700 0.000 -7.064) 7.562 11.931 ( -15.806 0.000 11.535) 19.568 12.011 ( 4.156 0.000 6.723) 7.904 12.109 ( -1.567 0.000 7.249) 7.417 12.718 ( 1.030 0.000 -0.590) 1.187 12.787 ( -11.783 0.000 9.430) 15.092 12.874 ( 0.501 0.000 -1.932) 1.996 12.957 ( 1.163 0.000 -0.694) 1.354 13.053 ( 5.717 0.000 4.599) 7.337 13.471 ( -4.959 0.000 -2.626) 5.611 13.932 ( 6.092 0.000 -5.014) 7.890 14.012 ( -2.485 0.000 5.814) 6.322 14.209 ( -0.464 0.000 -3.270) 3.302 14.645 ( -8.950 0.000 15.728) 18.096 14.792 ( 1.568 0.000 -8.583) 8.725 15.147 ( -0.588 0.000 -14.907) 14.918 15.297 ( -2.752 0.000 -2.663) 3.829 15.679 ( -1.935 0.000 -2.919) 3.502 15.689 ( 6.930 0.000 -9.335) 11.626 15.703 ( 5.193 0.000 4.520) 6.885 15.856 ( -1.829 0.000 10.113) 10.277 16.193 ( -4.293 0.000 -4.529) 6.240 16.197 ( -1.937 0.000 8.750) 8.962 16.407 ( 3.459 0.000 -3.656) 5.033 16.731 ( 2.318 0.000 -1.097) 2.565 17.060 ( -25.391 0.000 6.709) 26.262 19.072 ( -0.633 0.000 -9.345) 9.366 19.290 ( -0.555 0.000 9.280) 9.296 20.081 ( -1.254 0.000 8.929) 9.017 20.259 ( -0.861 0.000 9.654) 9.692 22.241 ( 6.189 0.000 -30.133) 30.762 22.393 ( 8.053 0.000 -27.169) 28.337 22.745 ( 1.994 0.000 -16.534) 16.653 22.840 ( 10.406 0.000 -20.878) 23.328 24.522 ( -8.911 0.000 7.107) 11.398 24.637 ( -9.532 0.000 5.479) 10.995 25.066 ( 22.646 0.000 -4.151) 23.023 25.260 ( 11.266 0.000 -6.762) 13.140 25.522 ( 0.375 0.000 16.090) 16.094 25.910 ( 2.885 0.000 14.114) 14.405 27.664 ( -3.229 0.000 -8.368) 8.969 28.043 ( 3.606 0.000 -24.103) 24.371 29.014 ( 1.947 0.000 3.477) 3.985 29.463 ( -0.714 0.000 -1.455) 1.621 29.692 ( -5.946 0.000 7.745) 9.764 29.778 ( -3.132 0.000 -3.595) 4.768 30.230 ( -5.993 0.000 1.521) 6.183 30.467 ( -10.465 0.000 14.834) 18.154 30.511 ( 4.364 0.000 7.922) 9.045 30.527 ( 16.547 0.000 7.952) 18.358 30.742 ( 5.166 0.000 11.065) 12.212 31.077 ( -1.259 0.000 13.022) 13.083 31.311 ( -1.667 0.000 9.823) 9.963 31.491 ( 0.183 0.000 0.167) 0.247 32.043 ( -1.419 0.000 9.973) 10.074 32.327 ( 0.839 0.000 -7.860) 7.905 32.994 ( -8.482 0.000 -9.972) 13.091 33.340 ( -10.812 0.000 -10.593) 15.136 ======================= Grid point 92 (42/128) ======================= q-point: ( 0.17 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( 9.189 0.000 34.968) 36.156 2.175 ( 37.430 0.000 33.158) 50.005 2.792 ( -1.797 0.000 9.880) 10.042 2.801 ( 9.683 0.000 49.546) 50.483 3.482 ( -17.191 0.000 25.423) 30.690 4.076 ( -11.902 0.000 4.613) 12.765 4.156 ( -7.359 0.000 15.980) 17.593 4.209 ( -8.884 0.000 -1.373) 8.990 4.351 ( 5.678 0.000 3.137) 6.487 4.384 ( -0.088 0.000 13.047) 13.047 4.798 ( -17.018 0.000 17.269) 24.245 4.890 ( -10.646 0.000 6.249) 12.345 5.032 ( -11.859 0.000 35.608) 37.530 5.128 ( 3.665 0.000 -5.412) 6.536 5.188 ( 2.003 0.000 3.840) 4.331 5.331 ( 4.290 0.000 -12.897) 13.592 5.415 ( -8.583 0.000 28.912) 30.159 5.620 ( -1.605 0.000 31.959) 31.999 5.669 ( 4.689 0.000 19.849) 20.395 5.839 ( -5.558 0.000 22.423) 23.101 6.196 ( -0.490 0.000 6.562) 6.580 6.265 ( 2.968 0.000 -2.914) 4.159 6.396 ( -3.644 0.000 -1.922) 4.119 6.664 ( 1.515 0.000 -4.177) 4.444 7.024 ( -3.733 0.000 8.588) 9.365 7.100 ( 7.696 0.000 -5.251) 9.317 7.112 ( -26.067 0.000 3.293) 26.274 7.200 ( 10.251 0.000 5.120) 11.459 7.342 ( 3.402 0.000 3.396) 4.807 7.558 ( 3.972 0.000 -5.344) 6.658 7.671 ( 1.331 0.000 5.053) 5.226 7.728 ( 1.525 0.000 -4.643) 4.887 7.833 ( 4.659 0.000 -13.322) 14.113 8.107 ( 5.731 0.000 -11.848) 13.161 8.269 ( 6.484 0.000 -7.916) 10.233 8.444 ( 2.794 0.000 -11.472) 11.808 8.653 ( 2.029 0.000 -4.689) 5.109 8.687 ( -3.993 0.000 -2.759) 4.853 8.776 ( 0.024 0.000 -1.987) 1.987 8.976 ( 1.873 0.000 -4.388) 4.771 9.162 ( 5.074 0.000 2.853) 5.821 9.234 ( 1.331 0.000 -6.561) 6.695 9.238 ( -0.419 0.000 -6.301) 6.315 9.348 ( 0.248 0.000 -3.472) 3.480 9.457 ( 9.608 0.000 -0.186) 9.609 9.622 ( 2.644 0.000 2.609) 3.714 9.763 ( 0.327 0.000 -3.055) 3.072 9.944 ( -0.292 0.000 0.679) 0.739 9.978 ( 0.109 0.000 -2.918) 2.920 10.060 ( -3.220 0.000 -14.546) 14.898 10.248 ( 3.854 0.000 4.584) 5.989 10.415 ( 0.446 0.000 -6.674) 6.688 10.523 ( 4.323 0.000 -0.784) 4.393 10.576 ( 0.615 0.000 -8.162) 8.185 10.769 ( -0.902 0.000 -16.926) 16.950 10.823 ( 6.541 0.000 -5.064) 8.272 11.031 ( -8.310 0.000 10.457) 13.357 11.082 ( -2.177 0.000 -13.287) 13.464 11.296 ( -1.178 0.000 3.821) 3.998 11.310 ( -2.098 0.000 -3.064) 3.713 11.522 ( -1.027 0.000 -1.838) 2.106 11.622 ( 3.166 0.000 10.411) 10.882 11.774 ( -0.365 0.000 8.194) 8.202 11.833 ( -0.716 0.000 -7.861) 7.894 12.118 ( -1.139 0.000 8.983) 9.055 12.151 ( 8.095 0.000 5.104) 9.569 12.562 ( -14.845 0.000 4.511) 15.515 12.629 ( -4.598 0.000 -2.579) 5.272 12.856 ( -2.207 0.000 1.195) 2.509 13.048 ( -1.230 0.000 3.174) 3.404 13.175 ( 8.394 0.000 6.121) 10.389 13.405 ( 0.678 0.000 -5.368) 5.411 13.995 ( -2.091 0.000 7.266) 7.561 14.063 ( 9.729 0.000 -3.743) 10.424 14.167 ( -2.058 0.000 -5.184) 5.577 14.538 ( -9.606 0.000 20.687) 22.809 14.794 ( 2.336 0.000 -8.376) 8.696 15.116 ( 3.304 0.000 -11.879) 12.330 15.194 ( -8.095 0.000 0.798) 8.135 15.610 ( -4.017 0.000 -1.095) 4.163 15.749 ( -5.681 0.000 9.655) 11.203 15.783 ( 7.916 0.000 -13.480) 15.632 15.906 ( 3.409 0.000 11.109) 11.620 16.090 ( -4.366 0.000 -6.454) 7.792 16.165 ( -6.783 0.000 12.215) 13.972 16.435 ( 1.024 0.000 -1.860) 2.123 16.503 ( -32.517 0.000 21.450) 38.955 16.762 ( 1.421 0.000 -1.962) 2.422 18.961 ( -5.997 0.000 -6.137) 8.581 19.278 ( -2.268 0.000 1.272) 2.601 20.058 ( -3.244 0.000 8.767) 9.348 20.255 ( -2.447 0.000 7.347) 7.744 22.231 ( 6.191 0.000 -30.974) 31.587 22.435 ( 7.996 0.000 -25.494) 26.718 22.704 ( 0.924 0.000 -18.338) 18.361 22.920 ( 6.825 0.000 -19.279) 20.451 24.411 ( -5.577 0.000 6.967) 8.924 24.531 ( -3.073 0.000 3.493) 4.652 25.536 ( 25.964 0.000 -8.006) 27.171 25.595 ( -0.032 0.000 16.427) 16.427 25.843 ( 49.208 0.000 -21.152) 53.561 25.985 ( -1.791 0.000 15.502) 15.605 27.474 ( -11.965 0.000 -10.326) 15.805 27.967 ( -1.031 0.000 -26.207) 26.227 29.102 ( 5.723 0.000 4.602) 7.344 29.424 ( -1.937 0.000 -2.959) 3.537 29.596 ( -7.287 0.000 4.757) 8.702 29.746 ( 0.168 0.000 -0.654) 0.676 30.140 ( -3.969 0.000 1.622) 4.287 30.342 ( -9.047 0.000 12.767) 15.647 30.599 ( 0.969 0.000 9.855) 9.903 30.631 ( -3.340 0.000 13.799) 14.198 31.115 ( 17.270 0.000 14.909) 22.815 31.215 ( 15.326 0.000 6.923) 16.817 31.315 ( -2.344 0.000 10.159) 10.425 31.505 ( 1.632 0.000 -1.523) 2.232 32.058 ( -1.540 0.000 10.300) 10.414 32.298 ( -0.491 0.000 -7.319) 7.336 32.575 ( -32.960 0.000 7.766) 33.862 33.087 ( -8.659 0.000 -17.326) 19.369 ======================= Grid point 93 (43/128) ======================= q-point: ( 0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( 18.890 0.000 27.003) 32.955 2.745 ( -9.518 0.000 11.941) 15.270 2.750 ( 7.377 0.000 41.049) 41.706 3.129 ( -14.245 0.000 20.231) 24.743 3.476 ( 28.682 0.000 22.724) 36.593 3.864 ( -10.396 0.000 -2.227) 10.632 4.014 ( -9.079 0.000 -1.878) 9.271 4.146 ( -0.595 0.000 16.027) 16.038 4.464 ( -4.042 0.000 12.399) 13.041 4.488 ( 5.199 0.000 10.181) 11.432 4.491 ( -16.630 0.000 22.974) 28.361 4.747 ( -7.357 0.000 9.736) 12.202 4.976 ( -8.368 0.000 26.470) 27.761 5.174 ( 3.788 0.000 -7.884) 8.747 5.190 ( -2.746 0.000 -1.189) 2.992 5.356 ( -6.658 0.000 23.302) 24.235 5.394 ( 7.140 0.000 -11.488) 13.526 5.647 ( -8.544 0.000 25.204) 26.612 5.781 ( -12.167 0.000 40.228) 42.028 5.928 ( 8.363 0.000 25.654) 26.982 6.213 ( -5.168 0.000 7.629) 9.215 6.279 ( -1.216 0.000 -1.188) 1.700 6.395 ( 5.749 0.000 -4.389) 7.232 6.494 ( -27.077 0.000 10.983) 29.219 6.688 ( -2.513 0.000 -2.643) 3.647 7.140 ( 8.098 0.000 4.963) 9.498 7.252 ( 9.796 0.000 -4.149) 10.638 7.310 ( -4.240 0.000 -1.669) 4.557 7.387 ( 5.788 0.000 5.563) 8.028 7.644 ( 0.862 0.000 -3.620) 3.722 7.723 ( 1.732 0.000 3.517) 3.920 7.755 ( 3.183 0.000 -2.579) 4.097 7.924 ( 11.935 0.000 -6.670) 13.672 8.235 ( 12.580 0.000 -9.575) 15.809 8.357 ( 5.698 0.000 -8.134) 9.932 8.456 ( 3.608 0.000 -10.855) 11.439 8.574 ( -7.102 0.000 -2.882) 7.665 8.674 ( 2.951 0.000 -4.525) 5.402 8.792 ( 1.871 0.000 -1.761) 2.569 8.922 ( -3.817 0.000 -2.441) 4.530 9.033 ( -11.427 0.000 -8.204) 14.067 9.218 ( 2.859 0.000 -12.034) 12.369 9.333 ( -2.367 0.000 -1.343) 2.721 9.356 ( 9.163 0.000 1.150) 9.235 9.552 ( -4.941 0.000 1.542) 5.176 9.643 ( -1.877 0.000 2.978) 3.520 9.786 ( 9.800 0.000 -4.444) 10.760 9.942 ( -3.287 0.000 -13.098) 13.504 9.989 ( 3.358 0.000 -7.462) 8.183 9.993 ( 0.608 0.000 -3.956) 4.002 10.315 ( 1.463 0.000 6.448) 6.611 10.390 ( 1.097 0.000 -12.927) 12.974 10.550 ( 1.729 0.000 -9.611) 9.765 10.622 ( 5.545 0.000 -3.044) 6.326 10.629 ( -7.235 0.000 -8.390) 11.078 10.872 ( 1.446 0.000 -12.775) 12.856 10.921 ( -7.321 0.000 8.918) 11.538 11.019 ( 1.813 0.000 -12.266) 12.400 11.247 ( -2.875 0.000 1.559) 3.271 11.270 ( 0.595 0.000 -3.267) 3.320 11.466 ( -3.542 0.000 -2.844) 4.542 11.752 ( 6.981 0.000 10.136) 12.307 11.757 ( -4.350 0.000 -1.346) 4.554 11.924 ( 9.047 0.000 7.498) 11.750 12.139 ( 0.273 0.000 4.379) 4.388 12.283 ( -7.223 0.000 3.844) 8.182 12.368 ( 3.999 0.000 2.296) 4.611 12.579 ( -0.107 0.000 -4.144) 4.145 12.817 ( -2.536 0.000 2.582) 3.619 12.939 ( -10.836 0.000 9.559) 14.449 13.352 ( 6.982 0.000 2.370) 7.374 13.439 ( 4.614 0.000 -5.918) 7.504 13.997 ( -1.274 0.000 8.851) 8.942 14.088 ( -3.659 0.000 -4.687) 5.946 14.218 ( 7.067 0.000 -9.164) 11.573 14.525 ( -0.842 0.000 31.466) 31.477 14.807 ( 2.763 0.000 -8.418) 8.860 15.007 ( -13.532 0.000 7.497) 15.470 15.171 ( 7.119 0.000 -8.787) 11.309 15.533 ( -3.247 0.000 -3.652) 4.887 15.649 ( -8.357 0.000 16.081) 18.123 15.856 ( 4.975 0.000 -13.806) 14.675 15.988 ( -5.409 0.000 20.790) 21.482 16.004 ( -1.320 0.000 -3.681) 3.910 16.044 ( -6.012 0.000 9.201) 10.991 16.227 ( -8.370 0.000 13.562) 15.937 16.433 ( -0.468 0.000 -1.096) 1.191 16.762 ( 0.077 0.000 -4.490) 4.491 18.842 ( -4.784 0.000 -2.354) 5.331 19.245 ( -1.111 0.000 -0.766) 1.350 20.059 ( -0.477 0.000 7.196) 7.212 20.230 ( -3.032 0.000 4.200) 5.180 22.220 ( 6.377 0.000 -30.681) 31.337 22.478 ( 8.041 0.000 -24.856) 26.124 22.624 ( -1.101 0.000 -20.770) 20.799 22.929 ( 2.723 0.000 -18.414) 18.615 24.401 ( 1.615 0.000 6.991) 7.175 24.559 ( 3.612 0.000 5.667) 6.720 25.641 ( -2.090 0.000 15.326) 15.468 25.959 ( -7.815 0.000 15.430) 17.296 25.994 ( 24.982 0.000 -12.454) 27.915 26.430 ( 21.619 0.000 -26.764) 34.405 27.256 ( -2.230 0.000 -12.965) 13.155 27.807 ( -3.463 0.000 -27.572) 27.788 29.239 ( 5.826 0.000 4.531) 7.380 29.386 ( -0.569 0.000 -3.705) 3.748 29.477 ( -6.462 0.000 3.825) 7.509 29.764 ( 1.363 0.000 1.901) 2.339 30.114 ( 0.346 0.000 1.672) 1.707 30.236 ( -7.697 0.000 9.478) 12.210 30.619 ( -3.550 0.000 13.491) 13.950 30.620 ( -3.270 0.000 11.343) 11.805 31.307 ( -2.954 0.000 10.415) 10.826 31.358 ( 4.146 0.000 29.034) 29.329 31.530 ( 1.905 0.000 -3.525) 4.006 31.546 ( 2.133 0.000 12.991) 13.165 32.065 ( -2.433 0.000 10.503) 10.781 32.136 ( -6.853 0.000 0.169) 6.856 32.264 ( 0.263 0.000 -6.537) 6.542 32.872 ( -6.491 0.000 -17.990) 19.125 ======================= Grid point 94 (44/128) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( 14.550 0.000 18.298) 23.377 2.512 ( -21.703 0.000 16.997) 27.567 2.606 ( -29.791 0.000 26.872) 40.120 3.179 ( 4.631 0.000 29.846) 30.203 3.703 ( -5.053 0.000 -1.002) 5.152 3.900 ( -6.971 0.000 10.863) 12.908 3.961 ( 4.461 0.000 -3.174) 5.475 4.139 ( -14.758 0.000 29.675) 33.143 4.286 ( 10.646 0.000 6.086) 12.263 4.585 ( -0.487 0.000 11.549) 11.559 4.644 ( 6.658 0.000 17.761) 18.968 4.718 ( 0.194 0.000 9.750) 9.752 4.927 ( -6.867 0.000 19.127) 20.322 5.139 ( -1.351 0.000 2.232) 2.609 5.196 ( 2.170 0.000 -8.579) 8.850 5.330 ( -8.717 0.000 25.199) 26.664 5.487 ( 7.124 0.000 -7.825) 10.582 5.552 ( -10.329 0.000 23.462) 25.635 5.712 ( -14.703 0.000 39.558) 42.202 5.873 ( -18.926 0.000 31.079) 36.388 6.094 ( -10.848 0.000 13.953) 17.674 6.250 ( -0.223 0.000 -4.817) 4.822 6.407 ( 14.184 0.000 6.421) 15.570 6.519 ( 8.181 0.000 -1.181) 8.266 6.755 ( 4.333 0.000 1.321) 4.530 7.205 ( -6.055 0.000 -3.204) 6.851 7.309 ( 8.384 0.000 2.523) 8.755 7.374 ( 3.203 0.000 -3.390) 4.664 7.451 ( -1.091 0.000 7.773) 7.850 7.568 ( -3.943 0.000 -7.544) 8.512 7.762 ( 1.763 0.000 2.773) 3.287 7.800 ( 2.238 0.000 -1.513) 2.701 8.141 ( 10.071 0.000 -1.390) 10.167 8.371 ( -0.040 0.000 -10.034) 10.034 8.425 ( 9.704 0.000 -5.811) 11.310 8.432 ( -5.593 0.000 -5.697) 7.983 8.479 ( 2.250 0.000 -8.808) 9.091 8.627 ( -9.496 0.000 -9.958) 13.760 8.773 ( 1.209 0.000 -2.266) 2.568 8.918 ( 6.723 0.000 -3.364) 7.518 8.958 ( 6.713 0.000 -3.621) 7.627 9.213 ( 2.090 0.000 -13.595) 13.755 9.249 ( -5.823 0.000 -2.094) 6.188 9.438 ( -4.280 0.000 -1.490) 4.532 9.536 ( 9.351 0.000 1.670) 9.499 9.581 ( -5.518 0.000 3.533) 6.552 9.823 ( -16.241 0.000 0.777) 16.260 9.862 ( -1.024 0.000 -4.021) 4.149 9.967 ( 9.475 0.000 -7.837) 12.296 10.032 ( 5.166 0.000 -10.001) 11.256 10.278 ( -6.442 0.000 -22.098) 23.018 10.375 ( 2.557 0.000 3.460) 4.302 10.491 ( -2.401 0.000 -0.512) 2.455 10.620 ( -2.094 0.000 -9.206) 9.441 10.633 ( 6.165 0.000 -3.992) 7.345 10.769 ( -7.418 0.000 -12.018) 14.123 10.889 ( 2.095 0.000 3.481) 4.063 11.046 ( 5.907 0.000 -9.750) 11.400 11.232 ( 0.557 0.000 -1.423) 1.528 11.341 ( 7.839 0.000 -7.689) 10.981 11.416 ( 0.512 0.000 -1.649) 1.727 11.700 ( -1.950 0.000 3.427) 3.943 11.878 ( 1.177 0.000 9.232) 9.307 12.050 ( -9.022 0.000 8.422) 12.341 12.148 ( 4.882 0.000 3.545) 6.033 12.156 ( 0.853 0.000 -1.133) 1.418 12.561 ( -1.424 0.000 -1.364) 1.973 12.567 ( 11.962 0.000 2.300) 12.181 12.791 ( -8.257 0.000 10.670) 13.492 12.794 ( -1.495 0.000 5.239) 5.449 13.393 ( -1.090 0.000 -6.425) 6.517 13.524 ( 4.657 0.000 0.965) 4.756 13.999 ( -3.276 0.000 -7.042) 7.766 14.016 ( -0.705 0.000 8.709) 8.738 14.238 ( -0.964 0.000 -0.398) 1.043 14.712 ( -0.907 0.000 21.680) 21.699 14.820 ( 2.284 0.000 -8.739) 9.032 14.884 ( 5.095 0.000 12.599) 13.590 15.289 ( 8.834 0.000 -7.737) 11.743 15.464 ( -1.940 0.000 -7.576) 7.821 15.626 ( -1.458 0.000 17.945) 18.004 15.823 ( -1.758 0.000 -9.106) 9.274 15.871 ( -10.010 0.000 13.384) 16.713 16.055 ( 6.423 0.000 -1.086) 6.514 16.086 ( 1.381 0.000 11.482) 11.565 16.193 ( -2.768 0.000 20.172) 20.361 16.411 ( -1.342 0.000 -1.822) 2.263 16.734 ( -0.468 0.000 -6.559) 6.576 18.777 ( -1.977 0.000 1.590) 2.537 19.236 ( 0.742 0.000 -1.915) 2.053 20.081 ( -0.627 0.000 6.072) 6.104 20.181 ( -3.619 0.000 3.226) 4.848 22.219 ( 6.830 0.000 -29.872) 30.643 22.510 ( -0.425 0.000 -24.481) 24.485 22.534 ( 8.465 0.000 -23.885) 25.340 22.886 ( 0.854 0.000 -17.650) 17.670 24.509 ( 5.859 0.000 8.510) 10.331 24.676 ( 5.056 0.000 8.750) 10.106 25.641 ( -4.381 0.000 13.438) 14.134 25.840 ( -10.948 0.000 14.053) 17.814 26.039 ( -14.063 0.000 -20.484) 24.847 26.596 ( 10.228 0.000 -25.039) 27.047 27.251 ( 3.786 0.000 -17.825) 18.223 27.742 ( 10.806 0.000 -22.826) 25.255 29.226 ( -7.323 0.000 0.574) 7.345 29.377 ( 1.312 0.000 -3.495) 3.734 29.514 ( 6.764 0.000 8.771) 11.076 29.812 ( 2.878 0.000 3.528) 4.553 30.134 ( -7.004 0.000 6.064) 9.264 30.157 ( 3.398 0.000 0.944) 3.527 30.575 ( -6.575 0.000 11.485) 13.234 30.615 ( -3.019 0.000 14.294) 14.609 31.283 ( -24.828 0.000 28.375) 37.704 31.297 ( -2.692 0.000 10.314) 10.659 31.511 ( -4.459 0.000 15.002) 15.650 31.537 ( 0.455 0.000 -3.858) 3.884 32.053 ( -3.259 0.000 10.259) 10.765 32.264 ( 2.540 0.000 -6.183) 6.684 32.370 ( 23.381 0.000 -2.856) 23.555 32.777 ( 4.764 0.000 -12.841) 13.697 ======================= Grid point 95 (45/128) ======================= q-point: (-0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( -29.089 0.000 23.505) 37.399 2.113 ( -35.351 0.000 23.656) 42.536 2.666 ( 4.453 0.000 10.794) 11.676 3.171 ( -27.421 0.000 27.129) 38.573 3.597 ( -10.832 0.000 25.441) 27.651 3.723 ( 6.060 0.000 5.124) 7.936 4.098 ( 10.708 0.000 -4.513) 11.620 4.147 ( -4.607 0.000 28.869) 29.235 4.488 ( 2.561 0.000 20.906) 21.062 4.579 ( -3.532 0.000 7.476) 8.268 4.787 ( 4.922 0.000 4.329) 6.555 4.791 ( 2.062 0.000 10.008) 10.218 4.898 ( -3.363 0.000 14.164) 14.558 5.173 ( -0.739 0.000 14.151) 14.170 5.187 ( 1.124 0.000 -10.096) 10.158 5.286 ( -2.895 0.000 21.800) 21.991 5.496 ( -5.156 0.000 22.087) 22.681 5.570 ( 3.686 0.000 -3.581) 5.139 5.577 ( -15.166 0.000 29.443) 33.120 5.706 ( -15.091 0.000 35.942) 38.982 6.134 ( 7.578 0.000 11.995) 14.189 6.234 ( 0.981 0.000 -7.100) 7.167 6.644 ( 3.148 0.000 3.813) 4.945 6.665 ( 8.386 0.000 2.396) 8.721 6.786 ( -0.561 0.000 1.142) 1.272 7.081 ( -4.351 0.000 -5.224) 6.799 7.315 ( -6.277 0.000 -2.915) 6.921 7.400 ( -4.451 0.000 11.993) 12.793 7.482 ( 6.011 0.000 -1.484) 6.191 7.493 ( -0.658 0.000 -11.356) 11.375 7.813 ( -0.240 0.000 -2.363) 2.375 7.814 ( 0.901 0.000 6.459) 6.521 8.188 ( -4.537 0.000 -0.504) 4.564 8.317 ( -0.150 0.000 -9.175) 9.176 8.364 ( 1.956 0.000 -10.935) 11.108 8.379 ( -7.833 0.000 -14.455) 16.441 8.512 ( 7.622 0.000 -8.100) 11.122 8.525 ( 1.658 0.000 -2.735) 3.199 8.826 ( 1.923 0.000 -9.339) 9.535 9.014 ( -3.074 0.000 -1.668) 3.497 9.093 ( 9.801 0.000 -0.610) 9.820 9.167 ( 5.597 0.000 -5.226) 7.658 9.257 ( 7.084 0.000 -4.628) 8.462 9.362 ( -6.480 0.000 -2.578) 6.974 9.484 ( -7.439 0.000 4.929) 8.924 9.508 ( -13.787 0.000 -6.401) 15.201 9.646 ( -1.332 0.000 -3.092) 3.367 9.883 ( 3.018 0.000 3.123) 4.343 10.018 ( 4.226 0.000 -10.528) 11.345 10.096 ( 5.833 0.000 -8.142) 10.016 10.149 ( 1.853 0.000 -6.463) 6.723 10.369 ( -3.730 0.000 -5.535) 6.674 10.505 ( 3.044 0.000 1.260) 3.295 10.554 ( -6.389 0.000 -9.806) 11.704 10.594 ( 1.253 0.000 -6.600) 6.718 10.687 ( 0.958 0.000 0.204) 0.980 11.002 ( 8.959 0.000 -7.005) 11.372 11.115 ( 5.545 0.000 -9.188) 10.732 11.239 ( 0.175 0.000 2.033) 2.040 11.388 ( 0.648 0.000 -1.133) 1.305 11.485 ( 5.317 0.000 -7.974) 9.584 11.725 ( 3.100 0.000 3.387) 4.591 11.801 ( -12.265 0.000 4.406) 13.033 11.942 ( -3.570 0.000 9.717) 10.352 12.157 ( 0.013 0.000 -3.323) 3.323 12.243 ( -0.973 0.000 8.158) 8.216 12.516 ( -2.743 0.000 6.170) 6.753 12.755 ( 6.344 0.000 -1.307) 6.477 12.778 ( 3.157 0.000 4.951) 5.872 12.832 ( 2.918 0.000 12.094) 12.441 13.288 ( -7.216 0.000 -6.249) 9.545 13.581 ( 1.027 0.000 0.209) 1.048 13.923 ( -1.531 0.000 -7.990) 8.135 14.034 ( -0.999 0.000 6.929) 7.001 14.218 ( -1.267 0.000 2.573) 2.868 14.689 ( -2.905 0.000 12.137) 12.480 14.818 ( 1.405 0.000 -8.919) 9.029 15.163 ( 12.078 0.000 2.986) 12.442 15.346 ( -1.101 0.000 -12.791) 12.839 15.461 ( 7.878 0.000 -9.228) 12.133 15.709 ( -0.268 0.000 6.157) 6.163 15.764 ( -1.999 0.000 -2.087) 2.890 15.772 ( -3.239 0.000 14.413) 14.773 16.143 ( 0.058 0.000 8.973) 8.973 16.183 ( 6.750 0.000 2.014) 7.044 16.370 ( -1.487 0.000 -5.345) 5.548 16.420 ( 18.598 0.000 41.486) 45.464 16.704 ( 0.204 0.000 -6.115) 6.119 18.792 ( 2.145 0.000 7.711) 8.004 19.250 ( 1.590 0.000 -2.873) 3.284 20.058 ( -3.741 0.000 3.380) 5.042 20.160 ( -0.794 0.000 8.135) 8.174 22.229 ( 7.196 0.000 -28.760) 29.647 22.415 ( 2.089 0.000 -27.521) 27.600 22.612 ( 10.234 0.000 -23.029) 25.200 22.830 ( 0.886 0.000 -17.133) 17.156 24.635 ( 2.500 0.000 9.735) 10.050 24.777 ( 0.996 0.000 10.628) 10.675 25.571 ( -9.130 0.000 12.994) 15.881 25.607 ( -20.596 0.000 -16.222) 26.217 25.744 ( -3.461 0.000 11.737) 12.236 26.256 ( -31.482 0.000 -42.452) 52.851 27.401 ( 16.287 0.000 -6.568) 17.561 27.914 ( 14.044 0.000 -21.001) 25.264 29.091 ( -6.769 0.000 0.992) 6.842 29.405 ( 2.964 0.000 -2.712) 4.018 29.671 ( 4.650 0.000 10.373) 11.367 29.909 ( 6.329 0.000 3.423) 7.195 30.029 ( -6.148 0.000 3.092) 6.881 30.235 ( 4.904 0.000 0.102) 4.905 30.485 ( -7.648 0.000 10.151) 12.709 30.624 ( -2.773 0.000 15.779) 16.021 30.958 ( -21.397 0.000 23.729) 31.952 31.294 ( -2.087 0.000 10.144) 10.357 31.365 ( -13.464 0.000 2.987) 13.792 31.519 ( -0.843 0.000 -2.277) 2.428 32.037 ( -2.817 0.000 9.918) 10.310 32.297 ( 3.530 0.000 -6.800) 7.662 32.835 ( 24.901 0.000 -4.257) 25.262 32.926 ( 14.764 0.000 0.712) 14.782 ======================= Grid point 96 (46/128) ======================= q-point: (-0.17 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( -34.050 0.000 28.564) 44.445 1.701 ( -26.523 0.000 31.424) 41.121 2.732 ( -28.492 0.000 49.769) 57.348 2.733 ( 0.146 0.000 8.550) 8.551 3.622 ( -3.784 0.000 25.538) 25.817 3.907 ( 9.526 0.000 8.398) 12.699 4.180 ( -4.312 0.000 28.822) 29.143 4.261 ( 7.432 0.000 -2.356) 7.797 4.506 ( -7.729 0.000 16.024) 17.791 4.515 ( -6.217 0.000 2.852) 6.840 4.865 ( 3.270 0.000 5.168) 6.115 4.896 ( 1.575 0.000 7.723) 7.882 4.957 ( 5.115 0.000 17.262) 18.004 5.163 ( 0.865 0.000 -9.926) 9.963 5.166 ( -4.275 0.000 12.585) 13.291 5.362 ( -9.616 0.000 38.163) 39.356 5.489 ( -0.924 0.000 14.596) 14.625 5.554 ( -4.817 0.000 -2.792) 5.568 5.554 ( 0.333 0.000 29.025) 29.027 5.615 ( -7.213 0.000 28.128) 29.039 6.229 ( 1.709 0.000 -7.534) 7.725 6.326 ( 6.579 0.000 3.510) 7.457 6.613 ( -7.219 0.000 4.470) 8.491 6.638 ( -6.223 0.000 -0.153) 6.225 6.826 ( 1.884 0.000 1.009) 2.138 7.052 ( 2.000 0.000 -2.628) 3.303 7.186 ( -5.476 0.000 -2.459) 6.003 7.331 ( -7.493 0.000 9.495) 12.096 7.483 ( 6.050 0.000 -12.974) 14.315 7.574 ( 4.413 0.000 -4.170) 6.072 7.777 ( -2.006 0.000 -3.977) 4.455 7.777 ( -7.945 0.000 6.906) 10.527 8.034 ( -9.029 0.000 -8.684) 12.527 8.231 ( -2.616 0.000 -13.184) 13.441 8.306 ( -2.764 0.000 -7.201) 7.713 8.391 ( 5.025 0.000 -10.733) 11.851 8.509 ( 1.552 0.000 -1.868) 2.429 8.674 ( 12.313 0.000 -8.783) 15.125 8.780 ( -0.344 0.000 -7.388) 7.396 8.898 ( -5.330 0.000 -2.857) 6.047 9.136 ( -6.258 0.000 -6.350) 8.915 9.168 ( -8.761 0.000 0.324) 8.767 9.308 ( -0.054 0.000 -0.904) 0.906 9.340 ( 1.307 0.000 -3.226) 3.480 9.374 ( 2.673 0.000 2.418) 3.604 9.403 ( 6.306 0.000 -1.273) 6.433 9.614 ( 1.695 0.000 2.633) 3.131 9.954 ( 2.148 0.000 5.552) 5.953 10.137 ( -2.933 0.000 -0.201) 2.940 10.144 ( 0.895 0.000 -5.131) 5.209 10.193 ( 14.274 0.000 -7.178) 15.977 10.287 ( -1.986 0.000 -5.159) 5.528 10.414 ( -0.438 0.000 -11.914) 11.922 10.579 ( 2.607 0.000 2.250) 3.444 10.653 ( 4.448 0.000 -2.532) 5.118 10.700 ( 3.383 0.000 -6.743) 7.544 11.101 ( 5.891 0.000 -12.415) 13.742 11.165 ( 3.786 0.000 -10.449) 11.113 11.277 ( 1.420 0.000 10.269) 10.367 11.380 ( -1.242 0.000 0.419) 1.311 11.510 ( 1.430 0.000 -4.785) 4.994 11.580 ( -13.264 0.000 7.233) 15.108 11.800 ( 3.857 0.000 -2.332) 4.507 11.940 ( -0.231 0.000 7.741) 7.744 12.127 ( -2.396 0.000 1.825) 3.012 12.158 ( -11.979 0.000 10.823) 16.144 12.579 ( 7.448 0.000 3.889) 8.402 12.830 ( 2.084 0.000 4.527) 4.984 12.899 ( -1.783 0.000 5.809) 6.076 12.904 ( 7.713 0.000 3.199) 8.350 13.101 ( -10.259 0.000 -4.065) 11.035 13.559 ( -3.098 0.000 -1.245) 3.339 13.889 ( 1.513 0.000 -7.272) 7.428 14.031 ( -1.980 0.000 5.611) 5.950 14.215 ( 0.189 0.000 -0.229) 0.297 14.700 ( -3.308 0.000 13.673) 14.067 14.804 ( 1.094 0.000 -8.822) 8.890 15.243 ( -2.657 0.000 -15.772) 15.994 15.296 ( 4.038 0.000 -2.530) 4.765 15.580 ( 9.002 0.000 -11.702) 14.764 15.653 ( -1.993 0.000 1.292) 2.375 15.727 ( -2.414 0.000 1.631) 2.914 15.834 ( 0.267 0.000 10.300) 10.303 16.178 ( -0.125 0.000 8.746) 8.747 16.265 ( -1.866 0.000 3.935) 4.355 16.346 ( 4.604 0.000 -9.785) 10.814 16.701 ( 1.614 0.000 -3.180) 3.566 17.047 ( 23.449 0.000 18.398) 29.805 18.951 ( 10.733 0.000 11.203) 15.515 19.262 ( 0.022 0.000 1.863) 1.863 20.031 ( 0.293 0.000 6.071) 6.078 20.201 ( 0.952 0.000 11.055) 11.096 22.243 ( 6.717 0.000 -28.469) 29.250 22.374 ( 5.972 0.000 -28.966) 29.575 22.717 ( 10.632 0.000 -20.489) 23.083 22.786 ( 2.175 0.000 -17.975) 18.106 24.638 ( -6.008 0.000 8.372) 10.305 24.770 ( -6.670 0.000 9.457) 11.573 25.250 ( -14.368 0.000 -13.736) 19.877 25.378 ( -36.001 0.000 -21.258) 41.809 25.487 ( -4.409 0.000 14.268) 14.934 25.796 ( 2.951 0.000 12.055) 12.410 27.632 ( 9.814 0.000 -6.630) 11.843 28.031 ( 8.177 0.000 -22.082) 23.547 29.009 ( -2.685 0.000 2.178) 3.458 29.451 ( 2.459 0.000 -1.595) 2.931 29.736 ( -2.098 0.000 10.040) 10.256 29.884 ( -6.207 0.000 -3.289) 7.025 30.151 ( 15.853 0.000 5.308) 16.718 30.307 ( -0.082 0.000 -0.014) 0.084 30.418 ( -0.896 0.000 8.842) 8.888 30.611 ( -8.524 0.000 17.030) 19.044 30.733 ( -10.185 0.000 19.223) 21.754 31.148 ( -10.158 0.000 4.938) 11.294 31.301 ( -1.679 0.000 9.932) 10.073 31.497 ( -0.836 0.000 -0.286) 0.883 32.033 ( -1.944 0.000 9.793) 9.984 32.326 ( 2.668 0.000 -7.646) 8.098 33.031 ( 7.636 0.000 -15.145) 16.961 33.329 ( 16.294 0.000 0.404) 16.299 ======================= Grid point 97 (47/128) ======================= q-point: ( 0.00 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( 12.052 19.483 36.173) 42.818 1.768 ( -5.941 26.486 27.552) 38.677 2.890 ( -8.211 23.392 42.165) 48.913 2.901 ( -3.898 16.115 15.620) 22.779 3.595 ( -7.074 -0.582 20.189) 21.401 4.044 ( -4.463 -21.368 9.916) 23.976 4.202 ( 0.572 2.779 9.567) 9.979 4.260 ( -6.524 -0.026 8.317) 10.570 4.350 ( -2.264 2.393 4.675) 5.719 4.420 ( 3.154 2.394 5.084) 6.444 4.849 ( 4.829 -8.072 6.298) 11.321 4.927 ( -9.797 -6.210 18.451) 21.794 4.971 ( -5.941 1.199 11.382) 12.895 5.165 ( -4.670 3.487 20.841) 21.641 5.256 ( 2.860 -0.423 15.972) 16.231 5.383 ( -4.533 6.232 17.572) 19.187 5.566 ( -6.301 10.422 9.165) 15.242 5.614 ( -3.295 0.382 25.966) 26.177 5.626 ( -4.555 10.853 11.272) 16.297 5.773 ( 4.507 2.245 8.274) 9.685 6.206 ( -7.878 -6.357 7.506) 12.602 6.229 ( 3.586 0.369 -3.617) 5.107 6.356 ( -0.821 -8.211 -0.949) 8.306 6.599 ( -1.687 -5.028 0.970) 5.392 6.844 ( 7.624 -6.583 3.271) 10.591 7.007 ( 1.119 -8.964 1.985) 9.249 7.095 ( -3.890 1.917 0.599) 4.377 7.324 ( -3.662 5.100 -2.227) 6.662 7.459 ( -13.738 -3.880 2.609) 14.512 7.632 ( 1.910 5.589 -5.738) 8.235 7.716 ( -3.998 -0.118 -2.349) 4.638 7.788 ( 0.599 8.018 0.546) 8.059 7.881 ( 1.438 2.389 -14.391) 14.658 8.144 ( -2.714 2.082 -10.242) 10.798 8.186 ( 0.989 -1.607 -5.334) 5.658 8.511 ( 2.659 5.891 -9.577) 11.553 8.575 ( 6.038 -0.584 -5.535) 8.212 8.747 ( -0.271 0.424 -4.798) 4.825 8.872 ( 5.447 2.200 -7.952) 9.886 8.968 ( 0.150 9.272 -2.191) 9.529 9.083 ( 4.494 0.159 -3.203) 5.521 9.138 ( 1.408 0.895 -0.446) 1.727 9.273 ( -0.729 1.714 -1.515) 2.401 9.334 ( 1.049 -1.294 -1.664) 2.355 9.444 ( -1.431 0.189 -0.479) 1.521 9.529 ( 6.833 0.497 1.440) 7.001 9.676 ( 4.646 -1.155 -1.599) 5.047 9.829 ( -2.997 -13.666 0.779) 14.013 9.994 ( 0.023 0.549 0.924) 1.076 10.142 ( -1.321 -0.381 -3.574) 3.829 10.203 ( 1.919 -0.004 -6.472) 6.750 10.441 ( 3.779 0.799 -5.101) 6.398 10.493 ( 3.659 0.043 -5.264) 6.411 10.549 ( 3.040 1.772 -5.117) 6.210 10.756 ( 4.385 -0.348 -0.871) 4.484 10.796 ( 1.662 4.488 -4.188) 6.360 11.086 ( -2.625 -3.103 -0.420) 4.087 11.172 ( 0.613 -0.108 -6.510) 6.540 11.309 ( -0.631 1.414 0.296) 1.577 11.445 ( 0.470 3.658 -0.489) 3.721 11.476 ( 1.848 0.945 3.871) 4.393 11.519 ( 0.604 0.088 -4.108) 4.153 11.760 ( -0.234 -7.194 -6.158) 9.473 11.905 ( 2.510 -1.996 10.093) 10.590 11.955 ( -12.906 0.928 9.325) 15.949 12.213 ( -0.373 4.681 8.143) 9.400 12.474 ( -5.200 -15.503 7.244) 17.885 12.816 ( -0.654 -4.641 1.958) 5.080 12.940 ( 3.516 5.458 -0.177) 6.495 13.024 ( -4.255 6.324 -2.813) 8.124 13.065 ( 3.379 1.602 4.369) 5.751 13.429 ( -4.947 -3.169 -3.930) 7.068 13.751 ( -2.494 -11.449 7.585) 13.958 14.030 ( 4.245 -3.401 -5.897) 8.023 14.134 ( -1.810 -5.441 -2.427) 6.227 14.518 ( -2.190 -9.129 -0.694) 9.414 14.951 ( -3.026 10.342 -2.171) 10.992 15.201 ( -1.219 4.227 -7.400) 8.609 15.319 ( 0.336 1.544 -3.637) 3.966 15.556 ( 5.098 -8.084 -6.329) 11.462 15.700 ( -2.459 1.917 3.545) 4.721 15.769 ( 2.078 4.111 4.795) 6.649 15.938 ( -0.066 2.757 1.671) 3.225 16.039 ( -2.790 -6.145 8.560) 10.900 16.287 ( -3.243 -1.802 7.374) 8.255 16.365 ( -0.536 3.032 -8.095) 8.661 16.718 ( 1.733 -1.462 0.866) 2.427 16.971 ( -11.528 -7.286 3.959) 14.200 19.042 ( -0.284 -2.504 -6.549) 7.017 19.218 ( -3.124 -6.013 11.070) 12.979 20.066 ( -1.317 -0.834 8.428) 8.570 20.222 ( -0.878 -3.132 9.795) 10.321 22.292 ( 6.166 4.465 -28.570) 29.567 22.436 ( 7.395 3.569 -27.156) 28.370 22.747 ( 2.773 0.177 -17.462) 17.682 22.835 ( 10.038 -0.569 -21.025) 23.306 24.571 ( -10.419 3.641 5.030) 12.129 24.642 ( -10.503 0.494 5.539) 11.884 25.072 ( 21.541 0.641 -3.744) 21.873 25.235 ( 11.619 -2.355 -6.123) 13.343 25.552 ( 0.505 3.015 15.764) 16.058 25.890 ( 2.662 -2.165 14.007) 14.421 27.644 ( -2.902 -0.714 -8.794) 9.288 28.005 ( 2.559 -3.749 -23.004) 23.447 29.106 ( 1.960 8.742 2.250) 9.237 29.480 ( -0.887 1.815 -1.199) 2.349 29.689 ( -4.257 -0.370 5.863) 7.255 29.775 ( -2.449 -0.595 -1.991) 3.212 30.218 ( -3.827 -1.586 4.980) 6.478 30.409 ( 5.689 -5.995 11.369) 14.055 30.517 ( -6.422 3.469 11.513) 13.632 30.604 ( 1.824 3.421 9.591) 10.345 30.726 ( 5.760 0.309 9.668) 11.258 31.048 ( -2.953 -2.769 14.554) 15.107 31.293 ( -2.354 -2.402 13.791) 14.195 31.479 ( 2.275 -0.134 -0.740) 2.396 31.972 ( -2.216 -4.093 13.376) 14.162 32.218 ( 0.295 -9.333 -5.251) 10.713 33.137 ( -2.474 10.930 -17.571) 20.841 33.453 ( -9.190 8.318 -18.125) 21.958 ======================= Grid point 98 (48/128) ======================= q-point: ( 0.17 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( 8.012 23.330 26.898) 36.496 2.311 ( 35.278 13.437 29.668) 48.013 2.907 ( -1.405 11.256 6.146) 12.902 3.036 ( 5.138 23.137 44.912) 50.782 3.514 ( -11.453 2.588 23.408) 26.188 3.880 ( -12.888 -17.265 2.149) 21.652 4.171 ( -5.975 -0.581 15.295) 16.431 4.260 ( -8.970 3.607 2.310) 9.940 4.291 ( 3.343 -2.601 2.085) 4.721 4.518 ( 3.776 8.584 8.677) 12.776 4.789 ( -12.061 -4.979 13.280) 18.617 4.829 ( -14.864 3.579 22.346) 27.076 4.969 ( 3.279 -11.755 3.360) 12.658 5.079 ( -7.553 3.826 15.678) 17.818 5.338 ( -9.110 6.628 6.165) 12.842 5.413 ( 3.240 5.714 12.182) 13.840 5.454 ( -4.133 3.286 19.091) 19.808 5.673 ( -0.031 5.294 15.156) 16.054 5.723 ( 5.349 5.967 20.745) 22.239 5.822 ( -5.484 -1.449 20.027) 20.815 6.156 ( -0.752 -2.955 9.738) 10.205 6.282 ( 3.107 1.971 -0.426) 3.704 6.323 ( -1.428 -4.123 -2.247) 4.908 6.628 ( 3.887 -3.498 -5.281) 7.432 6.926 ( -6.807 -9.701 8.157) 14.387 6.999 ( -9.616 -9.270 -2.210) 13.538 7.115 ( 4.835 -2.378 5.570) 7.750 7.227 ( 3.061 -3.451 6.253) 7.770 7.307 ( -1.692 7.262 -3.108) 8.078 7.569 ( -2.028 1.178 -5.823) 6.278 7.671 ( -0.027 -3.269 -1.583) 3.632 7.826 ( 3.356 7.378 -0.410) 8.116 7.902 ( 3.368 5.401 -6.683) 9.229 8.153 ( 7.025 2.695 -11.704) 13.914 8.218 ( 5.136 -0.426 -5.473) 7.518 8.518 ( 2.156 4.982 -9.737) 11.148 8.593 ( 0.344 -1.681 -5.817) 6.065 8.738 ( -0.424 3.214 -4.918) 5.891 8.860 ( -1.979 5.617 -3.404) 6.859 9.000 ( 1.991 2.320 -3.830) 4.900 9.149 ( 4.425 -0.334 -3.935) 5.931 9.168 ( -1.544 -3.927 -4.925) 6.485 9.281 ( 1.575 2.034 -6.169) 6.683 9.374 ( 1.529 0.498 -2.220) 2.741 9.431 ( 7.533 -2.351 0.902) 7.943 9.645 ( 4.113 1.554 2.501) 5.058 9.698 ( -3.117 -4.097 -0.180) 5.151 9.820 ( 4.030 -8.211 -2.886) 9.591 10.000 ( 0.478 1.371 0.444) 1.519 10.060 ( -2.955 -0.069 -11.615) 11.986 10.247 ( 5.090 -0.383 -4.351) 6.707 10.437 ( -1.477 -3.135 -5.003) 6.086 10.499 ( 0.177 -2.881 -7.612) 8.140 10.596 ( 1.833 4.005 -3.654) 5.723 10.771 ( -0.240 5.695 -8.300) 10.069 10.852 ( 5.477 -0.798 -0.927) 5.612 11.017 ( -5.751 0.532 7.850) 9.746 11.109 ( -3.883 1.748 -8.756) 9.736 11.343 ( 1.589 1.210 3.585) 4.103 11.380 ( -3.033 5.443 -6.646) 9.110 11.493 ( -1.728 -2.641 -1.993) 3.733 11.594 ( 2.159 -0.689 1.940) 2.984 11.728 ( 1.705 -4.267 7.067) 8.429 11.800 ( -3.505 -3.211 -1.561) 5.003 12.023 ( 2.234 -3.981 7.664) 8.920 12.228 ( 0.321 1.884 5.726) 6.036 12.392 ( -4.550 -10.330 5.863) 12.720 12.743 ( -8.643 2.558 4.292) 9.983 12.850 ( -4.115 1.527 -3.240) 5.456 13.047 ( -3.913 -0.203 3.882) 5.516 13.193 ( 9.513 2.120 3.487) 10.351 13.368 ( 1.590 -2.805 -5.879) 6.705 13.749 ( -2.011 -12.962 11.496) 17.442 14.075 ( -0.514 -9.000 -4.979) 10.299 14.105 ( 3.938 -1.232 -5.063) 6.531 14.486 ( -0.951 -7.864 0.513) 7.938 14.879 ( -4.101 8.201 0.407) 9.178 15.153 ( -1.557 2.731 -3.236) 4.512 15.294 ( -0.458 7.400 -4.263) 8.552 15.577 ( -1.358 -5.075 -3.307) 6.208 15.676 ( -1.367 -0.428 5.758) 5.934 15.839 ( -0.515 1.238 7.294) 7.416 15.932 ( 0.272 -0.665 0.051) 0.720 16.014 ( -3.214 -2.783 9.172) 10.109 16.225 ( -6.581 -3.192 7.189) 10.256 16.284 ( -5.074 6.944 -2.892) 9.073 16.718 ( -11.103 7.680 4.659) 14.282 16.746 ( -0.772 -1.299 -0.511) 1.595 18.942 ( -6.332 -1.638 -4.283) 7.818 19.188 ( -3.177 -7.885 5.062) 9.893 20.052 ( -2.591 -0.310 7.859) 8.281 20.225 ( -2.124 -2.874 7.015) 7.873 22.281 ( 5.692 4.618 -29.510) 30.407 22.465 ( 7.316 2.548 -25.345) 26.502 22.715 ( 1.483 1.185 -18.786) 18.881 22.910 ( 6.666 -1.066 -19.428) 20.568 24.431 ( -6.174 1.806 6.259) 8.975 24.527 ( -3.345 -0.341 3.568) 4.902 25.534 ( 26.861 -0.107 -7.392) 27.859 25.617 ( 1.121 2.036 14.888) 15.068 25.794 ( 45.003 -4.336 -15.220) 47.705 25.962 ( -1.711 -2.324 15.395) 15.663 27.459 ( -12.069 -0.485 -10.459) 15.977 27.899 ( -3.639 -6.249 -24.528) 25.572 29.186 ( 5.273 7.505 3.504) 9.819 29.435 ( -2.422 1.076 -2.751) 3.820 29.621 ( -5.746 2.263 3.866) 7.286 29.754 ( 0.426 0.733 0.148) 0.860 30.147 ( -4.537 0.349 4.434) 6.353 30.374 ( -7.175 2.714 10.708) 13.172 30.575 ( 0.275 -2.845 10.565) 10.945 30.628 ( -2.564 -0.159 14.114) 14.346 31.009 ( 15.900 -10.773 2.590) 19.380 31.109 ( 2.232 -3.657 22.294) 22.702 31.324 ( -0.013 -1.729 14.297) 14.401 31.552 ( 6.609 3.886 -0.992) 7.730 31.969 ( -5.151 -3.645 15.197) 16.455 32.192 ( -0.436 -8.553 -5.280) 10.061 32.857 ( -20.879 18.963 -10.101) 29.960 33.165 ( -9.778 6.574 -19.724) 22.975 ======================= Grid point 99 (49/128) ======================= q-point: ( 0.33 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.211 ( 15.524 17.567 23.150) 32.947 2.819 ( -7.731 10.046 12.877) 18.069 2.956 ( 11.809 16.333 31.273) 37.205 3.233 ( -12.532 9.394 18.513) 24.249 3.538 ( 16.395 8.215 19.616) 26.853 3.731 ( -2.016 -12.208 1.833) 12.508 4.073 ( -9.533 6.076 1.587) 11.415 4.151 ( -2.796 -2.699 15.970) 16.436 4.326 ( -3.171 -5.469 -1.022) 6.403 4.550 ( -4.892 -1.443 7.660) 9.202 4.624 ( -11.347 3.685 24.442) 27.199 4.720 ( -2.778 8.602 17.735) 19.906 5.000 ( -0.822 -4.337 7.365) 8.587 5.072 ( 0.043 -2.495 7.267) 7.683 5.194 ( -8.850 0.988 10.077) 13.448 5.459 ( 2.141 10.149 -5.449) 11.716 5.482 ( -5.266 2.082 28.777) 29.329 5.718 ( -4.288 6.339 11.921) 14.166 5.769 ( -8.157 -0.122 33.745) 34.717 5.931 ( 5.651 -0.117 18.403) 19.251 6.189 ( -3.229 -1.604 8.431) 9.170 6.276 ( -7.060 -0.315 7.454) 10.271 6.363 ( 4.516 1.613 -0.045) 4.795 6.508 ( -20.155 -5.132 4.046) 21.188 6.639 ( 0.268 0.255 -3.228) 3.249 7.071 ( 6.737 -6.280 6.072) 11.031 7.228 ( 1.525 -6.154 -0.141) 6.342 7.277 ( 0.359 -5.277 3.238) 6.201 7.364 ( 7.361 2.545 -1.582) 7.948 7.572 ( 2.229 0.015 -0.328) 2.253 7.712 ( 4.562 -3.683 0.879) 5.928 7.917 ( 1.625 4.549 -4.588) 6.663 7.930 ( 8.295 4.628 -1.234) 9.579 8.253 ( 8.059 -3.349 -10.908) 13.969 8.327 ( 7.877 4.228 -3.888) 9.749 8.510 ( 0.355 2.133 -8.202) 8.482 8.564 ( -1.287 0.951 -5.383) 5.616 8.700 ( 0.326 3.359 -5.183) 6.185 8.813 ( -1.391 1.847 -4.784) 5.314 8.955 ( -4.295 2.701 -4.278) 6.637 9.038 ( -7.070 0.116 -6.883) 9.867 9.201 ( 3.618 -1.069 -7.851) 8.711 9.285 ( -0.272 -1.742 -6.021) 6.274 9.404 ( 4.559 0.313 -2.390) 5.157 9.556 ( -4.002 1.571 3.784) 5.727 9.664 ( 0.658 0.564 4.539) 4.621 9.707 ( 6.625 -5.085 -2.013) 8.591 9.904 ( 4.861 -6.003 -7.199) 10.559 9.966 ( -0.960 2.377 -12.524) 12.783 10.022 ( 2.503 1.684 -5.913) 6.639 10.336 ( 6.093 -1.156 -6.894) 9.273 10.368 ( -3.488 -5.163 -6.194) 8.786 10.461 ( 0.094 -7.175 -8.852) 11.395 10.537 ( -5.799 2.009 -3.046) 6.852 10.733 ( -1.716 6.293 -3.735) 7.517 10.921 ( -4.747 3.185 6.684) 8.795 10.956 ( 1.689 0.296 -1.502) 2.279 11.010 ( 0.028 1.697 -10.382) 10.520 11.289 ( -3.904 4.449 -7.984) 9.939 11.333 ( -1.754 2.309 3.729) 4.724 11.452 ( -0.959 -1.098 -1.131) 1.845 11.656 ( 3.373 -5.180 -2.368) 6.619 11.762 ( 0.048 -2.141 6.632) 6.969 11.875 ( 7.742 -4.292 7.109) 11.353 12.017 ( -1.872 -8.883 0.066) 9.079 12.309 ( -7.416 -3.497 6.867) 10.695 12.354 ( 8.439 2.124 4.765) 9.921 12.644 ( -1.713 4.056 -3.278) 5.489 12.778 ( -3.793 -3.115 2.873) 5.687 12.922 ( -10.139 -1.714 8.099) 13.090 13.370 ( 7.100 1.865 1.788) 7.556 13.411 ( 4.948 -2.321 -5.812) 7.978 13.766 ( -2.169 -13.519 15.403) 20.609 14.023 ( -2.188 -6.003 -4.200) 7.647 14.174 ( 4.753 -4.230 -6.764) 9.287 14.499 ( 1.597 -10.649 2.769) 11.118 14.819 ( -3.568 9.103 8.119) 12.709 15.115 ( -1.507 3.602 -3.069) 4.966 15.294 ( 2.884 9.419 -4.409) 10.793 15.511 ( -3.534 -2.083 -2.524) 4.817 15.674 ( -3.605 2.351 13.449) 14.121 15.799 ( -3.641 -1.911 7.145) 8.243 15.942 ( -1.547 -2.815 0.781) 3.305 16.004 ( -0.673 -0.181 2.321) 2.424 16.162 ( -3.494 -0.087 11.298) 11.826 16.202 ( -2.387 11.039 0.229) 11.296 16.585 ( -5.209 9.281 2.014) 10.832 16.737 ( -0.410 -2.670 -3.757) 4.627 18.822 ( -5.330 -1.628 -0.027) 5.573 19.160 ( -1.192 -7.852 1.869) 8.159 20.055 ( -0.462 -0.297 6.410) 6.433 20.203 ( -2.776 -2.631 3.993) 5.529 22.267 ( 5.867 4.398 -29.318) 30.221 22.498 ( 7.385 1.414 -24.619) 25.742 22.643 ( -0.547 2.213 -20.849) 20.974 22.916 ( 2.660 -1.358 -18.707) 18.944 24.416 ( 1.679 1.465 6.703) 7.064 24.552 ( 3.526 -0.727 5.588) 6.648 25.661 ( -2.355 2.069 15.044) 15.367 25.937 ( -6.126 -2.212 13.878) 15.330 26.012 ( 24.373 1.844 -10.967) 26.790 26.398 ( 24.566 -3.454 -24.918) 35.161 27.215 ( -5.454 -2.902 -10.888) 12.519 27.695 ( -6.567 -10.110 -24.409) 27.223 29.308 ( 5.050 5.161 3.567) 8.054 29.397 ( 0.379 1.044 -1.607) 1.954 29.511 ( -6.946 4.003 1.320) 8.125 29.779 ( 1.572 1.439 2.347) 3.170 30.102 ( -2.912 -0.590 4.796) 5.642 30.309 ( -3.394 6.030 6.655) 9.601 30.580 ( -3.836 -3.477 12.121) 13.181 30.634 ( -3.492 0.845 14.144) 14.594 31.111 ( -3.350 -11.800 17.100) 21.044 31.335 ( 7.278 -12.071 2.778) 14.366 31.421 ( 4.071 0.792 22.661) 23.037 31.677 ( -0.312 4.827 8.888) 10.120 31.898 ( -5.018 -1.124 9.679) 10.961 32.168 ( -0.528 -7.571 -3.786) 8.482 32.524 ( -5.835 21.265 -8.648) 23.686 32.944 ( -5.197 5.699 -19.919) 21.359 ======================= Grid point 100 (50/128) ======================= q-point: (-0.50 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( -6.669 8.119 20.373) 22.923 2.643 ( -6.676 13.831 15.319) 21.692 2.823 ( -22.798 16.433 17.063) 32.878 3.344 ( 5.318 17.051 27.532) 32.818 3.675 ( -2.806 -0.821 2.716) 3.990 3.835 ( 5.650 -4.525 5.240) 8.937 4.055 ( -6.325 3.420 -1.984) 7.459 4.117 ( -8.108 -3.604 23.497) 25.117 4.231 ( 3.488 -6.673 3.400) 8.261 4.520 ( -0.675 -1.023 13.084) 13.141 4.642 ( -0.665 -4.275 13.610) 14.281 4.749 ( -0.951 10.009 11.796) 15.500 5.032 ( -0.533 5.190 10.685) 11.891 5.098 ( -1.419 -4.137 8.200) 9.294 5.133 ( -1.456 -1.921 13.032) 13.253 5.438 ( -9.393 -1.939 25.128) 26.896 5.511 ( 3.422 13.329 -0.901) 13.790 5.645 ( -12.564 3.114 29.917) 32.597 5.783 ( -3.035 8.255 16.260) 18.486 5.868 ( -18.227 -0.009 25.018) 30.954 6.056 ( -7.900 -2.864 6.184) 10.434 6.166 ( -0.088 -3.000 8.423) 8.942 6.485 ( 5.176 -1.932 1.465) 5.716 6.522 ( 8.242 0.570 4.940) 9.626 6.657 ( 3.914 -2.521 -3.829) 6.028 7.136 ( -4.277 -6.511 1.243) 7.889 7.217 ( 1.560 -6.432 0.350) 6.628 7.334 ( 2.531 -5.069 2.270) 6.104 7.471 ( 5.046 1.337 3.215) 6.131 7.629 ( 3.639 5.209 1.389) 6.504 7.777 ( 0.225 -0.261 1.187) 1.236 7.894 ( -0.763 7.464 -1.858) 7.730 8.141 ( 11.924 -0.876 -2.979) 12.322 8.298 ( 1.023 -5.675 -10.509) 11.987 8.388 ( -1.241 -1.143 -6.752) 6.960 8.461 ( -2.374 -0.422 -3.394) 4.163 8.538 ( 3.156 6.708 -8.278) 11.112 8.671 ( -5.240 3.493 -9.828) 11.673 8.816 ( 5.579 2.166 -2.523) 6.495 8.866 ( 2.839 -0.604 -5.252) 6.001 9.004 ( 4.170 2.461 -3.036) 5.716 9.203 ( -1.077 -2.686 -7.109) 7.675 9.236 ( -0.042 1.227 -7.699) 7.796 9.398 ( -3.165 -3.260 -4.085) 6.110 9.542 ( -1.017 0.544 3.817) 3.987 9.650 ( 0.568 5.516 1.966) 5.883 9.804 ( -1.110 -4.310 4.413) 6.268 9.858 ( -3.818 1.305 -9.302) 10.139 9.956 ( 0.542 -1.958 -10.610) 10.803 10.003 ( 0.939 -0.929 -12.621) 12.690 10.251 ( -2.748 -1.747 -13.721) 14.103 10.356 ( -1.331 -0.799 3.459) 3.792 10.426 ( -0.459 -2.951 -2.771) 4.074 10.567 ( 10.001 -5.172 -8.003) 13.814 10.618 ( -6.654 -1.615 -8.235) 10.710 10.886 ( -3.517 1.587 1.938) 4.318 10.940 ( 0.290 10.078 -1.530) 10.198 11.044 ( 5.048 -1.586 -4.933) 7.234 11.205 ( -1.277 0.587 -5.307) 5.490 11.364 ( 4.698 1.490 -4.664) 6.785 11.479 ( 3.594 1.808 2.003) 4.495 11.636 ( -1.908 -4.050 -1.880) 4.856 11.846 ( 2.439 -3.725 4.093) 6.048 11.967 ( -5.490 -6.167 4.402) 9.357 12.024 ( 4.495 -5.414 7.646) 10.391 12.221 ( -1.626 -0.929 3.231) 3.735 12.509 ( 2.300 -1.556 4.392) 5.197 12.621 ( 2.278 1.898 -1.927) 3.537 12.742 ( -3.418 -4.174 4.067) 6.756 12.822 ( -1.343 1.602 8.149) 8.413 13.411 ( -0.230 1.727 -5.410) 5.684 13.505 ( 4.374 -1.668 0.764) 4.743 13.792 ( -2.071 -13.772 16.505) 21.596 13.969 ( -1.164 -3.770 -6.462) 7.571 14.210 ( 1.375 -3.302 -3.445) 4.966 14.533 ( -0.023 -14.393 3.630) 14.844 14.863 ( 4.426 9.532 11.175) 15.340 15.079 ( 0.618 5.988 -6.880) 9.142 15.357 ( 5.116 5.162 -4.542) 8.570 15.442 ( -2.258 -1.859 -6.126) 6.789 15.683 ( -0.781 6.059 16.715) 17.797 15.793 ( -1.460 -1.624 8.523) 8.798 15.889 ( -3.389 -1.611 -0.386) 3.773 16.002 ( -0.360 3.184 1.209) 3.425 16.133 ( -3.228 -1.953 11.495) 12.099 16.261 ( 5.454 9.691 9.342) 14.524 16.515 ( -3.282 6.776 -0.248) 7.533 16.707 ( -0.507 -2.548 -5.555) 6.132 18.762 ( -1.965 -1.064 4.109) 4.678 19.163 ( 1.049 -6.946 0.119) 7.026 20.073 ( -0.629 -0.657 5.560) 5.634 20.159 ( -3.264 -2.115 3.149) 5.004 22.262 ( 6.386 4.127 -28.626) 29.619 22.523 ( 2.661 -0.101 -23.022) 23.175 22.559 ( 5.268 3.670 -24.783) 25.601 22.872 ( 0.992 -1.475 -18.214) 18.301 24.525 ( 5.985 1.591 8.346) 10.393 24.669 ( 5.254 -0.683 8.556) 10.064 25.653 ( -4.839 1.290 13.166) 14.086 25.828 ( -10.402 -1.242 13.847) 17.363 26.061 ( -14.294 2.344 -20.432) 25.045 26.564 ( 5.408 -3.891 -27.069) 27.877 27.186 ( 4.464 -4.802 -12.533) 14.144 27.627 ( 12.322 -10.187 -18.547) 24.487 29.297 ( -5.495 5.150 0.115) 7.532 29.411 ( -0.984 4.083 -3.348) 5.371 29.512 ( 6.791 -0.121 7.643) 10.225 29.828 ( 2.576 1.344 3.594) 4.622 30.056 ( -4.437 -2.446 4.398) 6.709 30.315 ( 1.634 9.168 3.492) 9.946 30.536 ( -6.485 -3.321 12.392) 14.375 30.623 ( -3.672 0.906 14.967) 15.438 31.079 ( -8.845 -8.921 20.326) 23.895 31.369 ( -2.160 -8.373 0.787) 8.683 31.506 ( -15.380 3.187 14.928) 21.669 31.564 ( -1.494 1.790 15.325) 15.501 31.927 ( -0.322 -3.034 6.154) 6.869 32.152 ( 1.497 -8.521 -3.268) 9.249 32.624 ( 17.727 16.499 -7.837) 25.454 32.879 ( 7.067 7.818 -15.120) 18.431 ======================= Grid point 101 (51/128) ======================= q-point: (-0.33 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( -23.543 13.005 22.517) 35.077 2.248 ( -35.650 11.935 18.428) 41.869 2.871 ( 3.725 18.100 10.665) 21.336 3.343 ( -16.820 15.022 21.155) 30.921 3.634 ( -11.712 2.731 12.726) 17.510 3.821 ( 3.277 8.793 18.155) 20.437 4.065 ( 8.638 -4.338 3.581) 10.308 4.124 ( -2.560 -2.981 15.643) 16.129 4.306 ( 1.427 -17.001 4.220) 17.574 4.570 ( -7.192 0.341 10.169) 12.460 4.646 ( 3.818 -6.156 12.474) 14.425 4.823 ( 2.783 8.575 9.854) 13.356 5.028 ( -2.516 3.517 5.961) 7.364 5.096 ( -5.832 -4.545 20.783) 22.059 5.218 ( 3.014 -1.704 17.600) 17.938 5.378 ( -6.142 2.188 17.645) 18.811 5.523 ( -8.346 4.157 27.477) 29.016 5.567 ( -1.135 9.638 2.994) 10.156 5.724 ( -11.890 2.717 33.326) 35.488 5.791 ( -1.495 13.813 1.094) 13.937 6.062 ( 5.643 -5.623 5.473) 9.665 6.208 ( 1.884 -1.735 3.853) 4.626 6.503 ( -4.154 -14.967 3.851) 16.003 6.644 ( 3.144 -4.103 3.310) 6.138 6.750 ( 3.603 0.019 -0.937) 3.723 7.045 ( -4.005 -3.374 -1.191) 5.370 7.221 ( 0.415 -3.892 -2.033) 4.410 7.374 ( 1.225 -0.301 5.124) 5.277 7.609 ( 5.810 1.506 5.540) 8.168 7.624 ( -5.624 8.246 -3.629) 10.621 7.743 ( -1.831 2.431 1.576) 3.428 7.890 ( 0.294 2.939 -2.492) 3.865 8.147 ( -6.102 -5.515 -8.652) 11.937 8.306 ( -2.514 -1.453 -5.016) 5.796 8.342 ( 4.885 2.575 -7.738) 9.507 8.399 ( -3.504 -0.888 -8.206) 8.966 8.497 ( 2.236 5.340 -11.277) 12.676 8.656 ( 6.136 4.504 -7.244) 10.507 8.849 ( 0.239 2.216 -7.613) 7.933 8.986 ( 3.271 -2.190 -0.693) 3.997 9.096 ( 4.594 0.613 -0.523) 4.664 9.173 ( 6.808 0.657 -4.473) 8.173 9.246 ( 3.241 -0.866 -3.114) 4.577 9.354 ( -0.707 -1.958 -6.803) 7.115 9.438 ( -9.606 0.445 -1.506) 9.733 9.610 ( -9.689 5.958 1.704) 11.501 9.644 ( -8.657 -3.339 -8.317) 12.461 9.863 ( 2.036 -7.960 -5.054) 9.646 9.892 ( 5.439 3.363 1.861) 6.660 10.057 ( 4.903 -1.956 -5.212) 7.418 10.189 ( -0.320 1.149 -8.374) 8.458 10.388 ( 2.592 -5.028 1.557) 5.867 10.412 ( 0.489 2.282 -8.891) 9.192 10.513 ( 1.419 -3.770 -8.653) 9.545 10.705 ( 5.391 -0.609 -3.843) 6.649 10.751 ( -6.527 5.895 -0.169) 8.797 11.025 ( 5.628 2.478 -0.691) 6.188 11.117 ( 5.498 0.139 -8.647) 10.248 11.195 ( 1.603 -0.845 -0.966) 2.053 11.422 ( 3.327 1.679 -5.087) 6.306 11.545 ( 1.536 3.245 -6.617) 7.528 11.626 ( 1.301 -7.248 6.155) 9.598 11.777 ( -8.923 -2.596 1.376) 9.394 11.914 ( -3.295 -3.369 7.895) 9.195 12.113 ( 3.066 -0.999 3.910) 5.068 12.237 ( -1.504 -3.950 8.027) 9.072 12.465 ( -5.663 -3.121 7.435) 9.853 12.723 ( 7.089 -1.438 -0.305) 7.240 12.733 ( 2.203 -3.137 2.182) 4.411 12.893 ( 3.212 2.832 5.122) 6.676 13.339 ( -5.387 4.637 -3.738) 8.031 13.553 ( 0.630 -2.323 0.094) 2.409 13.807 ( -2.895 -11.763 10.475) 16.015 13.948 ( 1.925 -4.221 -5.489) 7.187 14.201 ( -1.201 -2.115 -0.644) 2.516 14.545 ( 0.356 -10.508 2.748) 10.867 14.964 ( 1.671 10.291 1.589) 10.546 15.146 ( 9.024 -1.827 -3.096) 9.714 15.346 ( -2.381 -0.485 -11.085) 11.348 15.443 ( 4.612 -1.234 -7.545) 8.928 15.759 ( -0.754 3.547 6.825) 7.728 15.789 ( -1.190 2.655 7.120) 7.692 15.848 ( -0.572 4.006 5.791) 7.065 16.013 ( -0.610 -2.333 8.930) 9.250 16.172 ( 3.315 -2.739 7.929) 9.020 16.429 ( 0.675 3.659 3.760) 5.290 16.519 ( 11.592 5.750 13.096) 18.410 16.685 ( 0.540 -1.600 -4.098) 4.432 18.794 ( 2.909 0.566 9.499) 9.951 19.193 ( 2.080 -5.559 -1.166) 6.048 20.053 ( -3.269 -0.360 3.529) 4.824 20.141 ( -0.712 -1.762 7.708) 7.939 22.270 ( 6.857 3.934 -27.632) 28.741 22.449 ( 2.524 2.903 -26.339) 26.619 22.618 ( 9.757 0.699 -23.242) 25.217 22.818 ( 1.356 -1.228 -18.024) 18.117 24.653 ( 2.801 1.775 9.555) 10.114 24.775 ( 1.349 -0.255 10.409) 10.499 25.565 ( -12.328 -0.037 3.918) 12.936 25.629 ( -18.091 1.845 -6.838) 19.428 25.737 ( -3.733 -0.713 11.198) 11.825 26.139 ( -33.247 -10.834 -35.944) 50.147 27.387 ( 17.070 -0.180 -5.807) 18.031 27.841 ( 15.561 -6.492 -18.788) 25.244 29.181 ( -6.040 8.196 0.190) 10.183 29.421 ( 2.634 1.750 -2.271) 3.893 29.655 ( 4.347 -1.562 8.927) 10.051 29.903 ( 3.281 -1.507 1.569) 3.937 29.988 ( -3.247 -0.876 4.634) 5.726 30.377 ( 2.469 6.340 4.723) 8.283 30.458 ( -5.883 1.312 9.027) 10.855 30.624 ( -3.271 0.233 16.328) 16.654 30.933 ( -15.693 -1.722 20.735) 26.061 31.287 ( -7.721 -5.357 1.998) 9.608 31.335 ( -8.828 0.421 11.822) 14.761 31.515 ( -4.691 -0.758 1.766) 5.070 31.937 ( -1.778 -5.134 11.647) 12.852 32.186 ( 3.079 -9.003 -3.916) 10.289 32.969 ( 18.658 9.926 -15.079) 25.962 33.082 ( 20.995 12.170 -2.883) 24.438 ======================= Grid point 102 (52/128) ======================= q-point: (-0.17 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( -29.024 16.976 26.984) 43.113 1.911 ( -19.450 20.196 25.698) 38.034 2.904 ( -2.511 15.636 8.226) 17.845 3.031 ( -24.094 26.402 41.252) 54.583 3.604 ( -2.253 -0.059 16.731) 16.883 3.981 ( 4.763 -3.889 11.959) 13.447 4.131 ( -1.627 -2.534 21.963) 22.169 4.264 ( 7.644 -1.323 -1.395) 7.882 4.340 ( 1.231 -10.522 6.142) 12.246 4.441 ( -8.710 -4.266 4.109) 10.533 4.758 ( 0.367 -1.549 17.474) 17.546 4.921 ( 4.251 0.582 6.592) 7.866 5.042 ( -7.086 -7.363 14.609) 17.829 5.047 ( 1.258 4.553 12.989) 13.821 5.276 ( -7.937 1.261 26.674) 27.859 5.399 ( -1.019 1.171 14.853) 14.934 5.519 ( -2.090 5.487 15.654) 16.719 5.572 ( -0.726 6.373 19.167) 20.212 5.669 ( -4.842 6.160 22.044) 23.395 5.755 ( -4.068 14.831 -0.923) 15.407 6.173 ( 4.696 -3.823 -3.729) 7.112 6.273 ( 1.572 -4.971 4.703) 7.021 6.402 ( -7.223 -13.569 4.264) 15.952 6.652 ( -3.467 -5.338 4.013) 7.524 6.759 ( 0.272 -6.304 1.765) 6.552 6.990 ( -1.039 -5.578 -1.671) 5.915 7.226 ( -2.652 7.516 -4.865) 9.337 7.368 ( -5.259 1.435 8.555) 10.144 7.551 ( 6.010 7.224 -10.824) 14.334 7.629 ( -5.522 -6.869 2.315) 9.112 7.754 ( 2.012 8.341 -0.247) 8.584 7.837 ( -5.953 2.436 -1.140) 6.532 7.993 ( -5.506 -4.159 -11.902) 13.757 8.223 ( -2.838 -1.587 -4.974) 5.943 8.292 ( -5.333 1.336 -10.897) 12.205 8.430 ( 8.537 1.890 -4.650) 9.903 8.521 ( 2.524 4.868 -11.548) 12.784 8.752 ( 8.259 1.862 -8.781) 12.198 8.801 ( -1.354 1.276 -6.446) 6.709 8.972 ( 1.027 7.251 -2.902) 7.877 9.109 ( -6.874 -1.459 -4.656) 8.430 9.205 ( -5.734 2.034 -3.534) 7.036 9.268 ( 2.944 -2.594 -1.736) 4.291 9.351 ( -0.905 4.941 -0.556) 5.054 9.365 ( 8.018 -3.001 0.525) 8.577 9.472 ( -2.923 4.507 2.019) 5.739 9.591 ( 3.615 -2.189 -0.254) 4.234 9.878 ( -1.205 -11.845 -0.570) 11.919 9.983 ( 1.769 -0.682 0.149) 1.901 10.139 ( 5.856 -0.104 -4.954) 7.671 10.161 ( 1.537 -0.693 -3.653) 4.023 10.421 ( 1.460 -0.108 -8.586) 8.710 10.429 ( 4.500 1.402 -4.708) 6.662 10.523 ( 1.888 1.720 -3.552) 4.376 10.691 ( 2.024 1.670 -0.969) 2.797 10.773 ( 2.101 3.042 -1.099) 3.857 11.093 ( 3.614 -1.845 -8.522) 9.439 11.160 ( 2.912 -1.992 -5.675) 6.682 11.266 ( 4.707 2.001 3.092) 5.977 11.436 ( -0.048 2.214 -5.583) 6.006 11.505 ( -2.898 -2.871 2.159) 4.615 11.580 ( -6.848 3.761 0.996) 7.877 11.740 ( 3.685 -5.231 -1.751) 6.634 11.874 ( -3.263 -4.496 6.125) 8.269 12.131 ( -6.498 2.633 9.013) 11.419 12.206 ( -3.912 0.536 8.540) 9.409 12.455 ( 1.533 -10.341 8.365) 13.389 12.795 ( 2.919 -4.085 -0.657) 5.064 12.853 ( 5.367 -0.460 1.804) 5.681 12.949 ( 3.300 2.655 1.881) 4.635 13.200 ( -8.678 7.308 -1.050) 11.393 13.524 ( -3.389 -2.496 -2.008) 4.664 13.778 ( -3.194 -10.165 5.632) 12.052 13.983 ( 3.395 -4.508 -4.115) 6.985 14.171 ( -1.538 -3.315 -1.218) 3.852 14.552 ( -0.893 -9.607 0.386) 9.656 14.984 ( 0.239 11.778 -0.163) 11.782 15.253 ( 0.596 0.614 -12.080) 12.110 15.287 ( 3.527 -1.260 -2.003) 4.248 15.490 ( 5.026 -6.483 -10.165) 13.062 15.722 ( -2.780 5.285 3.793) 7.075 15.770 ( -2.425 2.890 3.187) 4.938 15.909 ( 1.768 5.267 5.817) 8.044 16.037 ( -0.992 -7.134 8.935) 11.476 16.269 ( 2.476 -2.896 6.513) 7.546 16.395 ( -0.365 4.505 -7.223) 8.521 16.685 ( 1.467 -1.489 -0.539) 2.159 16.912 ( 15.158 -10.298 12.765) 22.333 18.947 ( 8.210 -0.095 9.915) 12.873 19.217 ( 0.100 -4.310 2.454) 4.961 20.033 ( -0.127 0.254 6.049) 6.055 20.178 ( 0.381 -2.161 10.580) 10.805 22.285 ( 6.760 3.992 -27.235) 28.344 22.420 ( 6.225 3.818 -28.127) 29.059 22.714 ( 10.051 -0.323 -20.430) 22.771 22.782 ( 3.156 -0.416 -19.211) 19.473 24.673 ( -3.976 2.984 7.875) 9.313 24.776 ( -5.990 0.513 9.330) 11.099 25.232 ( -14.922 -1.715 -12.746) 19.700 25.329 ( -31.242 -4.261 -16.679) 35.671 25.515 ( -4.061 2.603 13.515) 14.350 25.782 ( 2.522 -1.535 11.964) 12.323 27.616 ( 9.361 -0.365 -6.977) 11.681 27.988 ( 9.100 -4.036 -20.817) 23.075 29.104 ( -2.424 8.969 1.008) 9.345 29.467 ( 2.510 1.751 -1.051) 3.235 29.719 ( -1.404 -1.659 8.715) 8.982 29.853 ( -4.545 -2.907 -3.463) 6.411 30.105 ( 10.008 -2.038 7.085) 12.430 30.357 ( -5.703 -3.709 10.503) 12.514 30.491 ( 5.335 11.796 1.810) 13.072 30.620 ( -5.845 0.352 16.889) 17.875 30.736 ( -11.844 1.020 16.960) 20.711 31.118 ( -9.384 -3.228 6.482) 11.853 31.291 ( -3.365 -1.392 12.762) 13.272 31.468 ( -0.834 -2.220 -0.253) 2.385 31.955 ( -1.707 -4.706 12.511) 13.476 32.217 ( 2.017 -9.321 -4.766) 10.661 33.141 ( 8.917 9.341 -17.912) 22.082 33.455 ( 16.135 8.725 -10.914) 21.344 ======================= Grid point 103 (53/128) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( 4.707 28.644 27.329) 39.868 2.378 ( 0.385 34.277 15.957) 37.811 3.097 ( -1.579 -0.194 5.859) 6.071 3.444 ( -7.177 16.926 27.392) 32.989 3.508 ( -4.656 -11.290 15.157) 19.465 3.658 ( -6.905 -7.188 15.679) 18.579 4.096 ( 9.698 -3.428 -5.667) 11.744 4.280 ( -6.417 5.884 4.995) 10.037 4.423 ( 6.742 -4.100 -2.849) 8.389 4.522 ( -2.009 3.624 5.507) 6.892 4.727 ( -6.193 1.014 29.227) 29.894 4.827 ( -7.187 -3.723 20.653) 22.182 4.992 ( -5.823 1.106 20.171) 21.024 5.183 ( -4.957 -4.656 17.949) 19.194 5.275 ( -0.276 1.720 31.922) 31.969 5.411 ( -1.770 -1.971 10.713) 11.036 5.629 ( -3.016 3.643 17.663) 18.286 5.744 ( -4.632 6.606 6.547) 10.390 5.768 ( -2.979 3.535 13.755) 14.511 5.962 ( -5.686 13.987 1.583) 15.181 6.073 ( -3.245 -7.039 12.152) 14.414 6.231 ( 4.940 -3.172 -0.188) 5.873 6.331 ( 4.309 7.410 0.597) 8.593 6.450 ( 1.247 -8.395 3.107) 9.038 6.655 ( 4.582 -9.176 2.782) 10.627 6.867 ( -0.367 -7.332 -5.675) 9.279 7.104 ( -11.316 -0.576 8.495) 14.161 7.244 ( -10.333 -7.849 6.354) 14.448 7.564 ( -0.426 9.140 -9.686) 13.325 7.685 ( -6.153 -0.013 -3.873) 7.271 7.728 ( -3.961 2.017 -2.403) 5.053 7.908 ( 1.563 0.790 -8.094) 8.281 7.936 ( 3.058 4.614 -3.513) 6.556 8.136 ( 0.539 -4.328 -3.642) 5.682 8.219 ( 0.202 7.095 -6.511) 9.632 8.564 ( 2.073 -2.368 -3.770) 4.911 8.628 ( 4.892 5.319 -10.134) 12.447 8.789 ( 2.288 3.861 -8.208) 9.355 8.855 ( 8.419 -3.639 -8.084) 12.226 8.994 ( 2.155 -3.983 -0.080) 4.529 9.171 ( 1.130 0.794 -8.327) 8.440 9.201 ( -0.319 10.253 -5.694) 11.732 9.330 ( -0.612 3.405 0.990) 3.599 9.363 ( -2.908 -0.381 -6.446) 7.082 9.375 ( -1.322 0.293 -0.971) 1.667 9.549 ( 6.340 -0.630 3.239) 7.147 9.626 ( -0.299 -4.845 0.419) 4.872 9.668 ( 4.686 -1.749 -1.174) 5.138 10.020 ( -0.190 2.779 0.928) 2.936 10.146 ( -2.741 0.566 -6.100) 6.711 10.185 ( 3.118 -2.161 -5.972) 7.075 10.343 ( -1.347 -7.843 -4.867) 9.328 10.533 ( -0.407 3.876 -2.284) 4.517 10.657 ( 6.972 7.822 -5.086) 11.647 10.758 ( 2.346 -0.276 4.487) 5.070 10.855 ( 4.959 1.037 -3.146) 5.963 11.031 ( 3.721 -2.867 -2.632) 5.385 11.130 ( 4.022 -3.251 -7.049) 8.742 11.250 ( -6.860 -3.128 12.619) 14.699 11.404 ( 2.072 -3.679 6.045) 7.374 11.519 ( 1.111 -2.165 -4.579) 5.185 11.593 ( -1.472 -2.090 -5.086) 5.692 11.641 ( 2.610 2.931 -8.391) 9.263 11.895 ( 1.800 -2.744 8.971) 9.553 11.988 ( -15.030 3.078 9.396) 17.991 12.195 ( -8.728 -10.321 11.245) 17.583 12.311 ( 0.611 6.982 5.972) 9.208 12.691 ( 1.124 -8.302 -1.363) 8.488 13.029 ( 4.610 4.391 -1.180) 6.474 13.090 ( 4.973 2.107 -2.573) 5.982 13.178 ( -6.997 7.247 -1.381) 10.168 13.381 ( -4.022 -2.692 -4.146) 6.373 13.586 ( -2.689 -3.779 8.039) 9.281 13.856 ( 2.207 -11.588 -6.463) 13.451 14.094 ( -1.630 0.512 -3.133) 3.569 14.320 ( -2.306 -10.571 -1.524) 10.926 15.117 ( -3.098 6.631 -11.760) 13.852 15.255 ( -2.645 0.507 -5.704) 6.307 15.332 ( 4.413 -0.155 0.635) 4.461 15.413 ( 5.090 -5.821 -1.152) 7.818 15.736 ( -3.940 1.835 6.460) 7.786 15.859 ( -1.610 4.077 9.121) 10.119 15.912 ( -1.038 -2.260 1.504) 2.907 15.957 ( -3.444 -3.208 8.509) 9.724 16.344 ( 1.026 7.889 1.367) 8.072 16.467 ( 1.974 5.671 -7.880) 9.907 16.671 ( 0.038 -3.230 4.416) 5.471 16.822 ( 0.364 -7.941 0.475) 7.963 19.004 ( -1.679 -0.858 -0.607) 1.981 19.102 ( -5.115 -5.400 9.340) 11.940 20.066 ( -1.425 0.888 7.722) 7.903 20.157 ( -1.122 -3.310 8.955) 9.613 22.390 ( 5.791 5.184 -25.622) 26.775 22.491 ( 6.086 1.359 -24.945) 25.713 22.755 ( 5.217 0.857 -19.869) 20.560 22.816 ( 9.051 -1.392 -21.346) 23.228 24.624 ( -10.697 1.803 4.267) 11.657 24.652 ( -12.404 0.338 5.254) 13.475 25.091 ( 18.386 1.304 -3.206) 18.709 25.180 ( 12.769 -3.084 -4.805) 13.987 25.631 ( 0.914 4.921 15.060) 15.870 25.827 ( 2.121 -4.215 13.995) 14.769 27.673 ( -2.111 3.865 -12.016) 12.797 27.906 ( 0.625 -6.181 -20.151) 21.087 29.315 ( 0.731 11.749 -0.339) 11.776 29.526 ( -2.457 2.437 -0.957) 3.590 29.675 ( -0.771 -1.095 3.244) 3.509 29.736 ( 1.022 -3.797 -0.143) 3.935 30.180 ( -1.468 -1.432 9.572) 9.789 30.286 ( 2.728 -6.138 12.632) 14.307 30.580 ( -6.952 2.638 12.601) 14.631 30.625 ( -5.379 -0.109 14.278) 15.258 30.794 ( 2.243 4.826 6.177) 8.153 30.970 ( -3.709 -5.073 16.651) 17.798 31.275 ( -0.802 2.319 11.604) 11.861 31.469 ( 4.092 -2.264 1.965) 5.072 31.930 ( -1.204 -0.570 11.020) 11.101 32.038 ( -0.232 -7.739 0.014) 7.743 33.343 ( -0.113 9.745 -22.269) 24.308 33.552 ( -4.494 1.001 -24.539) 24.967 ======================= Grid point 104 (54/128) ======================= q-point: ( 0.17 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( 7.703 25.263 18.524) 32.260 2.677 ( 22.963 23.537 22.194) 39.672 3.148 ( 3.815 6.267 1.552) 7.500 3.431 ( -5.656 -2.019 10.831) 12.384 3.484 ( -3.598 -7.491 16.345) 18.336 3.636 ( -1.862 8.885 25.848) 27.396 4.181 ( -4.012 2.888 4.713) 6.830 4.214 ( -2.777 0.567 5.137) 5.867 4.349 ( -5.824 6.133 6.471) 10.649 4.616 ( 2.261 -1.436 -2.891) 3.941 4.690 ( -7.609 -12.410 11.825) 18.755 4.822 ( -2.814 3.864 27.787) 28.196 4.933 ( -8.470 5.779 22.936) 25.124 5.106 ( -5.825 -2.861 7.576) 9.975 5.340 ( -8.770 -4.634 19.651) 22.012 5.386 ( -7.294 -3.172 27.199) 28.338 5.665 ( 2.119 10.192 13.112) 16.742 5.752 ( 2.834 1.219 4.998) 5.874 5.777 ( -4.256 2.879 14.832) 15.697 5.901 ( -3.460 7.778 8.888) 12.306 6.121 ( 2.871 0.247 12.011) 12.352 6.310 ( 3.285 2.682 4.819) 6.419 6.368 ( -0.574 2.798 -1.262) 3.123 6.542 ( 4.164 -1.630 -5.249) 6.895 6.689 ( -1.386 -11.429 7.427) 13.701 6.845 ( 1.096 -7.820 -0.031) 7.896 7.051 ( -0.232 -3.005 8.769) 9.273 7.140 ( -4.611 -3.731 11.739) 13.152 7.454 ( -4.830 3.633 -9.061) 10.891 7.538 ( -5.351 -3.741 -3.836) 7.572 7.666 ( -1.203 3.984 -3.332) 5.331 7.865 ( -1.005 -2.765 -7.978) 8.503 7.997 ( 4.251 3.930 1.097) 5.892 8.141 ( 1.385 -1.916 -5.338) 5.838 8.306 ( 7.995 5.973 -4.148) 10.807 8.559 ( -0.855 -2.056 -2.839) 3.608 8.658 ( 2.209 7.018 -8.510) 11.249 8.810 ( 3.411 5.143 -10.448) 12.134 8.916 ( 1.002 -1.276 -7.266) 7.445 9.031 ( 2.114 -0.208 -4.818) 5.266 9.145 ( -2.986 5.889 -3.119) 7.302 9.191 ( 3.306 2.122 -9.479) 10.260 9.298 ( -1.495 -2.333 -8.517) 8.956 9.351 ( 4.713 0.575 -1.320) 4.928 9.378 ( 3.275 -1.612 2.134) 4.228 9.608 ( -0.820 -8.321 -0.699) 8.391 9.680 ( 5.175 2.050 3.249) 6.445 9.732 ( 2.096 0.314 -1.725) 2.733 10.006 ( -1.063 -1.103 0.313) 1.563 10.085 ( 0.132 3.441 -9.859) 10.443 10.212 ( 2.412 -4.685 -8.527) 10.024 10.286 ( -1.548 -8.587 -6.698) 11.000 10.495 ( -2.549 3.869 -0.535) 4.664 10.688 ( -2.612 1.366 -2.014) 3.570 10.838 ( 5.656 1.407 -2.418) 6.310 10.922 ( 3.419 8.082 -3.394) 9.409 11.075 ( -0.446 2.985 3.906) 4.937 11.132 ( -3.315 0.270 -5.919) 6.790 11.220 ( 1.061 -6.574 7.267) 9.857 11.417 ( -2.176 -2.354 0.773) 3.298 11.487 ( -2.821 0.762 -1.675) 3.369 11.632 ( 6.814 -4.531 0.398) 8.193 11.682 ( 3.399 5.067 -8.526) 10.484 11.745 ( -11.225 -0.009 7.278) 13.378 11.931 ( -6.484 -5.343 6.697) 10.745 12.064 ( -3.538 -16.437 11.300) 20.258 12.366 ( 1.935 6.763 6.751) 9.750 12.683 ( -2.586 -6.570 3.619) 7.934 12.933 ( -9.031 4.937 -4.355) 11.176 13.041 ( -7.593 -0.372 0.308) 7.608 13.263 ( 9.584 4.572 -0.097) 10.619 13.351 ( 3.564 1.133 -7.357) 8.253 13.591 ( -0.689 -3.072 9.370) 9.884 13.869 ( 1.845 -11.476 -5.630) 12.915 14.074 ( 0.815 -0.698 -2.838) 3.035 14.283 ( -1.127 -11.015 -0.865) 11.106 15.025 ( -2.222 6.186 -8.514) 10.756 15.179 ( -2.165 -0.735 -5.553) 6.005 15.384 ( 0.536 1.763 2.811) 3.361 15.467 ( 0.330 -4.730 2.351) 5.293 15.702 ( -2.144 2.330 5.129) 6.027 15.848 ( -4.017 -2.819 11.709) 12.696 15.919 ( -0.025 1.512 2.528) 2.946 15.958 ( 0.964 -0.626 5.416) 5.536 16.323 ( -3.354 9.463 -0.463) 10.051 16.458 ( 0.560 10.094 -6.502) 12.020 16.676 ( -1.210 -5.116 1.644) 5.508 16.780 ( -3.769 -1.895 -0.543) 4.254 18.915 ( -6.953 -0.660 0.838) 7.034 19.032 ( -5.680 -7.111 8.987) 12.791 20.057 ( -2.017 1.025 6.386) 6.775 20.158 ( -1.939 -3.635 6.290) 7.519 22.383 ( 5.088 5.314 -26.569) 27.569 22.500 ( 5.760 0.353 -24.402) 25.075 22.755 ( 3.369 2.967 -19.940) 20.439 22.877 ( 6.182 -2.353 -19.848) 20.921 24.468 ( -6.443 1.844 5.121) 8.434 24.517 ( -4.226 -0.733 3.825) 5.746 25.539 ( 29.254 0.921 -6.303) 29.939 25.637 ( 23.105 -1.948 -0.850) 23.203 25.738 ( 16.164 1.013 7.062) 17.668 25.898 ( -1.243 -4.199 15.277) 15.892 27.490 ( -11.848 3.923 -13.199) 18.165 27.754 ( -7.926 -8.123 -21.205) 24.051 29.340 ( 1.708 7.229 1.689) 7.618 29.455 ( -3.536 0.528 -2.182) 4.188 29.676 ( -1.287 3.303 2.269) 4.209 29.766 ( 1.741 0.089 1.468) 2.279 30.155 ( -4.177 1.104 9.036) 10.016 30.361 ( -1.737 -6.375 12.648) 14.270 30.537 ( -2.577 1.625 9.495) 9.972 30.623 ( -1.106 -0.690 13.051) 13.116 30.879 ( 3.021 -1.973 8.015) 8.789 31.012 ( 0.577 -6.131 17.532) 18.582 31.337 ( 2.074 4.073 13.743) 14.483 31.578 ( 6.234 -2.582 4.157) 7.925 31.945 ( -2.224 0.448 11.131) 11.360 32.041 ( 0.729 -5.691 0.501) 5.760 33.148 ( -11.640 10.674 -21.427) 26.619 33.277 ( -11.245 3.690 -23.559) 26.365 ======================= Grid point 105 (55/128) ======================= q-point: ( 0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( 9.846 21.256 16.753) 28.800 3.076 ( -2.719 14.479 6.495) 16.100 3.264 ( 15.267 14.395 17.824) 27.532 3.318 ( -8.192 -8.712 8.478) 14.659 3.572 ( 6.255 -0.290 14.068) 15.399 3.758 ( 3.442 6.192 12.001) 13.936 4.041 ( -12.243 -6.736 12.412) 18.690 4.136 ( -5.261 10.074 1.913) 11.525 4.379 ( -6.359 2.890 6.997) 9.887 4.415 ( -6.570 -2.235 9.191) 11.517 4.724 ( 1.395 0.877 -3.674) 4.027 4.852 ( -3.372 -1.021 15.703) 16.093 4.930 ( -0.295 2.880 19.681) 19.893 5.086 ( -1.541 2.313 13.582) 13.864 5.188 ( -12.845 -2.463 20.415) 24.245 5.394 ( -5.645 -7.071 26.414) 27.920 5.702 ( -8.064 0.423 27.525) 28.685 5.752 ( -1.034 12.016 2.490) 12.315 5.831 ( 1.469 1.347 7.170) 7.441 5.922 ( -0.034 -1.826 12.386) 12.520 6.186 ( -3.072 0.205 4.244) 5.244 6.236 ( -10.241 -6.824 3.873) 12.902 6.425 ( 4.099 10.293 10.939) 15.569 6.523 ( -0.803 9.555 4.460) 10.575 6.704 ( -3.630 3.864 1.125) 5.420 6.929 ( 6.117 -8.429 8.084) 13.184 7.084 ( 0.463 -7.695 3.001) 8.273 7.132 ( -2.213 -7.534 9.464) 12.298 7.397 ( 2.104 -0.507 -1.624) 2.706 7.536 ( 5.381 -6.526 1.839) 8.656 7.688 ( 5.127 3.371 -1.621) 6.347 7.875 ( 5.924 -4.405 -6.185) 9.631 8.053 ( 0.744 3.991 1.578) 4.355 8.169 ( 4.391 -4.328 -8.891) 10.820 8.385 ( 2.168 1.455 -2.560) 3.657 8.509 ( -3.109 -2.056 -2.721) 4.615 8.658 ( 0.752 5.853 -5.902) 8.347 8.816 ( 0.449 2.814 -10.265) 10.653 8.868 ( -0.214 7.963 -6.836) 10.497 9.010 ( -0.541 5.000 -10.315) 11.475 9.071 ( -3.447 3.236 -2.718) 5.454 9.182 ( -0.938 -2.130 -9.134) 9.426 9.252 ( 1.726 -0.056 -6.703) 6.921 9.412 ( 3.188 1.534 -4.375) 5.627 9.545 ( 6.294 -7.368 -0.181) 9.693 9.586 ( 1.193 0.067 2.018) 2.345 9.736 ( 0.109 1.774 0.276) 1.799 9.788 ( 6.899 -4.477 -2.968) 8.744 10.002 ( 1.162 -3.440 -8.635) 9.367 10.040 ( -1.129 2.801 -9.685) 10.145 10.188 ( 1.116 -7.213 -9.420) 11.917 10.276 ( 2.956 -5.334 -7.066) 9.333 10.451 ( -1.658 5.136 -0.977) 5.485 10.587 ( -6.141 1.175 -3.020) 6.943 10.846 ( -9.676 3.698 -0.144) 10.360 10.938 ( 1.138 0.971 -2.358) 2.792 10.990 ( -5.736 3.184 -0.267) 6.566 11.087 ( -0.198 1.612 1.579) 2.265 11.275 ( 1.202 -3.807 6.633) 7.741 11.342 ( -5.095 0.744 -0.088) 5.150 11.427 ( -2.606 -0.209 -1.814) 3.182 11.670 ( 2.290 3.538 -5.365) 6.823 11.685 ( -1.277 -4.265 3.991) 5.979 11.790 ( 7.881 -4.823 1.555) 9.369 11.869 ( 2.616 -4.412 0.315) 5.139 12.116 ( -0.520 -14.148 12.025) 18.575 12.427 ( 2.296 4.544 6.457) 8.223 12.644 ( -2.460 -4.625 2.977) 6.025 12.769 ( -7.052 2.860 -2.214) 7.925 12.885 ( -8.248 -1.883 2.598) 8.850 13.400 ( 4.216 2.272 -6.177) 7.816 13.420 ( 6.973 2.851 -1.027) 7.602 13.626 ( -0.229 -1.584 10.708) 10.827 13.875 ( 0.898 -9.396 -4.735) 10.560 14.098 ( 2.722 -2.163 -1.851) 3.939 14.273 ( 0.253 -10.468 0.353) 10.477 14.977 ( -0.185 6.154 -4.053) 7.371 15.142 ( 0.046 -1.091 -4.572) 4.701 15.394 ( 0.183 1.876 1.709) 2.544 15.452 ( -2.201 -3.009 0.765) 3.805 15.713 ( 0.716 2.091 7.900) 8.204 15.819 ( -4.472 -1.267 13.570) 14.344 15.927 ( 0.317 3.175 -0.532) 3.235 16.005 ( 1.534 0.219 4.421) 4.685 16.236 ( -5.813 8.163 1.145) 10.086 16.448 ( 1.132 12.510 -4.568) 13.366 16.627 ( -4.386 -6.172 -0.625) 7.598 16.718 ( -2.242 1.094 -1.238) 2.785 18.803 ( -5.840 0.328 5.386) 7.951 18.988 ( -2.452 -8.768 6.897) 11.422 20.055 ( -0.719 0.587 4.816) 4.905 20.141 ( -2.174 -3.396 3.631) 5.426 22.367 ( 5.078 5.359 -26.599) 27.605 22.505 ( 5.514 -0.997 -24.051) 24.695 22.713 ( 1.220 4.641 -21.005) 21.546 22.875 ( 2.499 -2.908 -19.469) 19.843 24.453 ( 2.014 2.165 6.119) 6.796 24.530 ( 3.204 -1.514 5.502) 6.544 25.718 ( -3.065 3.639 14.392) 15.158 25.877 ( -5.072 -3.815 13.478) 14.898 26.068 ( 26.085 3.989 -11.149) 28.646 26.297 ( 28.461 -6.595 -19.136) 34.924 27.200 ( -11.055 2.053 -10.906) 15.664 27.479 ( -11.319 -11.005 -19.158) 24.825 29.378 ( 0.141 2.131 1.113) 2.408 29.413 ( 0.744 0.307 2.015) 2.169 29.635 ( -3.177 7.722 -0.866) 8.394 29.804 ( 1.439 0.321 2.152) 2.609 30.112 ( -4.553 2.280 8.494) 9.903 30.358 ( -2.979 -4.810 11.212) 12.559 30.541 ( -1.100 2.980 9.182) 9.716 30.652 ( -2.494 0.632 14.875) 15.095 30.943 ( -0.652 -4.584 12.802) 13.614 31.103 ( 2.587 -10.826 8.006) 13.711 31.449 ( 2.141 3.178 18.059) 18.461 31.682 ( -0.040 -4.627 9.040) 10.155 31.950 ( -0.501 4.202 6.494) 7.751 32.058 ( -0.660 -2.965 2.533) 3.956 32.861 ( -5.933 12.904 -18.229) 23.109 33.033 ( -4.408 2.573 -22.335) 22.911 ======================= Grid point 106 (56/128) ======================= q-point: (-0.50 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( -4.531 18.681 16.140) 25.100 2.931 ( -11.845 15.208 8.541) 21.084 3.110 ( -10.309 10.295 14.204) 20.347 3.607 ( 3.416 -1.959 14.601) 15.122 3.721 ( 0.361 -9.782 6.463) 11.730 3.757 ( -2.680 4.252 -4.943) 7.049 3.990 ( 0.344 -1.906 7.767) 8.004 4.017 ( -3.392 13.156 16.516) 21.386 4.218 ( -6.556 -9.160 5.434) 12.507 4.492 ( 3.260 9.191 5.337) 11.116 4.711 ( -1.931 5.220 3.785) 6.731 4.869 ( 0.382 -3.289 5.999) 6.853 5.013 ( -1.077 -3.842 14.285) 14.832 5.082 ( -7.979 -4.483 27.714) 29.187 5.136 ( -0.572 7.096 15.990) 17.503 5.379 ( -7.841 -4.155 27.639) 29.029 5.662 ( -10.183 0.460 33.652) 35.162 5.741 ( -1.997 6.619 3.214) 7.625 5.849 ( -5.179 -1.783 7.852) 9.574 5.882 ( -1.636 -0.607 11.422) 11.555 6.117 ( 0.339 6.119 5.697) 8.368 6.187 ( -4.524 7.075 8.907) 12.241 6.414 ( -8.756 3.709 5.529) 11.000 6.536 ( -1.113 2.807 8.142) 8.684 6.716 ( 4.741 2.267 -3.004) 6.053 6.993 ( -3.677 -9.514 4.999) 11.359 7.077 ( 1.710 -5.843 3.384) 6.965 7.212 ( 6.289 -7.247 6.446) 11.559 7.478 ( 4.404 1.165 7.174) 8.498 7.672 ( 4.926 -5.026 6.306) 9.450 7.800 ( 5.935 5.222 -1.092) 7.981 7.972 ( 1.552 -0.595 -2.096) 2.675 8.105 ( 7.292 -1.489 -5.793) 9.432 8.175 ( 2.424 -6.596 -8.476) 11.011 8.372 ( -2.376 -0.173 -5.350) 5.856 8.448 ( -1.559 -1.250 -3.830) 4.320 8.643 ( -0.173 3.438 -5.354) 6.365 8.736 ( -2.021 0.407 -10.067) 10.275 8.875 ( 1.543 8.250 -4.913) 9.725 8.969 ( 1.221 8.254 -8.735) 12.080 9.044 ( 2.372 1.668 -1.402) 3.221 9.146 ( 1.657 -2.713 -8.070) 8.674 9.266 ( 0.961 1.762 -6.600) 6.899 9.369 ( -3.252 0.439 -5.224) 6.169 9.557 ( -1.133 1.497 0.106) 1.880 9.657 ( 1.857 -6.255 -3.821) 7.561 9.718 ( -4.418 -2.618 -3.755) 6.362 9.870 ( 1.235 -2.685 -9.167) 9.631 9.927 ( 1.708 2.916 -2.769) 4.369 10.045 ( 3.407 2.994 -11.054) 11.948 10.221 ( 3.942 -1.911 -7.444) 8.637 10.304 ( 2.888 -9.397 -4.415) 10.777 10.429 ( -1.330 7.543 0.176) 7.661 10.518 ( 1.008 2.574 -5.208) 5.896 10.575 ( -11.155 -2.215 -3.885) 12.018 10.891 ( -7.372 -3.749 3.828) 9.113 10.958 ( 0.889 -1.746 1.973) 2.780 11.096 ( 0.293 0.884 0.753) 1.197 11.247 ( -1.416 2.016 -0.875) 2.614 11.380 ( 4.718 -0.466 3.339) 5.799 11.405 ( 1.293 -3.598 -1.001) 3.952 11.592 ( -2.660 -3.385 -6.583) 7.865 11.819 ( 6.869 1.635 2.414) 7.463 11.856 ( -3.010 -3.096 2.095) 4.799 11.975 ( 7.239 -0.221 4.118) 8.332 12.121 ( -1.768 -7.823 7.830) 11.209 12.492 ( -0.023 -0.751 5.483) 5.534 12.610 ( -1.666 -4.556 0.324) 4.862 12.685 ( -1.441 1.382 1.673) 2.605 12.826 ( 1.492 -1.848 3.364) 4.117 13.436 ( 1.930 1.580 -3.869) 4.603 13.499 ( 1.979 1.736 -1.235) 2.908 13.662 ( -0.758 -0.432 11.393) 11.426 13.857 ( -0.553 -7.863 -5.280) 9.487 14.146 ( 2.649 -1.871 -0.760) 3.331 14.299 ( 2.080 -9.530 2.004) 9.959 14.990 ( 3.067 4.023 -1.564) 5.295 15.129 ( 0.562 -0.881 -5.888) 5.980 15.408 ( -1.556 -0.812 -2.892) 3.383 15.411 ( 1.150 0.865 -2.282) 2.697 15.778 ( 0.233 0.859 10.670) 10.707 15.808 ( -0.650 3.433 11.531) 12.049 15.922 ( -0.770 4.865 0.368) 4.939 16.055 ( 2.333 0.077 5.206) 5.706 16.138 ( -5.906 5.423 4.608) 9.248 16.465 ( 1.726 7.606 -3.368) 8.495 16.542 ( -3.238 -3.066 0.324) 4.470 16.684 ( -0.875 0.402 -2.404) 2.590 18.765 ( -1.253 1.982 8.775) 9.083 19.001 ( 1.121 -8.898 5.163) 10.348 20.063 ( -0.791 -0.223 4.350) 4.427 20.110 ( -2.371 -2.519 3.004) 4.581 22.358 ( 5.610 5.257 -26.074) 27.184 22.505 ( 4.685 -1.822 -23.139) 23.679 22.653 ( 2.838 5.418 -23.386) 24.173 22.828 ( 1.385 -3.070 -19.674) 19.960 24.565 ( 6.157 2.369 8.045) 10.405 24.648 ( 5.703 -1.537 8.168) 10.080 25.689 ( -5.945 2.375 12.787) 14.300 25.792 ( -8.996 -2.343 13.347) 16.266 26.132 ( -14.636 5.028 -20.961) 26.055 26.433 ( -6.518 -8.974 -27.088) 29.271 27.146 ( 10.385 1.552 -6.981) 12.609 27.415 ( 14.936 -10.609 -12.375) 22.108 29.369 ( -0.499 2.795 0.894) 2.977 29.464 ( 0.926 -1.173 4.319) 4.570 29.583 ( -0.439 8.434 -2.007) 8.681 29.832 ( 0.710 -2.035 1.216) 2.475 30.060 ( -4.532 3.360 7.941) 9.740 30.341 ( -4.465 -7.122 12.609) 15.154 30.574 ( 0.910 7.400 7.878) 10.847 30.653 ( -3.971 2.046 16.322) 16.923 30.960 ( -3.906 -3.387 15.541) 16.378 31.148 ( -0.050 -12.199 2.792) 12.515 31.492 ( -7.558 0.547 18.236) 19.748 31.620 ( -8.621 -0.806 8.732) 12.297 31.951 ( -3.114 2.962 2.760) 5.108 32.025 ( -1.821 -3.381 1.925) 4.295 32.890 ( 15.220 10.322 -14.905) 23.672 33.004 ( 10.827 4.040 -17.689) 21.129 ======================= Grid point 107 (57/128) ======================= q-point: (-0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.564 ( -29.126 20.288 16.413) 39.107 2.602 ( -14.814 25.505 13.735) 32.536 3.224 ( 5.811 15.017 15.341) 22.240 3.477 ( -13.894 -15.146 12.459) 24.035 3.634 ( -7.756 0.790 8.345) 11.420 3.729 ( -1.288 -17.821 -5.021) 18.559 4.054 ( -2.683 5.585 4.321) 7.554 4.088 ( 4.755 2.137 -3.445) 6.249 4.248 ( 4.981 10.187 25.306) 27.731 4.546 ( -0.750 8.268 3.610) 9.053 4.706 ( -0.634 2.883 12.842) 13.177 4.907 ( 0.349 -3.097 3.728) 4.859 5.000 ( -5.656 -3.974 20.582) 21.712 5.068 ( -8.387 -2.879 22.357) 24.051 5.167 ( -2.024 0.234 26.198) 26.277 5.354 ( -7.736 -3.114 28.585) 29.776 5.594 ( -6.241 6.121 21.763) 23.453 5.747 ( -1.979 3.908 15.450) 16.059 5.896 ( 5.445 4.253 4.080) 8.024 5.950 ( 2.912 3.643 4.169) 6.255 6.081 ( -5.340 7.014 6.404) 10.895 6.190 ( -1.224 3.747 13.492) 14.056 6.265 ( -6.234 -1.932 -1.904) 6.798 6.541 ( -3.036 -5.661 6.539) 9.166 6.704 ( -4.673 -5.366 -0.769) 7.157 6.908 ( -4.731 -11.984 0.726) 12.905 7.218 ( 10.373 3.142 3.646) 11.436 7.353 ( 4.774 -3.228 8.192) 10.016 7.570 ( -0.202 0.429 9.284) 9.296 7.704 ( -3.309 -1.286 2.792) 4.516 7.841 ( 0.119 3.306 -5.267) 6.220 7.932 ( -1.912 0.625 -5.776) 6.116 8.065 ( -2.243 0.863 -10.797) 11.061 8.299 ( -1.180 1.202 -3.034) 3.471 8.327 ( 3.966 -5.623 -7.550) 10.215 8.411 ( 3.390 0.171 -6.282) 7.140 8.617 ( 1.649 5.293 -9.283) 10.812 8.690 ( 1.109 0.602 -8.086) 8.184 8.858 ( -2.023 -0.138 -5.990) 6.323 8.993 ( 1.795 0.775 -2.248) 2.979 9.109 ( 4.345 1.175 1.373) 4.706 9.193 ( 6.346 0.107 -4.812) 7.965 9.238 ( -0.053 0.961 -3.115) 3.260 9.339 ( 2.329 1.708 -8.265) 8.755 9.458 ( -7.486 -1.145 -8.683) 11.521 9.558 ( -3.646 1.411 -3.231) 5.072 9.680 ( -1.302 -0.288 -1.353) 1.900 9.806 ( -4.554 0.680 -6.112) 7.652 10.024 ( -0.242 -0.181 -7.158) 7.164 10.029 ( 5.537 5.028 -0.444) 7.492 10.185 ( -1.043 -0.105 -6.533) 6.617 10.348 ( 0.290 -1.275 1.124) 1.724 10.416 ( 6.279 -1.436 -1.053) 6.526 10.498 ( 3.927 4.731 -9.706) 11.489 10.636 ( 8.859 -4.100 -6.825) 11.911 10.770 ( -7.091 -2.635 5.753) 9.504 10.994 ( 2.424 -4.613 1.709) 5.484 11.074 ( -2.651 -4.015 -1.293) 4.982 11.260 ( 2.322 2.966 0.504) 3.801 11.433 ( 1.606 -4.352 -0.653) 4.684 11.480 ( 0.555 -4.414 2.175) 4.952 11.538 ( 3.293 -2.442 -6.839) 7.974 11.763 ( -6.442 1.724 3.194) 7.394 11.883 ( -1.476 0.545 2.819) 3.228 12.104 ( 2.657 -1.225 8.561) 9.047 12.159 ( 3.970 -0.465 6.181) 7.361 12.424 ( -8.283 -1.241 5.936) 10.266 12.625 ( 2.757 -7.582 -2.784) 8.534 12.743 ( 6.635 3.341 1.629) 7.605 12.917 ( 5.416 -1.269 1.031) 5.657 13.429 ( -1.780 3.474 -3.248) 5.078 13.494 ( -1.866 -1.675 2.327) 3.421 13.676 ( -2.815 -0.830 8.249) 8.756 13.830 ( 0.703 -7.868 -5.715) 9.750 14.171 ( 0.083 -0.039 -0.691) 0.697 14.352 ( 2.054 -8.830 2.053) 9.295 15.081 ( 6.854 0.388 0.612) 6.892 15.126 ( 2.925 -0.016 -6.446) 7.079 15.349 ( -2.089 1.746 -9.507) 9.889 15.418 ( 0.794 -1.315 -7.056) 7.221 15.784 ( -2.509 2.268 11.734) 12.212 15.862 ( -1.431 3.933 7.048) 8.197 15.931 ( 2.005 3.572 3.250) 5.229 16.050 ( -6.098 0.697 8.669) 10.622 16.153 ( 5.554 3.313 4.475) 7.864 16.440 ( -0.524 -4.241 -4.582) 6.265 16.587 ( 5.209 2.965 5.591) 8.197 16.667 ( 0.137 -0.365 -1.803) 1.844 18.830 ( 3.870 3.384 10.937) 12.085 19.060 ( 3.009 -7.464 3.359) 8.720 20.050 ( -2.142 0.153 4.022) 4.560 20.100 ( -0.646 -2.224 6.502) 6.902 22.363 ( 6.241 5.172 -25.206) 26.477 22.488 ( 4.157 0.233 -23.487) 23.853 22.650 ( 7.287 2.912 -23.985) 25.236 22.782 ( 2.578 -2.585 -20.200) 20.528 24.695 ( 3.125 2.333 9.348) 10.128 24.764 ( 2.175 -0.945 9.909) 10.189 25.584 ( -14.080 2.165 0.285) 14.248 25.671 ( -16.749 2.303 -1.758) 16.998 25.713 ( -6.221 -1.672 8.357) 10.551 25.910 ( -32.548 -11.100 -24.407) 42.170 27.428 ( 18.334 4.459 -7.836) 20.431 27.696 ( 17.893 -7.950 -15.130) 24.745 29.354 ( -2.014 8.276 1.111) 8.590 29.475 ( 1.436 3.323 -0.704) 3.688 29.621 ( 2.562 -0.978 4.135) 4.962 29.826 ( -1.586 -5.942 -2.386) 6.597 30.034 ( -1.244 4.840 9.279) 10.539 30.299 ( -5.517 -7.298 13.206) 16.065 30.623 ( -0.571 6.377 11.397) 13.072 30.652 ( -2.489 3.899 14.685) 15.396 30.912 ( -8.359 -0.033 14.646) 16.863 31.122 ( -4.941 -9.475 4.919) 11.763 31.357 ( -10.358 1.856 12.723) 16.511 31.489 ( -7.621 -2.405 2.949) 8.518 31.907 ( -2.488 0.978 6.794) 7.301 32.026 ( 0.519 -6.417 0.898) 6.501 33.152 ( 17.349 8.319 -18.080) 26.402 33.260 ( 22.055 4.857 -13.379) 26.249 ======================= Grid point 108 (58/128) ======================= q-point: (-0.17 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.165 ( -19.676 29.150 23.293) 42.183 2.422 ( -10.381 30.976 14.836) 35.881 3.178 ( -9.649 3.375 6.911) 12.340 3.477 ( -2.192 -14.126 24.115) 28.033 3.527 ( -9.319 17.893 22.221) 30.013 3.693 ( -1.464 -18.549 2.812) 18.818 3.998 ( 1.246 -0.803 -5.171) 5.380 4.226 ( 10.548 -4.670 -5.293) 12.692 4.382 ( -1.723 9.309 10.514) 14.148 4.511 ( -1.987 11.906 9.131) 15.135 4.763 ( -6.177 0.598 26.688) 27.400 4.904 ( -9.194 -4.911 14.068) 17.509 4.937 ( 1.341 0.343 12.976) 13.050 5.094 ( 0.967 -1.556 20.235) 20.317 5.242 ( -6.747 -3.472 36.316) 37.101 5.357 ( -1.329 -4.483 22.849) 23.322 5.613 ( -1.641 8.172 15.055) 17.208 5.755 ( -2.945 7.164 10.488) 13.038 5.864 ( -8.262 10.086 5.098) 13.999 6.026 ( 1.673 7.878 2.614) 8.467 6.088 ( -1.456 -7.489 10.384) 12.886 6.165 ( -0.896 -4.041 1.327) 4.346 6.254 ( 2.819 5.139 2.144) 6.241 6.478 ( -5.178 -10.000 5.996) 12.758 6.614 ( -2.903 -7.526 1.876) 8.282 6.871 ( 0.530 -8.260 -2.202) 8.565 7.330 ( -12.271 -1.560 8.192) 14.837 7.379 ( -1.046 -1.215 3.716) 4.047 7.527 ( -0.578 3.933 0.522) 4.009 7.687 ( 6.356 5.733 -5.232) 10.032 7.841 ( -5.084 -0.449 -6.656) 8.388 7.873 ( 2.935 -3.930 -5.808) 7.602 7.969 ( -3.326 7.159 -6.404) 10.165 8.211 ( -4.899 -1.405 -6.614) 8.350 8.296 ( -3.231 1.092 -4.700) 5.807 8.492 ( 6.556 1.785 -8.286) 10.715 8.622 ( 1.720 3.442 -9.190) 9.963 8.731 ( 7.254 -3.118 -8.439) 11.557 8.801 ( -0.633 0.517 -5.808) 5.865 8.976 ( -0.471 -4.787 -1.499) 5.038 9.189 ( 1.810 1.873 -4.760) 5.426 9.217 ( 0.934 4.054 -4.239) 5.940 9.298 ( 0.366 3.471 -0.836) 3.589 9.324 ( 6.832 2.935 -2.865) 7.969 9.448 ( 3.912 -4.331 -1.406) 6.003 9.500 ( -3.682 5.963 -2.676) 7.501 9.603 ( -3.250 3.558 0.542) 4.850 9.686 ( -3.900 -6.921 -5.023) 9.399 10.004 ( 1.598 2.165 -2.047) 3.381 10.126 ( 4.646 -2.555 -3.883) 6.572 10.199 ( 1.555 3.969 -4.156) 5.954 10.363 ( 0.687 -3.982 -2.285) 4.642 10.512 ( 3.928 4.000 -3.661) 6.696 10.555 ( 5.886 4.999 -5.377) 9.410 10.708 ( -0.537 -1.660 6.206) 6.447 10.765 ( 6.929 -1.559 -5.992) 9.292 11.020 ( -1.396 -5.279 -2.626) 6.059 11.062 ( 4.962 -5.746 -2.467) 7.983 11.305 ( -0.737 -0.234 7.903) 7.941 11.376 ( -4.826 -5.182 5.552) 8.998 11.503 ( 3.365 -1.598 -7.240) 8.142 11.609 ( 3.154 -7.380 -4.915) 9.411 11.676 ( -3.069 6.511 -3.589) 8.043 11.855 ( -1.652 -0.068 7.122) 7.312 12.135 ( -4.780 -0.723 14.084) 14.891 12.259 ( 0.604 7.517 4.473) 8.768 12.293 ( -5.780 -5.798 7.853) 11.344 12.665 ( 2.978 -9.011 -4.692) 10.587 12.894 ( 8.396 4.045 0.895) 9.363 13.004 ( 4.849 2.013 -2.083) 5.648 13.333 ( -7.062 6.062 -2.542) 9.648 13.462 ( -3.222 -4.625 1.466) 5.824 13.627 ( -4.680 -2.549 5.906) 7.955 13.840 ( 2.320 -9.442 -5.783) 11.312 14.144 ( -2.141 0.949 -2.033) 3.101 14.364 ( -1.301 -9.434 -0.455) 9.534 15.175 ( 3.749 6.018 -3.231) 7.791 15.238 ( 7.616 -2.432 0.636) 8.020 15.266 ( -0.798 0.719 -10.266) 10.322 15.382 ( 0.034 -3.915 -11.389) 12.043 15.778 ( -3.699 1.197 10.369) 11.074 15.848 ( -1.588 6.068 6.562) 9.078 15.949 ( -3.006 -1.657 4.989) 6.056 15.988 ( -3.110 -0.742 4.912) 5.861 16.276 ( 5.022 4.806 4.073) 8.057 16.446 ( 2.981 0.185 -6.140) 6.828 16.654 ( -0.184 -1.232 3.793) 3.992 16.743 ( 6.698 -6.559 3.513) 10.011 18.960 ( 4.566 1.659 7.744) 9.141 19.115 ( 0.736 -5.654 4.174) 7.066 20.046 ( -0.365 1.165 6.528) 6.641 20.128 ( -0.072 -2.732 9.249) 9.644 22.379 ( 6.373 5.188 -24.741) 26.070 22.481 ( 5.803 1.655 -24.893) 25.614 22.710 ( 8.827 0.308 -21.648) 23.381 22.766 ( 5.118 -1.309 -21.350) 21.994 24.731 ( -2.805 2.662 7.902) 8.798 24.784 ( -4.349 0.054 8.972) 9.971 25.198 ( -16.615 -1.326 -11.147) 20.052 25.245 ( -23.548 -3.842 -11.749) 26.595 25.580 ( -2.495 3.988 13.000) 13.825 25.736 ( 1.277 -3.218 12.018) 12.507 27.652 ( 9.350 4.124 -10.118) 14.381 27.887 ( 9.934 -6.169 -17.944) 21.418 29.320 ( -1.184 12.487 -0.675) 12.561 29.520 ( 2.615 3.607 0.268) 4.463 29.671 ( 0.235 -3.344 6.303) 7.139 29.761 ( -2.829 -6.912 -4.907) 8.936 30.098 ( 3.467 1.472 10.229) 10.901 30.260 ( -4.114 -5.570 12.390) 14.193 30.629 ( -4.979 1.194 18.334) 19.035 30.673 ( -3.015 4.034 12.683) 13.646 30.796 ( -6.992 5.890 7.442) 11.788 31.021 ( -7.773 -6.006 10.421) 14.321 31.275 ( -4.384 0.969 11.340) 12.196 31.423 ( -0.178 -3.105 0.797) 3.211 31.909 ( -1.209 -0.243 9.454) 9.534 32.038 ( 0.274 -7.870 0.497) 7.891 33.334 ( 10.328 9.692 -20.457) 24.881 33.553 ( 14.306 0.678 -19.928) 24.540 ======================= Grid point 109 (59/128) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.716 ( -0.263 -29.580 17.761) 34.503 2.716 ( -0.263 29.580 17.761) 34.503 3.030 ( -0.390 -31.075 11.939) 33.291 3.030 ( -0.390 31.075 11.939) 33.291 3.659 ( -3.170 -6.863 7.227) 10.458 3.659 ( -3.170 6.863 7.227) 10.458 4.197 ( 10.735 -12.492 -4.284) 17.018 4.197 ( 10.735 12.492 -4.284) 17.018 4.518 ( -10.273 -8.716 11.633) 17.800 4.518 ( -10.273 8.716 11.633) 17.800 4.773 ( -6.080 -3.364 25.243) 26.182 4.773 ( -6.080 3.364 25.243) 26.182 5.033 ( -6.034 -4.815 22.089) 23.399 5.033 ( -6.034 4.815 22.089) 23.399 5.342 ( -1.055 -4.510 23.840) 24.286 5.342 ( -1.055 4.510 23.840) 24.286 5.737 ( -5.508 -4.818 7.081) 10.183 5.737 ( -5.508 4.818 7.081) 10.183 5.908 ( -2.770 -9.020 11.363) 14.770 5.908 ( -2.770 9.020 11.363) 14.770 6.179 ( 4.301 -5.877 8.004) 10.821 6.179 ( 4.301 5.877 8.004) 10.821 6.352 ( 1.150 -1.781 2.150) 3.019 6.352 ( 1.150 1.781 2.150) 3.019 6.693 ( 1.671 -10.013 -4.877) 11.262 6.693 ( 1.671 10.013 -4.877) 11.262 7.124 ( -10.712 -3.696 9.607) 14.856 7.124 ( -10.712 3.696 9.607) 14.856 7.665 ( -7.284 -1.875 -9.246) 11.919 7.665 ( -7.284 1.875 -9.246) 11.919 7.832 ( 2.104 -6.989 -3.897) 8.274 7.832 ( 2.104 6.989 -3.897) 8.274 8.032 ( -0.048 -5.289 -3.677) 6.442 8.032 ( -0.048 5.289 -3.677) 6.442 8.417 ( 2.117 -11.260 -3.848) 12.086 8.417 ( 2.117 11.260 -3.848) 12.086 8.736 ( 6.554 -5.731 -9.893) 13.178 8.736 ( 6.554 5.731 -9.893) 13.178 8.905 ( 4.029 -6.084 -3.325) 8.018 8.905 ( 4.029 6.084 -3.325) 8.018 9.235 ( 1.414 -6.117 -8.270) 10.383 9.235 ( 1.414 6.117 -8.270) 10.383 9.364 ( -1.242 -4.703 -4.228) 6.445 9.364 ( -1.242 4.703 -4.228) 6.445 9.471 ( -2.852 -5.069 -0.309) 5.824 9.471 ( -2.852 5.069 -0.309) 5.824 9.623 ( 4.419 -3.156 1.523) 5.640 9.623 ( 4.419 3.156 1.523) 5.640 10.109 ( 1.447 -5.369 -4.193) 6.964 10.109 ( 1.447 5.369 -4.193) 6.964 10.196 ( -3.020 -5.559 -4.059) 7.517 10.196 ( -3.020 5.559 -4.059) 7.517 10.655 ( -0.779 -7.454 4.486) 8.735 10.655 ( -0.779 7.454 4.486) 8.735 10.812 ( 6.821 -4.704 -5.109) 9.734 10.812 ( 6.821 4.704 -5.109) 9.734 11.051 ( 7.184 -5.108 -6.511) 10.958 11.051 ( 7.184 5.108 -6.511) 10.958 11.304 ( -1.702 -6.961 9.787) 12.130 11.304 ( -1.702 6.961 9.787) 12.130 11.485 ( 0.566 -1.895 -2.251) 2.996 11.485 ( 0.566 1.895 -2.251) 2.996 11.778 ( -1.210 -7.223 2.943) 7.893 11.778 ( -1.210 7.223 2.943) 7.893 12.070 ( -13.181 -4.725 9.893) 17.145 12.070 ( -13.181 4.725 9.893) 17.145 12.500 ( 2.379 -10.918 -0.970) 11.216 12.500 ( 2.379 10.918 -0.970) 11.216 13.101 ( 4.029 -1.970 -4.386) 6.274 13.101 ( 4.029 1.970 -4.386) 6.274 13.294 ( -4.138 -5.291 0.327) 6.725 13.294 ( -4.138 5.291 0.327) 6.725 13.648 ( -0.063 -8.769 -2.052) 9.006 13.648 ( -0.063 8.769 -2.052) 9.006 14.152 ( -2.720 -5.899 -1.725) 6.721 14.152 ( -2.720 5.899 -1.725) 6.721 15.216 ( -2.955 -3.803 -12.705) 13.588 15.216 ( -2.955 3.803 -12.705) 13.588 15.343 ( 4.963 -1.768 3.817) 6.506 15.343 ( 4.963 1.768 3.817) 6.506 15.802 ( -4.157 -4.996 6.608) 9.268 15.802 ( -4.157 4.996 6.608) 9.268 15.936 ( -1.138 -1.533 5.406) 5.733 15.936 ( -1.138 1.533 5.406) 5.733 16.494 ( 4.339 -5.473 -3.153) 7.663 16.494 ( 4.339 5.473 -3.153) 7.663 16.674 ( -0.052 -6.047 2.061) 6.389 16.674 ( -0.052 6.047 2.061) 6.389 19.021 ( -4.025 -2.702 4.982) 6.952 19.021 ( -4.025 2.702 4.982) 6.952 20.100 ( -1.371 -2.493 7.999) 8.490 20.100 ( -1.371 2.493 7.999) 8.490 22.474 ( 5.383 -3.020 -23.791) 24.579 22.474 ( 5.383 3.020 -23.791) 24.579 22.783 ( 7.650 -1.858 -21.448) 22.847 22.783 ( 7.650 1.858 -21.448) 22.847 24.648 ( -11.715 -0.748 4.798) 12.681 24.648 ( -11.715 0.748 4.798) 12.681 25.126 ( 15.029 -2.357 -3.615) 15.636 25.126 ( 15.029 2.357 -3.615) 15.636 25.733 ( 1.490 -5.311 14.374) 15.396 25.733 ( 1.490 5.311 14.374) 15.396 27.779 ( -0.983 -6.519 -16.287) 17.571 27.779 ( -0.983 6.519 -16.287) 17.571 29.512 ( -4.042 -6.529 -2.826) 8.182 29.512 ( -4.042 6.529 -2.826) 8.182 29.663 ( 4.502 -1.369 2.852) 5.502 29.663 ( 4.502 1.369 2.852) 5.502 30.193 ( -0.541 -2.992 12.293) 12.664 30.193 ( -0.541 2.992 12.293) 12.664 30.616 ( -6.031 -1.055 13.693) 15.000 30.616 ( -6.031 1.055 13.693) 15.000 30.877 ( -2.523 -4.163 11.991) 12.941 30.877 ( -2.523 4.163 11.991) 12.941 31.375 ( 2.392 -6.527 6.539) 9.544 31.375 ( 2.392 6.527 6.539) 9.544 31.944 ( -0.377 -2.267 5.919) 6.350 31.944 ( -0.377 2.267 5.919) 6.350 33.499 ( -1.275 -5.939 -24.580) 25.319 33.499 ( -1.275 5.939 -24.580) 25.319 ======================= Grid point 111 (60/128) ======================= q-point: ( 0.17 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.851 ( 6.331 -24.430 12.001) 27.945 2.851 ( 6.331 24.430 12.001) 27.945 3.156 ( 8.416 -23.587 16.653) 30.075 3.156 ( 8.416 23.587 16.653) 30.075 3.608 ( -3.531 -13.333 1.072) 13.834 3.608 ( -3.531 13.333 1.072) 13.834 4.321 ( -6.999 -6.840 11.071) 14.776 4.321 ( -6.999 6.840 11.071) 14.776 4.450 ( 5.536 -5.097 5.602) 9.381 4.450 ( 5.536 5.097 5.602) 9.381 4.709 ( -10.471 -12.850 16.981) 23.730 4.709 ( -10.471 12.850 16.981) 23.730 5.032 ( -2.987 -3.507 24.009) 24.447 5.032 ( -2.987 3.507 24.009) 24.447 5.317 ( -9.782 -2.852 17.766) 20.481 5.317 ( -9.782 2.852 17.766) 20.481 5.737 ( -0.669 -1.172 14.438) 14.501 5.737 ( -0.669 1.172 14.438) 14.501 5.925 ( 0.069 -5.961 5.603) 8.182 5.925 ( 0.069 5.961 5.603) 8.182 6.224 ( -4.364 -9.344 4.033) 11.073 6.224 ( -4.364 9.344 4.033) 11.073 6.465 ( 9.750 -9.726 9.983) 17.010 6.465 ( 9.750 9.726 9.983) 17.010 6.685 ( 1.395 -8.670 -2.161) 9.043 6.685 ( 1.395 8.670 -2.161) 9.043 7.060 ( -3.066 -3.769 11.314) 12.313 7.060 ( -3.066 3.769 11.314) 12.313 7.481 ( -8.409 -1.568 -5.232) 10.028 7.481 ( -8.409 1.568 -5.232) 10.028 7.775 ( -1.997 -5.698 -6.838) 9.122 7.775 ( -1.997 5.698 -6.838) 9.122 8.072 ( 3.334 -4.357 -2.814) 6.166 8.072 ( 3.334 4.357 -2.814) 6.166 8.447 ( 1.435 -7.920 -1.927) 8.277 8.447 ( 1.435 7.920 -1.927) 8.277 8.790 ( 2.690 -6.152 -8.502) 10.834 8.790 ( 2.690 6.152 -8.502) 10.834 8.984 ( 6.683 -7.269 -7.506) 12.403 8.984 ( 6.683 7.269 -7.506) 12.403 9.206 ( -1.348 -4.755 -8.670) 9.980 9.206 ( -1.348 4.755 -8.670) 9.980 9.363 ( 2.996 -5.825 -4.297) 7.834 9.363 ( 2.996 5.825 -4.297) 7.834 9.399 ( -1.797 -7.920 -0.479) 8.136 9.399 ( -1.797 7.920 -0.479) 8.136 9.728 ( 4.455 -1.912 1.328) 5.027 9.728 ( 4.455 1.912 1.328) 5.027 10.052 ( -4.391 -7.115 -3.557) 9.086 10.052 ( -4.391 7.115 -3.557) 9.086 10.175 ( 2.356 -4.585 -7.867) 9.405 10.175 ( 2.356 4.585 -7.867) 9.405 10.621 ( -3.688 -7.018 2.578) 8.337 10.621 ( -3.688 7.018 2.578) 8.337 10.916 ( 5.515 -6.182 -2.983) 8.805 10.916 ( 5.515 6.182 -2.983) 8.805 11.104 ( -0.522 -3.299 -6.274) 7.108 11.104 ( -0.522 3.299 -6.274) 7.108 11.326 ( 0.225 -9.020 7.070) 11.463 11.326 ( 0.225 9.020 7.070) 11.463 11.508 ( 2.978 -4.974 -1.205) 5.922 11.508 ( 2.978 4.974 -1.205) 5.922 11.790 ( -2.315 -9.231 8.480) 12.747 11.790 ( -2.315 9.231 8.480) 12.747 11.834 ( -10.743 -4.917 3.579) 12.345 11.834 ( -10.743 4.917 3.579) 12.345 12.527 ( 0.092 -8.889 3.148) 9.431 12.527 ( 0.092 8.889 3.148) 9.431 13.013 ( -9.139 -2.917 -2.902) 10.023 13.013 ( -9.139 2.917 -2.902) 10.023 13.342 ( 7.431 -2.945 -3.986) 8.932 13.342 ( 7.431 2.945 -3.986) 8.932 13.657 ( 1.307 -9.131 0.107) 9.224 13.657 ( 1.307 9.131 0.107) 9.224 14.116 ( -0.555 -5.515 -1.045) 5.641 14.116 ( -0.555 5.515 -1.045) 5.641 15.125 ( -1.723 -4.274 -9.835) 10.861 15.125 ( -1.723 4.274 -9.835) 10.861 15.409 ( 0.267 -1.668 5.863) 6.101 15.409 ( 0.267 1.668 5.863) 6.101 15.765 ( -2.332 -4.163 4.985) 6.900 15.765 ( -2.332 4.163 4.985) 6.900 15.954 ( 0.429 -0.935 5.905) 5.994 15.954 ( 0.429 0.935 5.905) 5.994 16.512 ( -0.720 -8.503 -4.617) 9.703 16.512 ( -0.720 8.503 -4.617) 9.703 16.673 ( -0.480 -7.922 -0.012) 7.937 16.673 ( -0.480 7.922 -0.012) 7.937 18.934 ( -7.154 -2.939 6.843) 10.327 18.934 ( -7.154 2.939 6.843) 10.327 20.094 ( -1.941 -2.756 5.861) 6.761 20.094 ( -1.941 2.756 5.861) 6.761 22.470 ( 4.885 -3.314 -24.497) 25.199 22.470 ( 4.885 3.314 -24.497) 25.199 22.820 ( 5.218 -3.421 -20.294) 21.232 22.820 ( 5.218 3.421 -20.294) 21.232 24.498 ( -5.524 -1.247 4.319) 7.122 24.498 ( -5.524 1.247 4.319) 7.122 25.576 ( 32.106 -2.891 -6.023) 32.793 25.576 ( 32.106 2.891 -6.023) 32.793 25.808 ( 0.623 -4.731 15.045) 15.783 25.808 ( 0.623 4.731 15.045) 15.783 27.602 ( -10.686 -7.223 -17.299) 21.578 27.602 ( -10.686 7.223 -17.299) 21.578 29.438 ( -2.973 -2.724 -0.598) 4.076 29.438 ( -2.973 2.724 -0.598) 4.076 29.740 ( 2.512 -2.826 1.692) 4.143 29.740 ( 2.512 2.826 1.692) 4.143 30.220 ( -2.373 -5.957 12.776) 14.294 30.220 ( -2.373 5.957 12.776) 14.294 30.591 ( -1.507 -2.650 9.724) 10.191 30.591 ( -1.507 2.650 9.724) 10.191 30.906 ( -0.618 -4.054 13.564) 14.170 30.906 ( -0.618 4.054 13.564) 14.170 31.463 ( 3.477 -7.729 9.176) 12.491 31.463 ( 3.477 7.729 9.176) 12.491 31.972 ( 0.928 -2.177 6.128) 6.569 31.972 ( 0.928 2.177 6.128) 6.569 33.281 ( -10.153 -3.343 -24.422) 26.659 33.281 ( -10.153 3.343 -24.422) 26.659 ======================= Grid point 113 (61/128) ======================= q-point: ( 0.33 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.998 ( 4.738 -18.965 10.567) 22.222 2.998 ( 4.738 18.965 10.567) 22.222 3.363 ( 1.922 -11.097 6.064) 12.791 3.363 ( 1.922 11.097 6.064) 12.791 3.627 ( 7.972 -12.865 11.590) 19.063 3.627 ( 7.972 12.865 11.590) 19.063 4.118 ( -16.651 -12.196 8.074) 22.163 4.118 ( -16.651 12.196 8.074) 22.163 4.569 ( -4.430 -14.618 9.525) 18.001 4.569 ( -4.430 14.618 9.525) 18.001 4.640 ( 5.054 -7.870 2.938) 9.804 4.640 ( 5.054 7.870 2.938) 9.804 5.057 ( -7.721 -6.944 25.230) 27.283 5.057 ( -7.721 6.944 25.230) 27.283 5.234 ( -3.997 -8.379 16.829) 19.220 5.234 ( -3.997 8.379 16.829) 19.220 5.754 ( -6.405 -5.793 22.381) 23.989 5.754 ( -6.405 5.793 22.381) 23.989 5.904 ( -3.814 -2.551 0.994) 4.694 5.904 ( -3.814 2.551 0.994) 4.694 6.182 ( -0.096 -3.119 6.445) 7.161 6.182 ( -0.096 3.119 6.445) 7.161 6.661 ( 4.689 -5.104 1.908) 7.189 6.661 ( 4.689 5.104 1.908) 7.189 6.744 ( 1.555 -4.367 11.832) 12.707 6.744 ( 1.555 4.367 11.832) 12.707 7.018 ( -4.896 -2.679 8.032) 9.781 7.018 ( -4.896 2.679 8.032) 9.781 7.411 ( 3.066 -3.797 2.212) 5.358 7.411 ( 3.066 3.797 2.212) 5.358 7.777 ( 5.280 -5.030 -4.440) 8.538 7.777 ( 5.280 5.030 -4.440) 8.538 8.103 ( 1.512 -2.276 -4.659) 5.401 8.103 ( 1.512 2.276 -4.659) 5.401 8.439 ( -1.162 -4.057 -1.785) 4.582 8.439 ( -1.162 4.057 -1.785) 4.582 8.763 ( -1.621 -4.843 -7.230) 8.851 8.763 ( -1.621 4.843 -7.230) 8.851 9.052 ( 2.887 -5.555 -7.566) 9.820 9.052 ( 2.887 5.555 -7.566) 9.820 9.126 ( -1.810 -1.592 -9.830) 10.122 9.126 ( -1.810 1.592 -9.830) 10.122 9.355 ( 0.459 -9.100 -5.472) 10.629 9.355 ( 0.459 9.100 -5.472) 10.629 9.508 ( 10.048 -4.825 -1.308) 11.223 9.508 ( 10.048 4.825 -1.308) 11.223 9.754 ( -2.114 -3.357 -3.166) 5.076 9.754 ( -2.114 3.357 -3.166) 5.076 9.987 ( 0.461 -4.125 -2.974) 5.107 9.987 ( 0.461 4.125 -2.974) 5.107 10.187 ( 2.611 -4.009 -9.764) 10.873 10.187 ( 2.611 4.009 -9.764) 10.873 10.563 ( -2.839 -4.133 -0.116) 5.016 10.563 ( -2.839 4.133 -0.116) 5.016 10.930 ( -9.320 -6.100 0.876) 11.173 10.930 ( -9.320 6.100 0.876) 11.173 11.009 ( -1.372 -1.124 -2.006) 2.677 11.009 ( -1.372 1.124 -2.006) 2.677 11.341 ( -1.574 -1.680 3.212) 3.952 11.341 ( -1.574 1.680 3.212) 3.952 11.503 ( -3.755 -11.404 0.346) 12.012 11.503 ( -3.755 11.404 0.346) 12.012 11.736 ( 4.679 -3.250 4.468) 7.240 11.736 ( 4.679 3.250 4.468) 7.240 11.890 ( 5.012 -6.843 3.093) 9.029 11.890 ( 5.012 6.843 3.093) 9.029 12.529 ( -1.492 -6.065 4.847) 7.906 12.529 ( -1.492 6.065 4.847) 7.906 12.837 ( -7.997 -3.325 -1.104) 8.731 12.837 ( -7.997 3.325 -1.104) 8.731 13.451 ( 6.052 -0.683 -6.460) 8.879 13.451 ( 6.052 0.683 -6.460) 8.879 13.687 ( 1.036 -7.991 3.325) 8.717 13.687 ( 1.036 7.991 3.325) 8.717 14.123 ( 1.609 -4.751 -0.408) 5.033 14.123 ( 1.609 4.751 -0.409) 5.033 15.078 ( -0.002 -4.652 -6.545) 8.030 15.078 ( -0.002 4.652 -6.545) 8.030 15.417 ( -0.995 -1.065 3.851) 4.118 15.417 ( -0.995 1.065 3.851) 4.118 15.764 ( -0.114 -3.068 6.647) 7.322 15.764 ( -0.114 3.068 6.647) 7.322 15.987 ( 0.362 -2.188 5.732) 6.146 15.987 ( 0.362 2.188 5.732) 6.146 16.441 ( -4.559 -10.970 -4.721) 12.783 16.441 ( -4.559 10.970 -4.721) 12.783 16.660 ( -0.484 -7.095 -1.806) 7.337 16.660 ( -0.484 7.095 -1.806) 7.337 18.852 ( -4.686 -4.882 8.920) 11.196 18.852 ( -4.686 4.882 8.920) 11.196 20.083 ( -1.397 -2.317 3.734) 4.611 20.083 ( -1.397 2.317 3.734) 4.611 22.458 ( 4.769 -3.743 -24.589) 25.326 22.458 ( 4.769 3.743 -24.589) 25.326 22.804 ( 2.174 -4.405 -20.403) 20.986 22.804 ( 2.174 4.405 -20.403) 20.986 24.495 ( 2.624 -2.096 5.656) 6.578 24.495 ( 2.624 2.096 5.656) 6.578 25.796 ( -4.034 -4.324 13.757) 14.974 25.796 ( -4.034 4.324 13.757) 14.974 26.168 ( 28.223 -6.214 -13.639) 31.956 26.168 ( 28.223 6.214 -13.639) 31.956 27.295 ( -13.154 -7.529 -14.505) 20.979 27.295 ( -13.154 7.529 -14.505) 20.979 29.406 ( -0.690 -0.953 1.419) 1.843 29.406 ( -0.690 0.953 1.419) 1.843 29.763 ( -0.227 -4.715 0.238) 4.727 29.763 ( -0.227 4.715 0.238) 4.727 30.209 ( -4.166 -7.601 12.577) 15.274 30.209 ( -4.166 7.601 12.577) 15.274 30.628 ( 0.490 -3.579 10.532) 11.134 30.628 ( 0.490 3.579 10.532) 11.134 30.945 ( -0.732 -4.739 10.987) 11.988 30.945 ( -0.732 4.739 10.987) 11.988 31.552 ( 0.717 -7.045 11.946) 13.887 31.552 ( 0.717 7.045 11.946) 13.887 32.017 ( 0.474 -2.408 5.470) 5.995 32.017 ( 0.474 2.408 5.470) 5.995 33.023 ( -4.930 -4.069 -22.244) 23.144 33.023 ( -4.930 4.069 -22.244) 23.144 ======================= Grid point 115 (62/128) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.093 ( -1.136 -10.193 15.149) 18.295 3.093 ( -1.136 10.193 15.149) 18.295 3.291 ( -7.690 -20.833 1.116) 22.235 3.291 ( -7.690 20.833 1.116) 22.235 3.724 ( -12.900 -5.891 6.573) 15.631 3.724 ( -12.900 5.891 6.573) 15.631 4.001 ( 7.836 -7.704 8.006) 13.596 4.001 ( 7.836 7.704 8.006) 13.596 4.531 ( -1.324 -23.802 8.250) 25.226 4.531 ( -1.324 23.802 8.250) 25.226 4.729 ( 2.816 -7.623 -1.793) 8.322 4.729 ( 2.816 7.623 -1.793) 8.322 4.986 ( -8.417 -2.824 22.099) 23.816 4.986 ( -8.417 2.824 22.099) 23.816 5.277 ( -3.609 -6.385 26.808) 27.793 5.277 ( -3.609 6.385 26.808) 27.793 5.707 ( -7.136 -4.768 23.414) 24.937 5.707 ( -7.136 4.768 23.414) 24.937 5.862 ( -0.647 -2.485 3.162) 4.073 5.862 ( -0.647 2.485 3.162) 4.073 6.233 ( 1.046 -4.246 7.305) 8.513 6.233 ( 1.046 4.246 7.305) 8.513 6.605 ( -9.010 -5.331 3.929) 11.182 6.605 ( -9.010 5.331 3.929) 11.182 6.740 ( -6.337 -10.407 5.797) 13.493 6.740 ( -6.337 10.407 5.797) 13.493 7.082 ( 8.423 -5.020 6.678) 11.863 7.082 ( 8.423 5.020 6.678) 11.863 7.545 ( 5.856 -5.765 9.741) 12.745 7.545 ( 5.856 5.765 9.741) 12.745 7.902 ( 6.498 -5.058 -2.248) 8.536 7.902 ( 6.498 5.058 -2.248) 8.536 8.097 ( 2.841 -1.268 -8.185) 8.756 8.097 ( 2.841 1.268 -8.185) 8.756 8.402 ( -2.199 -2.862 -3.121) 4.772 8.402 ( -2.199 2.862 -3.121) 4.772 8.707 ( -0.378 -2.815 -7.336) 7.866 8.707 ( -0.378 2.815 -7.336) 7.866 9.008 ( -3.330 -4.335 -4.159) 6.868 9.008 ( -3.330 4.335 -4.159) 6.868 9.109 ( 3.523 -2.694 -10.673) 11.558 9.109 ( 3.523 2.694 -10.673) 11.558 9.330 ( -1.150 -4.770 -5.934) 7.700 9.330 ( -1.150 4.770 -5.934) 7.700 9.615 ( -1.625 -0.236 -3.947) 4.274 9.615 ( -1.625 0.236 -3.947) 4.274 9.712 ( 4.478 -9.203 -4.199) 11.062 9.712 ( 4.478 9.203 -4.199) 11.062 10.032 ( 3.449 -5.202 -4.921) 7.948 10.032 ( 3.449 5.202 -4.921) 7.948 10.196 ( 3.391 -0.434 -8.640) 9.291 10.196 ( 3.391 0.434 -8.640) 9.291 10.520 ( -1.423 -2.867 -4.602) 5.605 10.520 ( -1.423 2.867 -4.602) 5.605 10.715 ( -10.587 -12.559 8.894) 18.680 10.715 ( -10.587 12.559 8.894) 18.680 11.001 ( -0.475 -5.549 -3.037) 6.344 11.001 ( -0.475 5.549 -3.037) 6.344 11.318 ( -0.904 -4.435 1.452) 4.754 11.318 ( -0.904 4.435 1.452) 4.754 11.470 ( -0.780 -7.855 1.727) 8.081 11.470 ( -0.780 7.855 1.727) 8.081 11.855 ( 2.955 -2.264 3.008) 4.786 11.855 ( 2.955 2.264 3.008) 4.786 11.996 ( 6.369 -3.258 2.156) 7.472 11.996 ( 6.369 3.258 2.156) 7.472 12.513 ( -2.401 -3.653 3.704) 5.730 12.513 ( -2.401 3.653 3.704) 5.730 12.757 ( -0.048 -4.543 1.469) 4.775 12.757 ( -0.048 4.543 1.469) 4.775 13.501 ( 2.428 -2.889 -6.759) 7.741 13.501 ( 2.428 2.889 -6.759) 7.741 13.710 ( -0.545 -5.436 4.795) 7.269 13.710 ( -0.545 5.436 4.795) 7.269 14.166 ( 2.929 -4.070 0.466) 5.036 14.166 ( 2.929 4.070 0.466) 5.036 15.065 ( 1.087 -4.223 -4.565) 6.313 15.065 ( 1.087 4.223 -4.565) 6.313 15.412 ( -0.066 -0.522 -1.693) 1.773 15.412 ( -0.066 0.522 -1.693) 1.773 15.811 ( 1.591 -1.719 8.241) 8.567 15.811 ( 1.591 1.719 8.241) 8.567 16.010 ( -0.807 -3.699 7.439) 8.347 16.010 ( -0.807 3.699 7.439) 8.347 16.333 ( -4.325 -11.721 -4.703) 13.349 16.333 ( -4.325 11.721 -4.703) 13.349 16.645 ( -0.228 -5.091 -1.471) 5.304 16.645 ( -0.228 5.091 -1.471) 5.304 18.847 ( 0.160 -6.444 9.524) 11.500 18.847 ( 0.160 6.444 9.524) 11.500 20.072 ( -1.394 -1.284 3.294) 3.800 20.072 ( -1.394 1.284 3.294) 3.800 22.449 ( 5.082 -3.914 -24.030) 24.871 22.449 ( 5.082 3.914 -24.030) 24.871 22.753 ( 1.990 -4.652 -21.539) 22.125 22.753 ( 1.990 4.652 -21.539) 22.125 24.611 ( 6.080 -2.251 7.941) 10.251 24.611 ( 6.080 2.251 7.941) 10.251 25.741 ( -7.365 -2.821 12.870) 15.095 25.741 ( -7.365 2.821 12.870) 15.095 26.259 ( -13.321 -8.115 -23.312) 28.049 26.259 ( -13.321 8.115 -23.312) 28.049 27.238 ( 14.764 -7.362 -8.229) 18.436 27.238 ( 14.764 7.362 -8.229) 18.436 29.422 ( 1.283 -2.656 2.921) 4.151 29.422 ( 1.283 2.656 2.921) 4.151 29.741 ( -1.709 -6.927 -1.822) 7.364 29.741 ( -1.709 6.927 -1.822) 7.364 30.179 ( -4.470 -8.166 12.300) 15.426 30.179 ( -4.470 8.166 12.300) 15.426 30.674 ( -1.302 -1.412 14.162) 14.292 30.674 ( -1.302 1.412 14.162) 14.292 30.967 ( -0.951 -5.131 7.977) 9.532 30.967 ( -0.951 5.131 7.977) 9.532 31.549 ( -6.852 -4.609 11.265) 13.968 31.549 ( -6.852 4.609 11.265) 13.968 31.994 ( -4.286 -1.253 3.068) 5.418 31.994 ( -4.286 1.253 3.068) 5.418 33.017 ( 13.239 -2.837 -18.034) 22.551 33.017 ( 13.239 2.837 -18.034) 22.551 ======================= Grid point 117 (63/128) ======================= q-point: (-0.33 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.004 ( -16.691 -22.924 18.343) 33.772 3.004 ( -16.691 22.924 18.343) 33.772 3.145 ( -8.607 -26.635 6.745) 28.793 3.145 ( -8.607 26.635 6.745) 28.793 3.583 ( -0.536 -11.424 1.289) 11.509 3.583 ( -0.536 11.424 1.289) 11.509 4.102 ( 0.368 -1.351 -2.862) 3.186 4.102 ( 0.368 1.351 -2.862) 3.186 4.603 ( 1.695 -17.765 14.224) 22.820 4.603 ( 1.695 17.765 14.224) 22.820 4.776 ( 5.004 -9.120 -1.590) 10.523 4.776 ( 5.004 9.120 -1.590) 10.523 4.941 ( -8.332 -3.477 29.487) 30.838 4.941 ( -8.332 3.477 29.487) 30.838 5.262 ( -10.177 -6.005 32.108) 34.213 5.262 ( -10.177 6.005 32.108) 34.213 5.737 ( 1.960 -6.633 12.700) 14.461 5.737 ( 1.960 6.633 12.700) 14.461 5.899 ( 0.689 -3.554 10.765) 11.357 5.899 ( 0.689 3.554 10.765) 11.357 6.231 ( -5.301 -5.973 6.056) 10.023 6.231 ( -5.301 5.973 6.056) 10.023 6.451 ( -8.386 -10.135 4.002) 13.750 6.451 ( -8.386 10.135 4.002) 13.750 6.646 ( -3.315 -8.859 0.689) 9.484 6.646 ( -3.315 8.859 0.689) 9.484 7.285 ( 8.312 -3.178 8.604) 12.378 7.285 ( 8.312 3.178 8.604) 12.378 7.630 ( -0.599 -4.567 7.579) 8.869 7.630 ( -0.599 4.567 7.579) 8.869 7.891 ( -2.035 -3.455 -8.406) 9.313 7.891 ( -2.035 3.455 -8.406) 9.313 8.181 ( 3.645 -8.305 -7.625) 11.849 8.181 ( 3.645 8.305 -7.625) 11.849 8.356 ( 1.729 -4.199 -3.989) 6.044 8.356 ( 1.729 4.199 -3.989) 6.044 8.682 ( 0.504 -1.773 -8.665) 8.859 8.682 ( 0.504 1.773 -8.665) 8.859 8.921 ( -4.197 -5.648 -3.525) 7.871 8.921 ( -4.197 5.648 -3.525) 7.871 9.165 ( 5.261 -2.807 -2.654) 6.527 9.165 ( 5.261 2.807 -2.654) 6.527 9.289 ( 1.374 -4.123 -7.158) 8.374 9.289 ( 1.374 4.123 -7.158) 8.374 9.557 ( -1.734 -6.315 -6.950) 9.549 9.557 ( -1.734 6.315 -6.950) 9.549 9.736 ( -2.190 -8.570 -3.342) 9.456 9.736 ( -2.190 8.570 -3.342) 9.456 10.024 ( 0.840 -1.001 -5.807) 5.952 10.024 ( 0.840 1.001 -5.807) 5.952 10.264 ( 4.900 -5.578 -5.083) 8.998 10.264 ( 4.900 5.578 -5.083) 8.998 10.492 ( 1.165 -5.690 2.143) 6.191 10.492 ( 1.165 5.690 2.143) 6.191 10.681 ( 2.515 -6.875 0.236) 7.324 10.681 ( 2.515 6.875 0.236) 7.324 10.968 ( -1.221 -4.003 -3.117) 5.218 10.968 ( -1.221 4.003 -3.117) 5.218 11.319 ( -1.288 -4.643 5.956) 7.661 11.319 ( -1.288 4.643 5.956) 7.661 11.473 ( 0.965 -3.013 -1.544) 3.521 11.473 ( 0.965 3.013 -1.544) 3.521 11.846 ( -3.422 -4.360 2.998) 6.302 11.846 ( -3.422 4.360 2.998) 6.302 12.135 ( 5.836 -2.941 4.871) 8.151 12.135 ( 5.836 2.941 4.871) 8.151 12.472 ( -2.455 -6.640 0.481) 7.096 12.472 ( -2.455 6.640 0.481) 7.096 12.838 ( 7.026 -5.663 1.594) 9.164 12.838 ( 7.026 5.663 1.594) 9.164 13.485 ( -1.851 -2.348 -4.080) 5.058 13.485 ( -1.851 2.348 -4.080) 5.058 13.703 ( -1.709 -3.722 2.237) 4.667 13.703 ( -1.709 3.722 2.237) 4.667 14.216 ( 1.504 -4.846 1.018) 5.175 14.216 ( 1.504 4.846 1.018) 5.175 15.095 ( 4.406 -1.890 -2.859) 5.583 15.095 ( 4.406 1.890 -2.859) 5.583 15.390 ( -0.497 -1.760 -8.382) 8.579 15.390 ( -0.497 1.760 -8.382) 8.579 15.862 ( -0.304 -3.864 7.810) 8.719 15.862 ( -0.304 3.864 7.810) 8.719 16.003 ( -3.867 -4.165 7.937) 9.762 16.003 ( -3.867 4.165 7.937) 9.762 16.295 ( 2.813 -9.048 -2.283) 9.746 16.295 ( 2.813 9.048 -2.283) 9.746 16.644 ( 0.370 -2.250 0.358) 2.308 16.644 ( 0.370 2.250 0.358) 2.308 18.924 ( 3.739 -6.178 8.445) 11.112 18.924 ( 3.739 6.178 8.445) 11.112 20.064 ( -1.079 -1.375 5.056) 5.349 20.064 ( -1.079 1.375 5.056) 5.349 22.452 ( 5.641 -3.615 -23.213) 24.160 22.452 ( 5.641 3.615 -23.213) 24.160 22.719 ( 4.379 -3.720 -22.655) 23.373 22.719 ( 4.379 3.720 -22.655) 23.373 24.737 ( 2.911 -1.856 9.469) 10.079 24.737 ( 2.911 1.856 9.469) 10.079 25.647 ( -10.037 -3.777 5.302) 11.964 25.647 ( -10.037 3.777 5.302) 11.964 25.749 ( -24.890 -5.265 -12.153) 28.194 25.749 ( -24.890 5.265 -12.153) 28.194 27.546 ( 18.822 -7.272 -11.408) 23.180 27.546 ( 18.822 7.272 -11.408) 23.180 29.472 ( 2.789 -3.872 3.477) 5.905 29.472 ( 2.789 3.872 3.477) 5.905 29.690 ( -2.691 -7.250 -3.386) 8.442 29.690 ( -2.691 7.250 -3.386) 8.442 30.154 ( -3.414 -7.210 12.154) 14.538 30.154 ( -3.414 7.210 12.154) 14.538 30.689 ( -4.003 -1.983 17.650) 18.207 30.689 ( -4.003 1.983 17.650) 18.207 30.968 ( -2.727 -5.955 6.926) 9.532 30.968 ( -2.727 5.955 6.926) 9.532 31.418 ( -9.349 -4.195 7.018) 12.420 31.418 ( -9.349 4.195 7.018) 12.420 31.943 ( -2.291 -2.681 3.883) 5.245 31.943 ( -2.291 2.681 3.883) 5.245 33.270 ( 19.459 -3.301 -17.689) 26.504 33.270 ( 19.459 3.301 -17.689) 26.504 ======================= Grid point 119 (64/128) ======================= q-point: (-0.17 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.769 ( -13.738 -31.511 18.926) 39.241 2.769 ( -13.738 31.511 18.926) 39.241 3.047 ( -5.511 -31.470 8.817) 33.143 3.047 ( -5.511 31.470 8.817) 33.143 3.641 ( 1.417 -5.611 10.148) 11.682 3.641 ( 1.417 5.611 10.148) 11.682 4.087 ( 3.746 -8.478 -10.562) 14.053 4.087 ( 3.746 8.478 -10.562) 14.053 4.627 ( -4.311 -8.229 8.644) 12.689 4.627 ( -4.311 8.229 8.644) 12.689 4.799 ( -7.930 -5.879 21.089) 23.285 4.799 ( -7.930 5.879 21.089) 23.285 4.989 ( 1.315 -6.031 22.827) 23.646 4.989 ( 1.315 6.031 22.827) 23.646 5.249 ( -4.006 -4.780 31.425) 32.038 5.249 ( -4.006 4.780 31.425) 32.038 5.802 ( -1.787 -7.807 8.637) 11.779 5.802 ( -1.787 7.807 8.637) 11.779 5.930 ( -3.498 -4.588 12.330) 13.613 5.930 ( -3.498 4.588 12.330) 13.613 6.134 ( -3.810 -7.992 4.359) 9.869 6.134 ( -3.810 7.992 4.359) 9.869 6.358 ( -3.184 -5.927 2.536) 7.190 6.358 ( -3.184 5.927 2.536) 7.190 6.650 ( 2.913 -12.758 -0.875) 13.115 6.650 ( 2.913 12.758 -0.875) 13.115 7.316 ( -10.484 -2.232 9.444) 14.286 7.316 ( -10.484 2.232 9.444) 14.286 7.697 ( 9.181 -8.116 -2.768) 12.563 7.697 ( 9.181 8.116 -2.768) 12.563 7.810 ( -3.967 -2.135 -7.484) 8.736 7.810 ( -3.967 2.135 -7.484) 8.736 8.117 ( -4.421 -6.985 -6.930) 10.787 8.117 ( -4.421 6.985 -6.930) 10.787 8.406 ( 2.350 -8.441 -4.538) 9.868 8.406 ( 2.350 8.441 -4.538) 9.868 8.673 ( 3.649 -3.442 -10.019) 11.204 8.673 ( 3.649 3.442 -10.019) 11.204 8.869 ( 0.517 -5.670 -2.175) 6.095 8.869 ( 0.517 5.670 -2.175) 6.095 9.226 ( 2.524 -3.566 -4.327) 6.149 9.226 ( 2.524 3.566 -4.327) 6.149 9.355 ( 5.884 -3.804 -2.414) 7.410 9.355 ( 5.884 3.804 -2.414) 7.410 9.486 ( -2.062 -8.429 -5.446) 10.245 9.486 ( -2.062 8.429 -5.446) 10.245 9.645 ( -4.758 -1.010 -1.967) 5.247 9.645 ( -4.758 1.010 -1.967) 5.247 10.062 ( 4.465 -3.544 -4.347) 7.169 10.062 ( 4.465 3.544 -4.347) 7.169 10.269 ( -2.162 -4.316 -3.080) 5.726 10.269 ( -2.162 4.316 -3.080) 5.726 10.585 ( 5.555 -5.069 4.668) 8.852 10.585 ( 5.555 5.069 4.668) 8.852 10.739 ( 4.292 -4.735 -5.555) 8.467 10.739 ( 4.292 4.735 -5.555) 8.467 10.964 ( 3.350 -2.238 -3.975) 5.659 10.964 ( 3.350 2.238 -3.975) 5.659 11.309 ( -2.907 -1.980 9.499) 10.129 11.309 ( -2.907 1.980 9.499) 10.129 11.484 ( 1.015 -3.191 -3.124) 4.580 11.484 ( 1.015 3.191 -3.124) 4.580 11.800 ( -2.379 -5.009 2.454) 6.064 11.800 ( -2.379 5.009 2.454) 6.064 12.191 ( -4.173 -4.800 10.541) 12.311 12.191 ( -4.173 4.800 10.541) 12.311 12.459 ( 2.278 -11.603 -3.782) 12.415 12.459 ( 2.278 11.603 -3.782) 12.415 12.983 ( 8.159 -4.078 -1.044) 9.181 12.983 ( 8.159 4.078 -1.044) 9.181 13.404 ( -5.778 -1.446 -0.646) 5.991 13.404 ( -5.778 1.446 -0.646) 5.991 13.672 ( -1.574 -6.535 -1.398) 6.866 13.672 ( -1.574 6.535 -1.398) 6.866 14.209 ( -2.222 -5.907 -0.775) 6.358 14.209 ( -2.222 5.907 -0.775) 6.358 15.206 ( 7.615 -0.433 0.583) 7.650 15.206 ( 7.615 0.433 0.583) 7.650 15.323 ( -2.071 -3.145 -12.955) 13.492 15.323 ( -2.071 3.145 -12.955) 13.492 15.852 ( -4.212 -5.642 8.786) 11.259 15.852 ( -4.212 5.642 8.786) 11.259 15.955 ( -3.166 -3.633 4.574) 6.644 15.955 ( -3.166 3.633 4.574) 6.644 16.393 ( 6.934 -5.436 -0.667) 8.836 16.393 ( 6.934 5.436 -0.667) 8.836 16.659 ( 0.605 -2.151 2.093) 3.061 16.659 ( 0.605 2.151 2.093) 3.061 19.016 ( 2.094 -4.196 6.000) 7.615 19.016 ( 2.094 4.196 6.000) 7.615 20.079 ( -0.249 -2.220 7.710) 8.027 20.079 ( -0.249 2.220 7.710) 8.027 22.465 ( 5.850 -3.161 -23.042) 23.982 22.465 ( 5.850 3.161 -23.042) 23.982 22.733 ( 7.075 -1.822 -22.668) 23.816 22.733 ( 7.075 1.822 -22.668) 23.816 24.771 ( -3.262 -1.407 8.507) 9.219 24.771 ( -3.262 1.407 8.507) 9.219 25.195 ( -18.875 -1.185 -10.407) 21.587 25.195 ( -18.875 1.185 -10.407) 21.587 25.662 ( -0.546 -4.214 12.423) 13.129 25.662 ( -0.546 4.214 12.423) 13.129 27.760 ( 9.810 -6.531 -14.220) 18.469 27.760 ( 9.810 6.531 -14.220) 18.469 29.546 ( 3.468 -8.303 1.401) 9.106 29.546 ( 3.468 8.303 1.401) 9.106 29.621 ( -3.010 -4.088 -1.799) 5.386 29.621 ( -3.010 4.088 -1.799) 5.386 30.158 ( -1.404 -4.519 12.029) 12.927 30.158 ( -1.404 4.519 12.029) 12.927 30.670 ( -6.230 -2.410 18.432) 19.605 30.670 ( -6.230 2.410 18.432) 19.605 30.915 ( -5.547 -5.334 7.865) 11.003 30.915 ( -5.547 5.334 7.865) 11.003 31.338 ( -1.713 -4.914 5.375) 7.481 31.338 ( -1.713 4.914 5.375) 7.481 31.934 ( -1.012 -2.958 5.234) 6.097 31.934 ( -1.012 2.958 5.234) 6.097 33.493 ( 12.036 -6.244 -21.566) 25.475 33.493 ( 12.036 6.244 -21.566) 25.475 ======================= Grid point 133 (65/128) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( -8.191 0.000 37.183) 38.075 2.252 ( 12.157 0.000 40.128) 41.929 2.995 ( -0.875 0.000 13.932) 13.959 3.522 ( -5.733 0.000 34.379) 34.853 4.037 ( -1.850 0.000 13.622) 13.747 4.238 ( 1.701 0.000 -2.890) 3.353 4.283 ( -13.534 0.000 -4.601) 14.295 4.291 ( -1.527 0.000 -3.852) 4.144 4.380 ( -5.327 0.000 9.523) 10.911 4.534 ( 1.092 0.000 4.517) 4.647 4.881 ( 4.548 0.000 -3.992) 6.051 5.041 ( -0.271 0.000 2.382) 2.397 5.123 ( 0.622 0.000 2.628) 2.701 5.242 ( 0.142 0.000 1.251) 1.259 5.353 ( -13.392 0.000 1.594) 13.487 5.433 ( 10.958 0.000 4.456) 11.830 5.644 ( -8.121 0.000 -2.388) 8.464 6.073 ( 4.833 0.000 -9.628) 10.773 6.118 ( -4.446 0.000 31.771) 32.081 6.291 ( -9.491 0.000 16.792) 19.289 6.449 ( 3.670 0.000 24.672) 24.944 6.495 ( -8.103 0.000 -1.145) 8.183 6.521 ( -10.007 0.000 49.538) 50.539 6.811 ( -7.987 0.000 19.632) 21.194 6.914 ( 1.823 0.000 -7.323) 7.547 6.983 ( 9.154 0.000 7.062) 11.561 7.275 ( 10.297 0.000 1.458) 10.400 7.380 ( 3.955 0.000 -6.478) 7.590 7.418 ( -6.918 0.000 3.387) 7.703 7.484 ( -8.157 0.000 14.582) 16.708 7.530 ( 1.356 0.000 -15.118) 15.178 7.681 ( -2.713 0.000 -2.778) 3.884 7.850 ( -4.173 0.000 3.314) 5.329 7.958 ( -3.963 0.000 8.145) 9.058 8.190 ( -4.351 0.000 2.671) 5.105 8.250 ( 1.717 0.000 -8.504) 8.676 8.598 ( 3.415 0.000 2.377) 4.161 8.614 ( 7.135 0.000 -9.224) 11.662 8.695 ( 3.286 0.000 -10.572) 11.071 8.757 ( -1.295 0.000 -3.443) 3.678 9.068 ( 6.723 0.000 0.857) 6.777 9.177 ( 1.874 0.000 2.541) 3.157 9.224 ( -3.758 0.000 -0.370) 3.776 9.348 ( -2.743 0.000 -1.524) 3.138 9.355 ( -0.701 0.000 -1.396) 1.562 9.491 ( 8.793 0.000 -7.224) 11.380 9.627 ( 3.033 0.000 -5.765) 6.514 9.815 ( -2.184 0.000 -18.366) 18.495 9.967 ( -2.969 0.000 -3.982) 4.967 10.037 ( -5.816 0.000 0.589) 5.846 10.285 ( 3.433 0.000 4.585) 5.728 10.311 ( 8.144 0.000 -2.116) 8.414 10.389 ( 8.598 0.000 -4.749) 9.823 10.571 ( -0.417 0.000 -5.414) 5.430 10.587 ( -8.946 0.000 1.706) 9.107 10.657 ( 4.495 0.000 -3.352) 5.608 10.878 ( -0.941 0.000 -16.533) 16.560 11.093 ( 13.742 0.000 -2.319) 13.936 11.306 ( -1.821 0.000 -6.097) 6.363 11.407 ( 2.879 0.000 -9.749) 10.165 11.495 ( -10.679 0.000 15.618) 18.920 11.707 ( 2.222 0.000 9.076) 9.344 11.717 ( 1.123 0.000 -3.163) 3.356 12.166 ( -14.699 0.000 11.843) 18.876 12.173 ( 0.713 0.000 8.920) 8.948 12.241 ( 0.789 0.000 5.889) 5.941 12.684 ( -3.988 0.000 -2.880) 4.920 12.746 ( -4.469 0.000 -2.439) 5.091 12.889 ( 7.039 0.000 -6.470) 9.561 13.050 ( -7.134 0.000 10.456) 12.658 13.131 ( 7.326 0.000 2.939) 7.894 13.442 ( -5.589 0.000 -0.746) 5.639 13.779 ( 7.736 0.000 -7.708) 10.921 14.090 ( 0.185 0.000 -0.151) 0.238 14.098 ( -1.499 0.000 -6.108) 6.290 14.563 ( 3.813 0.000 -14.917) 15.397 14.841 ( 2.581 0.000 -13.628) 13.870 14.966 ( -5.136 0.000 11.646) 12.728 15.201 ( -1.366 0.000 -6.184) 6.333 15.361 ( 6.648 0.000 -14.593) 16.036 15.767 ( -5.680 0.000 5.105) 7.636 15.822 ( 5.600 0.000 5.939) 8.163 16.034 ( 0.161 0.000 7.456) 7.458 16.048 ( -4.744 0.000 -6.937) 8.404 16.353 ( -0.573 0.000 7.133) 7.156 16.421 ( 1.263 0.000 2.879) 3.144 16.807 ( 1.053 0.000 7.316) 7.391 17.178 ( -12.138 0.000 4.450) 12.928 18.997 ( -2.207 0.000 4.136) 4.688 19.560 ( -11.553 0.000 18.534) 21.840 20.333 ( -2.589 0.000 16.958) 17.154 20.503 ( -4.387 0.000 15.656) 16.259 21.548 ( 6.092 0.000 -39.339) 39.808 21.821 ( 12.195 0.000 -31.013) 33.325 22.348 ( 2.388 0.000 -23.769) 23.889 22.408 ( 12.241 0.000 -23.827) 26.787 24.635 ( -8.652 0.000 4.803) 9.895 24.729 ( -12.600 0.000 3.855) 13.177 24.977 ( 16.408 0.000 -4.775) 17.089 25.120 ( 13.801 0.000 -7.318) 15.621 25.864 ( 0.798 0.000 18.553) 18.570 26.208 ( 4.087 0.000 16.086) 16.597 27.459 ( -4.792 0.000 -12.500) 13.387 27.562 ( 2.196 0.000 -24.629) 24.727 29.086 ( 3.125 0.000 3.807) 4.926 29.416 ( -2.588 0.000 -3.372) 4.251 29.725 ( 0.268 0.000 -1.459) 1.483 29.801 ( -7.733 0.000 2.679) 8.184 30.283 ( -6.595 0.000 4.001) 7.714 30.528 ( 19.668 0.000 -2.132) 19.784 30.675 ( 5.884 0.000 8.383) 10.242 30.762 ( -10.774 0.000 11.936) 16.079 30.980 ( -3.593 0.000 11.127) 11.693 31.406 ( -0.072 0.000 -0.540) 0.545 31.417 ( 5.414 0.000 19.211) 19.959 31.610 ( -2.957 0.000 11.715) 12.083 32.159 ( -0.066 0.000 -3.040) 3.041 32.299 ( -0.543 0.000 10.157) 10.172 32.730 ( 0.356 0.000 -15.866) 15.870 33.155 ( -13.267 0.000 -8.676) 15.852 ======================= Grid point 134 (66/128) ======================= q-point: ( 0.17 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 3.750 0.000 37.024) 37.214 2.825 ( 30.288 0.000 33.096) 44.863 3.019 ( -2.579 0.000 12.905) 13.160 3.617 ( 1.790 0.000 31.229) 31.280 3.886 ( -22.351 0.000 15.112) 26.981 4.061 ( -12.908 0.000 -4.102) 13.545 4.142 ( 2.127 0.000 -8.336) 8.603 4.156 ( -8.930 0.000 -4.157) 9.850 4.516 ( 7.920 0.000 11.108) 13.642 4.577 ( 1.891 0.000 0.927) 2.106 4.979 ( 6.677 0.000 -0.709) 6.715 5.038 ( -4.593 0.000 11.135) 12.045 5.062 ( -10.000 0.000 2.530) 10.316 5.203 ( -5.985 0.000 1.251) 6.114 5.203 ( -0.440 0.000 -0.479) 0.650 5.353 ( -11.243 0.000 -2.226) 11.461 5.654 ( 3.248 0.000 1.888) 3.757 6.114 ( -2.863 0.000 19.095) 19.308 6.145 ( 6.991 0.000 -8.256) 10.818 6.245 ( -5.585 0.000 23.825) 24.471 6.336 ( -7.702 0.000 -4.483) 8.912 6.603 ( -3.857 0.000 43.374) 43.545 6.656 ( 6.791 0.000 17.153) 18.448 6.721 ( -9.613 0.000 24.809) 26.606 7.015 ( 10.208 0.000 -3.283) 10.723 7.187 ( 0.486 0.000 11.624) 11.634 7.267 ( -7.294 0.000 12.290) 14.292 7.331 ( -2.090 0.000 -4.097) 4.600 7.448 ( -2.248 0.000 20.932) 21.052 7.493 ( 10.311 0.000 -2.945) 10.723 7.593 ( 8.870 0.000 -9.226) 12.798 7.674 ( 2.388 0.000 -1.196) 2.671 7.837 ( -2.950 0.000 14.439) 14.737 7.930 ( 2.178 0.000 -2.825) 3.567 8.187 ( 3.136 0.000 0.392) 3.160 8.241 ( 1.695 0.000 -9.382) 9.534 8.579 ( -3.735 0.000 -8.824) 9.582 8.634 ( -0.439 0.000 2.845) 2.879 8.726 ( 0.008 0.000 -4.033) 4.033 8.786 ( 8.909 0.000 -15.051) 17.490 9.119 ( -8.535 0.000 -0.086) 8.536 9.138 ( -7.400 0.000 -2.143) 7.704 9.239 ( 8.016 0.000 3.603) 8.788 9.320 ( 0.583 0.000 -1.694) 1.792 9.390 ( 8.644 0.000 -5.783) 10.400 9.574 ( 3.626 0.000 -14.140) 14.598 9.654 ( 2.437 0.000 -7.132) 7.537 9.729 ( 0.658 0.000 -11.180) 11.199 9.911 ( -1.690 0.000 -4.357) 4.674 9.930 ( -5.515 0.000 0.642) 5.552 10.324 ( -5.157 0.000 -3.379) 6.166 10.350 ( 3.329 0.000 1.687) 3.732 10.433 ( -3.503 0.000 -6.427) 7.320 10.483 ( 3.910 0.000 -4.202) 5.739 10.577 ( 0.231 0.000 -2.886) 2.895 10.700 ( -0.666 0.000 -8.241) 8.268 10.789 ( 0.973 0.000 -12.876) 12.912 11.235 ( -2.950 0.000 -5.569) 6.302 11.305 ( 4.918 0.000 7.814) 9.233 11.372 ( -7.417 0.000 12.563) 14.589 11.389 ( 0.141 0.000 -12.802) 12.803 11.737 ( 1.452 0.000 -1.281) 1.936 11.805 ( 2.090 0.000 7.764) 8.041 11.959 ( -5.419 0.000 9.582) 11.008 12.270 ( -0.822 0.000 6.731) 6.781 12.280 ( 4.944 0.000 7.337) 8.847 12.552 ( -5.752 0.000 -4.191) 7.117 12.603 ( -10.354 0.000 2.723) 10.706 12.969 ( -5.804 0.000 8.464) 10.263 13.049 ( 8.987 0.000 -4.570) 10.082 13.265 ( 6.229 0.000 1.327) 6.368 13.339 ( -4.759 0.000 -0.128) 4.761 13.912 ( 9.581 0.000 -7.647) 12.259 14.036 ( -2.429 0.000 -7.031) 7.439 14.107 ( 1.349 0.000 1.756) 2.214 14.574 ( 3.717 0.000 -14.064) 14.546 14.869 ( 5.855 0.000 -11.337) 12.760 14.913 ( -4.715 0.000 12.439) 13.302 15.128 ( -3.847 0.000 -5.981) 7.111 15.389 ( 2.113 0.000 -15.403) 15.547 15.704 ( -2.043 0.000 2.510) 3.236 15.903 ( -0.177 0.000 5.695) 5.698 15.957 ( -1.798 0.000 -4.976) 5.290 16.104 ( 3.300 0.000 8.553) 9.167 16.381 ( 0.414 0.000 10.350) 10.359 16.445 ( 0.289 0.000 1.807) 1.830 16.823 ( -2.492 0.000 6.818) 7.260 16.880 ( -22.680 0.000 14.668) 27.010 18.972 ( -3.199 0.000 9.205) 9.745 19.398 ( -11.498 0.000 12.251) 16.802 20.314 ( -5.524 0.000 17.406) 18.261 20.459 ( -6.454 0.000 13.957) 15.377 21.515 ( 7.852 0.000 -40.474) 41.228 21.907 ( 10.266 0.000 -28.469) 30.264 22.275 ( 0.136 0.000 -25.362) 25.362 22.505 ( 8.474 0.000 -23.484) 24.966 24.528 ( -5.314 0.000 5.149) 7.400 24.597 ( -1.537 0.000 3.359) 3.694 25.354 ( 24.429 0.000 -9.804) 26.323 25.545 ( 32.893 0.000 -11.571) 34.869 25.939 ( -1.173 0.000 18.403) 18.440 26.300 ( -1.765 0.000 16.565) 16.658 27.231 ( -12.245 0.000 -14.598) 19.054 27.466 ( -2.210 0.000 -24.362) 24.462 29.193 ( 6.422 0.000 4.571) 7.883 29.346 ( -2.411 0.000 -4.577) 5.173 29.659 ( -8.367 0.000 1.446) 8.491 29.759 ( 2.441 0.000 1.680) 2.963 30.188 ( -4.621 0.000 2.788) 5.397 30.558 ( -10.735 0.000 8.337) 13.592 30.803 ( 3.153 0.000 10.576) 11.036 30.838 ( 3.281 0.000 6.728) 7.486 31.124 ( 20.508 0.000 -0.510) 20.514 31.403 ( 0.383 0.000 -1.800) 1.840 31.594 ( -3.611 0.000 10.633) 11.230 31.632 ( 8.513 0.000 21.950) 23.543 32.148 ( 0.380 0.000 -3.964) 3.982 32.319 ( -2.384 0.000 12.531) 12.756 32.607 ( -8.932 0.000 -7.656) 11.764 32.776 ( -21.198 0.000 -9.577) 23.261 ======================= Grid point 135 (67/128) ======================= q-point: ( 0.33 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.591 ( 8.932 0.000 30.791) 32.061 2.993 ( -6.631 0.000 12.920) 14.522 3.438 ( 18.902 0.000 28.239) 33.981 3.484 ( -26.985 0.000 15.705) 31.222 3.827 ( -10.429 0.000 -0.955) 10.473 3.868 ( 14.629 0.000 16.318) 21.915 3.980 ( -7.292 0.000 -1.449) 7.435 4.147 ( 2.070 0.000 -8.482) 8.731 4.604 ( 1.765 0.000 -3.245) 3.694 4.686 ( 5.412 0.000 8.146) 9.780 4.849 ( -17.103 0.000 12.329) 21.083 4.911 ( -6.543 0.000 5.926) 8.828 5.086 ( 3.321 0.000 0.957) 3.456 5.134 ( -2.061 0.000 6.949) 7.248 5.254 ( 6.996 0.000 -2.752) 7.518 5.299 ( 1.310 0.000 2.257) 2.610 5.571 ( -9.872 0.000 4.654) 10.914 6.192 ( -4.633 0.000 -7.393) 8.725 6.202 ( -6.430 0.000 15.613) 16.885 6.261 ( 8.771 0.000 -8.431) 12.166 6.298 ( 11.204 0.000 13.619) 17.636 6.515 ( -15.292 0.000 20.535) 25.603 6.725 ( -6.702 0.000 44.597) 45.098 6.862 ( -0.394 0.000 19.817) 19.821 7.030 ( -13.832 0.000 37.859) 40.306 7.169 ( 5.339 0.000 -5.013) 7.324 7.300 ( -3.739 0.000 17.984) 18.368 7.309 ( 1.388 0.000 2.447) 2.813 7.533 ( -1.741 0.000 -7.787) 7.980 7.573 ( 5.431 0.000 13.768) 14.800 7.739 ( 4.107 0.000 0.928) 4.211 7.795 ( -4.316 0.000 7.134) 8.338 7.812 ( 15.522 0.000 -5.846) 16.586 8.079 ( 12.721 0.000 -4.441) 13.473 8.248 ( 3.011 0.000 -9.845) 10.296 8.262 ( 2.866 0.000 0.074) 2.867 8.452 ( -5.371 0.000 -9.561) 10.967 8.628 ( -0.212 0.000 -0.892) 0.917 8.724 ( 2.572 0.000 -8.188) 8.583 8.881 ( 8.021 0.000 -12.627) 14.959 8.919 ( -11.601 0.000 -2.189) 11.806 8.940 ( -10.064 0.000 1.363) 10.156 9.304 ( -3.215 0.000 -3.098) 4.464 9.387 ( 6.054 0.000 1.942) 6.357 9.543 ( 2.446 0.000 -15.205) 15.400 9.565 ( 10.824 0.000 -9.574) 14.450 9.615 ( -4.368 0.000 -2.403) 4.985 9.746 ( 3.837 0.000 -5.278) 6.525 9.861 ( -1.668 0.000 -5.876) 6.109 9.888 ( 2.355 0.000 -4.346) 4.944 10.203 ( -6.832 0.000 -4.593) 8.232 10.364 ( 0.400 0.000 -9.214) 9.222 10.432 ( 2.122 0.000 2.172) 3.037 10.479 ( -0.463 0.000 -13.689) 13.697 10.536 ( -3.811 0.000 0.076) 3.812 10.609 ( 0.553 0.000 -13.064) 13.076 10.798 ( 1.545 0.000 -6.844) 7.016 11.171 ( -1.045 0.000 -6.909) 6.988 11.262 ( -11.367 0.000 14.983) 18.807 11.327 ( -2.967 0.000 10.603) 11.011 11.336 ( 0.409 0.000 -10.421) 10.429 11.749 ( 0.104 0.000 0.462) 0.473 11.924 ( 8.138 0.000 7.979) 11.397 12.050 ( 7.965 0.000 4.603) 9.199 12.232 ( -5.795 0.000 4.103) 7.100 12.367 ( -4.173 0.000 5.376) 6.806 12.472 ( 0.507 0.000 8.109) 8.124 12.504 ( 1.817 0.000 -1.777) 2.542 12.911 ( -3.577 0.000 6.488) 7.409 13.095 ( -4.541 0.000 4.400) 6.323 13.273 ( 0.536 0.000 -7.805) 7.823 13.395 ( 6.884 0.000 -1.099) 6.971 13.941 ( -3.632 0.000 -8.123) 8.898 14.055 ( 7.765 0.000 -6.700) 10.256 14.143 ( 0.858 0.000 3.743) 3.840 14.579 ( 3.201 0.000 -15.155) 15.490 14.923 ( 1.337 0.000 8.657) 8.759 14.950 ( 7.738 0.000 -12.032) 14.306 15.016 ( -6.071 0.000 -3.107) 6.820 15.311 ( -2.762 0.000 -15.906) 16.144 15.717 ( 2.315 0.000 0.223) 2.325 15.898 ( -2.714 0.000 9.481) 9.862 15.966 ( 3.662 0.000 1.026) 3.803 16.170 ( 0.606 0.000 5.537) 5.570 16.449 ( -0.479 0.000 1.507) 1.581 16.459 ( -1.568 0.000 19.474) 19.537 16.556 ( -15.695 0.000 17.989) 23.874 16.775 ( -5.156 0.000 4.870) 7.093 18.963 ( -3.235 0.000 16.304) 16.622 19.277 ( -5.601 0.000 6.453) 8.545 20.291 ( -4.731 0.000 15.395) 16.105 20.400 ( -5.650 0.000 14.375) 15.446 21.508 ( 9.294 0.000 -40.343) 41.400 21.968 ( 9.054 0.000 -27.285) 28.748 22.141 ( -2.862 0.000 -28.341) 28.485 22.526 ( 4.479 0.000 -23.222) 23.650 24.531 ( 3.402 0.000 6.414) 7.260 24.674 ( 6.717 0.000 6.185) 9.131 25.709 ( 15.751 0.000 -15.427) 22.047 25.960 ( -4.396 0.000 16.973) 17.533 26.001 ( 20.448 0.000 -18.501) 27.576 26.267 ( -8.955 0.000 15.798) 18.159 26.985 ( -5.495 0.000 -14.875) 15.857 27.323 ( -0.916 0.000 -21.917) 21.937 29.306 ( -0.050 0.000 -4.120) 4.120 29.310 ( 1.631 0.000 2.506) 2.990 29.555 ( -1.067 0.000 4.275) 4.406 29.813 ( 2.459 0.000 2.885) 3.791 30.148 ( -0.753 0.000 1.271) 1.478 30.392 ( -10.517 0.000 5.612) 11.920 30.858 ( -2.350 0.000 12.623) 12.840 30.872 ( -1.568 0.000 12.257) 12.357 31.406 ( 0.719 0.000 -2.211) 2.325 31.514 ( 18.198 0.000 -8.271) 19.990 31.572 ( -2.947 0.000 9.084) 9.550 31.865 ( 6.105 0.000 18.780) 19.748 32.143 ( 1.055 0.000 -4.288) 4.416 32.261 ( -23.072 0.000 6.353) 23.930 32.311 ( -4.100 0.000 13.300) 13.918 32.541 ( 0.936 0.000 -12.655) 12.690 ======================= Grid point 136 (68/128) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.812 ( -1.356 0.000 18.946) 18.994 2.863 ( -10.571 0.000 18.907) 21.661 3.034 ( -29.840 0.000 17.396) 34.541 3.715 ( 1.780 0.000 23.499) 23.567 3.733 ( 0.679 0.000 4.111) 4.167 3.932 ( 2.546 0.000 0.578) 2.611 3.970 ( -4.648 0.000 -3.231) 5.660 4.375 ( 19.592 0.000 4.738) 20.157 4.609 ( -4.812 0.000 12.646) 13.531 4.675 ( -1.355 0.000 -7.070) 7.199 4.724 ( -2.729 0.000 1.683) 3.206 4.907 ( 1.255 0.000 8.894) 8.982 5.100 ( -1.153 0.000 -0.107) 1.158 5.113 ( -4.521 0.000 12.266) 13.072 5.333 ( -1.896 0.000 9.105) 9.301 5.416 ( 9.712 0.000 0.535) 9.727 5.463 ( -1.130 0.000 0.367) 1.188 6.095 ( -1.917 0.000 -10.315) 10.492 6.120 ( -6.096 0.000 9.445) 11.241 6.340 ( -14.209 0.000 30.211) 33.385 6.417 ( 12.117 0.000 -8.122) 14.587 6.548 ( 4.805 0.000 12.229) 13.139 6.656 ( -14.171 0.000 38.001) 40.557 6.845 ( -11.441 0.000 50.855) 52.127 7.064 ( -5.644 0.000 32.108) 32.600 7.138 ( -5.131 0.000 -3.824) 6.399 7.315 ( 2.025 0.000 1.446) 2.488 7.357 ( -0.500 0.000 1.174) 1.276 7.430 ( -4.908 0.000 -6.609) 8.232 7.697 ( 1.456 0.000 16.312) 16.376 7.798 ( 1.029 0.000 0.383) 1.098 7.799 ( 2.871 0.000 3.691) 4.676 8.001 ( 7.525 0.000 -13.014) 15.033 8.149 ( -2.791 0.000 -10.102) 10.481 8.239 ( 1.354 0.000 -9.734) 9.828 8.352 ( -2.941 0.000 -7.804) 8.340 8.359 ( 7.120 0.000 -0.467) 7.135 8.501 ( -10.164 0.000 -1.608) 10.290 8.748 ( -1.794 0.000 0.075) 1.796 8.827 ( 7.458 0.000 -11.130) 13.397 8.913 ( 9.307 0.000 1.193) 9.383 9.006 ( 7.226 0.000 -2.749) 7.732 9.164 ( -7.570 0.000 -6.559) 10.017 9.394 ( -5.525 0.000 -1.149) 5.643 9.585 ( 4.321 0.000 -4.027) 5.907 9.589 ( 0.328 0.000 -2.704) 2.724 9.621 ( 1.660 0.000 -9.081) 9.231 9.782 ( 1.282 0.000 -5.306) 5.459 9.853 ( 6.387 0.000 -8.241) 10.427 9.929 ( -1.335 0.000 -12.564) 12.634 10.024 ( -5.589 0.000 7.842) 9.630 10.296 ( -6.451 0.000 -16.195) 17.433 10.389 ( 3.678 0.000 -5.569) 6.674 10.518 ( 0.714 0.000 -0.439) 0.838 10.527 ( 6.225 0.000 -4.815) 7.870 10.538 ( -4.510 0.000 -8.971) 10.041 10.835 ( 7.316 0.000 -11.971) 14.030 11.114 ( -9.859 0.000 10.912) 14.706 11.151 ( 3.690 0.000 -11.242) 11.832 11.351 ( 3.848 0.000 -4.326) 5.790 11.357 ( 0.399 0.000 13.744) 13.750 11.752 ( 0.011 0.000 1.331) 1.331 12.010 ( -2.147 0.000 4.829) 5.285 12.137 ( -4.158 0.000 -0.805) 4.235 12.239 ( -9.159 0.000 10.497) 13.931 12.261 ( 10.517 0.000 7.457) 12.893 12.566 ( 3.976 0.000 2.615) 4.759 12.629 ( 8.550 0.000 4.475) 9.650 12.912 ( 2.035 0.000 6.378) 6.695 12.976 ( -9.290 0.000 7.105) 11.695 13.238 ( -1.663 0.000 -9.391) 9.537 13.502 ( 5.499 0.000 -3.805) 6.687 13.833 ( -4.224 0.000 -8.371) 9.376 14.139 ( 4.014 0.000 -5.505) 6.813 14.155 ( -1.301 0.000 3.801) 4.018 14.572 ( 3.251 0.000 -17.218) 17.522 14.896 ( -4.457 0.000 -0.257) 4.464 15.022 ( 5.146 0.000 -17.114) 17.871 15.033 ( 6.291 0.000 2.842) 6.903 15.207 ( -0.346 0.000 -14.094) 14.098 15.777 ( 3.213 0.000 3.376) 4.661 15.890 ( -2.678 0.000 8.815) 9.213 16.071 ( 5.755 0.000 3.315) 6.642 16.166 ( -6.885 0.000 12.537) 14.303 16.304 ( -8.613 0.000 12.498) 15.178 16.442 ( -1.494 0.000 3.453) 3.762 16.676 ( 9.027 0.000 21.185) 23.028 16.693 ( -4.501 0.000 1.859) 4.870 18.987 ( -2.193 0.000 18.691) 18.819 19.258 ( 0.728 0.000 8.849) 8.879 20.246 ( -5.845 0.000 10.882) 12.352 20.391 ( -2.582 0.000 18.139) 18.322 21.530 ( 10.616 0.000 -39.015) 40.433 21.952 ( -2.516 0.000 -31.787) 31.886 22.039 ( 9.456 0.000 -26.868) 28.483 22.496 ( 2.652 0.000 -22.876) 23.030 24.675 ( 7.781 0.000 8.650) 11.634 24.847 ( 7.667 0.000 8.925) 11.766 25.655 ( -12.014 0.000 -18.298) 21.890 25.919 ( -6.886 0.000 14.691) 16.224 26.069 ( -5.971 0.000 -26.119) 26.793 26.123 ( -12.546 0.000 14.630) 19.273 26.982 ( 11.738 0.000 -11.945) 16.747 27.351 ( 12.418 0.000 -18.156) 21.996 29.233 ( -7.348 0.000 0.093) 7.349 29.312 ( 2.274 0.000 -2.982) 3.750 29.689 ( 9.261 0.000 8.793) 12.770 29.874 ( 3.112 0.000 2.908) 4.259 30.163 ( 2.106 0.000 -0.564) 2.180 30.219 ( -10.169 0.000 1.823) 10.332 30.818 ( -7.618 0.000 12.945) 15.020 30.898 ( -1.337 0.000 14.191) 14.254 31.407 ( 0.166 0.000 -1.088) 1.100 31.569 ( -1.264 0.000 8.476) 8.570 31.576 ( -6.478 0.000 -4.016) 7.622 31.710 ( -25.146 0.000 14.690) 29.123 32.154 ( 2.076 0.000 -4.299) 4.774 32.267 ( 18.584 0.000 -9.503) 20.873 32.280 ( -4.763 0.000 12.342) 13.229 32.692 ( 15.994 0.000 3.746) 16.427 ======================= Grid point 137 (69/128) ======================= q-point: (-0.33 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( -31.478 0.000 21.982) 38.393 2.579 ( -21.186 0.000 23.872) 31.917 2.911 ( -1.011 0.000 13.964) 14.001 3.675 ( -12.124 0.000 18.112) 21.795 3.868 ( 9.351 0.000 8.936) 12.935 3.953 ( 0.085 0.000 12.226) 12.226 4.053 ( 9.438 0.000 0.295) 9.443 4.518 ( -4.806 0.000 7.072) 8.550 4.651 ( -0.393 0.000 -1.760) 1.803 4.659 ( -4.415 0.000 -0.352) 4.429 4.739 ( 14.078 0.000 1.566) 14.164 4.931 ( -2.748 0.000 3.717) 4.623 5.078 ( -0.332 0.000 0.582) 0.670 5.097 ( -1.581 0.000 9.567) 9.696 5.321 ( -2.071 0.000 6.452) 6.776 5.507 ( 4.398 0.000 3.591) 5.678 5.558 ( 4.115 0.000 1.864) 4.517 6.043 ( 1.057 0.000 -11.636) 11.684 6.093 ( -2.811 0.000 13.776) 14.060 6.258 ( -7.565 0.000 29.099) 30.066 6.439 ( -15.985 0.000 39.993) 43.070 6.622 ( 11.642 0.000 -5.299) 12.791 6.741 ( -3.930 0.000 29.784) 30.042 6.814 ( -8.576 0.000 29.379) 30.605 6.989 ( -7.699 0.000 -3.922) 8.641 7.012 ( -12.111 0.000 26.069) 28.744 7.258 ( -7.295 0.000 -4.523) 8.583 7.340 ( -3.727 0.000 -2.931) 4.742 7.391 ( 6.435 0.000 -4.928) 8.105 7.723 ( -7.795 0.000 20.256) 21.705 7.752 ( -3.857 0.000 -7.742) 8.649 7.910 ( 5.869 0.000 3.212) 6.691 7.993 ( -3.244 0.000 -12.514) 12.928 8.044 ( -2.676 0.000 -11.534) 11.841 8.221 ( -0.776 0.000 -6.614) 6.659 8.291 ( -4.207 0.000 2.534) 4.911 8.320 ( 7.396 0.000 -10.472) 12.820 8.507 ( 1.463 0.000 1.302) 1.958 8.699 ( -1.097 0.000 -1.384) 1.767 8.936 ( -6.856 0.000 -7.444) 10.120 9.068 ( 4.374 0.000 -3.420) 5.552 9.076 ( 16.898 0.000 -4.925) 17.601 9.196 ( 7.919 0.000 0.008) 7.919 9.268 ( -6.234 0.000 -3.293) 7.051 9.429 ( -9.643 0.000 -1.853) 9.820 9.544 ( -7.445 0.000 0.711) 7.478 9.629 ( -4.105 0.000 -1.674) 4.433 9.866 ( 9.584 0.000 -6.261) 11.448 9.869 ( 9.464 0.000 -8.538) 12.746 9.968 ( 8.031 0.000 -4.347) 9.132 10.100 ( 3.542 0.000 4.385) 5.637 10.147 ( -1.206 0.000 -15.446) 15.493 10.339 ( -8.893 0.000 -9.704) 13.162 10.448 ( 4.720 0.000 -1.426) 4.930 10.563 ( 1.754 0.000 0.781) 1.920 10.673 ( 10.715 0.000 -7.961) 13.348 10.904 ( 5.295 0.000 -13.014) 14.050 10.978 ( -9.573 0.000 7.347) 12.068 11.227 ( 9.397 0.000 -15.421) 18.058 11.396 ( 1.418 0.000 -0.721) 1.591 11.436 ( 1.877 0.000 13.689) 13.817 11.753 ( -0.447 0.000 -0.657) 0.795 11.922 ( -9.288 0.000 7.641) 12.027 12.109 ( 2.146 0.000 -1.187) 2.453 12.142 ( -5.915 0.000 9.935) 11.563 12.420 ( 1.916 0.000 9.661) 9.849 12.634 ( 0.275 0.000 5.946) 5.952 12.734 ( 2.907 0.000 0.027) 2.907 12.882 ( -1.421 0.000 4.489) 4.708 13.041 ( 5.956 0.000 9.056) 10.839 13.132 ( -5.529 0.000 -9.537) 11.023 13.553 ( 1.629 0.000 -3.690) 4.033 13.738 ( -1.905 0.000 -8.785) 8.990 14.132 ( -2.161 0.000 1.705) 2.753 14.161 ( 0.826 0.000 -4.488) 4.563 14.563 ( 3.492 0.000 -17.653) 17.995 14.878 ( 1.941 0.000 4.438) 4.843 14.972 ( -0.754 0.000 -20.262) 20.276 15.147 ( 5.763 0.000 -3.704) 6.850 15.220 ( 6.108 0.000 -12.374) 13.800 15.838 ( 0.433 0.000 7.248) 7.261 15.843 ( -6.523 0.000 7.184) 9.704 16.053 ( -7.683 0.000 13.990) 15.961 16.166 ( 3.527 0.000 -1.748) 3.937 16.297 ( 0.536 0.000 6.279) 6.302 16.410 ( -4.256 0.000 7.058) 8.242 16.666 ( 1.485 0.000 1.437) 2.067 16.979 ( 14.567 0.000 15.243) 21.085 19.014 ( -1.429 0.000 9.776) 9.879 19.396 ( 6.883 0.000 23.828) 24.802 20.192 ( -3.853 0.000 11.083) 11.733 20.435 ( -1.250 0.000 19.127) 19.168 21.579 ( 11.176 0.000 -36.528) 38.199 21.790 ( 0.611 0.000 -35.619) 35.624 22.131 ( 11.983 0.000 -25.771) 28.421 22.448 ( 2.324 0.000 -22.714) 22.833 24.816 ( 1.817 0.000 8.922) 9.105 24.976 ( 1.175 0.000 9.853) 9.923 25.300 ( -16.237 0.000 -14.824) 21.986 25.617 ( -27.735 0.000 -24.719) 37.152 25.835 ( -8.193 0.000 13.773) 16.026 26.000 ( -5.061 0.000 14.117) 14.997 27.235 ( 17.528 0.000 -10.822) 20.600 27.522 ( 12.270 0.000 -18.990) 22.609 29.112 ( -5.508 0.000 1.162) 5.629 29.361 ( 3.988 0.000 -1.653) 4.317 29.868 ( 4.621 0.000 8.893) 10.021 29.931 ( -0.844 0.000 -0.815) 1.174 30.068 ( -2.740 0.000 0.644) 2.815 30.225 ( 5.420 0.000 -0.718) 5.467 30.700 ( -9.978 0.000 11.359) 15.119 30.932 ( -1.784 0.000 14.770) 14.878 31.332 ( -21.537 0.000 14.185) 25.788 31.398 ( -9.818 0.000 2.168) 10.055 31.406 ( 0.045 0.000 -0.131) 0.139 31.588 ( -0.918 0.000 9.873) 9.916 32.177 ( 1.814 0.000 -4.038) 4.427 32.249 ( -3.184 0.000 10.658) 11.124 32.549 ( 16.240 0.000 -15.114) 22.185 33.039 ( 17.874 0.000 2.136) 18.001 ======================= Grid point 138 (70/128) ======================= q-point: (-0.17 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( -18.772 0.000 33.940) 38.785 2.319 ( -18.402 0.000 31.582) 36.552 2.949 ( -0.492 0.000 13.422) 13.431 3.548 ( -11.234 0.000 29.781) 31.829 4.000 ( -0.524 0.000 12.561) 12.572 4.082 ( 9.526 0.000 8.119) 12.517 4.227 ( 8.053 0.000 -0.551) 8.072 4.471 ( -3.512 0.000 1.582) 3.852 4.546 ( -8.383 0.000 -0.739) 8.416 4.558 ( -7.277 0.000 1.296) 7.391 4.870 ( -1.907 0.000 -3.103) 3.642 4.991 ( 8.885 0.000 1.937) 9.094 5.094 ( 0.926 0.000 2.761) 2.912 5.137 ( 4.872 0.000 5.424) 7.291 5.316 ( 0.311 0.000 1.542) 1.573 5.545 ( -6.607 0.000 1.253) 6.725 5.639 ( 6.286 0.000 5.094) 8.091 6.040 ( 3.419 0.000 -10.881) 11.406 6.088 ( -6.874 0.000 29.498) 30.289 6.305 ( 1.731 0.000 18.680) 18.760 6.370 ( -9.752 0.000 36.082) 37.377 6.628 ( -19.479 0.000 41.656) 45.986 6.644 ( -7.326 0.000 -0.911) 7.382 6.841 ( 0.048 0.000 7.786) 7.786 6.902 ( -8.417 0.000 22.869) 24.369 6.957 ( 2.398 0.000 -6.982) 7.383 7.133 ( 0.838 0.000 -4.575) 4.651 7.312 ( 2.547 0.000 -2.443) 3.529 7.463 ( 2.372 0.000 -4.322) 4.930 7.604 ( -11.652 0.000 16.521) 20.217 7.634 ( -3.744 0.000 -14.194) 14.680 7.811 ( -8.976 0.000 -7.625) 11.777 7.936 ( -4.207 0.000 -0.777) 4.278 7.984 ( -1.469 0.000 3.179) 3.502 8.235 ( 3.267 0.000 -6.647) 7.406 8.286 ( -3.885 0.000 3.988) 5.568 8.461 ( 11.832 0.000 -11.314) 16.371 8.510 ( 2.437 0.000 2.103) 3.219 8.694 ( 0.864 0.000 -2.762) 2.894 8.814 ( -3.322 0.000 -5.744) 6.635 9.030 ( -1.796 0.000 -4.382) 4.735 9.171 ( -3.323 0.000 0.997) 3.469 9.278 ( 2.164 0.000 -2.222) 3.102 9.329 ( 8.880 0.000 -4.539) 9.973 9.355 ( -0.130 0.000 2.878) 2.881 9.414 ( -4.006 0.000 0.607) 4.052 9.599 ( 1.724 0.000 -3.913) 4.276 9.907 ( 0.209 0.000 -14.635) 14.637 10.046 ( -0.881 0.000 -5.869) 5.935 10.072 ( 9.341 0.000 -4.284) 10.277 10.144 ( 2.706 0.000 3.296) 4.265 10.193 ( 6.477 0.000 -5.967) 8.806 10.231 ( 5.866 0.000 -1.416) 6.035 10.532 ( 4.696 0.000 -3.010) 5.578 10.600 ( 3.016 0.000 -2.723) 4.063 10.766 ( -7.489 0.000 6.678) 10.034 10.891 ( 7.838 0.000 -7.506) 10.852 10.924 ( 2.653 0.000 -14.219) 14.464 11.317 ( 6.170 0.000 -14.865) 16.095 11.396 ( -0.436 0.000 -0.250) 0.502 11.522 ( 0.871 0.000 13.607) 13.635 11.729 ( -0.761 0.000 -3.414) 3.498 11.762 ( -11.281 0.000 10.547) 15.443 12.115 ( -1.070 0.000 9.170) 9.232 12.183 ( 3.890 0.000 3.185) 5.028 12.382 ( -10.471 0.000 11.575) 15.608 12.652 ( 2.147 0.000 2.933) 3.635 12.775 ( 1.848 0.000 -2.827) 3.378 12.935 ( -0.570 0.000 -4.371) 4.408 13.007 ( 0.818 0.000 -1.579) 1.778 13.112 ( -2.847 0.000 10.081) 10.475 13.529 ( -2.864 0.000 -2.326) 3.690 13.711 ( 3.029 0.000 -8.464) 8.989 14.101 ( -1.270 0.000 -0.253) 1.295 14.141 ( -0.770 0.000 -4.825) 4.886 14.558 ( 3.613 0.000 -16.496) 16.888 14.883 ( -0.145 0.000 -17.341) 17.342 14.960 ( 1.883 0.000 8.508) 8.713 15.209 ( 3.233 0.000 -5.859) 6.692 15.290 ( 7.094 0.000 -13.786) 15.504 15.758 ( -3.499 0.000 7.828) 8.575 15.836 ( -3.942 0.000 7.346) 8.337 16.020 ( -1.692 0.000 7.621) 7.806 16.155 ( -2.975 0.000 -6.304) 6.971 16.331 ( 0.071 0.000 6.697) 6.697 16.388 ( -0.232 0.000 5.569) 5.574 16.736 ( 3.489 0.000 5.507) 6.519 17.225 ( 5.787 0.000 3.507) 6.766 19.014 ( -1.387 0.000 3.717) 3.967 19.595 ( -0.115 0.000 25.576) 25.577 20.240 ( 3.428 0.000 15.340) 15.718 20.486 ( -1.672 0.000 18.165) 18.242 21.600 ( 5.946 0.000 -36.428) 36.910 21.736 ( 10.248 0.000 -35.303) 36.761 22.263 ( 13.423 0.000 -24.746) 28.152 22.400 ( 2.462 0.000 -22.946) 23.078 24.781 ( -8.158 0.000 6.450) 10.400 24.932 ( -9.889 0.000 7.095) 12.171 24.999 ( -12.787 0.000 -10.634) 16.631 25.107 ( -10.958 0.000 -10.677) 15.300 25.793 ( -2.101 0.000 16.713) 16.845 26.060 ( 4.023 0.000 14.689) 15.230 27.450 ( 10.210 0.000 -12.591) 16.211 27.602 ( 4.947 0.000 -20.907) 21.484 29.056 ( -1.317 0.000 2.586) 2.903 29.425 ( 2.705 0.000 -1.107) 2.923 29.800 ( -6.917 0.000 -4.928) 8.493 29.897 ( -3.865 0.000 5.206) 6.484 30.207 ( 13.849 0.000 1.045) 13.888 30.329 ( 2.503 0.000 3.044) 3.941 30.594 ( -3.605 0.000 8.737) 9.451 30.911 ( -8.271 0.000 13.053) 15.453 31.070 ( -12.528 0.000 13.412) 18.353 31.311 ( -1.776 0.000 11.969) 12.100 31.407 ( 0.009 0.000 0.104) 0.105 31.607 ( -1.829 0.000 11.485) 11.630 32.174 ( -0.384 0.000 -2.240) 2.272 32.263 ( 0.055 0.000 8.375) 8.375 32.714 ( 8.640 0.000 -16.371) 18.511 33.261 ( 5.486 0.000 -6.419) 8.444 ======================= Grid point 139 (71/128) ======================= q-point: ( 0.00 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( -5.745 12.438 30.890) 33.792 2.389 ( 10.600 13.986 37.268) 41.193 3.061 ( -2.297 6.343 10.503) 12.482 3.707 ( -6.265 15.531 28.571) 33.118 3.942 ( -1.227 -6.987 13.420) 15.179 4.049 ( -3.182 -13.729 -2.337) 14.286 4.206 ( -3.548 -7.787 -4.475) 9.656 4.315 ( 1.039 0.953 -1.280) 1.905 4.422 ( -0.313 -7.163 -0.045) 7.170 4.504 ( -3.611 5.784 6.670) 9.539 4.979 ( 1.158 5.268 -2.918) 6.133 5.058 ( -4.374 5.129 8.922) 11.182 5.200 ( -0.610 2.341 4.264) 4.902 5.249 ( 0.733 4.641 3.992) 6.165 5.438 ( 8.590 2.268 5.376) 10.384 5.503 ( -8.825 12.200 -0.014) 15.057 5.668 ( -4.908 1.501 -1.787) 5.435 6.032 ( 1.366 0.746 8.166) 8.313 6.172 ( -2.882 1.238 10.574) 11.029 6.293 ( -4.055 0.821 12.231) 12.912 6.394 ( -3.376 -4.777 24.964) 25.640 6.462 ( -4.527 -3.120 23.759) 24.387 6.531 ( -9.195 0.201 24.887) 26.532 6.684 ( -8.374 -6.855 18.008) 21.010 6.876 ( 6.806 -8.111 0.742) 10.614 7.017 ( 4.364 -1.873 2.855) 5.541 7.108 ( -0.177 -2.869 3.484) 4.517 7.382 ( -1.677 -1.219 2.061) 2.923 7.484 ( -6.263 1.304 3.996) 7.543 7.559 ( -3.591 4.123 -1.298) 5.620 7.643 ( 3.882 8.514 -6.418) 11.347 7.721 ( -2.250 4.827 0.087) 5.326 7.872 ( -1.819 2.522 8.671) 9.211 7.977 ( -0.834 2.713 0.162) 2.843 8.188 ( -4.124 0.148 4.879) 6.390 8.308 ( 2.878 5.100 -11.033) 12.490 8.522 ( 1.393 -2.849 -1.724) 3.610 8.632 ( 5.593 0.706 -6.750) 8.794 8.720 ( 3.419 1.683 -7.381) 8.307 8.894 ( 1.376 9.585 -4.016) 10.483 9.028 ( 2.709 -2.749 -1.757) 4.241 9.134 ( -0.218 -5.143 0.936) 5.232 9.224 ( -1.705 0.880 -2.894) 3.473 9.314 ( -2.351 0.843 0.365) 2.524 9.436 ( 1.507 -5.297 -3.331) 6.436 9.503 ( 4.062 7.011 -3.351) 8.768 9.590 ( 5.401 -0.588 -5.741) 7.904 9.709 ( -0.286 -8.201 -10.539) 13.357 9.989 ( -0.131 1.944 -1.871) 2.701 10.077 ( -6.262 1.186 -2.108) 6.713 10.206 ( -0.181 -5.172 4.670) 6.971 10.335 ( 2.157 -0.341 -5.114) 5.561 10.394 ( 9.012 1.221 -5.581) 10.670 10.500 ( -1.691 -2.172 -0.203) 2.760 10.656 ( 2.322 6.666 -6.442) 9.556 10.738 ( 2.153 2.670 -4.628) 5.761 10.901 ( -0.429 2.698 -12.983) 13.268 11.141 ( 11.213 5.087 -3.323) 12.753 11.295 ( -3.661 -6.206 3.955) 8.219 11.352 ( 3.629 0.037 -13.106) 13.599 11.493 ( -3.326 -1.637 -1.352) 3.946 11.622 ( -5.554 -5.284 7.782) 10.924 11.708 ( 4.341 -3.220 6.056) 8.117 12.088 ( 2.871 -3.561 7.390) 8.691 12.156 ( -16.425 -0.795 10.288) 19.397 12.357 ( 0.081 5.616 5.562) 7.905 12.536 ( -6.534 -8.190 0.874) 10.513 12.796 ( 7.564 -1.570 -0.988) 7.789 12.931 ( -2.157 4.387 -6.081) 7.803 13.049 ( -2.621 -0.003 7.839) 8.265 13.143 ( 3.522 1.142 3.042) 4.792 13.385 ( -6.068 -4.504 -0.729) 7.592 13.729 ( 5.166 -4.480 -6.220) 9.244 14.016 ( -0.938 -3.346 -2.273) 4.152 14.098 ( -1.238 -4.926 2.704) 5.754 14.451 ( 0.328 -10.403 -5.914) 11.971 14.729 ( 1.269 0.594 -16.804) 16.862 15.111 ( 0.574 -0.126 -6.694) 6.719 15.233 ( 1.593 6.090 -2.682) 6.842 15.351 ( 6.250 -1.004 -11.481) 13.111 15.776 ( -4.402 1.638 4.805) 6.719 15.877 ( 2.572 4.880 5.050) 7.479 15.997 ( -4.682 -2.445 -0.452) 5.301 16.102 ( 0.895 3.745 2.528) 4.606 16.338 ( 0.319 -1.075 4.767) 4.897 16.414 ( -1.955 -0.278 5.579) 5.918 16.802 ( 0.805 -0.925 6.152) 6.273 17.069 ( -8.157 -9.634 4.744) 13.485 19.022 ( -2.779 2.800 7.216) 8.224 19.522 ( -10.728 -3.964 19.995) 23.035 20.310 ( -2.871 -1.754 16.575) 16.913 20.467 ( -4.531 -3.321 15.677) 16.653 21.623 ( 6.209 6.934 -38.398) 39.510 21.867 ( 11.339 4.205 -30.847) 33.132 22.334 ( 3.068 -1.413 -24.521) 24.752 22.396 ( 12.261 -1.196 -24.211) 27.165 24.655 ( -9.466 1.683 3.727) 10.311 24.730 ( -12.858 0.032 3.436) 13.309 24.988 ( 16.493 1.091 -4.581) 17.152 25.107 ( 14.042 -1.285 -6.780) 15.646 25.888 ( 1.046 2.379 18.205) 18.390 26.186 ( 3.848 -2.242 16.038) 16.645 27.436 ( -4.347 -1.784 -12.537) 13.389 27.544 ( 1.246 -1.791 -23.753) 23.853 29.155 ( 3.164 6.641 2.735) 7.848 29.438 ( -3.083 2.119 -3.203) 4.925 29.714 ( 1.049 -0.809 -0.314) 1.362 29.813 ( -6.002 0.244 2.463) 6.493 30.306 ( -4.813 1.585 4.403) 6.713 30.543 ( 13.888 0.465 0.250) 13.898 30.650 ( 2.372 -0.555 6.457) 6.902 30.786 ( -8.518 1.721 9.934) 13.198 30.977 ( -2.621 0.301 12.396) 12.673 31.375 ( 2.534 -1.081 13.419) 13.699 31.473 ( 3.179 2.319 4.624) 6.072 31.565 ( -2.628 -3.478 12.819) 13.540 32.115 ( 0.044 -3.663 -1.561) 3.982 32.254 ( -1.158 -3.939 12.080) 12.759 32.791 ( 0.282 5.643 -17.763) 18.640 33.163 ( -10.873 0.252 -12.029) 16.217 ======================= Grid point 140 (72/128) ======================= q-point: ( 0.17 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 4.550 12.413 31.130) 33.821 2.903 ( 26.261 7.603 29.646) 40.328 3.073 ( -0.333 5.902 11.335) 12.784 3.724 ( -4.136 5.037 19.477) 20.539 3.894 ( -9.623 -4.876 13.503) 17.283 3.908 ( -11.377 -2.169 4.267) 12.343 4.164 ( -0.005 0.658 -5.031) 5.074 4.242 ( -6.961 6.016 -2.425) 9.515 4.381 ( -0.995 -7.695 1.984) 8.009 4.567 ( 5.291 -3.087 0.558) 6.151 4.968 ( -4.776 -1.512 3.664) 6.207 5.037 ( -0.012 3.009 2.981) 4.235 5.103 ( -9.069 -3.422 -0.597) 9.712 5.227 ( -5.079 10.842 16.429) 20.328 5.409 ( -2.872 12.877 0.972) 13.229 5.469 ( -6.182 10.543 -1.262) 12.287 5.677 ( 6.653 1.263 0.369) 6.782 6.083 ( -1.385 0.581 11.719) 11.815 6.149 ( 0.268 -0.073 7.774) 7.779 6.260 ( -5.521 -1.096 13.340) 14.479 6.327 ( -4.017 1.400 -0.018) 4.254 6.547 ( -2.018 -9.730 7.637) 12.533 6.604 ( -1.460 -1.465 42.496) 42.546 6.673 ( 0.445 -1.728 26.105) 26.166 7.017 ( 2.475 -12.057 7.956) 14.655 7.117 ( 6.011 4.130 0.326) 7.301 7.142 ( 3.275 -5.279 8.043) 10.163 7.364 ( -4.792 -0.314 14.380) 15.161 7.431 ( -6.376 1.339 1.943) 6.799 7.493 ( 6.166 -3.418 5.789) 9.122 7.682 ( -0.148 3.023 1.694) 3.469 7.737 ( 2.696 5.609 -1.058) 6.313 7.926 ( 1.151 7.871 7.250) 10.763 7.991 ( 4.227 6.208 -2.492) 7.914 8.178 ( 2.697 0.636 1.861) 3.338 8.308 ( 2.164 6.223 -11.214) 13.006 8.492 ( -1.363 -4.179 -5.215) 6.820 8.658 ( -1.489 2.428 -3.015) 4.147 8.758 ( 2.974 0.055 -9.342) 9.804 8.889 ( 1.713 7.852 -6.958) 10.630 9.052 ( -2.173 -5.260 -1.043) 5.786 9.095 ( -4.773 -3.606 -1.493) 6.166 9.216 ( -0.118 -1.486 -1.582) 2.173 9.320 ( 5.717 -0.806 -4.502) 7.321 9.424 ( 2.364 -0.752 -0.433) 2.519 9.566 ( 3.993 3.461 -11.762) 12.895 9.648 ( 3.058 -1.943 -8.545) 9.282 9.694 ( 3.175 -2.172 -4.233) 5.720 9.892 ( -8.182 0.545 -2.808) 8.668 10.021 ( 0.350 4.883 -1.379) 5.086 10.187 ( -3.009 -7.340 -0.185) 7.934 10.291 ( -1.910 -6.125 -6.779) 9.334 10.450 ( -3.300 -0.891 0.824) 3.517 10.504 ( 3.545 1.414 -7.504) 8.419 10.642 ( 1.015 7.743 -6.852) 10.389 10.764 ( 1.411 4.434 -9.443) 10.528 10.853 ( 1.116 4.329 -8.754) 9.829 11.195 ( -3.102 -1.412 -4.491) 5.638 11.345 ( 0.024 1.106 11.202) 11.256 11.350 ( 2.974 -0.315 -8.602) 9.107 11.428 ( -1.693 2.542 -1.645) 3.469 11.576 ( -0.540 -10.476 1.287) 10.569 11.841 ( 4.413 -1.714 6.532) 8.067 11.918 ( -9.081 -3.005 8.619) 12.876 12.150 ( -2.241 -7.374 3.939) 8.655 12.345 ( -0.178 -0.702 6.196) 6.238 12.478 ( -0.725 1.530 4.139) 4.472 12.742 ( -10.064 6.709 -1.013) 12.137 12.911 ( -2.148 -4.821 5.685) 7.757 13.083 ( 4.448 2.039 -0.725) 4.947 13.260 ( 6.280 -0.813 1.884) 6.607 13.279 ( -3.944 -4.775 -2.023) 6.515 13.819 ( 6.305 -7.358 -3.797) 10.407 13.999 ( 0.660 -1.258 -5.368) 5.552 14.091 ( -1.437 -6.013 6.123) 8.701 14.448 ( 1.768 -10.450 -4.402) 11.476 14.715 ( 3.890 -0.433 -13.711) 14.259 15.087 ( -0.603 -2.255 -6.617) 7.016 15.215 ( -1.057 11.718 -3.546) 12.289 15.375 ( 1.454 -1.044 -13.448) 13.566 15.724 ( -1.657 2.179 2.185) 3.502 15.919 ( -2.648 0.257 3.273) 4.218 15.954 ( 1.625 1.506 0.072) 2.217 16.161 ( 3.537 4.525 6.108) 8.384 16.345 ( -2.405 -3.842 7.259) 8.558 16.396 ( -2.521 -2.117 8.321) 8.948 16.809 ( -2.897 -1.730 5.977) 6.864 16.879 ( -13.778 -0.885 8.710) 16.324 19.000 ( -3.634 2.895 11.812) 12.693 19.374 ( -11.746 -2.322 15.077) 19.253 20.292 ( -5.213 -1.923 16.714) 17.613 20.423 ( -6.333 -3.376 13.745) 15.505 21.591 ( 7.542 7.159 -39.333) 40.685 21.938 ( 9.474 2.610 -28.691) 30.328 22.275 ( 1.135 0.199 -25.859) 25.885 22.489 ( 8.285 -1.653 -23.875) 25.325 24.536 ( -5.324 0.803 4.675) 7.131 24.594 ( -1.846 -0.304 3.313) 3.805 25.362 ( 24.616 0.815 -9.442) 26.377 25.525 ( 31.709 -1.915 -10.749) 33.537 25.966 ( -0.785 2.662 17.945) 18.158 26.276 ( -1.703 -2.423 16.509) 16.772 27.217 ( -11.996 -0.994 -14.357) 18.735 27.425 ( -3.861 -3.791 -23.312) 23.932 29.257 ( 6.257 5.859 3.676) 9.327 29.364 ( -2.434 1.699 -4.144) 5.098 29.673 ( -7.472 1.317 1.290) 7.696 29.776 ( 2.348 1.588 1.865) 3.393 30.220 ( -4.684 3.030 3.086) 6.375 30.569 ( -9.744 1.114 7.751) 12.501 30.770 ( 3.560 -3.703 9.380) 10.694 30.823 ( 5.500 -1.770 4.945) 7.604 31.065 ( 8.954 -2.903 5.392) 10.848 31.480 ( 6.602 4.383 3.975) 8.865 31.517 ( -2.563 -5.624 8.917) 10.850 31.658 ( 6.457 2.155 17.751) 19.011 32.108 ( 0.072 -3.626 -2.513) 4.413 32.266 ( -3.976 -3.904 14.555) 15.585 32.670 ( -5.983 5.066 -13.382) 15.509 32.820 ( -19.352 3.550 -11.085) 22.582 ======================= Grid point 141 (73/128) ======================= q-point: ( 0.33 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.716 ( 9.613 10.987 27.186) 30.858 3.036 ( -6.008 5.232 11.890) 14.312 3.525 ( 20.649 6.435 24.277) 32.515 3.556 ( -21.102 3.462 12.948) 24.998 3.714 ( -4.472 -2.437 1.666) 5.359 3.880 ( -0.891 1.772 9.511) 9.716 4.061 ( -4.502 -0.618 0.444) 4.566 4.174 ( -1.555 4.662 -9.111) 10.352 4.422 ( 3.489 -8.090 6.849) 11.159 4.630 ( 0.560 -3.949 1.240) 4.176 4.818 ( -10.141 -7.185 3.644) 12.951 4.954 ( -5.692 0.662 1.630) 5.958 5.080 ( 1.206 -2.249 3.952) 4.704 5.251 ( 0.971 13.032 14.259) 19.341 5.364 ( 0.166 10.368 0.338) 10.375 5.434 ( -2.453 10.445 5.672) 12.137 5.675 ( -3.539 9.119 -0.944) 9.827 6.128 ( -1.038 -4.655 7.659) 9.023 6.139 ( -5.389 -3.012 2.652) 6.719 6.289 ( 5.172 1.038 1.159) 5.401 6.344 ( 6.144 2.408 8.031) 10.394 6.468 ( -8.507 -3.208 15.547) 18.010 6.722 ( -5.491 -0.310 42.668) 43.021 6.766 ( -4.933 -6.790 22.414) 23.934 7.024 ( -7.562 -0.797 32.254) 33.138 7.184 ( 0.129 -3.431 1.084) 3.600 7.273 ( 1.666 0.347 12.030) 12.150 7.327 ( -2.123 0.458 8.551) 8.823 7.415 ( 3.368 -1.657 3.879) 5.398 7.662 ( 3.465 -2.206 12.953) 13.589 7.734 ( 7.711 -1.151 -0.824) 7.840 7.786 ( 4.558 2.725 -2.835) 6.020 7.933 ( -0.185 9.147 -1.522) 9.275 8.078 ( 5.725 -0.816 -4.811) 7.523 8.288 ( 2.682 2.513 -4.436) 5.760 8.311 ( 5.704 7.206 -4.921) 10.425 8.434 ( -1.892 -1.064 -8.523) 8.795 8.631 ( 1.643 1.204 -2.884) 3.531 8.717 ( -2.680 -0.863 -4.999) 5.737 8.871 ( -3.556 -0.289 -11.461) 12.003 8.935 ( -6.778 -0.433 -4.251) 8.012 9.006 ( 0.109 6.103 0.912) 6.171 9.209 ( -1.005 -6.030 -3.901) 7.251 9.385 ( 1.695 -2.643 -0.065) 3.141 9.533 ( 6.533 -0.033 -10.481) 12.350 9.600 ( 6.963 2.046 -8.491) 11.170 9.654 ( 0.342 0.884 -7.420) 7.480 9.723 ( 0.324 -1.893 -4.518) 4.909 9.765 ( -1.040 -0.963 -4.233) 4.464 10.006 ( -2.363 3.078 0.771) 3.956 10.109 ( -3.267 -4.608 -7.416) 9.322 10.281 ( 4.514 -6.382 -7.317) 10.707 10.392 ( -2.667 -2.843 0.834) 3.987 10.444 ( -5.138 -0.770 -10.668) 11.866 10.657 ( 1.851 8.628 -4.557) 9.931 10.737 ( 0.798 9.178 -11.295) 14.576 10.829 ( -0.883 1.784 -6.225) 6.536 11.117 ( -2.590 -2.410 -5.701) 6.710 11.297 ( -10.864 2.076 13.544) 17.487 11.315 ( -0.662 1.195 -3.501) 3.758 11.414 ( 1.807 4.711 -3.241) 5.997 11.602 ( 1.997 -12.107 0.299) 12.275 11.919 ( 4.015 -1.554 9.429) 10.365 11.990 ( 6.582 -5.695 3.317) 9.315 12.052 ( -4.240 -12.903 2.801) 13.868 12.449 ( -2.851 -0.836 8.051) 8.582 12.472 ( 3.043 5.883 6.652) 9.387 12.587 ( -3.143 5.165 -1.110) 6.147 12.874 ( -3.605 -3.588 6.284) 8.085 13.071 ( -6.624 -3.296 5.477) 9.205 13.269 ( 3.707 -0.129 -7.763) 8.603 13.380 ( 6.741 -1.044 -1.913) 7.084 13.874 ( -0.015 -5.646 -4.306) 7.101 14.019 ( 4.152 -1.752 -2.369) 5.092 14.095 ( -0.842 -6.582 5.744) 8.776 14.475 ( 2.964 -9.045 -5.650) 11.069 14.761 ( 6.510 -2.587 -9.929) 12.151 15.021 ( -3.408 -0.028 -7.624) 8.351 15.194 ( 0.857 9.328 -7.651) 12.095 15.304 ( -2.233 -0.024 -13.647) 13.828 15.743 ( 2.769 2.787 0.535) 3.965 15.915 ( -0.673 0.790 8.789) 8.850 15.971 ( 0.989 1.586 1.547) 2.426 16.233 ( 0.986 4.085 4.397) 6.082 16.287 ( -7.822 -5.896 12.323) 15.742 16.442 ( 2.847 -3.007 14.554) 15.132 16.687 ( -9.411 6.359 7.027) 13.356 16.758 ( -5.392 -2.144 4.854) 7.565 18.993 ( -3.699 2.995 18.592) 19.191 19.255 ( -6.305 -1.891 9.889) 11.879 20.271 ( -4.400 -1.783 14.941) 15.677 20.366 ( -5.432 -3.254 13.832) 15.213 21.582 ( 8.791 6.950 -39.083) 40.658 21.987 ( 8.647 1.154 -27.771) 29.109 22.157 ( -2.042 2.011 -28.441) 28.585 22.505 ( 4.252 -2.221 -23.738) 24.218 24.541 ( 3.612 1.050 6.229) 7.277 24.665 ( 6.519 -0.922 6.036) 8.932 25.722 ( 15.774 1.330 -15.288) 22.008 25.940 ( 8.778 -1.839 -0.829) 9.007 26.022 ( 7.033 1.848 -0.814) 7.317 26.247 ( -8.426 -1.957 15.598) 17.836 26.969 ( -6.015 -1.143 -13.986) 15.268 27.259 ( -2.189 -5.926 -20.074) 21.044 29.316 ( -0.247 1.724 -2.663) 3.182 29.394 ( 3.491 6.815 1.349) 7.775 29.554 ( -3.253 0.016 2.963) 4.401 29.832 ( 2.429 1.550 2.966) 4.135 30.170 ( -2.406 2.329 2.105) 3.956 30.433 ( -7.453 4.118 4.747) 9.749 30.812 ( -2.240 -3.878 11.538) 12.377 30.897 ( -0.931 1.196 12.462) 12.554 31.233 ( 6.006 -10.142 -0.267) 11.790 31.494 ( -3.730 -6.947 10.689) 13.282 31.680 ( 12.116 9.726 -6.079) 16.684 31.839 ( 4.213 -2.169 16.905) 17.557 32.107 ( 0.173 -5.424 1.837) 5.730 32.166 ( -14.891 -1.574 11.053) 18.612 32.463 ( -9.667 8.607 -0.803) 12.969 32.577 ( 1.871 2.927 -13.404) 13.847 ======================= Grid point 142 (74/128) ======================= q-point: (-0.50 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.856 ( -12.054 3.802 16.313) 20.637 3.014 ( 2.978 14.899 20.731) 25.703 3.138 ( -28.854 9.482 15.742) 34.209 3.603 ( -2.004 -2.431 2.336) 3.922 3.895 ( 4.039 3.242 4.459) 6.834 3.913 ( 1.791 3.284 14.380) 14.858 4.047 ( -2.113 4.296 -1.507) 5.019 4.172 ( 9.048 -15.894 -1.906) 18.388 4.521 ( -0.376 -4.879 13.750) 14.595 4.597 ( -0.263 -0.547 -6.156) 6.186 4.745 ( -0.329 -7.801 8.844) 11.798 4.895 ( -1.308 -0.202 1.983) 2.384 5.123 ( 2.932 -1.020 -1.301) 3.366 5.279 ( -6.285 15.341 18.080) 24.530 5.372 ( -3.002 1.201 4.530) 5.566 5.466 ( 7.132 10.277 0.167) 12.511 5.640 ( 0.330 13.552 -2.320) 13.753 6.056 ( -3.713 -1.835 -0.437) 4.165 6.093 ( -2.983 -3.193 3.442) 5.563 6.341 ( -11.789 -0.530 31.926) 34.037 6.401 ( 5.802 -0.872 3.577) 6.872 6.579 ( 8.749 1.873 5.123) 10.310 6.656 ( -12.135 -0.212 27.325) 29.899 6.796 ( -7.694 -5.133 41.900) 42.909 6.954 ( -14.401 -3.625 36.546) 39.448 7.159 ( -3.700 -0.459 1.929) 4.198 7.258 ( -5.561 -2.642 8.626) 10.598 7.386 ( 2.318 -0.250 3.175) 3.939 7.529 ( 7.490 6.335 1.787) 9.971 7.758 ( 1.295 1.358 12.949) 13.084 7.793 ( -0.028 -0.518 -3.658) 3.695 7.828 ( -1.726 6.258 -0.309) 6.499 7.990 ( 6.439 -0.954 -10.369) 12.243 8.114 ( 1.373 -3.097 -7.244) 7.997 8.237 ( -0.798 0.449 -8.095) 8.147 8.369 ( -2.268 1.159 -6.522) 7.002 8.410 ( 0.836 4.130 -4.191) 5.943 8.533 ( -6.342 3.408 -2.526) 7.630 8.776 ( 3.663 2.195 -1.362) 4.482 8.813 ( 4.866 -2.499 -2.622) 6.066 8.886 ( 8.658 1.164 -9.368) 12.809 9.059 ( 1.548 1.873 -1.017) 2.634 9.152 ( -0.293 0.726 -3.929) 4.006 9.348 ( -5.488 -3.842 -0.147) 6.701 9.531 ( -4.269 -4.951 -9.972) 11.923 9.624 ( 1.739 2.412 -6.373) 7.033 9.658 ( 3.804 0.007 -4.136) 5.619 9.715 ( -1.309 -4.916 -8.402) 9.822 9.808 ( 5.376 1.523 -6.001) 8.200 9.975 ( -1.161 -2.764 6.161) 6.851 10.033 ( 0.258 5.771 -8.538) 10.309 10.290 ( -5.348 -1.036 -12.234) 13.392 10.342 ( 0.992 -2.518 -4.204) 4.999 10.418 ( 8.667 -6.507 -5.817) 12.300 10.574 ( -6.361 2.319 4.937) 8.380 10.730 ( -1.480 13.518 -12.329) 18.356 10.831 ( 6.990 2.249 -10.562) 12.864 11.079 ( 1.552 -4.091 -7.988) 9.108 11.162 ( -6.270 0.974 4.696) 7.894 11.329 ( 1.325 1.089 5.567) 5.826 11.455 ( 2.707 5.294 -3.273) 6.787 11.639 ( 1.848 -10.229 0.433) 10.403 11.880 ( -4.737 -10.841 2.918) 12.185 12.080 ( 3.268 -3.851 2.950) 5.849 12.211 ( 5.916 -4.550 11.536) 13.740 12.308 ( -6.430 2.477 6.790) 9.674 12.597 ( 2.626 2.870 2.399) 4.571 12.621 ( 4.990 -0.479 4.566) 6.781 12.842 ( -3.199 -5.564 5.582) 8.506 12.968 ( -4.755 -1.972 5.503) 7.536 13.288 ( 1.343 4.088 -6.949) 8.173 13.479 ( 5.122 -2.020 -3.999) 6.805 13.809 ( -3.632 -1.817 -6.167) 7.384 14.073 ( -1.261 -6.737 8.456) 10.885 14.116 ( 3.063 -2.832 -3.555) 5.481 14.494 ( 2.113 -7.247 -8.515) 11.380 14.874 ( 9.249 -4.446 -8.189) 13.129 14.931 ( -1.993 2.726 -7.657) 8.369 15.142 ( -1.447 1.405 -15.750) 15.878 15.240 ( 0.872 3.044 -9.871) 10.367 15.812 ( 3.472 3.465 3.068) 5.785 15.930 ( -1.652 3.793 8.429) 9.389 16.038 ( 4.257 -3.030 5.592) 7.653 16.179 ( -8.843 -2.602 14.266) 16.985 16.241 ( -2.095 2.979 4.908) 6.111 16.552 ( -1.987 3.244 5.606) 6.775 16.640 ( 4.574 -0.333 14.187) 14.909 16.682 ( -3.142 -2.398 3.795) 5.480 19.014 ( -2.827 2.788 20.230) 20.616 19.240 ( 0.348 -1.546 12.069) 12.172 20.233 ( -5.305 -1.146 10.893) 12.170 20.359 ( -2.317 -3.107 17.396) 17.822 21.599 ( 10.038 6.515 -37.793) 39.642 21.989 ( -2.010 2.568 -31.814) 31.980 22.043 ( 9.487 1.298 -27.072) 28.715 22.468 ( 2.554 -2.783 -23.555) 23.856 24.688 ( 7.887 1.267 8.458) 11.634 24.837 ( 7.785 -1.061 8.696) 11.720 25.667 ( -12.248 1.247 -18.014) 21.819 25.933 ( -6.760 1.289 12.722) 14.464 26.025 ( -8.427 -4.021 -21.406) 23.354 26.115 ( -11.884 -0.956 11.610) 16.641 26.971 ( 12.269 -0.561 -10.749) 16.321 27.290 ( 12.934 -5.643 -16.376) 21.617 29.295 ( -4.533 4.924 -0.356) 6.702 29.347 ( -0.555 4.428 -2.822) 5.280 29.664 ( 8.214 -2.504 7.426) 11.353 29.886 ( 2.062 0.066 2.408) 3.171 30.120 ( -4.412 0.057 1.911) 4.808 30.361 ( -1.017 10.262 0.617) 10.331 30.780 ( -6.794 -3.765 12.360) 14.598 30.918 ( -2.159 1.859 14.694) 14.967 31.294 ( 1.385 -8.263 0.983) 8.435 31.462 ( -5.556 -7.541 11.318) 14.691 31.669 ( -8.368 5.857 -3.543) 10.811 31.778 ( -19.586 3.578 10.402) 22.463 32.049 ( 5.075 -6.536 1.320) 8.380 32.164 ( 1.055 -4.901 7.945) 9.394 32.450 ( 9.411 9.152 -9.133) 15.991 32.728 ( 15.872 2.634 -0.101) 16.090 ======================= Grid point 143 (75/128) ======================= q-point: (-0.33 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( -21.934 5.943 21.568) 31.330 2.668 ( -26.625 11.291 21.624) 36.111 3.093 ( -2.661 16.980 11.909) 20.910 3.662 ( 4.271 -4.283 11.777) 13.239 3.868 ( -6.402 4.810 8.718) 11.838 4.031 ( 8.912 -0.001 0.336) 8.918 4.060 ( 1.075 2.001 3.097) 3.840 4.303 ( 2.823 -20.651 4.597) 21.344 4.464 ( -4.964 -5.280 2.191) 7.572 4.628 ( -1.570 -1.694 9.617) 9.891 4.832 ( 5.799 -2.672 6.997) 9.472 4.927 ( 3.891 2.241 -1.029) 4.607 5.172 ( 2.690 4.450 -2.536) 5.785 5.213 ( -6.861 11.479 14.742) 19.904 5.359 ( 0.406 3.332 1.069) 3.523 5.548 ( 1.153 6.755 0.865) 6.907 5.671 ( 3.142 10.336 0.680) 10.824 6.006 ( -1.235 -0.998 -1.144) 1.957 6.095 ( 1.132 -1.591 4.452) 4.862 6.279 ( -8.674 1.968 31.328) 32.566 6.416 ( -13.097 -1.701 38.503) 40.705 6.637 ( 3.841 -0.004 -1.177) 4.018 6.702 ( -3.894 -3.578 25.760) 26.298 6.797 ( -4.882 -2.771 23.503) 24.164 6.858 ( -9.584 -9.723 27.076) 30.323 7.026 ( -11.828 1.552 2.905) 12.278 7.201 ( -2.488 1.101 2.346) 3.592 7.386 ( -2.379 5.196 -2.572) 6.267 7.634 ( 0.954 12.140 -2.569) 12.445 7.686 ( -5.039 -1.725 -0.727) 5.376 7.787 ( -4.642 1.225 8.077) 9.396 7.847 ( 2.877 -4.002 1.092) 5.048 7.959 ( -4.926 -2.918 -5.728) 8.099 8.103 ( 0.054 4.029 -13.237) 13.837 8.246 ( 3.838 -0.152 -4.934) 6.253 8.288 ( 0.293 2.609 -10.217) 10.549 8.304 ( -3.425 0.978 1.856) 4.017 8.565 ( 3.538 3.172 -1.812) 5.086 8.745 ( -0.822 3.604 -1.954) 4.181 8.935 ( -3.872 0.416 -5.881) 7.054 9.031 ( 10.010 -0.575 -3.509) 10.623 9.105 ( 11.055 0.904 -5.154) 12.231 9.203 ( -1.628 -1.224 -1.640) 2.615 9.261 ( 2.258 0.248 0.629) 2.358 9.378 ( -6.024 -3.527 -4.262) 8.179 9.539 ( -5.906 -7.428 -4.642) 10.564 9.616 ( -5.943 4.698 -1.190) 7.669 9.755 ( 5.727 -5.159 -5.075) 9.229 9.888 ( 6.549 -0.115 -7.995) 10.335 10.024 ( 4.904 3.407 1.217) 6.094 10.070 ( 4.127 -0.451 -0.947) 4.258 10.183 ( 0.507 3.039 -9.968) 10.433 10.353 ( 1.252 -1.117 -3.465) 3.850 10.500 ( 0.780 -4.148 2.295) 4.804 10.578 ( 2.134 1.754 -7.270) 7.778 10.655 ( 3.676 6.975 -8.271) 11.427 10.914 ( 5.806 3.293 -9.879) 11.922 11.031 ( -4.649 3.266 -0.927) 5.757 11.176 ( 7.402 -4.990 -9.358) 12.933 11.398 ( 3.257 -1.165 6.888) 7.708 11.453 ( -1.812 1.736 -1.489) 2.918 11.656 ( 0.324 -9.542 -3.839) 10.290 11.837 ( -2.951 -5.062 6.078) 8.443 12.105 ( -8.127 -3.668 10.154) 13.514 12.173 ( 3.719 3.722 2.235) 5.717 12.410 ( 2.063 -1.760 9.953) 10.315 12.629 ( -3.124 -0.908 7.337) 8.026 12.687 ( 1.683 -4.285 0.328) 4.615 12.822 ( 2.446 -4.315 4.438) 6.655 12.967 ( 0.653 -2.645 1.064) 2.925 13.267 ( -1.422 7.708 -2.847) 8.339 13.522 ( 1.087 -2.549 -3.653) 4.586 13.724 ( -1.986 -1.215 -7.557) 7.908 14.066 ( -2.424 -6.421 6.958) 9.773 14.138 ( 0.513 -1.773 -3.446) 3.909 14.490 ( 1.590 -6.876 -9.409) 11.762 14.876 ( 0.246 2.603 -12.697) 12.963 14.992 ( 5.583 0.282 -10.343) 11.757 15.116 ( 6.530 -2.662 -7.064) 9.981 15.221 ( 1.587 -0.580 -12.348) 12.463 15.863 ( -1.018 3.234 6.595) 7.415 15.914 ( -3.358 5.292 5.672) 8.453 16.069 ( -4.767 0.063 11.919) 12.838 16.166 ( 2.837 0.259 -0.831) 2.968 16.215 ( -2.010 -2.645 9.612) 10.170 16.487 ( -4.886 3.273 3.718) 6.958 16.673 ( 2.130 0.566 1.614) 2.732 16.884 ( 11.404 -8.559 13.628) 19.724 19.036 ( -1.950 2.403 11.629) 12.034 19.374 ( 5.490 -2.212 24.485) 25.191 20.193 ( -3.156 0.165 11.420) 11.849 20.404 ( -1.048 -2.997 18.465) 18.735 21.642 ( 10.613 5.983 -35.512) 37.544 21.842 ( 1.348 4.771 -35.034) 35.383 22.131 ( 11.794 -0.024 -26.169) 28.704 22.419 ( 2.528 -2.991 -23.529) 23.853 24.830 ( 2.056 1.383 8.653) 9.001 24.968 ( 1.446 -0.830 9.449) 9.595 25.303 ( -16.985 0.406 -14.652) 22.435 25.574 ( -26.664 -4.143 -22.679) 35.249 25.847 ( -8.016 1.262 13.557) 15.800 25.990 ( -5.202 -0.965 13.889) 14.862 27.229 ( 17.200 -0.170 -10.436) 20.119 27.479 ( 13.031 -3.961 -18.015) 22.584 29.185 ( -5.272 7.028 0.249) 8.790 29.387 ( 3.943 2.632 -1.083) 4.863 29.821 ( 4.683 -4.211 7.217) 9.578 29.883 ( -4.106 -4.753 -2.587) 6.793 30.085 ( 1.870 3.491 4.648) 6.106 30.393 ( 4.253 13.233 -1.711) 14.005 30.672 ( -9.733 -2.809 11.236) 15.128 30.940 ( -2.329 1.029 15.169) 15.381 31.264 ( -11.941 -4.999 9.932) 16.316 31.341 ( -6.645 -3.342 6.468) 9.857 31.489 ( -8.336 3.830 0.979) 9.226 31.586 ( -4.780 -0.448 8.999) 10.199 32.109 ( 1.497 -5.363 0.103) 5.569 32.192 ( -1.097 -4.470 9.886) 10.905 32.643 ( 14.307 7.728 -15.632) 22.556 33.050 ( 17.453 0.503 -2.443) 17.630 ======================= Grid point 144 (76/128) ======================= q-point: (-0.17 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( -16.686 13.733 32.939) 39.395 2.423 ( -15.140 10.593 26.554) 32.351 3.072 ( -3.509 11.315 10.301) 15.699 3.728 ( -6.601 13.521 24.341) 28.616 3.867 ( 2.161 -4.433 12.305) 13.257 4.070 ( 0.769 -9.185 -2.328) 9.507 4.199 ( 8.004 -4.101 -2.410) 9.311 4.311 ( -2.562 -12.197 1.537) 12.557 4.416 ( -0.605 -8.695 -0.237) 8.719 4.588 ( -7.296 1.911 12.727) 14.794 4.963 ( 2.848 4.688 -0.780) 5.540 5.022 ( 8.129 3.145 3.897) 9.547 5.147 ( -3.628 4.711 10.197) 11.803 5.219 ( 2.222 8.282 -1.877) 8.777 5.352 ( -1.110 5.015 2.255) 5.610 5.626 ( 5.940 -0.221 3.864) 7.090 5.666 ( -5.228 10.534 0.075) 11.760 6.000 ( 0.055 0.123 2.577) 2.580 6.144 ( 1.122 1.027 7.438) 7.592 6.284 ( -2.450 -1.266 21.645) 21.820 6.353 ( -10.402 -1.340 39.310) 40.685 6.561 ( -13.779 -3.819 26.300) 29.935 6.684 ( -12.056 0.338 16.770) 20.656 6.777 ( -7.936 -4.512 14.882) 17.459 6.814 ( -3.144 -6.106 11.640) 13.515 6.927 ( 4.250 -8.267 -0.724) 9.323 7.142 ( -3.844 5.957 -1.267) 7.202 7.371 ( 4.029 7.171 -5.977) 10.167 7.544 ( -3.576 -0.950 -1.984) 4.198 7.620 ( -7.993 5.364 6.248) 11.476 7.725 ( -2.687 5.888 -6.814) 9.398 7.794 ( -6.138 0.133 -1.747) 6.383 7.900 ( -2.992 -4.538 8.827) 10.366 8.013 ( -1.863 4.009 -10.326) 11.233 8.251 ( -3.229 0.924 3.398) 4.778 8.302 ( 1.976 1.427 -9.334) 9.647 8.390 ( 10.674 -0.615 -0.490) 10.702 8.608 ( 2.788 3.755 -5.573) 7.275 8.703 ( -1.286 0.802 -4.040) 4.315 8.881 ( 1.164 6.601 -5.027) 8.379 9.032 ( -1.993 -0.237 -3.548) 4.076 9.146 ( -2.482 -2.797 -0.567) 3.782 9.285 ( 2.305 -0.503 0.402) 2.393 9.325 ( 6.564 -1.229 -4.073) 7.822 9.335 ( -0.560 3.325 -0.068) 3.373 9.511 ( -0.920 -2.223 -1.151) 2.667 9.519 ( 2.533 1.036 -4.034) 4.874 9.760 ( -0.394 -10.859 -10.090) 14.829 9.968 ( 3.601 -0.400 -2.521) 4.414 10.131 ( 1.522 -1.540 2.084) 3.005 10.153 ( 5.628 0.084 4.425) 7.159 10.235 ( 8.001 4.277 -9.840) 13.384 10.327 ( -0.072 4.812 -5.814) 7.548 10.515 ( -0.227 -2.172 1.379) 2.583 10.594 ( 5.317 4.562 -7.048) 9.938 10.735 ( 3.221 -3.485 -4.696) 6.677 10.951 ( -1.515 4.752 -5.289) 7.269 10.987 ( 7.030 6.128 -8.691) 12.747 11.273 ( 6.464 -6.071 -9.423) 12.939 11.393 ( -3.414 -0.263 -2.596) 4.297 11.490 ( 3.095 -2.114 6.362) 7.383 11.629 ( -0.498 -7.977 -4.322) 9.086 11.765 ( -8.830 -0.921 10.717) 13.917 12.040 ( -1.837 -4.094 8.378) 9.504 12.283 ( 4.563 5.795 4.883) 8.846 12.374 ( -9.812 -0.801 9.445) 13.643 12.608 ( -1.470 -5.074 6.525) 8.395 12.697 ( 1.649 -5.975 -4.564) 7.698 12.940 ( 5.252 -0.235 -0.241) 5.262 12.973 ( 1.885 -0.672 2.567) 3.254 13.201 ( -5.928 5.794 2.408) 8.632 13.484 ( -3.715 -3.178 -2.273) 5.391 13.692 ( 1.904 -2.123 -7.809) 8.314 14.045 ( -2.085 -4.829 2.923) 6.017 14.117 ( -1.159 -3.198 -1.570) 3.746 14.474 ( 0.558 -8.409 -8.311) 11.836 14.799 ( -0.876 0.900 -18.280) 18.323 15.086 ( 6.259 4.402 -3.504) 8.416 15.193 ( 2.778 -1.805 -8.067) 8.721 15.255 ( 8.576 -3.052 -10.036) 13.549 15.819 ( -4.402 4.812 6.411) 9.145 15.879 ( -3.505 4.603 6.128) 8.428 16.053 ( -1.935 2.432 6.245) 6.976 16.122 ( -3.543 -2.803 -1.354) 4.716 16.288 ( 2.987 -1.271 5.510) 6.395 16.432 ( -2.694 2.093 4.302) 5.490 16.740 ( 3.175 0.014 4.642) 5.624 17.085 ( 4.660 -12.386 5.369) 14.281 19.037 ( -1.924 2.602 6.695) 7.436 19.545 ( -0.702 -4.871 25.414) 25.886 20.239 ( 2.072 0.169 15.211) 15.352 20.455 ( -1.770 -2.995 17.789) 18.126 21.664 ( 6.456 6.040 -35.546) 36.629 21.795 ( 9.719 5.409 -34.745) 36.482 22.258 ( 13.260 -0.607 -25.101) 28.394 22.374 ( 3.009 -2.593 -23.833) 24.162 24.806 ( -6.937 2.363 5.967) 9.451 24.930 ( -9.034 -0.137 6.015) 10.854 24.999 ( -12.201 -0.120 -9.513) 15.472 25.087 ( -11.306 -1.872 -10.175) 15.326 25.812 ( -1.665 1.922 16.352) 16.549 26.044 ( 3.636 -1.633 14.599) 15.133 27.435 ( 9.306 -1.088 -12.008) 15.231 27.576 ( 5.843 -2.351 -20.626) 21.567 29.128 ( -1.192 6.990 1.499) 7.248 29.452 ( 2.593 2.866 -0.510) 3.898 29.759 ( -5.308 -3.460 -4.251) 7.630 29.876 ( -1.697 -2.930 4.921) 5.973 30.214 ( 9.096 1.270 4.515) 10.234 30.469 ( 1.191 12.194 -0.835) 12.280 30.566 ( -2.351 -2.657 8.499) 9.210 30.921 ( -7.541 1.111 13.329) 15.354 31.047 ( -11.954 -1.803 12.648) 17.496 31.304 ( -1.844 -0.855 12.372) 12.538 31.432 ( 0.373 1.863 0.463) 1.956 31.569 ( -2.891 -3.670 11.822) 12.712 32.119 ( -0.024 -4.457 -0.109) 4.458 32.221 ( -0.188 -3.862 9.706) 10.448 32.786 ( 8.195 6.582 -17.586) 20.488 33.255 ( 6.048 -1.018 -9.857) 11.609 ======================= Grid point 145 (77/128) ======================= q-point: ( 0.00 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.644 ( -2.943 18.271 20.920) 27.931 2.769 ( 7.196 23.922 27.348) 37.039 3.185 ( -2.640 2.928 4.508) 5.989 3.678 ( -6.573 -10.589 1.264) 12.527 3.725 ( -1.262 -19.364 12.032) 22.832 3.935 ( -4.143 -7.057 0.657) 8.209 4.169 ( 6.133 0.315 12.910) 14.296 4.319 ( 9.710 2.060 0.770) 9.956 4.359 ( -1.513 9.311 2.758) 9.828 4.595 ( -4.281 2.391 0.957) 4.996 5.034 ( -4.413 2.923 6.365) 8.278 5.192 ( -6.353 6.574 9.289) 13.033 5.286 ( -8.504 3.634 -1.688) 9.400 5.315 ( 3.858 4.748 7.541) 9.710 5.469 ( 6.175 -0.399 7.325) 9.589 5.634 ( -4.040 -5.615 2.612) 7.394 5.825 ( -5.357 17.238 6.354) 19.137 6.120 ( 2.098 4.266 6.972) 8.439 6.182 ( 0.269 3.185 4.947) 5.890 6.249 ( -5.413 -4.257 20.723) 21.837 6.355 ( -4.794 -3.915 17.057) 18.146 6.402 ( -1.946 3.228 14.075) 14.571 6.517 ( -5.987 -1.829 11.439) 13.040 6.607 ( -8.762 -2.059 29.467) 30.811 6.721 ( 1.666 -7.364 -1.078) 7.626 6.819 ( 3.884 -10.422 16.292) 19.727 7.209 ( -4.319 5.388 4.826) 8.425 7.341 ( -2.252 -2.781 5.998) 6.984 7.504 ( -6.773 1.292 2.466) 7.323 7.564 ( -7.261 -1.603 -3.781) 8.341 7.758 ( 0.720 2.966 -0.781) 3.150 7.804 ( -2.794 2.130 1.393) 3.779 7.927 ( 3.353 2.596 4.947) 6.516 8.082 ( 6.774 3.382 -2.236) 7.895 8.196 ( -5.107 4.235 5.079) 8.356 8.427 ( 5.625 6.535 -10.017) 13.217 8.534 ( 3.029 1.343 -0.934) 3.443 8.598 ( 2.817 -4.042 -6.683) 8.303 8.752 ( 1.849 2.230 -4.234) 5.130 8.991 ( -0.173 -4.845 -0.064) 4.849 9.000 ( -1.362 -0.318 -7.959) 8.081 9.076 ( 2.439 6.542 -6.143) 9.300 9.196 ( -1.271 -5.926 -7.616) 9.733 9.344 ( -1.611 3.034 -0.246) 3.444 9.381 ( -1.914 0.963 -1.123) 2.419 9.546 ( 4.488 -5.329 -3.744) 7.909 9.583 ( 5.059 0.165 -2.063) 5.466 9.640 ( 3.918 2.537 -3.394) 5.772 10.012 ( -1.182 0.401 -3.060) 3.305 10.075 ( -1.120 -0.753 -2.687) 3.007 10.129 ( -2.769 -2.497 3.509) 5.120 10.251 ( -3.319 -6.397 -4.390) 8.439 10.481 ( 3.598 8.196 -3.889) 9.760 10.564 ( 2.112 7.319 -2.678) 8.075 10.743 ( 4.320 -1.379 -5.167) 6.875 10.781 ( 4.908 5.870 -7.557) 10.754 10.950 ( 0.158 0.881 -9.470) 9.513 11.076 ( 3.195 -13.445 6.350) 15.208 11.285 ( 1.450 4.206 -9.782) 10.746 11.340 ( 4.432 -0.242 -11.144) 11.996 11.465 ( -0.545 -0.552 -7.423) 7.464 11.523 ( 4.560 -5.388 1.688) 7.258 11.667 ( -5.454 2.678 14.029) 15.289 12.018 ( 3.089 -5.609 2.673) 6.939 12.148 ( -15.340 0.339 7.457) 17.060 12.328 ( -8.851 -7.902 2.679) 12.164 12.491 ( 1.502 3.475 10.003) 10.696 12.713 ( 7.133 -6.057 3.942) 10.154 13.008 ( -0.616 3.255 -5.549) 6.462 13.056 ( 2.044 0.568 2.691) 3.427 13.175 ( -1.922 2.488 1.155) 3.349 13.312 ( -6.968 -3.209 -2.488) 8.065 13.661 ( 1.432 -1.057 0.051) 1.780 13.883 ( -1.677 -10.339 7.800) 13.060 14.033 ( -2.097 1.085 -1.576) 2.838 14.265 ( -0.523 -8.989 -3.615) 9.703 14.806 ( 0.968 5.695 -18.377) 19.263 15.037 ( 0.520 -5.477 -13.540) 14.615 15.311 ( 6.677 1.268 -3.495) 7.643 15.328 ( 6.406 -1.036 -7.837) 10.175 15.828 ( -4.855 3.243 3.628) 6.874 15.939 ( -3.782 -1.904 0.287) 4.244 15.997 ( -0.169 5.095 5.468) 7.475 16.135 ( 0.820 -1.320 5.516) 5.730 16.356 ( -0.095 3.702 3.031) 4.785 16.431 ( -2.339 1.912 3.264) 4.448 16.760 ( 0.361 -2.935 3.981) 4.959 16.879 ( -1.816 -8.802 4.071) 9.867 19.111 ( -4.334 6.410 13.956) 15.958 19.412 ( -8.604 -7.148 21.556) 24.286 20.291 ( -3.845 0.245 15.563) 16.033 20.392 ( -4.708 -4.046 15.360) 16.567 21.780 ( 6.250 8.426 -35.693) 37.203 21.943 ( 8.927 2.287 -30.836) 32.183 22.304 ( 6.170 -1.044 -25.979) 26.722 22.362 ( 11.542 -2.265 -25.149) 27.764 24.688 ( -10.717 1.539 2.436) 11.098 24.727 ( -12.825 -0.410 2.531) 13.079 25.014 ( 15.969 1.481 -4.278) 16.598 25.076 ( 14.561 -1.743 -5.561) 15.684 25.952 ( 1.687 4.079 17.394) 17.945 26.124 ( 3.244 -3.991 16.111) 16.912 27.417 ( -3.453 0.255 -14.272) 14.686 27.498 ( -0.592 -2.772 -21.272) 21.460 29.313 ( 2.184 8.804 0.316) 9.076 29.484 ( -4.578 1.779 -3.157) 5.839 29.699 ( 3.811 -0.469 1.355) 4.072 29.787 ( -1.675 -2.954 2.510) 4.222 30.333 ( -1.264 1.769 6.216) 6.585 30.489 ( 3.926 -4.972 8.035) 10.232 30.709 ( -2.797 4.718 0.609) 5.519 30.805 ( -8.353 -0.058 6.636) 10.668 31.023 ( -0.361 4.989 14.291) 15.141 31.319 ( -0.162 -6.537 17.942) 19.097 31.463 ( 1.607 0.615 4.040) 4.392 31.554 ( 3.864 0.120 9.149) 9.932 32.059 ( -0.570 -1.123 2.817) 3.086 32.168 ( -1.014 -4.632 11.897) 12.807 32.921 ( -0.723 7.198 -19.918) 21.191 33.141 ( -6.515 -2.863 -17.132) 18.551 ======================= Grid point 146 (78/128) ======================= q-point: ( 0.17 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.747 ( 4.881 16.563 20.092) 26.492 3.104 ( 12.792 12.504 17.936) 25.331 3.235 ( 8.476 8.377 11.105) 16.289 3.532 ( -8.792 -12.413 3.271) 15.559 3.791 ( 1.492 -12.496 12.746) 17.912 3.889 ( -0.824 -9.162 1.016) 9.255 4.256 ( -2.415 4.466 1.944) 5.437 4.292 ( -6.847 12.963 3.414) 15.053 4.460 ( -2.238 8.249 5.734) 10.292 4.527 ( 4.485 -0.220 -0.660) 4.539 4.896 ( -13.268 -3.428 8.486) 16.118 5.061 ( -8.814 -2.399 -0.687) 9.161 5.143 ( -6.792 7.124 -1.476) 9.954 5.355 ( -1.322 2.730 10.165) 10.608 5.551 ( -3.230 0.865 1.759) 3.779 5.616 ( 1.829 -4.714 7.345) 8.917 5.810 ( 0.149 17.629 8.779) 19.695 6.156 ( -3.100 0.249 11.413) 11.829 6.185 ( -3.513 4.323 16.966) 17.857 6.232 ( -1.053 4.273 7.595) 8.778 6.310 ( -2.412 -7.264 5.332) 9.329 6.438 ( 0.321 3.898 -0.532) 3.947 6.572 ( 1.250 -1.586 28.511) 28.582 6.668 ( -0.286 1.738 28.257) 28.312 6.805 ( 6.489 -9.602 7.773) 13.955 6.961 ( 5.866 -9.735 10.004) 15.142 7.227 ( 3.204 3.428 7.826) 9.125 7.362 ( -0.887 -0.975 12.031) 12.103 7.430 ( -6.270 -0.661 0.971) 6.379 7.436 ( -1.541 -1.871 7.634) 8.010 7.718 ( -3.918 1.194 8.077) 9.056 7.781 ( -0.587 -0.653 0.024) 0.879 7.985 ( 2.032 1.344 1.539) 2.882 8.130 ( -3.380 0.003 3.214) 4.664 8.258 ( 9.477 9.525 -1.248) 13.494 8.461 ( 2.173 8.146 -8.127) 11.710 8.518 ( -0.054 6.601 -6.718) 9.419 8.657 ( 2.262 -5.235 -1.625) 5.930 8.748 ( 0.464 1.419 -9.015) 9.138 8.916 ( -2.160 -5.095 -9.870) 11.316 8.985 ( -1.118 -0.361 -4.587) 4.735 9.113 ( 3.341 3.360 -4.465) 6.510 9.166 ( -1.043 -1.142 -4.433) 4.695 9.313 ( 0.776 2.092 -1.321) 2.593 9.392 ( 4.367 -4.046 -1.303) 6.094 9.527 ( -1.589 -6.704 -5.822) 9.020 9.668 ( 1.489 3.494 -6.188) 7.261 9.695 ( 4.521 0.256 -1.634) 4.814 9.917 ( -4.524 3.111 -5.084) 7.483 10.073 ( -1.292 -0.464 3.260) 3.537 10.080 ( -3.184 -3.568 -2.005) 5.185 10.164 ( -2.447 -6.666 -5.416) 8.931 10.482 ( -2.033 5.720 -0.977) 6.149 10.577 ( -0.411 5.698 -8.093) 9.906 10.779 ( 3.297 1.789 -5.543) 6.693 10.802 ( 1.576 3.759 -9.533) 10.368 10.924 ( 1.055 2.422 -10.158) 10.496 11.164 ( 2.681 -10.284 2.691) 10.963 11.244 ( -0.481 -2.850 -8.057) 8.559 11.383 ( 3.582 5.419 -8.054) 10.347 11.443 ( 0.988 -2.180 -3.725) 4.427 11.565 ( -2.329 8.269 5.246) 10.066 11.708 ( 3.912 -8.852 5.921) 11.346 11.907 ( -10.834 1.725 8.747) 14.031 11.986 ( -9.457 -8.752 -0.225) 12.887 12.264 ( 1.701 -9.239 9.318) 13.231 12.548 ( 0.354 4.984 9.750) 10.955 12.797 ( -0.996 -6.561 6.777) 9.485 12.857 ( -9.391 6.089 -2.751) 11.525 13.074 ( -3.893 -3.496 1.625) 5.478 13.217 ( 1.954 0.218 -2.832) 3.448 13.255 ( 6.441 -0.503 -3.340) 7.273 13.712 ( 3.617 -2.441 2.024) 4.811 13.898 ( -0.272 -10.299 7.618) 12.813 14.011 ( 0.198 2.142 -1.044) 2.391 14.261 ( 1.033 -9.268 -1.411) 9.432 14.774 ( 3.038 5.137 -15.704) 16.800 15.005 ( 1.335 -5.567 -11.371) 12.731 15.347 ( 0.622 2.134 -9.764) 10.014 15.366 ( 1.194 0.404 -7.449) 7.555 15.782 ( -1.003 3.363 2.279) 4.184 15.894 ( -1.244 -2.111 0.978) 2.638 16.035 ( 1.109 5.236 4.394) 6.925 16.172 ( -0.586 -3.180 10.030) 10.538 16.350 ( -0.895 4.090 3.579) 5.508 16.400 ( -2.388 2.533 3.293) 4.792 16.754 ( -2.998 -3.333 4.366) 6.258 16.828 ( -5.055 -4.293 3.732) 7.609 19.085 ( -5.233 5.694 17.418) 19.057 19.310 ( -10.771 -4.349 19.992) 23.121 20.261 ( -5.240 -0.652 14.815) 15.728 20.346 ( -6.210 -4.153 13.326) 15.277 21.754 ( 6.921 8.765 -36.381) 38.057 21.969 ( 7.399 -0.509 -29.966) 30.870 22.297 ( 4.107 2.457 -26.437) 26.867 22.441 ( 7.729 -3.287 -24.838) 26.219 24.555 ( -4.938 0.984 3.847) 6.337 24.586 ( -2.733 -0.574 3.246) 4.282 25.385 ( 25.443 1.662 -8.768) 26.963 25.478 ( 29.364 -2.762 -9.343) 30.938 26.035 ( -0.594 4.236 17.259) 17.781 26.211 ( -1.460 -4.148 16.517) 17.092 27.214 ( -11.244 0.949 -15.242) 18.964 27.339 ( -7.117 -4.689 -20.849) 22.524 29.374 ( 3.285 4.996 1.661) 6.206 29.404 ( -1.900 2.078 -2.616) 3.844 29.708 ( -3.912 2.481 0.814) 4.703 29.800 ( 2.460 0.128 1.732) 3.012 30.297 ( -3.746 5.083 5.349) 8.275 30.571 ( -3.931 -3.821 8.851) 10.411 30.679 ( 1.844 -2.062 4.799) 5.539 30.775 ( 2.495 -2.912 3.766) 5.374 31.077 ( 0.045 3.895 11.943) 12.562 31.354 ( -3.198 -8.778 14.865) 17.557 31.576 ( 8.561 4.087 6.491) 11.494 31.700 ( 7.082 0.674 11.311) 13.362 32.051 ( -1.445 -0.616 1.667) 2.291 32.190 ( -2.127 -4.182 11.758) 12.660 32.771 ( -6.219 5.026 -18.098) 19.786 32.871 ( -14.376 0.999 -15.061) 20.845 ======================= Grid point 147 (79/128) ======================= q-point: ( 0.33 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.956 ( 8.322 13.393 18.540) 24.338 3.191 ( -3.552 9.861 7.969) 13.167 3.432 ( -2.841 -10.561 4.939) 12.000 3.597 ( 14.249 -1.590 13.057) 19.392 3.844 ( -2.228 1.190 12.217) 12.475 3.886 ( -4.973 3.599 4.080) 7.371 4.107 ( -4.591 -2.533 -0.541) 5.271 4.171 ( -5.621 12.007 -1.060) 13.300 4.471 ( 0.664 4.497 3.271) 5.600 4.569 ( -5.265 -4.396 4.536) 8.223 4.692 ( -7.838 0.662 7.347) 10.763 4.929 ( -4.907 -3.952 -1.786) 6.549 5.040 ( -2.374 -0.983 -4.385) 5.083 5.337 ( -3.912 -5.207 1.637) 6.716 5.553 ( 2.709 6.464 0.707) 7.045 5.638 ( -1.577 4.651 17.260) 17.945 5.848 ( -0.093 11.215 6.839) 13.136 6.125 ( -4.370 1.844 8.495) 9.730 6.160 ( -4.329 7.641 2.986) 9.276 6.277 ( -0.741 -2.481 21.736) 21.889 6.336 ( 1.094 0.945 6.972) 7.121 6.491 ( 4.322 2.143 6.081) 7.762 6.656 ( -4.503 -2.267 25.504) 25.998 6.730 ( -5.484 0.371 29.352) 29.863 6.983 ( 4.535 -3.358 17.004) 17.916 7.074 ( 2.266 -6.691 5.796) 9.138 7.266 ( -10.696 0.740 23.397) 25.737 7.344 ( -4.891 0.028 10.554) 11.632 7.427 ( 9.015 1.298 6.164) 10.998 7.586 ( 12.068 -5.124 6.660) 14.706 7.726 ( 2.508 0.511 5.830) 6.367 7.794 ( 2.145 -1.084 0.535) 2.463 8.030 ( 2.726 -0.927 -3.673) 4.667 8.078 ( -3.696 1.132 0.615) 3.914 8.333 ( -0.166 2.401 -4.342) 4.965 8.425 ( -1.875 4.571 -5.917) 7.709 8.538 ( 2.047 7.684 -5.547) 9.696 8.669 ( 1.927 0.653 -4.399) 4.847 8.706 ( -0.162 2.666 -7.265) 7.741 8.840 ( -1.428 -2.110 -9.861) 10.185 8.938 ( -0.134 1.106 -9.300) 9.367 9.082 ( -4.805 -1.694 -1.478) 5.305 9.157 ( 2.367 4.142 -1.006) 4.875 9.354 ( 1.768 1.149 -1.650) 2.677 9.472 ( 0.555 -9.720 -8.854) 13.160 9.533 ( 8.885 -2.889 -6.115) 11.167 9.666 ( 2.025 -0.277 -5.285) 5.666 9.712 ( -1.132 -2.837 -5.607) 6.385 9.835 ( -2.146 7.922 -6.372) 10.391 9.974 ( -4.247 -1.222 1.739) 4.749 10.089 ( 1.080 -2.474 -0.238) 2.710 10.153 ( 3.036 -6.734 -5.232) 9.052 10.411 ( -4.672 5.603 -3.187) 7.961 10.464 ( -6.430 2.661 -9.478) 11.758 10.797 ( 4.343 4.542 -12.432) 13.930 10.815 ( -2.572 0.600 -3.145) 4.107 10.894 ( 1.776 3.046 -5.473) 6.510 11.158 ( -1.379 7.381 -5.895) 9.546 11.211 ( -3.475 -13.009 -1.010) 13.503 11.370 ( -2.976 3.375 -4.055) 6.057 11.449 ( -3.534 -1.508 7.057) 8.035 11.515 ( 5.337 7.255 -8.638) 12.479 11.741 ( -7.616 -15.066 2.296) 17.037 11.862 ( 4.428 -7.313 -1.233) 8.638 11.944 ( 6.876 2.496 12.709) 14.664 12.341 ( -1.344 -10.689 10.805) 15.258 12.583 ( -0.169 5.015 8.652) 10.002 12.690 ( -5.012 5.180 -0.292) 7.214 12.790 ( -3.634 -4.002 6.067) 8.126 12.965 ( -6.939 -6.505 4.012) 10.323 13.286 ( 5.492 1.840 -5.334) 7.874 13.362 ( 6.243 -1.127 -4.466) 7.758 13.787 ( 2.516 -2.285 2.670) 4.322 13.921 ( -1.507 -8.306 10.083) 13.150 14.031 ( 3.027 2.243 -2.561) 4.555 14.287 ( 1.980 -9.692 0.354) 9.899 14.788 ( 4.899 4.021 -13.464) 14.882 14.984 ( 1.052 -3.922 -10.992) 11.718 15.279 ( -2.109 1.908 -15.334) 15.595 15.327 ( -1.249 0.864 -8.603) 8.736 15.813 ( 3.344 3.730 1.304) 5.177 15.906 ( 1.313 -1.313 4.494) 4.862 16.052 ( -1.134 5.841 4.607) 7.525 16.170 ( -4.281 -2.700 12.993) 13.944 16.367 ( -3.203 2.490 4.569) 6.110 16.401 ( 4.584 1.574 5.497) 7.328 16.691 ( -5.718 -3.671 4.415) 8.103 16.742 ( -5.141 -0.707 2.267) 5.663 19.072 ( -4.826 4.775 22.490) 23.492 19.215 ( -7.238 -2.247 17.417) 18.994 20.236 ( -3.978 -1.360 13.576) 14.212 20.292 ( -4.972 -3.862 12.696) 14.171 21.742 ( 7.766 8.634 -36.124) 37.945 21.978 ( 6.998 -2.475 -29.833) 30.742 22.231 ( 0.805 5.347 -27.807) 28.328 22.441 ( 3.643 -4.275 -25.042) 25.664 24.569 ( 4.214 1.725 5.870) 7.429 24.640 ( 5.933 -1.626 5.762) 8.429 25.761 ( 16.118 2.667 -15.068) 22.225 25.890 ( 16.110 -3.202 -11.747) 20.194 26.068 ( -1.734 2.830 10.345) 10.864 26.196 ( -7.002 -3.210 15.052) 16.909 26.964 ( -6.632 1.025 -13.163) 14.775 27.128 ( -4.503 -6.788 -16.704) 18.585 29.364 ( -0.104 3.120 -1.401) 3.422 29.477 ( 5.289 -0.573 3.535) 6.388 29.612 ( -5.965 7.347 -1.617) 9.601 29.840 ( 0.827 -1.655 1.470) 2.363 30.252 ( -3.880 6.610 5.523) 9.447 30.520 ( -2.622 2.343 5.360) 6.411 30.717 ( -1.269 -4.081 8.767) 9.753 30.878 ( 4.172 -4.352 7.021) 9.254 31.117 ( -0.016 -0.046 8.626) 8.626 31.342 ( -3.892 -8.108 12.604) 15.484 31.783 ( 7.825 0.501 10.970) 13.484 31.852 ( 2.868 2.247 8.875) 9.593 32.010 ( -4.098 -1.002 1.619) 4.518 32.154 ( -6.819 -1.544 5.285) 8.765 32.596 ( -6.414 4.749 -11.347) 13.872 32.631 ( 0.884 2.237 -12.841) 13.064 ======================= Grid point 148 (80/128) ======================= q-point: (-0.50 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.001 ( -10.737 11.312 9.918) 18.483 3.259 ( 2.129 8.523 20.992) 22.756 3.369 ( -9.932 11.622 12.612) 19.819 3.649 ( -4.933 2.544 -3.771) 6.711 3.712 ( -2.607 -17.602 -1.365) 17.846 3.859 ( -6.455 -1.203 7.909) 10.279 4.102 ( -2.631 6.625 4.431) 8.393 4.183 ( 3.036 0.463 4.622) 5.550 4.479 ( -2.320 2.335 -2.104) 3.906 4.553 ( 5.444 -5.299 18.555) 20.050 4.645 ( -0.027 3.915 -1.109) 4.069 4.876 ( 0.199 -3.354 -2.765) 4.351 5.045 ( 5.168 -4.865 -4.132) 8.213 5.269 ( -1.740 -9.777 -1.097) 9.991 5.605 ( -1.387 11.927 9.662) 15.412 5.727 ( 4.919 12.459 8.907) 16.086 5.868 ( -0.735 8.335 4.892) 9.692 6.065 ( -5.525 2.243 6.315) 8.685 6.094 ( -3.145 6.646 3.232) 8.031 6.324 ( -4.903 -0.413 26.168) 26.627 6.383 ( -1.149 -0.852 15.330) 15.396 6.573 ( -0.908 -3.843 12.436) 13.048 6.652 ( -4.176 0.627 14.785) 15.376 6.713 ( -8.797 -2.541 28.556) 29.988 6.953 ( -17.132 2.254 34.553) 38.633 7.132 ( -1.163 -3.176 10.759) 11.278 7.200 ( -4.120 -1.760 13.515) 14.238 7.354 ( 3.986 -3.399 8.356) 9.862 7.625 ( 7.943 4.669 5.961) 10.974 7.776 ( -2.240 -0.210 1.664) 2.798 7.798 ( 6.744 2.837 6.466) 9.765 7.887 ( 3.253 -2.090 -5.734) 6.916 7.991 ( -3.852 0.154 -3.200) 5.010 8.038 ( 3.965 -4.528 -5.600) 8.221 8.270 ( -2.433 2.900 -5.482) 6.662 8.374 ( -2.550 -0.358 -3.153) 4.071 8.498 ( -4.052 3.971 -8.063) 9.859 8.595 ( -1.761 1.243 -4.258) 4.773 8.796 ( 7.384 3.259 -4.317) 9.154 8.848 ( 3.599 4.614 -4.376) 7.307 8.924 ( 6.255 1.236 -10.380) 12.182 9.042 ( 1.156 -3.104 -2.134) 3.940 9.192 ( 1.908 2.205 0.150) 2.920 9.313 ( -5.233 0.243 0.480) 5.261 9.408 ( -4.934 -4.885 -14.051) 15.673 9.571 ( -0.620 -3.465 -5.918) 6.885 9.647 ( -1.292 -3.647 -1.184) 4.046 9.714 ( 2.541 1.036 -7.196) 7.702 9.827 ( 4.410 3.416 -8.424) 10.104 9.995 ( 4.342 3.076 4.231) 6.799 10.096 ( -1.003 -1.643 -3.490) 3.985 10.204 ( 4.518 -9.093 -6.159) 11.876 10.310 ( -1.849 2.611 -6.342) 7.104 10.372 ( 2.651 2.277 -10.170) 10.754 10.650 ( -11.756 6.615 5.891) 14.719 10.845 ( 3.143 3.070 -7.787) 8.941 10.946 ( 4.235 -3.134 -3.678) 6.426 11.095 ( -0.027 7.639 -12.695) 14.817 11.140 ( -3.224 -0.463 2.148) 3.901 11.326 ( 0.815 -2.517 -4.403) 5.137 11.430 ( -2.410 -8.804 0.505) 9.142 11.528 ( -1.768 -0.244 -1.442) 2.295 11.712 ( 6.270 -2.282 -5.200) 8.459 11.980 ( 6.426 -6.745 -0.424) 9.326 12.131 ( 4.665 -1.881 14.859) 15.687 12.285 ( -5.390 -4.919 9.791) 12.211 12.612 ( -0.780 -0.184 5.604) 5.661 12.660 ( -1.412 2.081 4.272) 4.957 12.745 ( -2.862 -2.457 4.785) 6.093 12.901 ( -0.911 -4.550 3.154) 5.611 13.351 ( 3.632 2.065 -4.351) 6.032 13.436 ( 3.972 -2.346 -5.089) 6.869 13.793 ( -2.661 0.640 0.746) 2.836 13.928 ( -2.427 -6.601 11.602) 13.567 14.094 ( 4.200 1.234 -2.291) 4.941 14.329 ( 2.194 -8.964 -0.340) 9.235 14.849 ( 7.560 1.274 -10.716) 13.176 14.958 ( 1.406 -1.040 -11.151) 11.288 15.164 ( -2.833 2.149 -17.982) 18.330 15.262 ( -1.285 -0.927 -12.078) 12.182 15.894 ( 3.916 4.137 2.383) 6.175 15.971 ( 2.698 -1.319 8.477) 8.993 16.039 ( -2.769 5.248 6.945) 9.134 16.154 ( -1.525 -0.032 7.235) 7.394 16.312 ( -5.772 2.454 7.993) 10.160 16.532 ( 5.934 -4.828 7.562) 10.757 16.592 ( -5.983 -1.319 3.583) 7.097 16.684 ( -1.396 0.237 1.085) 1.783 19.087 ( -3.827 4.318 22.870) 23.586 19.208 ( -1.159 -1.769 18.811) 18.930 20.213 ( -3.868 -0.567 11.247) 11.907 20.286 ( -1.936 -3.948 15.355) 15.973 21.749 ( 8.877 8.217 -35.098) 37.124 21.980 ( 5.894 -2.844 -30.536) 31.230 22.136 ( 2.746 6.853 -28.788) 29.719 22.390 ( 2.332 -5.180 -25.310) 25.940 24.721 ( 8.080 2.088 8.103) 11.632 24.807 ( 8.019 -1.926 8.236) 11.655 25.708 ( -12.561 3.164 -17.903) 22.097 25.904 ( -9.287 -5.676 -17.845) 20.902 25.988 ( -9.757 1.909 10.038) 14.128 26.084 ( -11.153 -2.159 11.241) 15.981 26.982 ( 13.532 1.983 -9.755) 16.799 27.165 ( 13.973 -6.629 -13.257) 20.370 29.379 ( 1.663 4.421 0.298) 4.733 29.484 ( -5.588 6.907 -1.882) 9.082 29.606 ( 5.827 -2.104 3.858) 7.299 29.834 ( -1.836 -5.353 -0.746) 5.708 30.203 ( -3.570 7.937 6.360) 10.779 30.523 ( -0.208 1.313 5.307) 5.471 30.715 ( -2.016 1.562 7.367) 7.796 30.952 ( -0.337 0.148 13.010) 13.015 31.154 ( 1.119 -4.451 5.038) 6.816 31.314 ( -5.155 -7.578 12.989) 15.897 31.744 ( -11.970 1.632 2.801) 12.401 31.802 ( -16.034 -1.025 8.971) 18.402 31.987 ( 3.276 0.636 2.620) 4.243 32.088 ( -0.965 -2.860 5.644) 6.401 32.608 ( 11.330 7.017 -12.672) 18.390 32.757 ( 15.267 -0.165 -6.572) 16.623 ======================= Grid point 149 (81/128) ======================= q-point: (-0.33 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.821 ( -12.889 15.097 13.967) 24.272 2.977 ( -24.637 19.586 20.150) 37.371 3.437 ( -7.162 11.728 4.865) 14.578 3.626 ( 7.090 -0.000 7.441) 10.278 3.684 ( -0.254 -15.880 0.636) 15.895 3.873 ( 4.252 -16.157 11.506) 20.286 4.027 ( -4.568 -6.299 1.876) 8.004 4.186 ( -6.235 0.455 8.403) 10.473 4.411 ( -0.918 6.167 -7.824) 10.004 4.638 ( -1.455 0.930 4.905) 5.200 4.813 ( 12.219 2.419 9.359) 15.581 4.923 ( 5.651 -1.473 -0.169) 5.843 5.188 ( 10.050 -1.464 1.233) 10.230 5.279 ( 1.003 -5.363 2.861) 6.160 5.571 ( -5.391 15.791 8.592) 18.768 5.767 ( -6.090 13.300 2.698) 14.874 5.879 ( 2.537 6.774 0.933) 7.293 6.014 ( -1.811 -1.209 4.253) 4.778 6.087 ( -0.224 6.331 6.927) 9.387 6.319 ( -7.501 0.980 28.580) 29.564 6.393 ( -7.943 0.529 29.824) 30.868 6.575 ( -4.962 -5.611 15.274) 17.012 6.620 ( -2.759 -4.371 1.615) 5.415 6.674 ( -6.319 -5.318 29.208) 30.353 6.798 ( -13.680 -0.851 30.714) 33.634 6.986 ( -15.623 -6.129 14.539) 22.204 7.293 ( 4.797 6.966 5.474) 10.075 7.492 ( 6.554 3.159 3.568) 8.103 7.628 ( -9.133 -0.776 -10.046) 13.599 7.724 ( -5.522 -1.527 6.827) 8.913 7.774 ( -3.169 -1.450 3.813) 5.166 7.874 ( -1.106 2.607 -1.978) 3.454 7.944 ( -1.463 2.869 -0.905) 3.345 8.130 ( 2.542 -2.024 -11.113) 11.578 8.242 ( 3.209 1.040 -8.038) 8.717 8.304 ( -1.836 -1.169 0.768) 2.308 8.419 ( 0.135 7.885 -7.251) 10.713 8.595 ( 1.758 -0.396 -2.695) 3.242 8.797 ( -1.596 2.692 -0.719) 3.212 8.947 ( 1.626 -0.267 -3.289) 3.679 9.047 ( 6.820 0.422 -6.332) 9.316 9.107 ( 8.621 -0.404 -4.586) 9.773 9.197 ( -3.071 0.046 -0.611) 3.132 9.266 ( -1.192 3.189 -3.113) 4.613 9.269 ( 3.798 -6.596 -5.376) 9.318 9.498 ( -3.748 1.916 -5.349) 6.807 9.631 ( -1.299 -4.611 -2.962) 5.632 9.697 ( -3.017 1.627 -4.070) 5.321 9.870 ( 5.187 -0.204 -8.301) 9.790 10.040 ( 0.085 -3.677 -0.629) 3.731 10.120 ( 5.121 4.277 1.935) 6.947 10.280 ( 2.211 -0.694 -6.680) 7.070 10.305 ( 8.445 2.644 -7.543) 11.628 10.480 ( 10.081 -2.424 -8.155) 13.191 10.524 ( -4.224 6.115 7.479) 10.543 10.801 ( -4.274 3.408 -3.637) 6.566 10.999 ( 2.058 -4.785 -2.077) 5.608 11.056 ( -2.060 -2.510 -2.517) 4.109 11.152 ( 7.154 10.344 -10.475) 16.368 11.344 ( 0.993 -4.704 -4.688) 6.715 11.374 ( 0.215 -8.106 -4.390) 9.221 11.521 ( 0.867 -3.108 -2.476) 4.067 11.793 ( 2.007 0.911 -0.295) 2.224 12.003 ( -5.196 -6.353 6.270) 10.328 12.224 ( 5.953 1.715 5.665) 8.395 12.340 ( 2.956 -4.727 11.350) 12.646 12.578 ( -8.973 -3.568 8.832) 13.086 12.595 ( -2.470 -4.624 0.913) 5.322 12.802 ( 6.356 2.535 3.370) 7.628 12.935 ( 2.663 -1.625 0.382) 3.142 13.368 ( -0.730 2.561 -2.991) 4.004 13.465 ( 1.101 -3.414 -4.083) 5.435 13.723 ( -4.145 2.020 -0.761) 4.674 13.919 ( -3.401 -7.242 10.379) 13.104 14.133 ( 0.318 1.794 -1.746) 2.524 14.345 ( 0.080 -7.526 -3.398) 8.258 14.957 ( 2.793 3.760 -15.413) 16.109 14.979 ( 9.798 -0.974 -8.047) 12.716 15.071 ( 2.707 -0.835 -11.903) 12.236 15.186 ( -1.144 -2.961 -14.415) 14.761 15.945 ( -0.479 4.668 4.836) 6.738 16.008 ( -3.329 3.548 7.515) 8.953 16.050 ( 1.646 -0.182 7.906) 8.078 16.147 ( -3.467 -1.983 0.293) 4.004 16.259 ( -1.247 4.884 9.547) 10.795 16.500 ( -4.499 -2.382 4.342) 6.691 16.657 ( 3.729 -2.665 0.398) 4.601 16.730 ( 5.114 -4.864 7.203) 10.085 19.109 ( -2.530 4.988 16.604) 17.520 19.312 ( 1.956 -4.132 24.624) 25.045 20.206 ( -1.597 1.462 12.609) 12.794 20.331 ( -0.595 -4.226 16.818) 17.351 21.782 ( 9.571 7.655 -33.431) 35.607 21.932 ( 3.914 2.856 -33.085) 33.438 22.141 ( 9.715 1.895 -27.439) 29.169 22.337 ( 3.239 -5.304 -25.607) 26.350 24.865 ( 2.421 2.109 8.168) 8.776 24.944 ( 2.023 -1.635 8.588) 8.973 25.323 ( -18.851 1.881 -14.583) 23.907 25.476 ( -24.041 -5.439 -18.616) 30.888 25.880 ( -7.453 2.050 13.207) 15.303 25.963 ( -5.716 -1.815 13.430) 14.708 27.244 ( 16.601 1.932 -11.090) 20.058 27.390 ( 14.646 -4.805 -15.906) 22.149 29.356 ( -4.035 9.804 -0.892) 10.640 29.461 ( 3.744 4.846 0.196) 6.127 29.719 ( 4.154 -6.008 4.726) 8.699 29.765 ( -4.553 -7.171 -3.482) 9.180 30.195 ( 0.107 7.547 7.115) 10.373 30.520 ( -3.692 -5.462 8.606) 10.841 30.722 ( 0.886 12.212 1.751) 12.369 30.978 ( -3.100 2.512 15.814) 16.310 31.166 ( -5.302 -4.926 6.748) 9.895 31.252 ( -5.305 -5.864 11.477) 13.937 31.536 ( -9.885 1.151 1.832) 10.119 31.568 ( -10.124 -1.077 8.004) 12.951 32.035 ( 0.561 -1.529 4.381) 4.674 32.107 ( -0.550 -3.954 8.870) 9.727 32.802 ( 14.050 8.153 -16.258) 22.982 33.033 ( 16.386 -2.714 -9.817) 19.294 ======================= Grid point 150 (82/128) ======================= q-point: (-0.17 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.678 ( -11.007 24.342 27.604) 38.414 2.710 ( -10.905 18.302 16.100) 26.703 3.275 ( -8.707 4.485 3.331) 10.346 3.681 ( -0.356 -19.518 5.170) 20.195 3.778 ( -0.026 -1.923 4.376) 4.779 3.963 ( 1.153 -9.828 11.798) 15.399 4.070 ( -4.287 -1.841 14.185) 14.932 4.111 ( 9.410 -10.639 -3.469) 14.621 4.385 ( -0.598 11.544 -1.924) 11.719 4.627 ( -0.852 0.608 1.162) 1.564 5.003 ( 4.898 1.904 2.702) 5.908 5.097 ( 11.812 4.403 7.844) 14.847 5.263 ( -6.354 3.167 13.948) 15.651 5.355 ( 5.139 2.624 6.237) 8.497 5.482 ( -7.193 9.522 -3.594) 12.463 5.664 ( -3.420 4.056 4.074) 6.689 5.901 ( -2.695 11.208 3.834) 12.149 6.042 ( 4.548 -4.554 -0.793) 6.485 6.118 ( 1.184 6.410 6.087) 8.919 6.286 ( -9.190 -0.571 30.408) 31.771 6.355 ( -7.394 3.585 25.759) 27.038 6.490 ( -11.306 -2.929 20.302) 23.422 6.616 ( -1.207 -8.109 0.238) 8.201 6.663 ( -10.696 -4.229 31.549) 33.581 6.722 ( -4.069 -6.896 23.715) 25.030 6.774 ( -9.186 -4.739 3.699) 10.978 7.308 ( -4.681 8.745 -1.641) 10.054 7.415 ( -7.321 -1.010 -1.987) 7.652 7.615 ( -0.602 3.557 -1.254) 3.819 7.660 ( 1.317 2.472 7.659) 8.155 7.704 ( -5.698 -3.007 -2.633) 6.960 7.837 ( -0.519 -1.540 2.153) 2.698 7.907 ( -2.500 5.696 -1.711) 6.452 8.060 ( -1.498 -0.896 -7.847) 8.039 8.270 ( -3.150 2.185 1.380) 4.074 8.333 ( 7.005 2.038 -6.538) 9.796 8.451 ( 5.776 4.348 -4.738) 8.644 8.605 ( 0.248 -3.928 -4.059) 5.654 8.751 ( -1.681 4.626 -0.696) 4.971 8.961 ( 2.378 -2.010 -0.591) 3.170 9.067 ( -0.917 -0.596 -5.132) 5.248 9.088 ( -2.382 5.689 -6.545) 8.993 9.237 ( 1.706 -7.233 -5.993) 9.546 9.320 ( 6.039 3.856 0.245) 7.169 9.398 ( 8.940 -4.418 -3.918) 10.715 9.436 ( -1.906 4.466 -4.072) 6.337 9.583 ( -1.443 -2.938 -3.599) 4.865 9.601 ( -1.481 -0.084 -2.123) 2.590 9.966 ( 5.924 0.044 -2.768) 6.539 10.075 ( 2.425 -3.893 -0.479) 4.611 10.170 ( -0.861 1.258 1.220) 1.952 10.297 ( 0.761 -3.867 -5.528) 6.789 10.406 ( 5.685 11.219 -5.500) 13.727 10.536 ( 1.734 4.859 3.110) 6.024 10.633 ( 9.489 -2.402 -7.553) 12.364 10.738 ( 0.972 4.522 -4.894) 6.734 10.987 ( -1.249 -2.347 -4.382) 5.125 11.033 ( -0.463 -8.275 4.134) 9.262 11.250 ( 7.121 9.005 -12.870) 17.247 11.323 ( 2.403 -4.587 -11.190) 12.330 11.424 ( 4.018 -5.958 2.078) 7.481 11.511 ( -0.381 -3.057 -6.248) 6.966 11.754 ( -7.660 1.162 10.486) 13.038 11.965 ( 0.126 -4.550 3.649) 5.834 12.346 ( -7.110 -0.062 7.912) 10.638 12.373 ( 3.911 1.677 3.779) 5.691 12.480 ( -6.118 -6.029 10.573) 13.622 12.575 ( 4.076 -6.583 -1.150) 7.828 12.943 ( 7.013 1.319 0.978) 7.203 12.986 ( 2.867 0.818 1.051) 3.161 13.291 ( -6.491 3.613 -1.285) 7.539 13.429 ( -3.820 -3.177 -3.039) 5.824 13.663 ( -1.493 0.752 -1.389) 2.174 13.895 ( -3.232 -9.122 9.181) 13.340 14.093 ( -3.121 1.435 -2.227) 4.094 14.308 ( -1.852 -8.244 -4.753) 9.695 14.882 ( -0.592 5.881 -20.580) 21.412 15.089 ( 1.527 -3.766 -14.780) 15.329 15.160 ( 9.165 -0.586 -4.634) 10.287 15.199 ( 10.031 -2.430 -5.388) 11.643 15.907 ( -5.025 4.308 4.423) 7.960 15.986 ( -2.210 4.997 5.149) 7.507 16.044 ( -6.385 -2.497 2.930) 7.456 16.099 ( 0.717 -0.639 5.535) 5.618 16.317 ( 2.525 4.131 4.354) 6.512 16.457 ( -2.256 0.411 3.272) 3.995 16.717 ( 2.655 -2.287 2.337) 4.212 16.846 ( 3.365 -10.143 5.542) 12.038 19.122 ( -2.839 6.144 13.474) 15.078 19.421 ( -2.061 -7.600 23.872) 25.138 20.257 ( 0.210 1.786 15.301) 15.406 20.383 ( -1.584 -4.058 16.900) 17.452 21.805 ( 6.949 7.649 -33.482) 35.041 21.905 ( 8.415 4.603 -33.185) 34.543 22.238 ( 12.226 -1.112 -26.043) 28.792 22.308 ( 5.080 -3.868 -25.933) 26.707 24.859 ( -5.314 2.786 5.377) 8.057 24.926 ( -6.933 -0.363 5.428) 8.812 24.994 ( -11.322 -0.216 -8.877) 14.389 25.043 ( -12.156 -2.410 -9.127) 15.391 25.864 ( -0.492 3.236 15.577) 15.917 25.998 ( 2.561 -3.037 14.557) 15.090 27.429 ( 8.152 0.773 -12.974) 15.342 27.522 ( 7.103 -3.043 -18.963) 20.477 29.302 ( -1.030 10.346 -0.816) 10.429 29.535 ( 2.078 5.505 0.898) 5.952 29.666 ( -2.532 -6.476 -4.050) 8.047 29.785 ( 0.803 -6.042 4.456) 7.550 30.263 ( 3.773 3.795 6.886) 8.721 30.475 ( -4.376 -5.544 9.326) 11.699 30.739 ( 0.251 12.893 -2.442) 13.125 30.953 ( -7.937 1.538 12.764) 15.109 31.022 ( -8.645 0.081 12.200) 14.953 31.256 ( -0.872 -5.071 13.864) 14.789 31.449 ( -1.187 -0.173 2.053) 2.378 31.500 ( -2.495 -2.339 10.572) 11.111 32.053 ( -0.224 -1.554 3.847) 4.155 32.137 ( -0.490 -4.367 10.251) 11.153 32.936 ( 7.769 8.307 -18.997) 22.141 33.205 ( 6.916 -4.326 -15.315) 17.352 ======================= Grid point 151 (83/128) ======================= q-point: ( 0.00 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.011 ( -2.393 -17.928 10.306) 20.817 3.011 ( -2.393 17.928 10.306) 20.817 3.265 ( 3.813 -26.011 16.969) 31.290 3.265 ( 3.813 26.011 16.969) 31.290 3.712 ( -6.983 -11.375 -1.630) 13.446 3.712 ( -6.983 11.375 -1.630) 13.446 4.236 ( 11.139 -5.769 8.375) 15.083 4.236 ( 11.139 5.769 8.375) 15.083 4.584 ( -1.497 -5.082 -1.185) 5.428 4.584 ( -1.497 5.082 -1.185) 5.428 5.166 ( -7.890 -8.538 10.494) 15.661 5.166 ( -7.890 8.538 10.494) 15.661 5.382 ( 1.332 -6.982 4.342) 8.329 5.382 ( 1.332 6.982 4.342) 8.329 5.475 ( -5.616 -9.073 4.016) 11.402 5.475 ( -5.616 9.073 4.016) 11.402 6.056 ( -0.748 -7.495 14.566) 16.399 6.056 ( -0.748 7.495 14.566) 16.399 6.254 ( -5.347 -3.663 11.572) 13.263 6.254 ( -5.347 3.663 11.572) 13.263 6.389 ( -0.510 -9.064 9.326) 13.015 6.389 ( -0.510 9.064 9.326) 13.015 6.533 ( -0.432 -6.209 2.983) 6.902 6.533 ( -0.432 6.209 2.983) 6.902 6.672 ( -2.229 -4.482 25.039) 25.535 6.672 ( -2.229 4.482 25.039) 25.535 7.284 ( -5.213 -2.937 9.368) 11.116 7.284 ( -5.213 2.937 9.368) 11.116 7.534 ( -6.443 -1.533 -2.122) 6.954 7.534 ( -6.443 1.533 -2.122) 6.954 7.800 ( -2.730 -1.663 -0.051) 3.196 7.800 ( -2.730 1.663 -0.051) 3.196 8.008 ( 3.810 -5.980 2.010) 7.370 8.008 ( 3.810 5.980 2.010) 7.370 8.395 ( 2.936 -11.305 0.929) 11.717 8.395 ( 2.936 11.305 0.929) 11.717 8.546 ( 5.082 -4.086 -6.935) 9.520 8.546 ( 5.082 4.086 -6.935) 9.520 8.846 ( -1.644 -7.199 -3.430) 8.142 8.846 ( -1.644 7.199 -3.430) 8.142 9.078 ( 1.236 -4.996 -6.125) 8.000 9.078 ( 1.236 4.996 -6.125) 8.000 9.246 ( -0.497 -9.461 -8.012) 12.408 9.246 ( -0.497 9.461 -8.012) 12.408 9.461 ( -0.778 -3.552 -1.017) 3.775 9.461 ( -0.778 3.552 -1.017) 3.775 9.629 ( 5.275 -3.357 -0.977) 6.329 9.629 ( 5.275 3.357 -0.977) 6.329 10.043 ( 1.613 -2.546 -3.895) 4.925 10.043 ( 1.613 2.546 -3.895) 4.925 10.136 ( -5.537 -3.929 -0.085) 6.790 10.136 ( -5.537 3.929 -0.085) 6.790 10.651 ( 1.737 -5.199 -5.506) 7.770 10.651 ( 1.737 5.199 -5.506) 7.770 10.788 ( 3.105 -12.429 3.055) 13.170 10.788 ( 3.105 12.429 3.055) 13.170 10.900 ( 4.331 -5.018 -9.309) 11.428 10.900 ( 4.331 5.018 -9.309) 11.428 11.321 ( 1.662 -3.224 -6.668) 7.590 11.321 ( 1.662 3.224 -6.668) 7.590 11.467 ( 2.824 -2.152 -3.247) 4.812 11.467 ( 2.824 2.152 -3.247) 4.812 11.835 ( -0.405 -11.979 4.983) 12.981 11.835 ( -0.405 11.979 4.983) 12.981 12.193 ( -12.634 -4.757 4.946) 14.378 12.193 ( -12.634 4.757 4.946) 14.378 12.589 ( 4.501 -6.229 7.945) 11.054 12.589 ( 4.501 6.229 7.945) 11.054 13.053 ( 2.664 -1.222 -2.498) 3.851 13.053 ( 2.664 1.222 -2.498) 3.851 13.242 ( -5.591 -3.965 -2.515) 7.301 13.242 ( -5.591 3.965 -2.515) 7.301 13.714 ( -1.528 -6.309 6.796) 9.398 13.714 ( -1.528 6.309 6.796) 9.398 14.108 ( -1.446 -6.488 -1.837) 6.896 14.108 ( -1.446 6.488 -1.837) 6.896 14.923 ( 0.567 -6.120 -16.486) 17.595 14.923 ( 0.567 6.120 -16.486) 17.595 15.317 ( 7.194 -0.144 -5.417) 9.007 15.317 ( 7.194 0.144 -5.417) 9.007 15.889 ( -4.824 -2.963 2.177) 6.066 15.889 ( -4.824 2.963 2.177) 6.066 16.082 ( -0.044 -3.447 6.984) 7.788 16.082 ( -0.044 3.447 6.984) 7.788 16.436 ( 0.008 -2.767 -0.091) 2.768 16.436 ( 0.008 2.767 -0.091) 2.768 16.751 ( -0.025 -3.517 3.984) 5.314 16.751 ( -0.025 3.517 3.984) 5.314 19.258 ( -6.335 -8.258 19.639) 22.226 19.258 ( -6.335 8.258 19.639) 22.226 20.323 ( -4.584 -2.836 15.101) 16.034 20.323 ( -4.584 2.836 15.101) 16.034 21.918 ( 6.528 -4.918 -32.577) 33.587 21.918 ( 6.528 4.918 -32.577) 33.587 22.315 ( 9.927 -2.094 -26.137) 28.037 22.315 ( 9.927 2.094 -26.137) 28.037 24.713 ( -11.921 -1.026 2.069) 12.143 24.713 ( -11.921 1.026 2.069) 12.143 25.043 ( 15.162 -1.573 -4.523) 15.900 25.043 ( 15.162 1.573 -4.523) 15.900 26.038 ( 2.477 -4.673 16.580) 17.403 26.038 ( 2.477 4.673 16.580) 17.403 27.445 ( -2.239 -2.376 -17.737) 18.035 27.445 ( -2.239 2.376 -17.737) 18.035 29.458 ( -1.910 -5.051 -2.358) 5.892 29.458 ( -1.910 5.051 -2.358) 5.892 29.720 ( 2.966 -2.966 2.582) 4.925 29.720 ( 2.966 2.966 2.582) 4.925 30.392 ( 0.623 -4.389 8.095) 9.229 30.392 ( 0.623 4.389 8.095) 9.229 30.781 ( -7.395 -2.476 3.587) 8.583 30.781 ( -7.395 2.476 3.587) 8.583 31.160 ( -0.818 -8.485 15.406) 17.607 31.160 ( -0.818 8.485 15.406) 17.607 31.517 ( 4.083 -3.472 7.177) 8.957 31.517 ( 4.083 3.472 7.177) 8.957 32.086 ( -0.759 -3.436 8.104) 8.835 32.086 ( -0.759 3.436 8.104) 8.835 33.053 ( -2.967 -6.032 -19.844) 20.951 33.053 ( -2.967 6.032 -19.844) 20.951 ======================= Grid point 153 (84/128) ======================= q-point: ( 0.17 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.071 ( 3.852 -15.927 10.459) 19.439 3.071 ( 3.852 15.927 10.459) 19.439 3.427 ( 3.584 -14.317 10.981) 18.396 3.427 ( 3.584 14.317 10.981) 18.396 3.648 ( 2.935 -10.864 5.303) 12.441 3.648 ( 2.935 10.864 5.303) 12.441 4.384 ( -0.951 -5.033 1.931) 5.474 4.384 ( -0.951 5.033 1.931) 5.474 4.541 ( -1.007 -1.252 2.150) 2.684 4.541 ( -1.007 1.252 2.150) 2.684 4.953 ( -14.408 -7.608 6.549) 17.561 4.953 ( -14.408 7.608 6.549) 17.561 5.322 ( -7.731 -8.673 -5.444) 12.831 5.322 ( -7.731 8.673 -5.444) 12.831 5.517 ( 2.737 -0.313 14.043) 14.311 5.517 ( 2.737 0.313 14.043) 14.311 6.072 ( -3.373 -8.802 15.901) 18.485 6.072 ( -3.373 8.802 15.901) 18.485 6.226 ( -0.277 -1.178 6.714) 6.822 6.226 ( -0.277 1.178 6.714) 6.822 6.412 ( -2.615 -7.162 13.380) 15.400 6.412 ( -2.615 7.162 13.380) 15.400 6.636 ( 5.215 -7.143 8.572) 12.316 6.636 ( 5.215 7.143 8.572) 12.316 6.773 ( 5.566 -8.637 16.657) 19.571 6.773 ( 5.566 8.637 16.657) 19.571 7.295 ( 1.841 -4.273 11.355) 12.271 7.295 ( 1.841 4.273 11.355) 12.271 7.426 ( -6.172 -0.469 5.218) 8.096 7.426 ( -6.172 0.469 5.218) 8.096 7.746 ( -2.839 -1.954 4.362) 5.559 7.746 ( -2.839 1.954 4.362) 5.559 8.051 ( 0.082 -5.337 1.687) 5.597 8.051 ( 0.082 5.337 1.687) 5.597 8.452 ( 0.632 -9.529 2.241) 9.810 8.452 ( 0.632 9.529 2.241) 9.810 8.613 ( 5.722 -3.679 -9.083) 11.348 8.613 ( 5.722 3.679 -9.083) 11.348 8.800 ( 0.217 -5.266 -9.853) 11.175 8.800 ( 0.217 5.266 -9.853) 11.175 9.062 ( -0.727 -5.593 -6.126) 8.327 9.062 ( -0.727 5.593 -6.126) 8.327 9.250 ( 4.367 -7.216 -7.206) 11.093 9.250 ( 4.367 7.216 -7.206) 11.093 9.410 ( -3.269 -6.244 1.423) 7.190 9.410 ( -3.269 6.244 1.423) 7.190 9.697 ( 2.070 -0.385 -3.992) 4.513 9.697 ( 2.070 0.385 -3.992) 4.513 10.025 ( -2.563 -6.776 -3.863) 8.211 10.025 ( -2.563 6.776 -3.863) 8.211 10.050 ( -2.041 -0.293 0.112) 2.065 10.050 ( -2.041 0.293 0.112) 2.065 10.615 ( -3.400 -4.442 -3.329) 6.509 10.615 ( -3.400 4.442 -3.329) 6.509 10.852 ( 3.107 -8.544 -5.288) 10.518 10.852 ( 3.107 8.544 -5.288) 10.518 10.925 ( 2.801 -2.570 -9.291) 10.038 10.925 ( 2.801 2.570 -9.291) 10.038 11.333 ( 2.582 -7.503 -5.340) 9.565 11.333 ( 2.582 7.503 -5.340) 9.565 11.520 ( 3.823 -7.697 -1.629) 8.747 11.520 ( 3.823 7.697 -1.629) 8.747 11.795 ( -8.767 -10.682 -0.355) 13.823 11.795 ( -8.767 10.682 -0.355) 13.823 12.034 ( -4.315 -11.043 12.636) 17.327 12.034 ( -4.315 11.043 12.636) 17.327 12.666 ( 0.155 -6.779 9.087) 11.338 12.666 ( 0.155 6.779 9.087) 11.338 12.980 ( -8.121 -5.948 -1.678) 10.205 12.980 ( -8.121 5.948 -1.678) 10.205 13.239 ( 5.533 -1.220 -4.209) 7.058 13.239 ( 5.533 1.220 -4.209) 7.058 13.740 ( 1.365 -5.225 6.404) 8.377 13.740 ( 1.365 5.225 6.404) 8.377 14.099 ( 0.529 -6.837 0.184) 6.860 14.099 ( 0.529 6.837 0.184) 6.860 14.887 ( 2.268 -6.265 -14.091) 15.587 14.887 ( 2.268 6.265 -14.091) 15.587 15.365 ( 1.307 -0.639 -8.389) 8.514 15.365 ( 1.307 0.639 -8.389) 8.514 15.844 ( -0.950 -2.956 2.226) 3.820 15.844 ( -0.950 2.956 2.226) 3.820 16.114 ( 0.001 -2.948 8.118) 8.637 16.114 ( 0.001 2.948 8.118) 8.637 16.422 ( -1.120 -2.325 -0.577) 2.645 16.422 ( -1.120 2.325 -0.577) 2.645 16.741 ( -2.842 -3.107 3.926) 5.757 16.741 ( -2.842 3.107 3.926) 5.757 19.205 ( -7.976 -6.248 21.232) 23.526 19.205 ( -7.976 6.248 21.232) 23.526 20.279 ( -5.867 -2.421 13.407) 14.833 20.279 ( -5.867 2.421 13.407) 14.833 21.903 ( 6.420 -6.010 -32.867) 34.023 21.903 ( 6.420 6.010 -32.867) 34.023 22.366 ( 6.632 -4.165 -25.903) 27.061 22.366 ( 6.632 4.165 -25.903) 27.061 24.572 ( -3.934 -0.813 3.353) 5.233 24.572 ( -3.934 0.813 3.353) 5.233 25.426 ( 27.105 -2.483 -8.583) 28.540 25.426 ( 27.105 2.483 -8.583) 28.540 26.123 ( -0.997 -4.738 16.776) 17.460 26.123 ( -0.997 4.738 16.776) 17.460 27.257 ( -9.739 -3.443 -17.831) 20.607 27.257 ( -9.739 3.443 -17.831) 20.607 29.426 ( -0.823 -0.419 -0.598) 1.100 29.426 ( -0.823 0.419 -0.598) 1.100 29.768 ( 1.045 -3.093 0.974) 3.406 29.768 ( 1.045 3.093 0.974) 3.406 30.427 ( -1.039 -8.158 8.334) 11.708 30.427 ( -1.039 8.158 8.334) 11.708 30.714 ( -1.032 -3.248 3.494) 4.881 30.714 ( -1.032 3.248 3.494) 4.881 31.192 ( -2.197 -7.532 14.061) 16.102 31.192 ( -2.197 7.532 14.061) 16.102 31.658 ( 7.260 -4.099 9.691) 12.784 31.658 ( 7.260 4.099 9.691) 12.784 32.101 ( -0.920 -4.604 6.336) 7.887 32.101 ( -0.920 4.604 6.336) 7.887 32.851 ( -9.508 -2.885 -18.015) 20.574 32.851 ( -9.508 2.885 -18.015) 20.574 ======================= Grid point 155 (85/128) ======================= q-point: ( 0.33 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.212 ( 6.202 -12.244 10.688) 17.396 3.212 ( 6.202 12.245 10.688) 17.396 3.413 ( -4.291 -13.122 2.511) 14.032 3.413 ( -4.291 13.122 2.511) 14.032 3.886 ( 13.058 -7.210 12.742) 19.618 3.886 ( 13.058 7.210 12.742) 19.618 4.202 ( -16.298 -12.312 2.909) 20.632 4.202 ( -16.298 12.312 2.909) 20.632 4.548 ( -0.222 -5.858 -3.157) 6.658 4.548 ( -0.222 5.858 -3.157) 6.658 4.790 ( -6.357 -8.020 7.280) 12.559 4.790 ( -6.357 8.020 7.280) 12.559 5.133 ( -7.729 -11.256 -7.310) 15.488 5.133 ( -7.729 11.256 -7.310) 15.488 5.636 ( 5.025 -2.701 9.428) 11.020 5.636 ( 5.025 2.701 9.428) 11.020 6.063 ( -4.592 -8.585 17.344) 19.889 6.063 ( -4.592 8.585 17.344) 19.889 6.272 ( 0.159 -3.376 7.376) 8.113 6.272 ( 0.159 3.376 7.375) 8.113 6.422 ( -2.506 -7.005 16.111) 17.746 6.422 ( -2.506 7.005 16.111) 17.746 6.707 ( -2.236 -3.851 15.027) 15.673 6.707 ( -2.236 3.851 15.027) 15.673 6.961 ( 6.801 -3.137 10.277) 12.717 6.961 ( 6.801 3.137 10.277) 12.717 7.316 ( -11.879 -2.966 22.159) 25.316 7.316 ( -11.879 2.966 22.159) 25.316 7.476 ( 13.696 -4.730 5.326) 15.437 7.476 ( 13.696 4.730 5.326) 15.437 7.759 ( 2.274 -2.362 4.677) 5.712 7.759 ( 2.274 2.362 4.677) 5.712 8.041 ( -1.624 -2.932 -0.926) 3.478 8.041 ( -1.624 2.932 -0.926) 3.478 8.418 ( -3.423 -5.090 -1.328) 6.276 8.418 ( -3.423 5.090 -1.328) 6.276 8.629 ( -1.659 -4.782 -5.820) 7.714 8.629 ( -1.659 4.782 -5.820) 7.714 8.805 ( 6.119 -3.916 -14.127) 15.885 8.805 ( 6.119 3.916 -14.127) 15.885 9.007 ( -2.479 -5.503 -5.028) 7.855 9.007 ( -2.479 5.503 -5.028) 7.855 9.279 ( -0.095 -7.974 -2.434) 8.338 9.279 ( -0.095 7.974 -2.434) 8.338 9.442 ( 7.406 -6.221 -4.926) 10.854 9.442 ( 7.405 6.221 -4.926) 10.854 9.661 ( -2.987 -1.200 -5.227) 6.139 9.661 ( -2.987 1.200 -5.227) 6.139 9.980 ( -0.904 -2.821 1.574) 3.354 9.980 ( -0.904 2.821 1.574) 3.354 10.033 ( 0.597 -1.724 -5.113) 5.429 10.033 ( 0.597 1.724 -5.113) 5.429 10.502 ( -6.280 -0.696 -6.410) 9.000 10.502 ( -6.280 0.696 -6.410) 9.000 10.855 ( 1.239 -3.700 -8.214) 9.094 10.855 ( 1.239 3.700 -8.214) 9.094 10.940 ( 1.260 -9.124 -4.006) 10.044 10.940 ( 1.260 9.124 -4.006) 10.044 11.366 ( 2.477 -9.043 -4.620) 10.453 11.366 ( 2.477 9.043 -4.620) 10.453 11.476 ( -11.304 -9.222 2.437) 14.791 11.476 ( -11.304 9.222 2.437) 14.791 11.697 ( 6.178 -9.511 -7.153) 13.409 11.697 ( 6.178 9.511 -7.153) 13.409 12.094 ( 1.678 -12.218 14.926) 19.362 12.094 ( 1.678 12.218 14.926) 19.362 12.672 ( -3.067 -4.493 8.369) 9.982 12.672 ( -3.067 4.493 8.369) 9.982 12.840 ( -5.773 -6.399 0.915) 8.667 12.840 ( -5.773 6.399 0.915) 8.667 13.328 ( 5.530 -2.245 -5.092) 7.845 13.328 ( 5.530 2.245 -5.092) 7.845 13.800 ( 1.760 -3.642 6.658) 7.790 13.800 ( 1.760 3.642 6.658) 7.790 14.122 ( 1.719 -6.912 1.054) 7.200 14.122 ( 1.719 6.912 1.054) 7.200 14.886 ( 3.221 -5.602 -12.629) 14.186 14.886 ( 3.221 5.602 -12.629) 14.186 15.315 ( -1.774 -1.653 -11.992) 12.235 15.315 ( -1.774 1.653 -11.992) 12.235 15.871 ( 2.519 -2.285 3.334) 4.763 15.871 ( 2.519 2.285 3.334) 4.763 16.137 ( -1.325 -2.107 8.365) 8.727 16.137 ( -1.325 2.107 8.365) 8.727 16.403 ( -1.308 -3.109 2.459) 4.174 16.403 ( -1.308 3.109 2.459) 4.174 16.688 ( -3.881 -3.350 2.346) 5.639 16.688 ( -3.881 3.350 2.346) 5.639 19.159 ( -6.458 -3.796 22.818) 24.016 19.159 ( -6.458 3.796 22.818) 24.016 20.236 ( -4.313 -1.538 12.349) 13.171 20.236 ( -4.313 1.538 12.349) 13.171 21.891 ( 6.862 -6.352 -32.798) 34.105 21.891 ( 6.862 6.352 -32.798) 34.105 22.343 ( 2.671 -5.742 -26.562) 27.306 22.343 ( 2.671 5.742 -26.562) 27.306 24.605 ( 5.075 -1.916 5.666) 7.844 24.605 ( 5.075 1.916 5.666) 7.844 25.823 ( 16.841 -3.555 -14.592) 22.566 25.823 ( 16.841 3.555 -14.592) 22.566 26.130 ( -5.087 -3.442 13.928) 15.222 26.130 ( -5.087 3.442 13.928) 15.222 27.017 ( -6.154 -4.421 -14.140) 16.042 27.017 ( -6.154 4.421 -14.140) 16.042 29.429 ( 1.184 -3.366 0.970) 3.697 29.429 ( 1.184 3.366 0.970) 3.697 29.758 ( -2.070 -6.492 -0.782) 6.859 29.758 ( -2.070 6.492 -0.782) 6.859 30.419 ( -3.234 -9.593 8.784) 13.403 30.419 ( -3.234 9.593 8.784) 13.403 30.762 ( 3.837 -6.280 3.855) 8.308 30.762 ( 3.837 6.280 3.855) 8.308 31.195 ( -3.292 -6.611 12.976) 14.931 31.195 ( -3.292 6.611 12.976) 14.931 31.814 ( 2.664 -3.025 13.858) 14.432 31.814 ( 2.664 3.025 13.858) 14.432 32.086 ( -2.918 -5.207 -0.378) 5.981 32.086 ( -2.918 5.207 -0.378) 5.981 32.648 ( -2.502 -0.757 -13.596) 13.845 32.648 ( -2.502 0.757 -13.596) 13.845 ======================= Grid point 157 (86/128) ======================= q-point: (-0.50 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.273 ( -4.965 -14.413 3.781) 15.706 3.273 ( -4.965 14.413 3.781) 15.706 3.438 ( 5.858 -2.028 12.353) 13.821 3.438 ( 5.858 2.029 12.353) 13.821 3.811 ( -20.842 -7.856 5.717) 22.995 3.811 ( -20.842 7.856 5.717) 22.995 4.133 ( 0.590 -2.220 6.341) 6.744 4.133 ( 0.590 2.220 6.341) 6.744 4.567 ( 5.141 -2.638 -6.499) 8.697 4.567 ( 5.141 2.638 -6.499) 8.697 4.749 ( -0.339 -9.732 8.454) 12.896 4.749 ( -0.339 9.732 8.454) 12.896 5.054 ( 2.753 -8.793 -5.327) 10.643 5.054 ( 2.753 8.793 -5.327) 10.643 5.762 ( 4.539 -4.846 5.753) 8.785 5.762 ( 4.539 4.846 5.753) 8.785 6.047 ( -5.225 -6.314 17.847) 19.639 6.047 ( -5.225 6.314 17.847) 19.639 6.264 ( -4.010 -7.678 9.208) 12.642 6.264 ( -4.010 7.678 9.208) 12.642 6.448 ( -1.755 -7.589 15.303) 17.172 6.448 ( -1.755 7.589 15.303) 17.172 6.676 ( -7.782 -1.646 17.158) 18.912 6.676 ( -7.782 1.646 17.158) 18.912 7.025 ( -11.494 -5.403 23.058) 26.324 7.025 ( -11.494 5.403 23.058) 26.324 7.256 ( 2.946 -5.713 13.242) 14.719 7.256 ( 2.946 5.713 13.242) 14.719 7.738 ( 7.709 -5.979 7.997) 12.615 7.738 ( 7.709 5.979 7.997) 12.615 7.839 ( 2.543 -2.272 -1.454) 3.707 7.839 ( 2.543 2.272 -1.454) 3.707 7.975 ( -1.261 -0.547 -3.022) 3.320 7.975 ( -1.261 0.547 -3.022) 3.320 8.340 ( -4.206 -3.436 -3.827) 6.644 8.340 ( -4.206 3.436 -3.827) 6.644 8.567 ( -0.955 -3.190 -6.199) 7.037 8.567 ( -0.955 3.190 -6.199) 7.037 8.885 ( 6.181 -4.248 -9.224) 11.889 8.885 ( 6.181 4.248 -9.224) 11.889 8.963 ( 1.728 -5.119 -4.274) 6.889 8.963 ( 1.728 5.119 -4.274) 6.889 9.245 ( -3.232 -3.840 -2.014) 5.408 9.245 ( -3.232 3.840 -2.014) 5.408 9.466 ( -1.658 -6.321 -8.804) 10.964 9.466 ( -1.658 6.321 -8.804) 10.964 9.664 ( 4.307 -5.162 -2.024) 7.021 9.664 ( 4.307 5.162 -2.024) 7.021 9.957 ( -2.090 -8.425 -4.018) 9.565 9.957 ( -2.090 8.425 -4.018) 9.565 10.072 ( 6.196 -3.859 -2.284) 7.648 10.072 ( 6.196 3.859 -2.284) 7.648 10.385 ( -1.618 -2.527 -8.905) 9.397 10.385 ( -1.618 2.527 -8.905) 9.397 10.833 ( -2.351 -9.261 0.698) 9.581 10.833 ( -2.351 9.261 0.698) 9.581 10.935 ( -0.222 -8.224 -2.814) 8.695 10.935 ( -0.222 8.224 -2.814) 8.695 11.291 ( -4.686 -1.999 -1.775) 5.395 11.291 ( -4.686 1.999 -1.775) 5.395 11.405 ( 2.256 -8.634 -7.378) 11.579 11.405 ( 2.256 8.634 -7.378) 11.579 11.821 ( 7.694 -9.089 -6.019) 13.343 11.821 ( 7.694 9.089 -6.019) 13.343 12.167 ( 0.294 -5.265 14.021) 14.980 12.167 ( 0.294 5.265 14.021) 14.980 12.630 ( -5.129 -2.199 7.317) 9.202 12.630 ( -5.129 2.199 7.317) 9.202 12.802 ( 1.082 -5.316 2.371) 5.920 12.802 ( 1.082 5.316 2.371) 5.920 13.388 ( 3.164 -2.295 -4.602) 6.038 13.388 ( 3.164 2.295 -4.602) 6.038 13.834 ( -1.547 -3.406 6.891) 7.841 13.834 ( -1.547 3.406 6.891) 7.841 14.172 ( 3.201 -6.601 0.668) 7.367 14.172 ( 3.201 6.601 0.668) 7.367 14.902 ( 4.226 -3.654 -11.153) 12.474 14.902 ( 4.226 3.654 -11.153) 12.474 15.220 ( -2.363 -3.022 -15.575) 16.040 15.220 ( -2.363 3.022 -15.575) 16.040 15.948 ( 3.504 -1.505 5.420) 6.627 15.948 ( 3.504 1.505 5.420) 6.627 16.132 ( -2.299 -3.231 5.643) 6.897 16.132 ( -2.299 3.231 5.643) 6.897 16.387 ( -2.791 -6.910 7.964) 10.908 16.387 ( -2.791 6.910 7.964) 10.908 16.644 ( -0.803 -3.756 -0.043) 3.841 16.644 ( -0.803 3.756 -0.043) 3.841 19.163 ( -3.242 -3.143 23.156) 23.592 19.163 ( -3.242 3.143 23.156) 23.592 20.225 ( -2.373 -1.999 12.802) 13.173 20.225 ( -2.373 1.999 12.802) 13.173 21.892 ( 7.708 -6.134 -32.357) 33.823 21.892 ( 7.708 6.134 -32.357) 33.823 22.272 ( 2.173 -6.830 -27.405) 28.326 22.272 ( 2.173 6.830 -27.405) 28.326 24.765 ( 8.152 -2.314 7.971) 11.634 24.765 ( 8.152 2.314 7.971) 11.634 25.791 ( -12.041 -5.334 -18.674) 22.850 25.791 ( -12.041 5.334 -18.674) 22.850 26.036 ( -10.088 -2.665 11.701) 15.677 26.036 ( -10.088 2.665 11.701) 15.677 27.050 ( 14.319 -4.932 -10.812) 18.608 27.050 ( 14.319 4.932 -10.812) 18.608 29.471 ( 2.484 -4.742 2.170) 5.776 29.471 ( 2.484 4.742 2.170) 5.776 29.698 ( -3.358 -8.049 -2.377) 9.040 29.698 ( -3.358 8.049 -2.377) 9.040 30.390 ( -3.774 -10.296 9.115) 14.259 30.390 ( -3.774 10.296 9.115) 14.259 30.859 ( 4.437 -8.537 4.792) 10.748 30.859 ( 4.437 8.537 4.792) 10.748 31.180 ( -4.143 -5.633 12.847) 14.627 31.180 ( -4.143 5.633 12.847) 14.627 31.768 ( -12.881 -1.652 8.456) 15.497 31.768 ( -12.881 1.652 8.457) 15.497 32.035 ( -0.833 -3.027 1.960) 3.701 32.035 ( -0.833 3.027 1.960) 3.701 32.716 ( 13.545 -3.970 -11.305) 18.084 32.716 ( 13.545 3.970 -11.305) 18.084 ======================= Grid point 159 (87/128) ======================= q-point: (-0.33 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.181 ( -5.656 -20.175 3.261) 21.205 3.181 ( -5.656 20.175 3.261) 21.205 3.399 ( -19.389 -20.180 16.854) 32.668 3.399 ( -19.389 20.180 16.854) 32.668 3.705 ( 9.712 -5.283 8.286) 13.817 3.705 ( 9.712 5.283 8.286) 13.817 4.052 ( -8.755 -8.472 1.876) 12.327 4.052 ( -8.755 8.472 1.876) 12.327 4.587 ( 1.224 -6.767 -7.308) 10.035 4.588 ( 1.224 6.768 -7.308) 10.035 4.895 ( 9.752 -3.167 7.465) 12.683 4.895 ( 9.752 3.167 7.465) 12.683 5.172 ( 8.970 -2.665 2.284) 9.632 5.172 ( 8.970 2.665 2.284) 9.632 5.806 ( -1.736 -8.917 0.682) 9.110 5.806 ( -1.736 8.917 0.682) 9.110 5.996 ( -8.290 -6.957 17.368) 20.464 5.996 ( -8.290 6.957 17.368) 20.464 6.248 ( -2.030 -7.807 13.727) 15.922 6.248 ( -2.030 7.807 13.727) 15.922 6.477 ( -0.600 -5.238 8.686) 10.161 6.477 ( -0.600 5.238 8.686) 10.161 6.587 ( -8.945 -2.392 17.742) 20.013 6.587 ( -8.945 2.392 17.742) 20.013 6.835 ( -18.002 -6.187 31.165) 36.518 6.835 ( -18.002 6.187 31.165) 36.518 7.434 ( 8.539 -6.876 6.347) 12.668 7.434 ( 8.539 6.876 6.347) 12.668 7.682 ( -10.424 -4.097 -3.059) 11.610 7.682 ( -10.424 4.097 -3.059) 11.610 7.817 ( -2.069 -5.391 3.651) 6.832 7.817 ( -2.069 5.391 3.651) 6.832 8.047 ( 2.609 -5.595 -5.909) 8.546 8.047 ( 2.609 5.595 -5.909) 8.546 8.271 ( 1.085 -1.806 -4.574) 5.036 8.271 ( 1.085 1.806 -4.574) 5.036 8.545 ( -0.142 -4.650 -3.719) 5.956 8.545 ( -0.142 4.650 -3.719) 5.956 8.880 ( -1.623 -5.135 -1.180) 5.513 8.880 ( -1.623 5.135 -1.180) 5.513 9.082 ( 7.530 -3.306 -6.651) 10.577 9.082 ( 7.530 3.306 -6.651) 10.577 9.182 ( 1.820 -1.978 -2.945) 3.987 9.182 ( 1.820 1.978 -2.945) 3.987 9.415 ( -0.987 -8.371 -6.403) 10.585 9.415 ( -0.987 8.371 -6.403) 10.585 9.671 ( -2.552 -4.923 -3.692) 6.661 9.671 ( -2.552 4.923 -3.692) 6.661 9.928 ( 2.465 -6.218 -4.426) 8.021 9.928 ( 2.465 6.218 -4.426) 8.021 10.188 ( 5.341 -3.691 -2.023) 6.800 10.188 ( 5.341 3.691 -2.023) 6.800 10.410 ( 7.934 -4.130 -7.324) 11.561 10.410 ( 7.934 4.130 -7.324) 11.561 10.788 ( -3.518 -13.799 5.907) 15.417 10.788 ( -3.518 13.799 5.907) 15.417 10.903 ( -2.026 -4.692 -2.130) 5.537 10.903 ( -2.026 4.692 -2.130) 5.537 11.273 ( 3.840 -3.786 -8.779) 10.303 11.273 ( 3.840 3.786 -8.779) 10.303 11.414 ( 1.887 -8.260 -5.648) 10.183 11.414 ( 1.887 8.260 -5.648) 10.183 11.872 ( -0.523 -6.555 -0.646) 6.608 11.872 ( -0.523 6.555 -0.646) 6.608 12.262 ( 5.454 -2.845 9.154) 11.029 12.262 ( 5.454 2.845 9.154) 11.029 12.541 ( -7.430 -0.376 5.996) 9.555 12.541 ( -7.430 0.376 5.996) 9.555 12.878 ( 5.303 -4.173 1.614) 6.938 12.878 ( 5.303 4.173 1.614) 6.938 13.404 ( 0.234 -2.357 -3.645) 4.347 13.404 ( 0.234 2.357 -3.645) 4.347 13.800 ( -4.637 -5.303 6.586) 9.644 13.800 ( -4.637 5.303 6.586) 9.644 14.211 ( 0.090 -5.911 -1.197) 6.031 14.211 ( 0.090 5.911 -1.197) 6.031 14.974 ( 8.355 -0.558 -8.777) 12.130 14.974 ( 8.355 0.558 -8.777) 12.130 15.115 ( -1.464 -4.004 -16.849) 17.381 15.115 ( -1.464 4.004 -16.849) 17.381 16.017 ( 0.855 -2.149 6.357) 6.765 16.017 ( 0.855 2.149 6.357) 6.765 16.092 ( -4.321 -3.456 3.969) 6.809 16.092 ( -4.321 3.456 3.969) 6.809 16.381 ( -0.631 -7.658 7.297) 10.597 16.381 ( -0.631 7.658 7.297) 10.597 16.663 ( 2.319 -2.890 0.777) 3.786 16.663 ( 2.319 2.890 0.777) 3.786 19.216 ( -1.377 -5.606 21.880) 22.628 19.216 ( -1.377 5.606 21.880) 22.628 20.254 ( -0.541 -3.395 14.643) 15.041 20.254 ( -0.541 3.395 14.643) 15.041 21.909 ( 8.121 -4.743 -31.879) 33.237 21.909 ( 8.121 4.743 -31.879) 33.237 22.224 ( 5.102 -5.895 -27.750) 28.824 22.224 ( 5.102 5.895 -27.750) 28.824 24.907 ( 2.436 -2.139 8.039) 8.668 24.907 ( 2.436 2.139 8.039) 8.668 25.381 ( -21.239 -4.076 -15.638) 26.688 25.381 ( -21.239 4.076 -15.638) 26.688 25.923 ( -6.579 -2.238 13.132) 14.858 25.923 ( -6.579 2.238 13.132) 14.858 27.303 ( 15.892 -3.980 -13.330) 21.121 27.303 ( 15.892 3.980 -13.330) 21.121 29.519 ( 1.198 -3.851 0.867) 4.125 29.519 ( 1.198 3.851 0.867) 4.125 29.640 ( -1.379 -2.499 -1.201) 3.097 29.640 ( -1.379 2.499 -1.201) 3.097 30.362 ( -3.042 -9.136 8.911) 13.120 30.362 ( -3.042 9.136 8.911) 13.120 30.945 ( 2.048 -8.413 5.622) 10.324 30.945 ( 2.048 8.413 5.622) 10.324 31.140 ( -6.016 -4.101 12.597) 14.550 31.140 ( -6.016 4.101 12.597) 14.550 31.551 ( -10.922 -0.751 5.260) 12.146 31.551 ( -10.922 0.751 5.260) 12.146 32.046 ( -0.479 -2.207 6.746) 7.114 32.046 ( -0.479 2.207 6.746) 7.114 32.944 ( 15.063 -6.230 -14.593) 21.879 32.944 ( 15.063 6.230 -14.593) 21.879 ======================= Grid point 161 (88/128) ======================= q-point: (-0.17 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.082 ( -7.962 -16.160 6.198) 19.052 3.082 ( -7.962 16.160 6.198) 19.052 3.209 ( -6.508 -25.249 18.049) 31.711 3.209 ( -6.508 25.249 18.049) 31.711 3.860 ( -5.987 -11.138 -3.294) 13.067 3.860 ( -5.987 11.138 -3.294) 13.067 3.982 ( 9.335 -6.018 13.465) 17.455 3.982 ( 9.335 6.018 13.465) 17.455 4.590 ( 1.539 -5.543 -4.679) 7.415 4.590 ( 1.539 5.543 -4.679) 7.415 5.095 ( 8.258 -5.764 6.556) 12.017 5.095 ( 8.258 5.764 6.556) 12.017 5.314 ( 3.080 -4.315 9.653) 11.013 5.314 ( 3.080 4.315 9.653) 11.013 5.673 ( -12.202 -6.573 -1.235) 13.915 5.673 ( -12.202 6.573 -1.235) 13.915 5.977 ( 0.663 -1.072 14.105) 14.161 5.977 ( 0.663 1.072 14.105) 14.161 6.271 ( -2.932 -4.783 16.160) 17.106 6.271 ( -2.932 4.783 16.160) 17.106 6.440 ( -7.010 -5.073 7.428) 11.404 6.440 ( -7.010 5.073 7.428) 11.404 6.553 ( -0.827 -7.501 6.612) 10.033 6.553 ( -0.827 7.501 6.612) 10.033 6.674 ( -12.816 -3.647 33.176) 35.751 6.674 ( -12.816 3.647 33.176) 35.751 7.409 ( -9.964 -1.528 1.364) 10.173 7.409 ( -9.964 1.528 1.364) 10.173 7.632 ( -0.892 -2.303 2.017) 3.188 7.632 ( -0.892 2.303 2.017) 3.188 7.785 ( 1.835 -4.848 -0.522) 5.210 7.785 ( 1.835 4.848 -0.522) 5.210 7.991 ( -2.737 -4.361 -4.686) 6.962 7.991 ( -2.737 4.361 -4.686) 6.962 8.337 ( 5.010 -2.664 -2.608) 6.245 8.337 ( 5.010 2.664 -2.608) 6.245 8.516 ( -0.354 -3.458 -3.442) 4.892 8.516 ( -0.354 3.458 -3.442) 4.892 8.866 ( -0.328 -6.314 1.314) 6.458 8.866 ( -0.328 6.314 1.314) 6.458 9.089 ( 0.418 -4.915 -7.116) 8.659 9.089 ( 0.418 4.915 -7.116) 8.659 9.283 ( 2.641 -8.633 -6.438) 11.089 9.283 ( 2.641 8.633 -6.438) 11.089 9.404 ( 5.058 -4.327 -3.373) 7.462 9.404 ( 5.058 4.327 -3.373) 7.462 9.601 ( -2.053 -2.440 -2.546) 4.080 9.601 ( -2.053 2.440 -2.546) 4.080 9.995 ( 4.877 -3.456 -2.723) 6.568 9.995 ( 4.877 3.456 -2.723) 6.568 10.212 ( -1.606 -3.458 -1.818) 4.224 10.212 ( -1.606 3.458 -1.818) 4.224 10.563 ( 9.914 -4.509 -6.463) 12.664 10.563 ( 9.914 4.509 -6.463) 12.664 10.762 ( -2.045 -12.890 6.619) 14.633 10.762 ( -2.045 12.890 6.619) 14.633 10.872 ( 1.083 -4.391 -5.344) 7.001 10.872 ( 1.083 4.391 -5.344) 7.001 11.310 ( 3.338 -3.726 -8.918) 10.225 11.310 ( 3.338 3.726 -8.918) 10.225 11.435 ( 2.463 -5.620 -4.078) 7.368 11.435 ( 2.463 5.620 -4.078) 7.368 11.841 ( -2.309 -7.207 3.421) 8.305 11.841 ( -2.309 7.207 3.421) 8.305 12.359 ( -4.970 -1.921 5.505) 7.662 12.359 ( -4.970 1.921 5.505) 7.662 12.466 ( 2.646 -3.929 5.785) 7.477 12.466 ( 2.646 3.929 5.785) 7.477 12.979 ( 5.142 -1.625 -0.284) 5.400 12.979 ( 5.142 1.625 -0.284) 5.400 13.357 ( -4.196 -3.649 -2.867) 6.256 13.357 ( -4.196 3.649 -2.867) 6.256 13.741 ( -4.278 -6.555 6.814) 10.378 13.741 ( -4.278 6.555 6.814) 10.378 14.165 ( -3.218 -5.913 -2.844) 7.308 14.165 ( -3.218 5.913 -2.844) 7.308 14.995 ( -0.363 -5.446 -18.463) 19.252 14.995 ( -0.363 5.446 -18.463) 19.252 15.164 ( 10.715 -1.033 -4.599) 11.706 15.164 ( 10.715 1.033 -4.599) 11.706 15.984 ( -5.921 -3.496 2.399) 7.282 15.984 ( -5.921 3.496 2.399) 7.282 16.063 ( -0.961 -2.860 7.337) 7.934 16.063 ( -0.961 2.860 7.337) 7.934 16.416 ( 1.475 -4.845 2.749) 5.763 16.416 ( 1.475 4.845 2.749) 5.763 16.716 ( 2.180 -3.521 2.836) 5.019 16.716 ( 2.180 3.521 2.836) 5.019 19.265 ( -3.018 -8.140 19.917) 21.727 19.265 ( -3.018 8.140 19.917) 21.727 20.309 ( -0.924 -3.429 15.947) 16.337 20.309 ( -0.924 3.429 15.947) 16.337 21.923 ( 7.311 -3.346 -32.038) 33.032 21.923 ( 7.311 3.346 -32.038) 33.032 22.243 ( 9.018 -2.172 -27.124) 28.667 22.243 ( 9.018 2.172 -27.124) 28.667 24.906 ( -4.901 -1.870 5.409) 7.534 24.906 ( -4.901 1.870 5.409) 7.534 25.004 ( -12.190 -1.428 -8.818) 15.113 25.004 ( -12.190 1.428 -8.818) 15.113 25.932 ( 1.057 -3.660 14.879) 15.359 25.932 ( 1.057 3.660 14.879) 15.359 27.464 ( 7.673 -2.664 -15.950) 17.898 27.464 ( 7.673 2.664 -15.950) 17.898 29.504 ( -1.590 -9.866 -3.188) 10.489 29.504 ( -1.590 9.866 -3.188) 10.489 29.658 ( 2.219 -6.749 3.107) 7.754 29.658 ( 2.219 6.749 3.107) 7.754 30.359 ( -0.932 -5.901 8.379) 10.291 30.359 ( -0.932 5.901 8.379) 10.291 30.918 ( -7.604 -5.233 3.754) 9.965 30.918 ( -7.604 5.233 3.754) 9.965 31.113 ( -1.595 -8.185 14.742) 16.937 31.113 ( -1.595 8.185 14.742) 16.937 31.463 ( -1.656 -1.718 6.549) 6.970 31.463 ( -1.656 1.718 6.549) 6.970 32.066 ( -0.597 -2.587 7.844) 8.281 32.066 ( -0.597 2.587 7.844) 8.281 33.091 ( 7.452 -7.283 -18.477) 21.212 33.091 ( 7.452 7.283 -18.477) 21.212 ======================= Grid point 175 (89/128) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.916 ( -4.655 0.000 34.394) 34.708 2.989 ( 11.440 0.000 34.210) 36.072 3.300 ( -3.242 0.000 16.917) 17.224 3.865 ( 4.208 0.000 -7.141) 8.289 3.951 ( -3.730 0.000 -2.921) 4.738 4.089 ( -4.363 0.000 -12.938) 13.653 4.188 ( -3.803 0.000 -3.734) 5.330 4.427 ( -4.803 0.000 -5.426) 7.247 4.462 ( -8.485 0.000 2.346) 8.803 4.566 ( 5.578 0.000 6.319) 8.429 4.881 ( 2.044 0.000 4.774) 5.193 5.128 ( 0.870 0.000 3.664) 3.766 5.199 ( 4.778 0.000 -0.718) 4.832 5.200 ( -1.532 0.000 4.623) 4.870 5.416 ( -11.208 0.000 4.323) 12.013 5.495 ( 13.169 0.000 3.201) 13.552 5.634 ( -14.163 0.000 1.647) 14.258 5.885 ( 5.669 0.000 -9.391) 10.969 6.193 ( 1.618 0.000 -4.123) 4.429 6.420 ( -9.068 0.000 -7.530) 11.787 6.619 ( -6.330 0.000 9.407) 11.338 6.792 ( 7.347 0.000 -4.394) 8.561 6.898 ( -11.040 0.000 9.670) 14.676 7.115 ( 8.932 0.000 22.155) 23.887 7.216 ( 9.635 0.000 -4.537) 10.650 7.219 ( -2.493 0.000 6.398) 6.867 7.221 ( 2.030 0.000 -10.849) 11.038 7.404 ( -3.863 0.000 26.579) 26.858 7.413 ( 3.694 0.000 2.302) 4.353 7.485 ( -7.430 0.000 21.556) 22.801 7.644 ( -1.136 0.000 -1.321) 1.743 7.658 ( -1.895 0.000 -2.912) 3.474 8.054 ( 1.546 0.000 -13.039) 13.130 8.085 ( 1.798 0.000 20.726) 20.804 8.267 ( -3.891 0.000 13.389) 13.943 8.382 ( 3.333 0.000 -15.934) 16.279 8.473 ( 1.998 0.000 -7.408) 7.673 8.491 ( -7.932 0.000 24.046) 25.320 8.734 ( -3.312 0.000 -0.390) 3.335 8.743 ( -0.834 0.000 17.245) 17.265 9.114 ( 4.319 0.000 5.331) 6.861 9.133 ( 3.037 0.000 -24.864) 25.049 9.261 ( -2.629 0.000 2.867) 3.890 9.269 ( 0.434 0.000 7.975) 7.987 9.342 ( -4.463 0.000 -2.332) 5.036 9.378 ( -4.275 0.000 4.273) 6.044 9.512 ( 6.681 0.000 -12.311) 14.007 9.518 ( 1.700 0.000 -3.894) 4.249 9.876 ( -1.556 0.000 -7.705) 7.861 10.117 ( 9.896 0.000 -18.935) 21.365 10.137 ( -5.834 0.000 9.532) 11.175 10.298 ( 3.664 0.000 2.169) 4.258 10.393 ( -0.216 0.000 0.357) 0.417 10.501 ( 0.884 0.000 -2.155) 2.329 10.540 ( -1.649 0.000 -14.254) 14.349 10.627 ( 8.576 0.000 -0.801) 8.613 10.632 ( -15.587 0.000 1.887) 15.701 11.011 ( 7.585 0.000 -21.149) 22.469 11.075 ( 15.705 0.000 0.933) 15.732 11.254 ( -6.486 0.000 -6.665) 9.300 11.709 ( 1.430 0.000 1.316) 1.944 11.784 ( -4.935 0.000 2.163) 5.388 11.886 ( -2.693 0.000 19.776) 19.959 12.327 ( -2.631 0.000 6.736) 7.232 12.331 ( 2.437 0.000 2.715) 3.648 12.371 ( -10.545 0.000 8.721) 13.684 12.611 ( -6.104 0.000 -4.484) 7.574 12.702 ( 10.409 0.000 -12.602) 16.345 12.807 ( -4.135 0.000 8.504) 9.456 13.143 ( 6.577 0.000 -2.542) 7.051 13.220 ( -5.716 0.000 6.979) 9.021 13.413 ( -2.201 0.000 -2.784) 3.549 13.677 ( 6.081 0.000 -2.082) 6.428 13.938 ( 3.146 0.000 -13.232) 13.601 14.010 ( -3.545 0.000 -2.298) 4.225 14.247 ( 6.098 0.000 -15.345) 16.512 14.743 ( 1.308 0.000 3.444) 3.684 15.027 ( 0.229 0.000 -5.772) 5.777 15.123 ( -3.705 0.000 0.092) 3.706 15.171 ( 4.198 0.000 -5.109) 6.613 15.838 ( -6.267 0.000 1.138) 6.370 15.875 ( 4.679 0.000 -0.219) 4.684 16.006 ( -7.297 0.000 3.252) 7.989 16.134 ( 4.191 0.000 1.971) 4.631 16.459 ( 0.975 0.000 3.380) 3.518 16.473 ( 0.053 0.000 2.009) 2.010 16.973 ( 1.107 0.000 8.850) 8.919 17.211 ( -5.164 0.000 -1.359) 5.340 19.288 ( -3.592 0.000 25.545) 25.796 20.008 ( -17.176 0.000 26.732) 31.774 20.738 ( -3.198 0.000 24.224) 24.435 20.743 ( 5.249 0.000 -42.189) 42.514 20.879 ( -8.431 0.000 22.682) 24.198 21.199 ( 15.922 0.000 -32.167) 35.891 21.832 ( 2.404 0.000 -28.540) 28.641 21.907 ( 13.194 0.000 -27.025) 30.074 24.721 ( -8.794 0.000 4.167) 9.731 24.795 ( -14.632 0.000 3.264) 14.991 24.885 ( 12.802 0.000 -4.479) 13.563 24.982 ( 15.046 0.000 -6.561) 16.415 26.240 ( 1.035 0.000 19.958) 19.985 26.533 ( 4.691 0.000 17.015) 17.650 27.087 ( -0.522 0.000 -23.432) 23.438 27.187 ( -4.147 0.000 -15.523) 16.068 29.163 ( 4.048 0.000 4.054) 5.729 29.336 ( -4.294 0.000 -4.588) 6.284 29.723 ( 3.878 0.000 1.126) 4.038 29.804 ( -7.382 0.000 -1.679) 7.571 30.368 ( -9.286 0.000 4.059) 10.134 30.479 ( 17.177 0.000 -2.497) 17.358 30.825 ( 8.126 0.000 6.710) 10.539 30.921 ( -12.097 0.000 4.029) 12.751 31.165 ( -2.189 0.000 7.975) 8.270 31.368 ( -0.141 0.000 -2.891) 2.894 31.749 ( 8.543 0.000 13.682) 16.130 31.839 ( -4.760 0.000 10.239) 11.291 32.110 ( -0.394 0.000 -0.772) 0.867 32.424 ( 0.356 0.000 -14.575) 14.579 32.534 ( 1.565 0.000 12.491) 12.589 32.979 ( -9.787 0.000 -9.721) 13.794 ======================= Grid point 176 (90/128) ======================= q-point: ( 0.17 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.020 ( 0.462 0.000 32.422) 32.425 3.272 ( -5.288 0.000 12.010) 13.122 3.442 ( 22.017 0.000 29.227) 36.592 3.832 ( -2.877 0.000 -14.840) 15.116 3.911 ( -0.623 0.000 -3.019) 3.083 3.965 ( -5.535 0.000 -5.018) 7.471 4.069 ( -6.582 0.000 -3.088) 7.271 4.236 ( -13.528 0.000 14.496) 19.828 4.405 ( 1.926 0.000 -14.277) 14.406 4.696 ( 5.269 0.000 5.692) 7.756 4.973 ( 4.838 0.000 2.653) 5.518 5.147 ( -3.869 0.000 4.204) 5.713 5.167 ( 2.814 0.000 -2.058) 3.486 5.264 ( -7.616 0.000 -3.033) 8.198 5.266 ( -6.187 0.000 5.191) 8.076 5.344 ( -7.049 0.000 12.590) 14.429 5.710 ( 5.127 0.000 4.828) 7.043 5.981 ( 7.798 0.000 -7.828) 11.049 6.213 ( -9.400 0.000 -7.662) 12.127 6.217 ( 2.980 0.000 -0.362) 3.002 6.477 ( -9.793 0.000 5.440) 11.202 6.886 ( 3.313 0.000 8.993) 9.584 6.957 ( 9.505 0.000 -3.761) 10.222 7.120 ( -5.852 0.000 7.870) 9.807 7.252 ( 6.757 0.000 -2.974) 7.382 7.362 ( 5.742 0.000 -6.719) 8.838 7.376 ( -4.404 0.000 19.779) 20.263 7.476 ( 7.574 0.000 20.658) 22.003 7.509 ( 7.641 0.000 -3.373) 8.353 7.531 ( 4.004 0.000 23.001) 23.346 7.657 ( 2.379 0.000 -1.612) 2.874 7.679 ( 4.473 0.000 1.361) 4.675 8.047 ( 3.551 0.000 -12.102) 12.612 8.217 ( -4.725 0.000 13.854) 14.637 8.249 ( 2.396 0.000 25.390) 25.503 8.302 ( -1.991 0.000 -18.462) 18.569 8.416 ( -10.119 0.000 28.575) 30.314 8.495 ( 1.052 0.000 -8.724) 8.787 8.690 ( 0.981 0.000 -3.096) 3.248 8.816 ( -2.443 0.000 18.177) 18.341 9.087 ( 2.563 0.000 -26.280) 26.404 9.148 ( -6.221 0.000 1.864) 6.495 9.197 ( -5.389 0.000 2.939) 6.139 9.234 ( -2.653 0.000 1.484) 3.040 9.283 ( -0.331 0.000 -2.263) 2.287 9.366 ( 2.297 0.000 2.505) 3.399 9.552 ( 4.150 0.000 -2.445) 4.816 9.598 ( 5.594 0.000 -7.257) 9.163 9.806 ( -2.333 0.000 -7.466) 7.822 10.039 ( -7.751 0.000 11.527) 13.891 10.152 ( 4.023 0.000 -22.101) 22.464 10.294 ( -4.983 0.000 -16.736) 17.463 10.305 ( -5.968 0.000 1.820) 6.239 10.341 ( -10.401 0.000 -2.863) 10.788 10.491 ( 0.022 0.000 -3.809) 3.809 10.566 ( 2.850 0.000 0.615) 2.916 10.778 ( 4.600 0.000 4.735) 6.601 11.032 ( 3.428 0.000 -18.433) 18.749 11.119 ( -2.971 0.000 -9.861) 10.299 11.321 ( 8.577 0.000 -0.368) 8.585 11.696 ( -4.845 0.000 8.980) 10.204 11.741 ( 1.205 0.000 1.049) 1.597 11.982 ( 3.645 0.000 15.203) 15.634 12.112 ( -10.722 0.000 6.141) 12.356 12.377 ( 0.183 0.000 3.441) 3.446 12.436 ( 3.341 0.000 9.167) 9.757 12.486 ( -4.143 0.000 -2.866) 5.038 12.734 ( -7.383 0.000 9.858) 12.316 12.868 ( 11.620 0.000 -12.788) 17.279 13.131 ( -6.953 0.000 7.666) 10.349 13.214 ( 2.482 0.000 -5.872) 6.375 13.360 ( -2.245 0.000 0.115) 2.248 13.800 ( 7.629 0.000 -3.406) 8.355 13.934 ( -3.124 0.000 -2.595) 4.061 13.972 ( 6.217 0.000 -14.137) 15.444 14.287 ( 4.293 0.000 -13.427) 14.097 14.788 ( 1.816 0.000 3.188) 3.669 14.988 ( -1.847 0.000 -7.829) 8.044 15.033 ( -4.636 0.000 1.557) 4.891 15.177 ( -1.882 0.000 -6.268) 6.545 15.758 ( -2.737 0.000 2.521) 3.721 15.946 ( 0.613 0.000 3.766) 3.816 15.966 ( 4.515 0.000 1.172) 4.664 16.214 ( 1.799 0.000 2.463) 3.050 16.477 ( -0.480 0.000 1.052) 1.156 16.530 ( 6.185 0.000 3.909) 7.317 16.982 ( -3.872 0.000 8.686) 9.510 17.047 ( -12.592 0.000 2.669) 12.872 19.353 ( -1.143 0.000 29.125) 29.148 19.770 ( -19.276 0.000 25.339) 31.837 20.695 ( 8.037 0.000 -42.524) 43.276 20.728 ( -8.508 0.000 24.359) 25.802 20.811 ( -7.547 0.000 22.127) 23.378 21.332 ( 12.394 0.000 -30.103) 32.555 21.729 ( -1.402 0.000 -29.819) 29.852 22.002 ( 9.134 0.000 -27.678) 29.146 24.619 ( -4.783 0.000 4.400) 6.499 24.670 ( 1.491 0.000 4.354) 4.602 25.174 ( 19.640 0.000 -8.430) 21.373 25.347 ( 24.861 0.000 -9.028) 26.450 26.309 ( -2.546 0.000 19.423) 19.589 26.627 ( -2.418 0.000 16.782) 16.955 26.897 ( -9.525 0.000 -19.485) 21.688 27.038 ( -3.688 0.000 -19.212) 19.563 29.256 ( -2.012 0.000 -4.453) 4.886 29.279 ( 6.128 0.000 4.163) 7.408 29.664 ( -6.562 0.000 -0.375) 6.573 29.805 ( 3.704 0.000 2.979) 4.754 30.228 ( -6.447 0.000 1.011) 6.526 30.637 ( -7.456 0.000 -0.482) 7.471 30.880 ( 13.383 0.000 -0.871) 13.411 30.997 ( 6.383 0.000 9.021) 11.051 31.190 ( 2.485 0.000 5.959) 6.456 31.353 ( -0.024 0.000 -2.873) 2.873 31.773 ( -5.361 0.000 5.535) 7.706 31.972 ( 8.963 0.000 12.284) 15.207 32.107 ( -0.300 0.000 1.058) 1.100 32.335 ( -2.762 0.000 -14.935) 15.188 32.589 ( -1.746 0.000 14.325) 14.431 32.697 ( -16.688 0.000 -3.239) 16.999 ======================= Grid point 177 (91/128) ======================= q-point: ( 0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.142 ( -0.489 0.000 21.617) 21.622 3.238 ( -3.831 0.000 12.817) 13.377 3.631 ( -13.971 0.000 0.578) 13.983 3.838 ( -1.958 0.000 -15.452) 15.576 3.853 ( -5.581 0.000 4.337) 7.068 3.940 ( 12.910 0.000 20.606) 24.316 3.972 ( -2.729 0.000 1.952) 3.355 4.160 ( 4.888 0.000 5.398) 7.282 4.407 ( 3.916 0.000 -10.559) 11.261 4.754 ( -0.958 0.000 -0.554) 1.107 4.969 ( -13.691 0.000 3.452) 14.120 5.010 ( -0.318 0.000 4.616) 4.627 5.188 ( 0.345 0.000 6.749) 6.757 5.255 ( 6.465 0.000 -4.019) 7.612 5.260 ( 7.158 0.000 2.143) 7.472 5.412 ( -0.988 0.000 13.114) 13.151 5.691 ( -6.944 0.000 8.272) 10.800 6.023 ( -5.402 0.000 -9.302) 10.757 6.101 ( 6.874 0.000 -6.434) 9.415 6.200 ( -5.398 0.000 -3.090) 6.220 6.502 ( 8.544 0.000 10.232) 13.330 6.974 ( 2.367 0.000 2.218) 3.244 7.042 ( -7.621 0.000 15.909) 17.640 7.055 ( 4.059 0.000 -6.643) 7.785 7.355 ( -0.008 0.000 -9.451) 9.451 7.379 ( -2.013 0.000 16.858) 16.978 7.395 ( 3.301 0.000 4.577) 5.643 7.627 ( 2.937 0.000 22.536) 22.727 7.630 ( 6.594 0.000 -12.568) 14.193 7.715 ( 1.921 0.000 6.722) 6.991 7.732 ( 2.919 0.000 14.497) 14.788 7.793 ( 6.397 0.000 3.416) 7.252 8.075 ( 2.229 0.000 -8.310) 8.604 8.148 ( -7.051 0.000 11.507) 13.496 8.231 ( 3.253 0.000 -11.955) 12.390 8.322 ( -5.651 0.000 34.934) 35.388 8.437 ( 0.528 0.000 -13.951) 13.961 8.487 ( 2.117 0.000 21.639) 21.742 8.696 ( -15.410 0.000 15.372) 21.766 8.771 ( 7.575 0.000 -3.635) 8.402 8.971 ( -10.744 0.000 9.022) 14.029 8.977 ( -4.958 0.000 -8.369) 9.728 9.143 ( -1.951 0.000 -6.278) 6.575 9.272 ( 6.337 0.000 -12.982) 14.446 9.299 ( 5.059 0.000 -5.712) 7.630 9.439 ( 4.678 0.000 0.536) 4.709 9.614 ( 1.563 0.000 -1.882) 2.446 9.631 ( 2.023 0.000 -7.626) 7.890 9.740 ( -1.813 0.000 -7.231) 7.455 9.924 ( -9.691 0.000 9.114) 13.304 10.058 ( -4.061 0.000 -26.097) 26.411 10.202 ( 1.688 0.000 -3.179) 3.599 10.226 ( 7.418 0.000 -20.366) 21.675 10.246 ( -4.614 0.000 5.198) 6.950 10.475 ( -0.691 0.000 -3.290) 3.362 10.577 ( -2.820 0.000 3.306) 4.345 10.764 ( -5.381 0.000 -1.461) 5.576 10.984 ( -1.271 0.000 -13.342) 13.403 11.143 ( 7.971 0.000 -5.380) 9.617 11.344 ( -4.399 0.000 1.732) 4.728 11.637 ( -5.520 0.000 9.554) 11.034 11.757 ( 0.304 0.000 0.339) 0.456 12.065 ( 1.269 0.000 1.960) 2.335 12.189 ( 12.113 0.000 17.234) 21.065 12.275 ( -8.859 0.000 0.341) 8.865 12.520 ( -0.594 0.000 10.265) 10.283 12.526 ( 5.263 0.000 2.559) 5.852 12.655 ( -3.038 0.000 9.504) 9.977 12.994 ( 7.522 0.000 -12.812) 14.857 13.044 ( -5.260 0.000 6.755) 8.561 13.172 ( -4.290 0.000 -5.067) 6.639 13.348 ( 1.159 0.000 -3.025) 3.239 13.812 ( -3.943 0.000 -4.144) 5.720 13.970 ( 6.792 0.000 -1.874) 7.045 14.031 ( 6.344 0.000 -15.434) 16.687 14.282 ( 0.552 0.000 -12.166) 12.179 14.821 ( 0.695 0.000 -0.132) 0.707 14.905 ( -3.131 0.000 -5.578) 6.397 14.997 ( -0.142 0.000 -0.686) 0.700 15.075 ( -4.403 0.000 -7.481) 8.681 15.773 ( 2.833 0.000 4.456) 5.280 16.027 ( 0.111 0.000 3.922) 3.924 16.050 ( 6.828 0.000 6.895) 9.704 16.231 ( 1.233 0.000 0.671) 1.404 16.470 ( -0.133 0.000 0.251) 0.284 16.698 ( 8.615 0.000 5.282) 10.106 16.801 ( -15.080 0.000 5.674) 16.112 16.907 ( -7.779 0.000 7.742) 10.975 19.478 ( -2.037 0.000 34.587) 34.646 19.559 ( -10.997 0.000 22.839) 25.349 20.636 ( -10.436 0.000 20.418) 22.930 20.693 ( 10.525 0.000 -42.068) 43.364 20.804 ( -4.463 0.000 25.755) 26.139 21.417 ( 10.541 0.000 -29.268) 31.108 21.533 ( -5.936 0.000 -32.896) 33.427 22.020 ( 5.532 0.000 -28.240) 28.777 24.661 ( 6.238 0.000 7.202) 9.528 24.807 ( 9.880 0.000 7.634) 12.486 25.424 ( 8.979 0.000 -13.413) 16.141 25.672 ( 12.935 0.000 -15.422) 20.128 26.297 ( -6.900 0.000 17.477) 18.790 26.573 ( -10.319 0.000 15.541) 18.655 26.685 ( -2.743 0.000 -15.454) 15.695 26.936 ( 2.507 0.000 -18.193) 18.365 29.232 ( 1.030 0.000 -3.363) 3.517 29.337 ( -3.010 0.000 0.459) 3.045 29.648 ( 5.956 0.000 5.298) 7.972 29.875 ( 2.610 0.000 3.499) 4.365 30.150 ( -2.281 0.000 -1.113) 2.538 30.433 ( -12.354 0.000 -1.432) 12.437 31.078 ( 4.200 0.000 7.741) 8.807 31.100 ( -0.391 0.000 11.884) 11.890 31.339 ( 12.856 0.000 -7.556) 14.912 31.353 ( 1.401 0.000 -2.607) 2.960 31.709 ( -2.927 0.000 3.053) 4.229 32.075 ( -1.932 0.000 -0.662) 2.042 32.105 ( -0.159 0.000 1.025) 1.037 32.192 ( -12.031 0.000 -3.832) 12.627 32.523 ( 4.454 0.000 4.165) 6.098 32.581 ( -5.337 0.000 13.710) 14.712 ======================= Grid point 178 (92/128) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.146 ( -7.297 0.000 15.856) 17.455 3.217 ( -4.889 0.000 15.450) 16.206 3.309 ( -22.210 0.000 10.358) 24.506 3.760 ( 0.367 0.000 -13.234) 13.239 3.848 ( 3.556 0.000 6.250) 7.191 4.007 ( 3.771 0.000 8.275) 9.094 4.046 ( 0.540 0.000 3.504) 3.546 4.409 ( 9.926 0.000 -4.136) 10.753 4.485 ( 9.876 0.000 -0.996) 9.926 4.684 ( -4.583 0.000 -4.214) 6.226 4.836 ( -3.718 0.000 8.019) 8.840 5.029 ( 0.086 0.000 2.421) 2.423 5.175 ( -3.947 0.000 6.228) 7.374 5.334 ( -7.186 0.000 7.420) 10.329 5.386 ( 5.173 0.000 -1.767) 5.467 5.453 ( 10.451 0.000 1.603) 10.573 5.610 ( -6.775 0.000 12.659) 14.358 5.901 ( -3.632 0.000 -8.047) 8.829 6.120 ( -1.187 0.000 -0.926) 1.506 6.253 ( 12.840 0.000 -7.564) 14.903 6.663 ( 2.305 0.000 9.641) 9.913 6.969 ( -7.963 0.000 17.082) 18.847 7.023 ( 3.527 0.000 3.092) 4.691 7.049 ( -2.880 0.000 -5.949) 6.609 7.273 ( -3.769 0.000 -7.071) 8.012 7.396 ( -3.762 0.000 -3.903) 5.421 7.429 ( -1.111 0.000 17.867) 17.901 7.596 ( -2.784 0.000 -14.023) 14.297 7.689 ( -12.355 0.000 25.219) 28.083 7.745 ( -3.250 0.000 9.979) 10.495 7.801 ( 4.911 0.000 19.271) 19.887 7.922 ( 5.387 0.000 4.007) 6.713 8.043 ( -8.396 0.000 5.315) 9.936 8.068 ( 1.719 0.000 -8.761) 8.928 8.178 ( -5.719 0.000 -8.337) 10.110 8.327 ( -18.450 0.000 27.738) 33.314 8.464 ( 2.123 0.000 19.108) 19.226 8.573 ( 16.669 0.000 -12.327) 20.732 8.621 ( -3.527 0.000 15.118) 15.524 8.781 ( -2.539 0.000 -2.655) 3.673 8.946 ( 4.095 0.000 5.209) 6.626 8.995 ( 2.008 0.000 -1.438) 2.470 9.054 ( 0.997 0.000 -1.013) 1.421 9.293 ( 1.010 0.000 -10.404) 10.453 9.435 ( 12.249 0.000 -10.107) 15.880 9.467 ( -4.783 0.000 -0.264) 4.790 9.625 ( 5.192 0.000 -0.348) 5.203 9.642 ( 3.579 0.000 -14.691) 15.121 9.677 ( -2.386 0.000 -6.248) 6.688 9.783 ( -9.217 0.000 -0.028) 9.217 9.899 ( -0.462 0.000 -21.584) 21.589 10.214 ( 0.793 0.000 7.025) 7.070 10.267 ( 1.559 0.000 -17.270) 17.341 10.336 ( 9.174 0.000 5.129) 10.510 10.464 ( 4.524 0.000 -9.315) 10.355 10.522 ( -3.402 0.000 3.542) 4.911 10.664 ( -3.123 0.000 -4.384) 5.382 10.913 ( 0.076 0.000 -13.051) 13.052 11.241 ( -7.364 0.000 3.669) 8.227 11.284 ( 7.888 0.000 -1.622) 8.053 11.620 ( -0.618 0.000 9.391) 9.411 11.753 ( -0.734 0.000 -0.823) 1.103 12.090 ( 0.024 0.000 2.943) 2.943 12.132 ( -5.912 0.000 0.037) 5.912 12.435 ( -4.727 0.000 10.922) 11.901 12.492 ( 5.331 0.000 16.375) 17.221 12.643 ( 5.896 0.000 3.998) 7.124 12.734 ( 3.944 0.000 5.454) 6.730 13.012 ( -1.841 0.000 -9.038) 9.223 13.034 ( 3.177 0.000 6.271) 7.030 13.045 ( -6.056 0.000 -5.562) 8.223 13.369 ( 3.962 0.000 -9.221) 10.036 13.712 ( -4.907 0.000 -3.043) 5.774 14.066 ( 4.064 0.000 -1.609) 4.371 14.070 ( 4.578 0.000 -15.398) 16.064 14.218 ( -1.355 0.000 -12.788) 12.860 14.796 ( -2.260 0.000 -3.909) 4.516 14.857 ( 0.239 0.000 -2.717) 2.727 15.012 ( 2.479 0.000 -3.008) 3.898 15.016 ( 1.045 0.000 -5.628) 5.724 15.879 ( 5.643 0.000 5.868) 8.141 15.992 ( -4.363 0.000 1.951) 4.780 16.170 ( 1.566 0.000 6.017) 6.218 16.293 ( 4.270 0.000 2.134) 4.773 16.511 ( 4.814 0.000 3.210) 5.786 16.517 ( -16.594 0.000 6.416) 17.791 16.776 ( -8.981 0.000 5.863) 10.725 16.911 ( 10.770 0.000 3.861) 11.442 19.384 ( -11.446 0.000 23.971) 26.564 19.738 ( 7.644 0.000 36.445) 37.238 20.537 ( -8.789 0.000 18.985) 20.921 20.742 ( 13.117 0.000 -40.661) 42.725 20.840 ( -3.426 0.000 26.827) 27.045 21.275 ( -5.948 0.000 -37.254) 37.726 21.499 ( 11.255 0.000 -27.836) 30.025 21.990 ( 3.939 0.000 -28.495) 28.766 24.854 ( 9.275 0.000 9.809) 13.499 25.036 ( 9.519 0.000 10.722) 14.338 25.330 ( -10.859 0.000 -15.016) 18.531 25.616 ( -10.678 0.000 -20.089) 22.750 26.206 ( -9.620 0.000 14.587) 17.474 26.409 ( -13.036 0.000 14.738) 19.675 26.745 ( 13.970 0.000 -12.628) 18.831 27.014 ( 12.394 0.000 -16.528) 20.658 29.233 ( -6.460 0.000 0.079) 6.460 29.265 ( 3.631 0.000 -1.823) 4.063 29.850 ( 10.441 0.000 7.458) 12.831 29.929 ( 1.689 0.000 2.649) 3.142 30.134 ( 1.621 0.000 -2.080) 2.636 30.196 ( -12.016 0.000 -3.749) 12.587 31.067 ( -8.402 0.000 12.375) 14.958 31.146 ( 0.146 0.000 10.627) 10.628 31.370 ( 1.070 0.000 -2.246) 2.487 31.463 ( 2.764 0.000 -6.951) 7.480 31.711 ( 1.458 0.000 4.573) 4.800 31.826 ( -18.351 0.000 -2.160) 18.478 32.118 ( 1.301 0.000 0.663) 1.460 32.148 ( 6.780 0.000 -0.795) 6.827 32.514 ( -7.015 0.000 11.050) 13.088 32.754 ( 15.179 0.000 0.432) 15.185 ======================= Grid point 179 (93/128) ======================= q-point: (-0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.970 ( -20.018 0.000 20.018) 28.310 3.034 ( -12.198 0.000 22.421) 25.524 3.207 ( -2.548 0.000 16.221) 16.420 3.751 ( 2.975 0.000 -6.892) 7.507 4.013 ( 10.246 0.000 4.944) 11.377 4.058 ( 0.411 0.000 -3.191) 3.217 4.131 ( 5.417 0.000 7.118) 8.945 4.490 ( 3.976 0.000 -8.145) 9.063 4.571 ( -5.078 0.000 -7.550) 9.099 4.629 ( 2.773 0.000 1.505) 3.155 4.882 ( 4.437 0.000 10.044) 10.980 4.993 ( -6.053 0.000 2.943) 6.730 5.132 ( -0.834 0.000 2.670) 2.798 5.217 ( -5.351 0.000 3.961) 6.658 5.395 ( -5.738 0.000 -1.478) 5.925 5.602 ( 3.831 0.000 1.634) 4.165 5.623 ( 4.454 0.000 9.767) 10.734 5.834 ( 0.292 0.000 -8.051) 8.056 6.144 ( 3.448 0.000 -1.315) 3.691 6.486 ( 14.335 0.000 -8.005) 16.419 6.688 ( -2.745 0.000 11.959) 12.270 6.890 ( -6.985 0.000 14.657) 16.236 6.898 ( -9.091 0.000 -6.728) 11.310 7.107 ( 0.911 0.000 10.490) 10.530 7.150 ( -7.485 0.000 -6.129) 9.674 7.309 ( -1.119 0.000 -5.148) 5.268 7.423 ( -8.787 0.000 18.490) 20.472 7.473 ( -5.281 0.000 -9.403) 10.784 7.568 ( -9.902 0.000 25.174) 27.051 7.636 ( -14.998 0.000 21.035) 25.835 7.878 ( -7.589 0.000 1.704) 7.778 7.904 ( -8.689 0.000 -2.778) 9.123 7.996 ( 4.150 0.000 9.726) 10.575 8.087 ( 2.748 0.000 -5.516) 6.163 8.131 ( 7.115 0.000 -7.525) 10.357 8.134 ( -6.569 0.000 13.025) 14.587 8.611 ( -2.295 0.000 -12.885) 13.088 8.613 ( -4.086 0.000 9.783) 10.602 8.620 ( 0.938 0.000 32.854) 32.867 8.863 ( -3.129 0.000 4.497) 5.479 8.955 ( 10.845 0.000 -7.208) 13.022 9.006 ( -0.243 0.000 1.616) 1.634 9.241 ( 11.006 0.000 2.123) 11.209 9.259 ( -2.631 0.000 0.623) 2.704 9.386 ( -0.094 0.000 -1.772) 1.775 9.522 ( -6.175 0.000 -2.312) 6.594 9.568 ( 0.560 0.000 -21.763) 21.771 9.600 ( -8.792 0.000 -0.218) 8.795 9.704 ( 13.363 0.000 -19.672) 23.781 9.792 ( 12.219 0.000 -0.839) 12.248 9.932 ( 8.318 0.000 -10.800) 13.631 10.181 ( -1.270 0.000 -6.632) 6.753 10.286 ( 0.938 0.000 12.270) 12.306 10.489 ( 0.398 0.000 2.842) 2.870 10.534 ( 4.627 0.000 -9.427) 10.501 10.555 ( 10.974 0.000 0.519) 10.986 10.623 ( 2.047 0.000 -10.658) 10.852 10.897 ( 4.672 0.000 -16.505) 17.153 11.103 ( -9.995 0.000 4.032) 10.777 11.385 ( 2.891 0.000 -0.610) 2.955 11.671 ( 1.785 0.000 8.656) 8.838 11.724 ( -1.758 0.000 -1.493) 2.306 12.086 ( -3.517 0.000 8.758) 9.438 12.100 ( 3.225 0.000 -0.320) 3.241 12.320 ( -7.989 0.000 8.480) 11.651 12.641 ( 0.387 0.000 12.953) 12.959 12.735 ( -0.446 0.000 3.177) 3.208 12.769 ( 0.028 0.000 3.766) 3.766 12.885 ( -4.868 0.000 -7.997) 9.362 12.943 ( -1.418 0.000 -6.595) 6.746 13.186 ( 7.062 0.000 5.912) 9.210 13.413 ( 4.789 0.000 -10.691) 11.714 13.628 ( -2.830 0.000 -1.388) 3.152 14.053 ( -1.539 0.000 -9.534) 9.657 14.100 ( 0.336 0.000 -1.223) 1.268 14.171 ( 4.049 0.000 -18.612) 19.048 14.741 ( -1.748 0.000 -2.257) 2.855 14.909 ( 6.067 0.000 -0.244) 6.072 15.043 ( 3.854 0.000 -5.627) 6.820 15.053 ( 3.609 0.000 -4.782) 5.991 15.913 ( -4.440 0.000 -0.068) 4.441 15.982 ( 1.518 0.000 6.383) 6.562 16.161 ( -2.451 0.000 1.253) 2.752 16.261 ( -13.156 0.000 4.359) 13.859 16.376 ( 3.261 0.000 2.997) 4.429 16.570 ( -6.207 0.000 8.374) 10.423 16.726 ( 5.621 0.000 4.062) 6.935 17.111 ( 9.560 0.000 0.434) 9.570 19.303 ( -7.993 0.000 22.981) 24.332 20.037 ( 6.220 0.000 37.272) 37.787 20.494 ( -2.984 0.000 19.536) 19.762 20.841 ( 14.743 0.000 -38.081) 40.835 20.886 ( -3.523 0.000 26.525) 26.758 21.045 ( -1.435 0.000 -40.157) 40.182 21.611 ( 13.243 0.000 -27.137) 30.196 21.942 ( 3.537 0.000 -28.572) 28.790 24.992 ( -0.468 0.000 9.291) 9.303 25.034 ( -12.891 0.000 -12.291) 17.811 25.172 ( -0.963 0.000 10.491) 10.535 25.233 ( -19.801 0.000 -15.557) 25.181 26.107 ( -5.980 0.000 14.131) 15.345 26.288 ( -5.041 0.000 15.321) 16.129 26.973 ( 14.842 0.000 -15.761) 21.649 27.178 ( 11.383 0.000 -16.214) 19.811 29.138 ( -3.968 0.000 1.562) 4.264 29.341 ( 4.828 0.000 -0.505) 4.855 29.874 ( -9.170 0.000 -4.861) 10.378 29.976 ( 0.276 0.000 1.337) 1.365 30.078 ( 2.800 0.000 1.095) 3.007 30.245 ( 10.344 0.000 3.812) 11.024 30.913 ( -12.730 0.000 10.091) 16.244 31.168 ( -2.479 0.000 8.975) 9.311 31.375 ( 0.778 0.000 -2.564) 2.679 31.425 ( -6.890 0.000 -1.519) 7.056 31.539 ( -9.845 0.000 8.477) 12.992 31.779 ( 2.423 0.000 8.613) 8.947 32.149 ( 0.881 0.000 1.193) 1.483 32.306 ( 10.741 0.000 -9.294) 14.204 32.441 ( -4.252 0.000 8.156) 9.197 32.998 ( 11.687 0.000 -5.842) 13.066 ======================= Grid point 180 (94/128) ======================= q-point: (-0.17 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.812 ( -6.862 0.000 30.544) 31.306 2.925 ( -10.434 0.000 30.022) 31.783 3.255 ( -0.348 0.000 17.841) 17.844 3.801 ( 4.343 0.000 -3.149) 5.364 4.026 ( -2.129 0.000 -5.100) 5.527 4.165 ( 2.652 0.000 0.116) 2.655 4.220 ( 1.779 0.000 -3.011) 3.497 4.483 ( 0.637 0.000 -3.726) 3.780 4.487 ( 0.053 0.000 -9.958) 9.958 4.606 ( -6.658 0.000 6.797) 9.515 4.889 ( -5.288 0.000 5.544) 7.662 5.043 ( 7.540 0.000 7.177) 10.409 5.166 ( 2.269 0.000 3.574) 4.233 5.166 ( -1.392 0.000 -1.526) 2.065 5.330 ( 2.071 0.000 0.415) 2.112 5.576 ( -6.438 0.000 1.036) 6.521 5.729 ( 1.411 0.000 5.603) 5.778 5.847 ( 3.325 0.000 -7.659) 8.350 6.189 ( 2.118 0.000 -6.408) 6.749 6.567 ( -3.145 0.000 -7.985) 8.582 6.671 ( -4.831 0.000 12.141) 13.067 6.780 ( -0.354 0.000 -10.401) 10.407 6.895 ( 1.632 0.000 21.868) 21.928 7.060 ( 3.591 0.000 -1.489) 3.887 7.086 ( -9.857 0.000 12.983) 16.301 7.287 ( -0.685 0.000 -10.848) 10.870 7.309 ( -9.000 0.000 11.009) 14.220 7.369 ( -1.375 0.000 0.326) 1.413 7.429 ( -12.823 0.000 25.537) 28.576 7.530 ( -6.386 0.000 20.071) 21.062 7.733 ( -7.259 0.000 -3.049) 7.873 7.748 ( -6.050 0.000 -2.371) 6.498 8.022 ( -2.930 0.000 16.765) 17.019 8.082 ( 0.906 0.000 -10.139) 10.179 8.221 ( 3.999 0.000 11.232) 11.923 8.281 ( 10.013 0.000 -6.204) 11.780 8.523 ( -1.077 0.000 -13.965) 14.006 8.537 ( -6.309 0.000 9.713) 11.582 8.722 ( -5.010 0.000 31.099) 31.500 8.794 ( -4.104 0.000 2.784) 4.959 9.020 ( 1.911 0.000 6.014) 6.310 9.117 ( 8.479 0.000 -12.909) 15.444 9.234 ( -0.584 0.000 5.642) 5.672 9.332 ( -5.506 0.000 1.724) 5.770 9.396 ( -0.471 0.000 -2.693) 2.734 9.408 ( -0.222 0.000 2.577) 2.586 9.504 ( 1.854 0.000 -21.474) 21.554 9.509 ( -0.267 0.000 -3.487) 3.498 9.885 ( 9.393 0.000 -13.866) 16.748 9.982 ( 6.766 0.000 -13.635) 15.222 10.030 ( 12.876 0.000 -0.383) 12.882 10.280 ( 9.856 0.000 2.516) 10.173 10.300 ( -4.998 0.000 12.829) 13.768 10.498 ( 0.669 0.000 -1.831) 1.949 10.545 ( 1.301 0.000 -3.675) 3.899 10.618 ( 1.450 0.000 -15.711) 15.778 10.785 ( 12.485 0.000 1.301) 12.552 10.906 ( -12.277 0.000 3.499) 12.766 10.943 ( 8.512 0.000 -21.571) 23.190 11.370 ( -3.622 0.000 -2.332) 4.308 11.696 ( -0.547 0.000 0.060) 0.550 11.747 ( 3.103 0.000 6.319) 7.040 11.995 ( -11.652 0.000 15.460) 19.359 12.225 ( 8.410 0.000 0.574) 8.429 12.275 ( -0.061 0.000 6.890) 6.891 12.579 ( -10.288 0.000 7.170) 12.540 12.656 ( -2.757 0.000 -5.432) 6.091 12.753 ( -5.522 0.000 -9.518) 11.004 12.809 ( 0.221 0.000 7.660) 7.663 13.016 ( 7.545 0.000 -0.835) 7.591 13.262 ( -0.949 0.000 5.184) 5.270 13.440 ( 1.770 0.000 -7.316) 7.527 13.612 ( 1.555 0.000 -0.575) 1.658 13.973 ( -1.526 0.000 -10.725) 10.833 14.074 ( -2.432 0.000 -1.488) 2.851 14.199 ( 6.365 0.000 -17.771) 18.876 14.722 ( -0.141 0.000 1.145) 1.154 15.015 ( 3.862 0.000 -2.923) 4.843 15.102 ( 5.076 0.000 -5.609) 7.565 15.114 ( 4.501 0.000 -2.112) 4.972 15.845 ( -2.079 0.000 0.355) 2.109 15.950 ( -6.032 0.000 2.839) 6.667 16.114 ( -3.557 0.000 1.083) 3.718 16.116 ( -4.693 0.000 2.881) 5.507 16.430 ( 1.274 0.000 3.497) 3.722 16.484 ( -3.570 0.000 4.066) 5.411 16.874 ( 5.782 0.000 7.837) 9.739 17.233 ( 3.611 0.000 -2.400) 4.336 19.274 ( -5.595 0.000 23.566) 24.221 20.143 ( -9.129 0.000 29.749) 31.118 20.623 ( 4.862 0.000 23.517) 24.014 20.842 ( 2.625 0.000 -40.617) 40.701 20.911 ( -5.526 0.000 25.041) 25.644 21.031 ( 16.435 0.000 -36.048) 39.618 21.758 ( 14.531 0.000 -26.729) 30.423 21.891 ( 3.384 0.000 -28.556) 28.755 24.828 ( -4.274 0.000 -7.193) 8.367 24.900 ( -11.145 0.000 6.036) 12.674 24.921 ( -5.688 0.000 -8.490) 10.219 25.058 ( -14.065 0.000 6.241) 15.387 26.135 ( 1.078 0.000 18.211) 18.243 26.363 ( 5.022 0.000 16.172) 16.934 27.108 ( 7.772 0.000 -20.828) 22.231 27.259 ( 3.767 0.000 -15.354) 15.809 29.111 ( 0.020 0.000 3.025) 3.025 29.400 ( 0.516 0.000 -1.670) 1.748 29.710 ( -3.888 0.000 -3.779) 5.422 29.925 ( -4.840 0.000 -1.613) 5.101 30.218 ( 11.272 0.000 0.498) 11.283 30.432 ( 3.958 0.000 6.823) 7.888 30.745 ( -6.027 0.000 6.409) 8.798 31.113 ( -8.638 0.000 7.224) 11.261 31.224 ( -9.091 0.000 3.359) 9.691 31.377 ( 0.439 0.000 -2.777) 2.811 31.575 ( 4.330 0.000 12.954) 13.658 31.843 ( -0.516 0.000 11.845) 11.856 32.137 ( -1.901 0.000 -0.510) 1.968 32.421 ( 6.279 0.000 -13.142) 14.565 32.454 ( 1.556 0.000 9.176) 9.307 33.095 ( 1.877 0.000 -10.405) 10.573 ======================= Grid point 181 (95/128) ======================= q-point: ( 0.00 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( -2.659 2.383 28.982) 29.201 3.079 ( 8.455 8.699 31.816) 34.050 3.301 ( -3.289 0.222 13.530) 13.926 3.808 ( 1.885 -7.512 -11.179) 13.600 3.980 ( -5.192 -0.910 -4.065) 6.657 4.117 ( -5.271 2.169 -7.349) 9.301 4.168 ( 3.454 1.449 1.372) 3.989 4.328 ( -0.929 -6.310 -0.287) 6.384 4.405 ( 1.654 -1.464 6.418) 6.788 4.616 ( -8.456 1.896 3.650) 9.403 4.893 ( 3.939 3.381 -2.734) 5.867 5.090 ( -3.952 -1.355 -7.030) 8.178 5.331 ( -2.968 7.671 11.630) 14.245 5.385 ( 8.383 8.493 8.000) 14.367 5.510 ( 1.058 4.217 1.208) 4.512 5.521 ( -1.808 13.517 3.294) 14.030 5.678 ( -10.194 3.916 2.706) 11.251 5.924 ( 7.330 3.848 -9.344) 12.484 6.140 ( 2.607 -3.438 -4.465) 6.209 6.372 ( -9.833 -4.017 -8.520) 13.617 6.632 ( -8.678 -0.246 8.343) 12.040 6.746 ( 1.263 -4.645 0.111) 4.815 6.807 ( 3.180 -12.043 9.972) 15.956 6.960 ( 2.739 -3.188 8.571) 9.546 7.131 ( 0.473 -2.689 -2.704) 3.843 7.188 ( -0.164 -3.382 6.672) 7.482 7.292 ( -4.769 -1.833 12.504) 13.508 7.454 ( -4.060 2.097 10.813) 11.739 7.490 ( 3.087 6.665 5.625) 9.252 7.628 ( -0.851 11.360 12.821) 17.151 7.678 ( -0.856 3.986 3.161) 5.159 7.723 ( 0.574 6.334 0.284) 6.366 8.066 ( 3.692 0.498 -3.022) 4.797 8.106 ( 1.299 2.995 7.100) 7.815 8.220 ( 0.620 -2.138 11.685) 11.895 8.403 ( -2.883 -1.798 -4.241) 5.434 8.464 ( 0.107 1.708 -3.946) 4.301 8.538 ( -4.443 4.129 16.423) 17.507 8.709 ( -3.030 1.258 10.244) 10.756 8.851 ( 2.333 4.977 -0.111) 5.498 9.019 ( 1.909 -3.768 -1.583) 4.511 9.135 ( -4.239 -5.844 -5.316) 8.965 9.224 ( -2.138 -5.554 3.335) 6.822 9.266 ( -0.007 4.041 -3.242) 5.181 9.326 ( -0.448 0.111 0.806) 0.929 9.455 ( 3.038 0.236 -5.228) 6.051 9.491 ( 2.923 3.784 -3.437) 5.889 9.536 ( 1.197 -0.059 -3.770) 3.956 9.907 ( -0.314 2.257 -7.729) 8.058 10.083 ( 4.135 -3.068 -13.573) 14.517 10.152 ( -3.924 0.777 4.708) 6.178 10.295 ( 0.985 0.360 1.038) 1.476 10.365 ( -1.186 -1.688 3.017) 3.655 10.469 ( 3.288 -1.068 -6.291) 7.178 10.569 ( -1.940 -0.581 -1.752) 2.678 10.586 ( 1.498 2.109 -6.896) 7.366 10.713 ( -2.938 3.665 -5.168) 6.984 11.003 ( 8.359 -0.094 -20.566) 22.201 11.103 ( 10.065 2.637 -0.090) 10.405 11.278 ( -4.219 2.188 -6.223) 7.830 11.529 ( -0.012 -13.868 6.275) 15.221 11.715 ( -0.368 -7.331 -0.058) 7.340 11.943 ( -2.947 1.120 15.423) 15.742 12.176 ( 0.688 -8.400 2.143) 8.696 12.325 ( -14.234 -2.504 6.668) 15.917 12.436 ( 1.388 1.185 3.808) 4.223 12.563 ( -4.302 -0.158 0.701) 4.361 12.712 ( 9.763 0.804 -10.010) 14.005 12.893 ( -3.120 5.013 4.687) 7.538 13.122 ( 4.805 -1.917 -2.289) 5.657 13.221 ( -4.980 -0.082 5.830) 7.668 13.372 ( -3.070 -3.604 -1.348) 4.922 13.656 ( 4.592 -0.406 0.346) 4.623 13.929 ( -0.471 -0.135 -6.823) 6.841 14.070 ( 0.182 3.690 -4.690) 5.970 14.293 ( 5.013 4.104 -13.229) 14.730 14.551 ( -1.208 -14.399 4.567) 15.154 14.934 ( 1.753 -7.910 -10.071) 12.925 15.172 ( -0.069 1.415 -3.551) 3.823 15.208 ( 3.451 2.454 -3.468) 5.474 15.852 ( -5.886 1.573 1.867) 6.372 15.910 ( 3.305 3.210 -0.648) 4.653 16.005 ( -6.318 0.060 3.529) 7.237 16.154 ( 4.018 1.515 0.530) 4.326 16.443 ( -0.069 -0.437 4.666) 4.687 16.494 ( -0.063 1.309 2.338) 2.680 16.929 ( 1.402 -4.277 6.718) 8.086 17.116 ( -4.226 -8.708 -0.446) 9.689 19.365 ( -4.291 7.577 27.384) 28.735 19.996 ( -15.574 -1.586 28.020) 32.097 20.710 ( -3.848 -2.428 23.995) 24.423 20.830 ( 2.047 4.538 -22.672) 23.212 20.838 ( -4.122 0.138 2.018) 4.591 21.249 ( 13.933 4.162 -31.009) 34.249 21.805 ( 3.411 -2.471 -28.945) 29.249 21.889 ( 12.989 -1.792 -27.246) 30.237 24.723 ( -8.685 0.203 3.369) 9.318 24.782 ( -12.342 -1.092 2.022) 12.554 24.905 ( 10.898 1.673 -3.534) 11.578 24.980 ( 14.379 -0.219 -5.899) 15.544 26.257 ( 1.357 1.697 19.577) 19.697 26.510 ( 4.469 -2.310 16.926) 17.658 27.085 ( -1.074 -0.171 -22.696) 22.722 27.162 ( -3.928 -2.168 -15.503) 16.140 29.213 ( 4.119 4.887 3.227) 7.160 29.363 ( -4.591 2.574 -4.197) 6.731 29.729 ( 4.504 0.510 1.774) 4.868 29.819 ( -6.765 0.747 -1.494) 6.968 30.387 ( -7.165 1.726 3.677) 8.236 30.502 ( 13.046 2.792 -2.830) 13.638 30.789 ( 6.366 -3.427 6.698) 9.856 30.913 ( -10.802 -1.117 2.588) 11.164 31.188 ( -1.601 2.638 9.173) 9.678 31.403 ( 0.744 3.412 -2.337) 4.202 31.742 ( 6.920 -1.942 13.291) 15.110 31.791 ( -3.250 -3.975 9.482) 10.783 32.107 ( -0.658 0.097 1.272) 1.435 32.426 ( 0.836 -1.176 -8.148) 8.275 32.535 ( 0.143 1.504 5.238) 5.451 32.952 ( -8.453 -2.819 -10.353) 13.659 ======================= Grid point 182 (96/128) ======================= q-point: ( 0.17 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.049 ( 2.126 2.591 27.428) 27.632 3.270 ( -1.757 0.349 11.709) 11.846 3.495 ( 19.292 4.703 25.900) 32.636 3.769 ( -3.047 -9.456 -5.568) 11.389 3.861 ( -3.723 1.301 -9.001) 9.827 4.008 ( -3.738 2.267 -6.923) 8.188 4.146 ( -8.401 6.746 -1.021) 10.822 4.251 ( -7.709 -6.916 0.738) 10.383 4.384 ( -0.507 8.274 4.581) 9.471 4.644 ( 5.756 -3.521 7.191) 9.861 4.956 ( -2.408 -0.152 -4.478) 5.087 4.984 ( -0.168 -5.768 -2.124) 6.149 5.219 ( -8.434 -2.375 5.604) 10.400 5.379 ( -10.956 9.171 0.014) 14.288 5.463 ( -0.218 12.346 5.906) 13.688 5.569 ( 0.593 19.244 10.138) 21.759 5.691 ( 5.313 -0.168 1.226) 5.455 6.038 ( 7.657 5.783 -6.098) 11.369 6.164 ( -4.425 -3.481 -4.923) 7.479 6.174 ( -1.613 -3.808 -6.571) 7.764 6.466 ( -7.978 -1.020 7.978) 11.329 6.840 ( 5.261 -4.137 8.891) 11.128 6.913 ( 3.300 -4.715 4.805) 7.497 7.117 ( 4.539 -7.747 -0.928) 9.027 7.187 ( 3.403 2.713 2.357) 4.950 7.207 ( 8.075 -5.028 4.157) 10.381 7.359 ( 4.537 -8.549 16.070) 18.759 7.430 ( -1.525 -0.582 8.278) 8.437 7.587 ( 3.379 5.029 11.602) 13.089 7.667 ( 0.405 7.604 5.121) 9.176 7.721 ( 3.443 4.579 4.995) 7.601 7.785 ( 4.697 10.734 0.868) 11.749 8.090 ( 3.183 4.574 -9.090) 10.662 8.216 ( -0.333 -1.868 9.953) 10.132 8.235 ( 1.098 0.611 10.238) 10.315 8.326 ( -3.680 1.439 4.559) 6.033 8.421 ( -11.085 1.648 20.782) 23.611 8.501 ( 2.355 1.556 -8.836) 9.276 8.714 ( -0.914 1.824 6.794) 7.093 8.870 ( -5.915 3.349 6.371) 9.317 9.020 ( 4.701 -3.690 -16.741) 17.776 9.095 ( -2.888 -7.341 4.604) 9.134 9.141 ( -4.368 -5.576 -0.008) 7.083 9.257 ( -0.189 2.636 -2.646) 3.740 9.298 ( -2.540 5.469 -2.199) 6.418 9.461 ( 1.719 4.241 -1.577) 4.841 9.501 ( 1.882 -4.662 -3.263) 5.993 9.615 ( 5.276 1.520 -5.578) 7.827 9.843 ( -3.586 2.209 -5.694) 7.082 10.037 ( -2.445 -0.528 2.504) 3.539 10.124 ( -0.526 -1.605 -9.903) 10.046 10.228 ( -8.049 -4.644 3.012) 9.769 10.273 ( -4.855 1.901 -12.290) 13.350 10.414 ( -6.242 4.664 -9.735) 12.469 10.519 ( 0.918 -1.331 0.700) 1.762 10.618 ( 3.978 6.062 -3.507) 8.054 10.767 ( 3.953 -1.530 -1.558) 4.516 11.042 ( 4.842 1.920 -17.096) 17.872 11.104 ( -3.949 -1.264 -6.250) 7.501 11.316 ( 5.351 -0.538 -3.863) 6.622 11.584 ( 2.275 -12.597 5.629) 13.984 11.684 ( -2.515 -1.763 4.103) 5.125 11.989 ( -0.967 -5.478 8.181) 9.893 12.077 ( -7.501 0.241 10.185) 12.651 12.208 ( -3.821 -11.648 3.288) 12.692 12.463 ( 1.896 -0.276 4.704) 5.080 12.548 ( 1.805 6.383 3.173) 7.353 12.773 ( -4.902 1.590 0.434) 5.172 12.897 ( 6.148 2.222 -3.452) 7.393 13.135 ( -4.427 -0.018 5.285) 6.894 13.181 ( 0.580 -2.648 -5.201) 5.865 13.320 ( -1.794 -3.418 1.252) 4.058 13.763 ( 6.277 -1.933 -0.448) 6.583 13.915 ( 1.046 0.094 -3.610) 3.760 14.063 ( 2.172 4.902 -8.711) 10.228 14.320 ( 3.057 2.865 -11.271) 12.024 14.576 ( 1.898 -14.326 5.002) 15.292 14.914 ( 0.109 -6.839 -10.063) 12.167 15.110 ( -4.165 1.758 -5.010) 6.748 15.204 ( -1.770 2.811 -5.144) 6.124 15.780 ( -2.386 2.245 3.010) 4.449 15.942 ( 0.780 -0.056 3.014) 3.114 16.001 ( 3.779 3.021 1.918) 5.204 16.239 ( 3.105 2.065 1.221) 3.924 16.459 ( -0.573 -1.641 3.776) 4.157 16.520 ( 3.030 -0.656 3.532) 4.700 16.937 ( -3.719 -4.628 6.706) 8.957 16.987 ( -9.515 -5.365 1.643) 11.046 19.421 ( -2.090 6.673 30.426) 31.220 19.790 ( -18.131 1.727 26.993) 32.562 20.697 ( -8.069 -2.964 24.061) 25.551 20.768 ( -7.129 -3.261 18.728) 20.303 20.790 ( 7.475 8.390 -38.949) 40.538 21.352 ( 11.040 1.364 -30.747) 32.697 21.724 ( -0.062 -0.220 -29.862) 29.863 21.979 ( 8.842 -2.349 -27.971) 29.429 24.621 ( -4.308 0.192 4.185) 6.009 24.665 ( 1.056 -0.508 4.164) 4.326 25.186 ( 19.646 1.205 -8.303) 21.363 25.335 ( 24.229 -1.200 -8.819) 25.812 26.328 ( -2.405 1.973 19.043) 19.296 26.602 ( -2.377 -2.521 16.644) 17.001 26.891 ( -9.539 -0.419 -18.877) 21.154 27.012 ( -4.356 -2.482 -18.763) 19.422 29.282 ( -2.021 2.594 -3.741) 4.981 29.330 ( 6.554 4.667 3.426) 8.745 29.674 ( -7.205 0.878 -0.843) 7.307 29.825 ( 3.874 1.481 2.988) 5.112 30.262 ( -5.984 3.626 1.132) 7.088 30.638 ( -6.421 0.377 -0.784) 6.480 30.845 ( 11.590 -3.516 -0.603) 12.127 30.948 ( 5.189 -4.676 8.323) 10.865 31.213 ( 0.249 2.663 8.020) 8.454 31.423 ( 3.420 6.223 -3.840) 8.073 31.723 ( -4.988 -4.665 6.338) 9.318 31.968 ( 8.984 -0.632 12.007) 15.009 32.102 ( -0.497 -0.560 2.323) 2.440 32.343 ( -3.931 0.543 -15.159) 15.670 32.552 ( -3.848 -2.662 12.775) 13.605 32.706 ( -13.010 0.168 -3.832) 13.564 ======================= Grid point 183 (97/128) ======================= q-point: ( 0.33 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.176 ( 0.152 2.374 15.937) 16.114 3.312 ( 0.655 6.881 16.939) 18.295 3.670 ( -5.174 -8.855 -1.396) 10.350 3.736 ( -10.979 7.529 2.445) 13.536 3.919 ( -1.931 4.233 -7.449) 8.782 3.958 ( 17.984 -3.972 14.391) 23.373 3.960 ( -6.041 4.118 -2.445) 7.709 4.103 ( -5.892 -6.335 0.591) 8.672 4.449 ( 4.028 6.824 -1.072) 7.997 4.748 ( 1.426 -2.772 8.751) 9.290 4.805 ( -6.821 -5.300 -1.628) 8.790 5.003 ( -0.994 -6.300 1.721) 6.606 5.152 ( -2.771 -4.712 5.154) 7.513 5.307 ( 4.173 9.327 -0.072) 10.218 5.462 ( -0.586 8.711 -0.239) 8.734 5.634 ( -2.483 18.074 10.484) 21.042 5.662 ( -4.652 0.686 2.340) 5.252 6.009 ( -4.464 -0.732 -9.461) 10.486 6.129 ( -0.842 -3.265 -0.202) 3.378 6.172 ( 5.188 3.994 -7.066) 9.633 6.529 ( 8.018 2.765 11.819) 14.547 6.922 ( -3.504 -5.702 10.079) 12.098 6.947 ( 1.805 -1.187 4.490) 4.983 7.146 ( 2.025 0.742 -3.721) 4.301 7.287 ( 4.570 -3.308 7.957) 9.754 7.391 ( 4.546 0.013 6.072) 7.585 7.449 ( -1.560 3.986 6.804) 8.038 7.537 ( 8.340 -6.358 14.736) 18.087 7.664 ( 1.250 1.447 2.003) 2.769 7.725 ( 2.143 0.818 9.136) 9.420 7.807 ( 0.811 6.611 3.091) 7.343 7.852 ( 3.409 5.719 1.852) 6.910 8.109 ( 1.772 3.117 -8.267) 9.011 8.156 ( -6.880 1.027 13.131) 14.860 8.252 ( -2.861 -0.542 1.413) 3.236 8.304 ( -3.939 1.157 19.572) 19.998 8.447 ( 7.024 0.404 3.306) 7.774 8.510 ( -0.183 2.513 3.806) 4.565 8.684 ( -12.573 -0.920 11.495) 17.061 8.748 ( 0.355 -1.624 0.337) 1.696 8.907 ( -9.478 -3.920 -4.223) 11.092 9.067 ( -0.835 3.188 -1.808) 3.759 9.127 ( -1.069 -0.344 2.281) 2.543 9.242 ( 3.982 -1.065 -9.994) 10.810 9.328 ( 5.937 2.419 -7.772) 10.075 9.465 ( 1.796 0.475 -5.844) 6.132 9.556 ( 1.211 -3.966 -2.458) 4.821 9.648 ( 2.224 0.486 -4.807) 5.319 9.741 ( -4.944 0.032 -0.753) 5.001 9.985 ( -6.636 5.072 -2.790) 8.806 10.072 ( -3.557 -0.246 -6.096) 7.062 10.121 ( 3.350 -3.812 -11.832) 12.874 10.168 ( -0.595 -0.287 -2.614) 2.697 10.323 ( 0.551 4.074 -10.693) 11.456 10.514 ( -0.706 -1.522 -2.172) 2.745 10.652 ( -0.268 9.835 -0.996) 9.889 10.758 ( -3.009 -1.302 -3.528) 4.816 10.985 ( -3.065 -0.490 -8.152) 8.723 11.129 ( 6.890 0.449 -8.126) 10.663 11.326 ( -1.474 -2.075 -2.923) 3.876 11.592 ( -7.221 -7.373 8.903) 13.630 11.637 ( 0.079 -7.221 1.784) 7.439 11.976 ( 2.410 -8.735 -2.201) 9.325 12.099 ( -7.839 -13.981 2.875) 16.284 12.216 ( 10.441 1.835 18.281) 21.132 12.557 ( 5.181 2.405 2.080) 6.079 12.619 ( 0.247 6.772 7.895) 10.404 12.651 ( -5.814 -0.719 6.767) 8.950 12.959 ( 0.321 -2.327 -1.669) 2.881 13.093 ( -1.438 1.546 -0.602) 2.196 13.136 ( -1.556 -1.780 -4.686) 5.249 13.322 ( 1.764 -2.067 -3.037) 4.075 13.814 ( -1.617 0.840 -0.860) 2.015 13.962 ( 5.594 -0.087 -1.070) 5.696 14.082 ( 4.108 3.094 -11.113) 12.245 14.303 ( -0.231 1.698 -10.058) 10.203 14.657 ( 4.891 -10.756 2.622) 12.103 14.855 ( -2.262 -4.766 -7.945) 9.537 14.999 ( -4.410 -1.250 -8.002) 9.222 15.131 ( -2.857 2.949 -6.485) 7.676 15.803 ( 3.052 2.860 4.587) 6.208 16.024 ( 4.909 -0.772 4.462) 6.679 16.064 ( 1.171 2.167 5.813) 6.313 16.271 ( 1.618 3.440 -0.204) 3.807 16.441 ( -2.551 -2.249 3.790) 5.092 16.645 ( 6.969 -4.746 5.389) 10.007 16.789 ( -10.700 -1.526 1.896) 10.973 16.872 ( -6.998 -3.557 6.075) 9.925 19.535 ( -1.860 5.473 35.317) 35.786 19.595 ( -12.007 3.594 24.917) 27.892 20.613 ( -9.856 -2.134 20.262) 22.633 20.753 ( -2.609 -2.380 14.333) 14.762 20.794 ( 8.323 6.962 -30.137) 32.031 21.411 ( 9.138 -1.345 -31.353) 32.686 21.558 ( -3.798 2.996 -31.707) 32.074 21.990 ( 5.150 -3.118 -28.614) 29.240 24.668 ( 6.461 0.756 7.051) 9.594 24.794 ( 9.627 -1.265 7.396) 12.206 25.437 ( 8.977 1.321 -13.437) 16.213 25.651 ( 12.379 -2.081 -15.194) 19.708 26.315 ( -7.072 1.760 17.014) 18.509 26.550 ( -9.978 -2.275 15.104) 18.245 26.684 ( -2.611 0.055 -14.619) 14.851 26.899 ( 1.941 -3.507 -17.179) 17.640 29.260 ( 1.038 2.849 -2.664) 4.036 29.403 ( -2.726 6.366 -0.362) 6.935 29.626 ( 4.534 -2.303 4.292) 6.654 29.893 ( 2.218 0.641 3.089) 3.856 30.187 ( -2.730 4.494 -0.022) 5.258 30.465 ( -9.551 3.406 -1.554) 10.258 31.018 ( 1.611 -4.805 8.284) 9.711 31.083 ( 7.010 -5.106 5.421) 10.228 31.248 ( 0.908 -0.578 3.869) 4.016 31.505 ( 7.221 7.914 -7.494) 13.074 31.667 ( -3.112 -3.116 3.522) 5.639 32.049 ( -2.015 -0.933 6.120) 6.510 32.150 ( -7.262 1.761 -7.733) 10.753 32.175 ( -2.018 -1.503 0.021) 2.516 32.479 ( -1.266 -2.665 7.996) 8.523 32.597 ( -1.412 0.422 6.847) 7.004 ======================= Grid point 184 (98/128) ======================= q-point: (-0.50 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.161 ( -8.033 1.265 15.065) 17.120 3.355 ( -5.350 12.807 13.611) 19.440 3.417 ( -19.704 10.764 9.048) 24.208 3.694 ( 3.136 -8.466 7.588) 11.793 3.874 ( 0.869 2.191 -7.661) 8.016 3.924 ( 4.342 2.475 -1.240) 5.149 4.031 ( -1.041 -10.431 -2.440) 10.763 4.271 ( 8.647 -5.579 1.888) 10.462 4.516 ( 3.153 3.765 2.153) 5.363 4.752 ( -0.946 -5.696 8.190) 10.021 4.783 ( 1.510 1.748 -0.021) 2.310 5.012 ( 1.285 -1.851 3.577) 4.228 5.124 ( -3.072 -5.294 5.454) 8.198 5.401 ( 1.269 -1.356 -0.968) 2.094 5.459 ( 2.439 3.177 -1.623) 4.322 5.537 ( -3.571 13.381 1.700) 13.953 5.653 ( -2.518 8.575 8.100) 12.061 5.914 ( -2.617 2.147 -6.958) 7.738 6.099 ( -0.288 -1.535 0.246) 1.581 6.295 ( 10.058 2.622 -8.776) 13.604 6.701 ( 4.063 3.296 9.630) 10.959 6.892 ( -4.034 -3.478 12.784) 13.849 6.972 ( -0.827 -0.343 6.431) 6.493 7.141 ( -3.172 2.787 0.406) 4.242 7.345 ( -7.359 0.757 14.531) 16.305 7.438 ( 2.067 2.137 1.092) 3.167 7.455 ( 2.352 7.594 0.768) 7.987 7.563 ( -7.489 -2.675 -5.650) 9.755 7.692 ( -11.426 0.075 24.998) 27.485 7.754 ( 3.570 -0.116 -2.120) 4.154 7.811 ( 0.706 3.196 13.812) 14.195 7.946 ( 3.569 1.797 6.084) 7.279 8.050 ( -9.355 0.822 7.549) 12.049 8.093 ( -0.385 1.020 -3.761) 3.916 8.167 ( -5.893 -0.202 -1.718) 6.142 8.345 ( -15.961 2.034 18.231) 24.316 8.430 ( 3.633 -1.438 11.250) 11.909 8.595 ( -0.849 -0.663 7.866) 7.940 8.635 ( 11.699 3.323 -7.037) 14.051 8.790 ( -0.245 -3.123 0.247) 3.143 8.836 ( 7.969 -3.152 2.201) 8.848 9.021 ( -4.368 0.833 -1.190) 4.603 9.148 ( 2.596 5.815 2.770) 6.945 9.243 ( 1.133 -4.452 -11.299) 12.197 9.434 ( 5.214 -2.041 -3.483) 6.594 9.460 ( -2.674 -0.083 -4.514) 5.247 9.493 ( 1.387 -5.055 -11.342) 12.494 9.646 ( -0.825 -0.395 -1.232) 1.535 9.732 ( 2.366 2.203 -2.755) 4.248 9.895 ( 1.416 3.618 -13.296) 13.853 9.914 ( -5.877 6.807 -6.990) 11.390 10.199 ( 2.860 -1.701 4.011) 5.212 10.247 ( 10.301 -7.318 -9.042) 15.538 10.308 ( 0.052 2.141 -3.393) 4.012 10.499 ( 0.792 4.429 -6.875) 8.216 10.622 ( 2.084 7.830 -7.808) 11.253 10.685 ( -4.304 3.499 2.791) 6.210 10.908 ( -1.582 -1.662 -8.784) 9.078 11.155 ( -3.266 -3.542 -0.220) 4.823 11.338 ( 5.755 1.647 -5.691) 8.260 11.535 ( -1.920 -8.962 8.183) 12.286 11.649 ( -0.460 -8.231 0.630) 8.268 11.939 ( -5.192 -12.798 2.420) 14.022 12.074 ( 4.819 -6.718 -2.823) 8.736 12.483 ( -10.017 2.588 9.828) 14.270 12.490 ( 8.009 -0.719 16.613) 18.457 12.655 ( 5.009 1.255 3.618) 6.305 12.729 ( 2.257 0.139 5.412) 5.865 12.926 ( -2.837 -4.514 1.284) 5.484 12.998 ( -6.249 -2.908 -2.932) 7.490 13.163 ( 4.584 6.311 -4.146) 8.833 13.352 ( 4.118 -1.358 -8.215) 9.289 13.740 ( -5.223 3.491 -0.166) 6.285 14.057 ( 4.332 -0.343 -0.926) 4.443 14.109 ( 2.781 1.985 -9.178) 9.793 14.242 ( -0.839 1.932 -12.500) 12.676 14.715 ( -1.038 -5.309 -3.285) 6.329 14.822 ( 3.087 -4.110 -2.965) 5.934 14.933 ( 1.695 -3.858 -5.653) 7.051 15.059 ( -1.674 -0.047 -8.453) 8.617 15.907 ( 5.346 2.767 5.636) 8.246 16.025 ( -3.648 3.200 1.474) 5.072 16.159 ( 2.977 -1.149 6.793) 7.506 16.304 ( 0.693 -0.154 1.390) 1.561 16.411 ( -4.474 -2.113 8.431) 9.776 16.604 ( -4.223 2.028 -0.667) 4.731 16.738 ( -7.575 -3.566 5.011) 9.758 16.851 ( 8.468 -5.744 3.782) 10.908 19.446 ( -11.237 6.028 25.969) 28.930 19.757 ( 5.587 1.698 36.788) 37.249 20.527 ( -7.928 -0.822 19.160) 20.752 20.775 ( 0.456 -1.713 6.715) 6.945 20.850 ( 8.811 5.749 -20.180) 22.758 21.306 ( -3.842 2.444 -37.678) 37.952 21.501 ( 10.197 0.591 -27.994) 29.799 21.951 ( 3.690 -3.893 -28.929) 29.422 24.863 ( 9.326 0.934 9.637) 13.443 25.019 ( 9.468 -1.597 10.285) 14.071 25.341 ( -10.982 1.184 -14.955) 18.592 25.587 ( -10.926 -2.868 -19.444) 22.487 26.218 ( -9.850 1.176 14.310) 17.412 26.392 ( -12.669 -1.709 14.394) 19.252 26.748 ( 13.961 0.475 -12.192) 18.541 26.978 ( 12.509 -3.407 -15.604) 20.287 29.287 ( -2.496 4.576 -0.353) 5.224 29.304 ( -0.313 4.595 -1.551) 4.860 29.793 ( 8.488 -4.743 5.693) 11.267 29.917 ( -1.390 -3.374 0.283) 3.660 30.150 ( -1.723 5.150 2.059) 5.808 30.325 ( -3.195 10.152 -4.198) 11.441 31.009 ( -6.732 -5.540 10.760) 13.848 31.175 ( 0.052 1.193 10.677) 10.743 31.286 ( 2.626 -4.883 -0.918) 5.620 31.547 ( -1.058 6.006 -7.471) 9.644 31.646 ( -1.246 -5.081 6.708) 8.507 31.850 ( -15.219 0.918 -3.037) 15.546 32.081 ( 2.722 -1.197 4.018) 4.998 32.215 ( 4.698 3.786 -1.975) 6.349 32.482 ( -4.630 -2.509 9.792) 11.119 32.737 ( 13.532 -1.913 -1.114) 13.712 ======================= Grid point 185 (99/128) ======================= q-point: (-0.33 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.043 ( -11.913 1.759 19.625) 23.025 3.081 ( -19.061 10.371 21.279) 30.392 3.329 ( -4.645 11.273 12.196) 17.245 3.778 ( 3.788 -3.967 -5.275) 7.610 3.933 ( 5.740 -1.214 3.988) 7.094 4.025 ( 2.783 -6.698 -1.298) 7.368 4.057 ( 7.430 -0.620 1.272) 7.563 4.355 ( 3.067 -7.614 -6.061) 10.204 4.492 ( -6.904 -5.067 2.388) 8.891 4.788 ( 0.400 -4.677 7.893) 9.183 4.841 ( 4.755 3.887 -5.832) 8.469 5.038 ( -2.420 4.963 11.318) 12.594 5.119 ( 3.079 1.808 -1.752) 3.977 5.361 ( -1.483 3.137 -0.532) 3.511 5.459 ( -6.457 13.128 3.250) 14.986 5.560 ( 6.282 -3.772 3.705) 8.210 5.690 ( 2.874 6.440 2.787) 7.582 5.855 ( -0.548 2.862 -7.273) 7.835 6.116 ( 1.553 -2.029 0.124) 2.558 6.440 ( 9.484 -4.525 -11.802) 15.802 6.749 ( -2.388 4.965 10.712) 12.046 6.883 ( -3.044 0.590 10.947) 11.378 6.925 ( -9.631 -0.699 3.095) 10.140 7.047 ( -5.040 0.019 3.776) 6.297 7.237 ( -7.175 5.046 9.100) 12.640 7.338 ( -8.527 1.643 3.642) 9.417 7.436 ( -5.976 -1.701 -1.795) 6.467 7.491 ( -9.365 3.649 17.112) 19.845 7.617 ( -1.403 4.791 11.689) 12.710 7.691 ( -10.124 5.556 12.927) 17.334 7.891 ( -8.175 -0.155 -0.545) 8.195 7.897 ( -2.167 -0.985 -0.084) 2.382 7.932 ( -3.452 -3.258 6.741) 8.244 8.076 ( -0.896 -0.837 0.005) 1.226 8.130 ( -3.260 2.323 4.013) 5.669 8.202 ( 6.398 3.471 1.467) 7.425 8.532 ( -1.976 -3.307 8.861) 9.663 8.591 ( 0.094 -1.018 7.660) 7.728 8.720 ( -1.246 5.318 6.363) 8.386 8.876 ( -1.882 1.036 3.049) 3.729 8.983 ( 3.268 -1.850 -0.312) 3.769 9.004 ( 10.864 2.884 -2.129) 11.440 9.174 ( 4.542 -5.474 -4.691) 8.520 9.295 ( 0.056 2.385 1.567) 2.854 9.317 ( -1.176 -4.744 0.419) 4.906 9.424 ( -2.763 -7.063 -8.598) 11.465 9.572 ( -1.422 2.250 -3.653) 4.520 9.642 ( -2.589 0.315 -11.839) 12.123 9.678 ( 8.303 -0.552 -5.833) 10.162 9.911 ( 6.792 8.136 -8.929) 13.858 9.984 ( 11.410 3.796 -5.639) 13.281 10.248 ( -0.148 3.239 -9.493) 10.031 10.274 ( 0.046 -1.436 10.663) 10.759 10.375 ( 5.273 -5.152 -8.533) 11.277 10.528 ( 4.080 3.553 0.665) 5.451 10.626 ( -1.651 0.649 0.856) 1.970 10.710 ( 8.672 8.332 -8.735) 14.864 10.869 ( 2.897 -2.078 -13.080) 13.557 11.057 ( -6.933 -2.952 -0.625) 7.562 11.408 ( 2.609 1.061 -4.315) 5.153 11.571 ( 1.412 -9.444 7.694) 12.262 11.610 ( -3.249 -10.404 0.896) 10.937 11.921 ( 2.295 -9.464 1.784) 9.901 12.174 ( 6.541 -2.974 -0.876) 7.239 12.323 ( -10.662 2.792 11.015) 15.582 12.611 ( -0.867 -2.465 8.792) 9.172 12.705 ( -3.802 -3.386 2.937) 5.877 12.762 ( -2.062 -0.766 3.624) 4.239 12.870 ( -0.869 -2.351 -2.066) 3.248 12.933 ( 2.468 1.031 -1.083) 2.885 13.242 ( 3.798 4.023 -0.018) 5.533 13.398 ( 4.212 -1.214 -8.730) 9.768 13.650 ( -4.227 3.127 1.066) 5.365 14.077 ( -2.858 1.691 -5.275) 6.233 14.101 ( 0.566 -0.139 -0.827) 1.012 14.215 ( 4.739 3.620 -16.825) 17.850 14.646 ( -3.633 -6.760 -2.810) 8.173 14.902 ( 6.637 -1.554 -3.152) 7.510 15.004 ( 2.747 -3.688 -7.152) 8.502 15.023 ( 5.469 -3.064 -4.121) 7.503 15.955 ( -3.841 3.920 -0.725) 5.536 15.999 ( 0.689 1.628 5.646) 5.917 16.170 ( -2.420 0.720 2.031) 3.240 16.245 ( -8.632 -1.875 3.363) 9.452 16.380 ( 0.678 1.302 6.395) 6.561 16.570 ( -6.322 -0.344 5.248) 8.224 16.703 ( 5.882 -2.409 1.596) 6.553 17.023 ( 8.094 -8.293 1.621) 11.701 19.375 ( -7.982 7.146 25.246) 27.425 20.008 ( 3.588 -2.943 36.673) 36.965 20.504 ( -2.110 1.205 20.241) 20.387 20.820 ( 0.217 -3.030 11.158) 11.564 20.943 ( 10.235 6.328 -22.935) 25.900 21.105 ( 0.061 5.596 -39.599) 39.992 21.602 ( 13.004 -0.825 -27.533) 30.460 21.900 ( 3.620 -4.219 -29.015) 29.543 24.995 ( -2.044 0.372 6.602) 6.921 25.040 ( -11.227 0.565 -9.662) 14.823 25.152 ( -4.183 -1.737 6.420) 7.857 25.224 ( -15.857 -1.069 -11.157) 19.419 26.116 ( -5.903 0.946 13.951) 15.178 26.273 ( -5.010 -1.498 14.947) 15.835 26.976 ( 14.713 0.392 -15.300) 21.230 27.148 ( 11.507 -2.819 -15.788) 19.739 29.194 ( -3.964 5.494 0.733) 6.814 29.378 ( 4.920 3.807 0.153) 6.223 29.812 ( -7.788 -5.237 -4.477) 10.398 29.920 ( 2.844 -4.854 2.936) 6.345 30.170 ( 2.481 6.788 3.436) 8.002 30.347 ( 6.628 10.412 -1.315) 12.413 30.874 ( -11.653 -4.157 9.127) 15.375 31.190 ( -2.971 2.274 10.085) 10.757 31.309 ( -1.529 -4.958 -1.590) 5.427 31.471 ( -4.241 3.024 -1.962) 5.566 31.537 ( -8.745 -0.400 8.661) 12.315 31.755 ( 1.056 -2.434 7.977) 8.407 32.130 ( 0.590 -1.155 2.833) 3.116 32.317 ( 5.610 -0.447 -3.410) 6.580 32.457 ( 0.904 2.728 1.627) 3.302 32.961 ( 11.325 -3.785 -6.855) 13.769 ======================= Grid point 186 (100/128) ======================= q-point: (-0.17 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.911 ( -7.803 7.919 25.801) 28.094 2.959 ( -8.430 5.583 29.906) 31.569 3.309 ( -3.532 4.508 13.666) 14.817 3.805 ( 3.001 -5.973 -10.065) 12.083 4.026 ( 1.437 4.081 1.804) 4.688 4.084 ( 3.972 -4.248 0.380) 5.828 4.202 ( 6.312 -1.290 0.731) 6.484 4.301 ( -7.122 -10.172 -1.816) 12.550 4.404 ( -0.442 -6.189 -1.539) 6.393 4.763 ( -7.158 -0.985 5.032) 8.805 4.866 ( 1.611 5.738 -5.977) 8.441 5.124 ( 5.977 3.516 3.332) 7.693 5.167 ( 4.661 3.778 1.090) 6.098 5.354 ( -6.094 14.326 8.805) 17.886 5.396 ( 4.437 7.312 2.024) 8.790 5.670 ( -2.944 7.338 1.003) 7.970 5.707 ( 1.922 -1.416 4.826) 5.384 5.857 ( 4.337 1.495 -8.600) 9.747 6.136 ( 0.873 -3.572 -4.490) 5.803 6.516 ( 1.993 -6.408 -10.040) 12.077 6.700 ( -6.583 0.904 6.866) 9.555 6.749 ( -7.159 -6.609 9.073) 13.313 6.813 ( -5.305 3.966 0.215) 6.627 7.017 ( -3.532 -5.836 8.318) 10.757 7.161 ( -8.662 -0.383 14.227) 16.661 7.207 ( -3.479 -1.033 -4.056) 5.442 7.362 ( -6.901 3.046 14.592) 16.426 7.410 ( -0.107 6.315 9.136) 11.106 7.516 ( -10.159 5.401 14.093) 18.192 7.646 ( -2.778 8.460 6.010) 10.743 7.748 ( -8.034 1.165 2.270) 8.430 7.760 ( -4.722 2.492 -1.108) 5.453 7.999 ( 2.914 -3.854 3.329) 5.867 8.093 ( 0.354 3.194 -2.700) 4.198 8.127 ( 3.355 -3.230 9.720) 10.779 8.387 ( 8.935 3.477 -0.059) 9.588 8.489 ( -2.880 -1.354 -0.769) 3.274 8.550 ( -4.810 0.837 2.925) 5.692 8.741 ( -5.178 2.851 22.498) 23.262 8.836 ( -0.904 2.717 0.123) 2.866 8.994 ( 0.002 -0.587 1.660) 1.761 9.173 ( 5.530 1.066 -0.486) 5.653 9.233 ( -1.403 -1.589 0.700) 2.232 9.269 ( 2.284 -4.071 -5.119) 6.927 9.337 ( -1.096 -0.453 0.769) 1.413 9.375 ( 2.800 -5.156 -9.063) 10.796 9.514 ( -1.463 3.596 -0.876) 3.979 9.552 ( -0.908 -0.342 -6.993) 7.060 9.867 ( 10.392 -0.861 -10.071) 14.496 10.002 ( 7.772 3.099 -13.513) 15.893 10.155 ( 6.412 7.178 -3.957) 10.406 10.265 ( 5.223 -0.155 2.689) 5.877 10.284 ( -2.730 -1.587 9.249) 9.774 10.439 ( 5.641 -2.554 -9.284) 11.159 10.552 ( -0.287 1.548 1.178) 1.966 10.615 ( -0.850 -2.237 -4.354) 4.968 10.842 ( 4.573 4.464 -6.067) 8.812 10.914 ( -2.156 2.934 -0.754) 3.718 10.935 ( 9.184 -0.697 -18.338) 20.521 11.382 ( -3.411 0.703 -3.692) 5.075 11.540 ( -3.244 -13.146 3.913) 14.095 11.663 ( 4.121 -9.123 3.399) 10.572 11.967 ( -1.924 -3.004 8.659) 9.365 12.180 ( -4.739 -5.775 6.371) 9.818 12.333 ( 7.326 5.447 2.008) 9.347 12.539 ( -10.389 -2.878 6.108) 12.391 12.622 ( -1.223 -5.381 -6.091) 8.219 12.686 ( -5.037 -0.614 1.230) 5.221 12.892 ( 1.901 2.860 0.034) 3.434 13.028 ( 5.466 1.419 1.377) 5.813 13.268 ( -1.600 0.403 2.974) 3.401 13.414 ( 0.372 -2.102 -5.333) 5.745 13.612 ( -0.244 1.303 1.417) 1.940 13.990 ( -2.995 1.144 -7.252) 7.929 14.090 ( -0.860 1.103 -1.634) 2.150 14.251 ( 5.718 4.419 -15.016) 16.664 14.580 ( -3.038 -10.951 1.080) 11.416 14.943 ( 1.595 -6.516 -9.822) 11.894 15.101 ( 9.089 -0.004 -2.033) 9.313 15.131 ( 5.555 -0.366 -3.063) 6.354 15.893 ( -1.990 4.400 -0.438) 4.849 15.959 ( -5.598 1.025 2.386) 6.171 16.108 ( -5.323 -0.190 2.509) 5.887 16.143 ( -3.159 1.706 1.174) 3.777 16.420 ( 0.409 -0.234 5.965) 5.984 16.498 ( -2.136 1.045 2.444) 3.409 16.838 ( 5.680 -3.600 5.387) 8.617 17.130 ( 2.962 -9.539 -0.688) 10.012 19.352 ( -5.928 7.733 25.703) 27.488 20.101 ( -8.188 -4.379 30.611) 31.988 20.621 ( 2.877 0.060 23.383) 23.559 20.855 ( -2.881 -3.510 15.918) 16.553 20.922 ( 2.285 6.831 -36.148) 36.859 21.111 ( 14.152 6.394 -31.132) 34.790 21.744 ( 14.379 -1.398 -27.142) 30.747 21.853 ( 3.894 -3.774 -28.928) 29.431 24.827 ( -4.296 -0.107 -7.077) 8.279 24.897 ( -6.797 -0.950 -4.297) 8.097 24.928 ( -9.474 1.375 1.788) 9.739 25.055 ( -13.554 -0.367 5.900) 14.787 26.147 ( 1.398 1.243 17.827) 17.925 26.345 ( 4.794 -1.824 16.013) 16.815 27.111 ( 7.528 0.274 -20.167) 21.528 27.231 ( 3.893 -2.507 -15.286) 15.972 29.163 ( 0.077 5.196 2.163) 5.629 29.438 ( -0.154 3.756 -1.288) 3.974 29.684 ( -1.880 -2.416 -2.813) 4.158 29.920 ( -3.272 -1.686 -0.230) 3.688 30.271 ( 8.367 5.044 0.925) 9.814 30.479 ( 3.402 5.597 3.159) 7.272 30.715 ( -5.878 -3.138 6.331) 9.191 31.115 ( -10.681 -0.817 4.601) 11.659 31.209 ( -5.039 0.017 6.140) 7.943 31.409 ( -0.755 2.840 -1.759) 3.425 31.574 ( 4.438 -0.511 12.276) 13.064 31.801 ( -1.326 -4.262 11.613) 12.442 32.123 ( -1.584 -0.725 1.129) 2.076 32.387 ( 3.488 -2.989 0.980) 4.697 32.508 ( 3.769 4.902 -5.492) 8.270 33.054 ( 2.268 -4.079 -10.986) 11.936 ======================= Grid point 187 (101/128) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.019 ( -1.024 6.384 17.805) 18.943 3.265 ( -1.756 3.215 9.935) 10.589 3.339 ( 5.032 9.279 20.805) 23.329 3.646 ( -1.311 -6.147 -2.543) 6.780 3.852 ( -1.503 -9.977 -5.701) 11.589 3.925 ( -4.084 -14.854 4.753) 16.122 4.341 ( 0.112 4.913 1.503) 5.139 4.390 ( 1.841 12.025 -0.544) 12.177 4.425 ( 7.193 3.251 11.830) 14.222 4.619 ( -3.373 -1.663 2.842) 4.713 4.987 ( -2.788 5.979 -6.847) 9.509 5.119 ( -4.234 3.620 -11.421) 12.707 5.384 ( -9.789 -0.403 4.734) 10.882 5.432 ( 5.375 0.054 4.297) 6.882 5.601 ( 4.823 2.156 10.207) 11.493 5.687 ( -5.642 -1.365 4.076) 7.093 5.913 ( -0.380 14.811 0.084) 14.816 6.018 ( 10.231 7.930 -7.955) 15.194 6.177 ( 3.022 7.648 -3.637) 8.992 6.300 ( -5.718 -3.573 -9.834) 11.923 6.533 ( -6.184 -7.386 7.132) 11.986 6.610 ( -1.747 -3.620 7.024) 8.093 6.698 ( 0.246 -2.579 7.294) 7.741 6.853 ( -1.581 -8.256 5.128) 9.846 7.097 ( -3.430 -4.265 14.235) 15.251 7.117 ( -1.863 -1.310 5.850) 6.278 7.330 ( -5.319 5.273 0.912) 7.545 7.450 ( -5.183 -1.549 -0.656) 5.449 7.602 ( 0.854 5.709 12.693) 13.944 7.722 ( -2.652 2.121 17.447) 17.775 7.842 ( 0.522 5.676 4.189) 7.074 7.845 ( 1.936 4.761 5.907) 7.830 8.080 ( 6.529 1.561 2.177) 7.057 8.143 ( 1.810 -0.872 12.831) 12.988 8.263 ( 2.954 6.406 -5.166) 8.744 8.378 ( -2.919 1.100 8.155) 8.731 8.509 ( -1.164 2.262 -2.048) 3.266 8.596 ( 1.299 0.231 8.100) 8.207 8.748 ( -5.630 2.549 8.044) 10.143 8.892 ( 0.872 0.776 -2.394) 2.663 8.980 ( -2.173 -3.567 -2.634) 4.938 9.025 ( -3.854 -1.717 -1.382) 4.439 9.091 ( -2.630 -6.353 1.177) 6.976 9.275 ( 0.856 -6.942 -3.852) 7.985 9.357 ( -0.236 4.544 -2.128) 5.023 9.460 ( 4.164 -2.391 -4.614) 6.659 9.518 ( 7.963 3.512 -6.300) 10.744 9.578 ( -0.704 3.257 -0.645) 3.394 9.928 ( 0.052 -0.497 -6.183) 6.203 10.008 ( -0.131 -4.308 -8.096) 9.172 10.168 ( -2.816 1.363 3.514) 4.705 10.269 ( -3.121 -3.572 5.128) 6.986 10.407 ( 2.946 5.945 -0.861) 6.691 10.510 ( 1.094 4.695 -9.387) 10.553 10.592 ( 3.087 2.271 -8.277) 9.121 10.633 ( -0.129 4.527 -2.881) 5.368 10.747 ( -1.147 -0.508 -8.806) 8.894 11.036 ( 6.255 3.279 -14.939) 16.524 11.172 ( 2.880 3.290 -3.233) 5.438 11.233 ( 1.187 -13.957 6.335) 15.373 11.312 ( -1.053 0.035 -5.480) 5.581 11.517 ( 5.418 -11.927 -3.166) 13.477 11.922 ( -3.797 -1.292 9.498) 10.310 12.024 ( 0.720 -6.609 -0.512) 6.668 12.292 ( -13.361 -1.146 7.630) 15.429 12.391 ( -2.778 -4.413 3.998) 6.571 12.614 ( 3.462 3.643 1.421) 5.222 12.718 ( 7.463 -0.567 -5.060) 9.035 12.963 ( -1.730 2.867 2.675) 4.286 13.079 ( 1.582 -2.494 -0.861) 3.076 13.219 ( -3.626 0.239 3.651) 5.151 13.299 ( -4.514 -3.503 0.348) 5.725 13.706 ( 0.928 5.459 4.823) 7.344 13.926 ( -1.558 -1.151 -2.796) 3.401 14.097 ( -0.076 -0.742 3.227) 3.312 14.255 ( -0.780 -9.109 6.648) 11.304 14.447 ( 2.962 6.127 -16.939) 18.254 14.765 ( 2.205 -8.982 -14.091) 16.855 15.174 ( 1.928 -0.198 -5.744) 6.062 15.219 ( 4.961 -1.261 -5.355) 7.407 15.894 ( -5.475 2.477 2.594) 6.545 15.962 ( -2.755 0.446 2.544) 3.777 16.031 ( -0.221 3.749 -0.453) 3.783 16.166 ( 3.607 -0.828 -1.732) 4.087 16.459 ( -1.059 2.058 5.791) 6.236 16.517 ( -0.838 0.830 3.694) 3.877 16.831 ( 1.369 -4.672 3.660) 6.091 16.933 ( -1.726 -8.880 0.724) 9.075 19.556 ( -5.854 11.311 30.517) 33.068 19.929 ( -11.620 -5.705 30.725) 33.341 20.671 ( -5.860 -0.878 22.690) 23.451 20.755 ( -7.596 -4.158 20.583) 22.330 21.034 ( 6.236 11.251 -39.553) 41.592 21.307 ( 10.380 0.329 -32.797) 34.402 21.759 ( 6.898 -1.333 -29.066) 29.903 21.840 ( 12.275 -3.193 -27.826) 30.580 24.729 ( -8.563 0.431 1.933) 8.789 24.760 ( -10.188 -1.130 0.977) 10.297 24.938 ( 9.992 1.563 -3.075) 10.571 24.974 ( 12.703 -0.445 -4.530) 13.494 26.304 ( 2.153 3.115 18.639) 19.020 26.449 ( 3.885 -3.712 17.003) 17.832 27.083 ( -2.182 0.058 -20.775) 20.890 27.119 ( -3.484 -2.001 -16.331) 16.818 29.329 ( 3.285 6.284 1.280) 7.205 29.419 ( -4.555 2.487 -3.210) 6.102 29.737 ( 5.031 0.369 2.313) 5.549 29.807 ( -3.528 -2.076 -0.363) 4.110 30.434 ( -2.120 3.451 4.443) 6.012 30.574 ( 3.765 2.288 -0.430) 4.426 30.722 ( 2.937 -1.402 3.208) 4.570 30.870 ( -8.540 -3.402 -0.211) 9.195 31.275 ( -1.307 6.333 10.850) 12.631 31.486 ( 2.031 4.378 -0.606) 4.864 31.628 ( -0.965 -7.481 12.649) 14.728 31.730 ( 5.621 -3.802 6.754) 9.574 32.137 ( -1.378 3.423 5.030) 6.238 32.353 ( 0.165 -5.629 3.898) 6.849 32.617 ( -1.363 6.153 -7.936) 10.134 32.871 ( -5.603 -5.451 -11.302) 13.742 ======================= Grid point 188 (102/128) ======================= q-point: ( 0.17 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.119 ( 3.946 4.949 16.394) 17.574 3.300 ( 2.443 2.155 6.720) 7.468 3.543 ( -0.280 -6.162 4.647) 7.723 3.613 ( 5.069 0.689 11.886) 12.940 3.873 ( 5.625 -2.956 1.125) 6.453 3.916 ( 2.530 -8.419 -1.470) 8.913 4.267 ( -6.868 10.054 -1.547) 12.274 4.309 ( -11.287 8.135 0.490) 13.922 4.557 ( -2.656 4.160 3.408) 5.997 4.621 ( 6.157 2.013 10.581) 12.407 4.920 ( -2.689 -1.074 -4.353) 5.228 4.981 ( -6.556 3.117 -10.306) 12.606 5.143 ( -13.478 -3.877 6.472) 15.446 5.482 ( -6.321 -6.564 4.730) 10.267 5.545 ( -4.878 5.887 0.603) 7.669 5.748 ( 4.546 -0.034 6.660) 8.064 5.922 ( 0.592 13.864 -0.232) 13.879 6.117 ( -1.445 -0.051 -13.233) 13.311 6.161 ( 0.550 5.416 -5.852) 7.992 6.209 ( 3.057 8.819 -2.513) 9.666 6.476 ( -0.333 3.586 12.428) 12.940 6.717 ( 5.917 -6.921 12.178) 15.206 6.842 ( 6.716 -2.734 5.737) 9.246 6.938 ( 8.748 -8.093 2.134) 12.107 7.141 ( 4.507 -2.762 8.448) 9.965 7.191 ( 3.599 -7.876 15.255) 17.541 7.287 ( 2.794 5.061 -0.137) 5.783 7.399 ( -0.551 -2.096 3.708) 4.295 7.678 ( 0.269 4.878 13.586) 14.437 7.774 ( -0.460 2.824 13.027) 13.338 7.820 ( 0.056 4.784 5.832) 7.543 7.937 ( 3.505 3.269 2.511) 5.411 8.156 ( -1.625 -0.306 5.251) 5.505 8.224 ( 0.031 -0.844 10.170) 10.205 8.268 ( 2.958 8.221 -6.328) 10.788 8.382 ( -0.629 4.597 9.808) 10.850 8.488 ( -7.411 5.443 10.766) 14.158 8.558 ( 0.543 3.220 -5.224) 6.161 8.732 ( -1.717 -0.647 6.014) 6.287 8.817 ( -10.368 -8.884 2.308) 13.847 8.978 ( -5.385 -2.501 2.700) 6.522 8.998 ( 7.908 0.364 -11.640) 14.077 9.025 ( 0.622 -4.872 -2.090) 5.338 9.307 ( 3.786 -7.530 -5.168) 9.887 9.346 ( -1.010 2.741 0.800) 3.029 9.443 ( -4.598 3.153 -1.925) 5.898 9.525 ( 1.202 3.605 -6.468) 7.502 9.635 ( 3.445 0.284 -5.059) 6.127 9.856 ( -4.916 0.006 -1.700) 5.202 9.987 ( 2.322 -4.292 -10.128) 11.242 10.135 ( -3.511 0.632 5.490) 6.547 10.188 ( -6.313 0.363 5.489) 8.373 10.381 ( -3.874 6.734 -8.728) 11.685 10.489 ( -4.802 2.751 -0.807) 5.592 10.519 ( 0.288 4.903 -13.177) 14.063 10.686 ( 6.944 -0.876 -9.171) 11.537 10.733 ( 0.931 -0.289 -4.770) 4.868 11.074 ( 2.390 -0.931 -9.355) 9.701 11.144 ( -1.000 5.376 -5.948) 8.080 11.277 ( 2.496 -4.822 -1.398) 5.607 11.335 ( 3.271 -8.017 -1.993) 8.885 11.606 ( 5.501 -7.920 -4.229) 10.529 11.847 ( -10.592 -5.104 6.065) 13.230 11.960 ( -7.247 -9.683 1.068) 12.142 12.148 ( -3.455 3.822 13.630) 14.571 12.423 ( 3.808 -5.298 6.585) 9.270 12.668 ( 2.303 5.722 1.322) 6.309 12.789 ( -0.713 0.334 -4.438) 4.507 12.920 ( -1.738 0.726 4.809) 5.165 13.075 ( -2.148 -5.261 -1.728) 5.939 13.180 ( -1.699 1.825 1.989) 3.190 13.261 ( 0.239 -2.304 2.091) 3.121 13.766 ( 3.588 2.482 4.000) 5.919 13.922 ( 1.968 -0.646 -1.763) 2.720 14.105 ( -0.523 0.173 3.003) 3.053 14.287 ( 0.695 -7.896 7.019) 10.587 14.457 ( 5.309 4.619 -14.963) 16.535 14.756 ( 2.567 -8.829 -13.795) 16.578 15.125 ( -3.698 1.243 -8.671) 9.508 15.222 ( -1.282 -1.383 -7.544) 7.776 15.837 ( -1.546 3.295 3.430) 5.001 15.934 ( -0.062 -1.086 3.778) 3.932 16.080 ( 3.814 5.047 0.570) 6.352 16.253 ( 5.418 -1.619 -0.549) 5.681 16.448 ( -2.424 1.344 5.644) 6.288 16.513 ( -1.038 -0.240 4.568) 4.691 16.828 ( -3.367 -5.159 3.139) 6.914 16.874 ( -4.558 -5.743 0.681) 7.363 19.586 ( -4.659 9.396 32.686) 34.327 19.812 ( -14.272 -0.394 30.689) 33.847 20.634 ( -7.741 -2.683 22.746) 24.177 20.683 ( -8.362 -4.396 20.801) 22.846 21.001 ( 7.648 11.801 -39.638) 42.059 21.341 ( 8.239 -3.476 -33.508) 34.680 21.744 ( 3.655 2.754 -29.477) 29.830 21.914 ( 8.008 -4.230 -28.608) 30.008 24.627 ( -3.100 0.438 3.790) 4.916 24.652 ( -0.080 -0.742 3.801) 3.874 25.217 ( 19.989 1.997 -8.078) 21.652 25.303 ( 22.694 -2.048 -8.371) 24.275 26.382 ( -2.192 3.435 18.144) 18.596 26.537 ( -2.273 -3.957 16.652) 17.266 26.889 ( -9.135 0.348 -17.933) 20.129 26.956 ( -6.033 -2.900 -18.017) 19.220 29.348 ( -1.769 3.962 -2.353) 4.936 29.418 ( 5.516 2.974 2.260) 6.662 29.701 ( -6.011 2.415 -1.439) 6.636 29.833 ( 2.906 -1.250 1.612) 3.550 30.375 ( -3.706 8.033 2.995) 9.340 30.663 ( -5.465 2.135 -0.406) 5.882 30.742 ( 8.755 -7.126 1.857) 11.440 30.841 ( 2.489 -5.622 4.603) 7.680 31.294 ( -1.250 5.561 9.386) 10.981 31.523 ( 0.702 -0.349 1.436) 1.636 31.652 ( 2.607 1.731 3.515) 4.706 31.918 ( 10.275 -5.188 6.747) 13.342 32.115 ( -3.678 2.822 5.706) 7.352 32.314 ( -5.177 -4.260 -4.118) 7.868 32.544 ( -4.663 2.571 1.619) 5.565 32.686 ( -9.063 -2.313 -5.704) 10.955 ======================= Grid point 189 (103/128) ======================= q-point: ( 0.33 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.248 ( 1.646 5.525 10.818) 12.258 3.404 ( 4.968 2.160 11.184) 12.427 3.487 ( -0.404 -7.976 0.171) 7.988 3.737 ( 0.690 -13.357 3.128) 13.736 3.988 ( 1.623 8.641 -2.878) 9.251 4.025 ( -9.954 9.001 3.930) 13.984 4.058 ( 0.075 4.955 5.560) 7.448 4.147 ( -0.216 11.789 0.488) 11.801 4.557 ( 0.260 -2.034 4.368) 4.825 4.681 ( -4.576 -3.900 9.551) 11.286 4.752 ( -7.118 3.609 -8.600) 11.733 4.903 ( 0.026 -4.152 -0.997) 4.270 5.015 ( -5.461 -7.156 9.324) 12.960 5.336 ( -8.688 -11.023 0.918) 14.065 5.544 ( 3.847 8.577 0.106) 9.401 5.794 ( -0.420 2.910 0.576) 2.996 5.911 ( -1.104 9.792 -4.278) 10.742 6.014 ( -0.797 0.849 -10.838) 10.901 6.150 ( -1.466 8.758 -1.415) 8.992 6.270 ( 3.847 3.198 -6.311) 8.053 6.607 ( 5.958 5.559 15.904) 17.870 6.857 ( 2.792 -0.990 16.004) 16.276 6.940 ( 1.876 -0.134 6.639) 6.900 7.089 ( 6.012 -2.859 1.194) 6.764 7.240 ( 2.109 -3.390 12.057) 12.700 7.323 ( 0.933 -6.933 14.166) 15.799 7.463 ( 13.898 1.421 6.887) 15.575 7.522 ( 10.756 0.534 4.165) 11.547 7.688 ( -3.846 2.534 6.674) 8.109 7.766 ( -3.480 1.828 10.208) 10.939 7.911 ( 3.027 4.588 8.763) 10.345 7.970 ( -0.677 4.068 -4.651) 6.216 8.128 ( -3.085 -1.272 2.745) 4.321 8.174 ( -7.746 0.005 20.339) 21.764 8.295 ( -6.705 6.921 7.107) 11.974 8.355 ( -0.940 3.114 6.771) 7.512 8.485 ( 6.552 3.630 -3.999) 8.491 8.563 ( -1.620 2.773 -2.122) 3.849 8.639 ( -5.988 -5.292 1.042) 8.059 8.711 ( -4.723 -3.462 3.669) 6.910 8.838 ( -5.391 -0.675 -2.592) 6.019 9.019 ( -0.173 -4.482 -2.018) 4.919 9.141 ( 7.200 -1.352 -8.648) 11.334 9.280 ( -5.146 3.472 2.739) 6.786 9.347 ( 3.104 -4.014 -6.653) 8.367 9.422 ( 3.433 1.092 -5.977) 6.978 9.546 ( 2.540 1.151 -4.157) 5.006 9.632 ( 0.580 -2.050 -4.729) 5.187 9.752 ( -5.768 2.721 -0.422) 6.392 9.991 ( 1.490 -4.091 -8.999) 9.997 10.075 ( -3.302 0.337 5.701) 6.597 10.147 ( -0.782 6.309 -1.837) 6.618 10.243 ( -5.951 3.249 -6.696) 9.530 10.348 ( -7.004 -0.745 -2.863) 7.604 10.524 ( 4.719 4.361 -12.368) 13.937 10.727 ( 2.015 1.016 -6.633) 7.006 10.792 ( 6.299 -0.871 -3.773) 7.394 10.992 ( -6.134 3.949 -5.604) 9.199 11.173 ( 4.415 -1.417 -7.121) 8.498 11.280 ( -1.731 0.937 -4.331) 4.757 11.400 ( 4.868 -5.750 -1.942) 7.780 11.558 ( -10.335 -2.674 4.048) 11.417 11.765 ( 3.976 -12.223 -6.591) 14.444 11.799 ( -8.745 -15.388 3.365) 18.016 12.269 ( 7.153 3.870 17.710) 19.488 12.524 ( 1.977 -6.321 7.016) 9.648 12.680 ( -2.723 4.210 0.391) 5.029 12.734 ( -0.813 4.523 4.744) 6.605 12.910 ( -2.854 -2.584 4.257) 5.740 13.000 ( -4.843 -6.683 -0.273) 8.258 13.198 ( 3.587 4.200 -2.564) 6.090 13.291 ( 2.448 -1.141 -2.209) 3.489 13.847 ( 2.214 2.430 4.137) 5.284 13.972 ( 3.788 -0.299 -0.179) 3.804 14.105 ( -0.280 0.752 1.778) 1.951 14.300 ( -1.302 -3.637 0.252) 3.871 14.536 ( 8.429 0.026 -7.827) 11.503 14.742 ( 1.765 -6.511 -12.413) 14.128 14.994 ( -5.601 1.586 -11.157) 12.584 15.133 ( -4.073 -2.489 -9.858) 10.953 15.872 ( 3.431 3.996 4.508) 6.933 15.998 ( 4.575 -1.979 5.261) 7.247 16.135 ( 0.568 4.989 3.359) 6.041 16.314 ( 0.578 -0.843 0.366) 1.086 16.426 ( -1.679 1.893 4.961) 5.569 16.550 ( 3.255 -4.267 5.089) 7.396 16.740 ( -5.840 -3.024 -0.737) 6.618 16.784 ( -6.261 -4.813 2.853) 8.397 19.656 ( -2.784 5.922 35.750) 36.344 19.682 ( -12.609 4.516 29.973) 32.830 20.569 ( -8.315 -1.802 20.452) 22.151 20.656 ( -4.772 -5.615 23.856) 24.968 20.995 ( 9.240 11.431 -39.295) 41.954 21.346 ( 7.365 -5.467 -34.521) 35.719 21.651 ( 0.134 6.234 -30.667) 31.295 21.904 ( 4.084 -5.576 -29.484) 30.284 24.690 ( 7.084 1.449 6.765) 9.902 24.762 ( 8.923 -1.955 6.932) 11.467 25.475 ( 9.146 2.500 -13.602) 16.580 25.597 ( 11.077 -3.296 -14.643) 18.654 26.361 ( -7.626 2.913 16.054) 18.011 26.493 ( -9.254 -3.438 14.797) 17.787 26.696 ( -1.917 1.381 -13.664) 13.867 26.818 ( 0.693 -4.412 -15.253) 15.894 29.338 ( 1.393 5.087 -1.083) 5.385 29.541 ( 6.198 0.936 2.520) 6.756 29.575 ( -6.343 3.315 -1.528) 7.319 29.858 ( -0.790 -4.471 0.246) 4.547 30.339 ( -2.116 10.770 3.920) 11.655 30.561 ( -3.616 5.719 -1.009) 6.841 30.886 ( -0.332 -9.231 8.583) 12.609 30.931 ( 9.336 -8.005 -0.601) 12.313 31.305 ( -1.685 4.955 9.332) 10.699 31.526 ( -1.000 -4.978 5.718) 7.647 31.733 ( 4.299 9.310 -8.309) 13.198 32.053 ( -3.751 1.162 10.024) 10.766 32.083 ( -2.584 -6.201 -9.343) 11.507 32.167 ( -2.195 -1.908 5.842) 6.526 32.468 ( -3.030 1.878 3.036) 4.682 32.583 ( -0.718 -1.896 1.327) 2.423 ======================= Grid point 190 (104/128) ======================= q-point: (-0.50 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.213 ( -8.292 4.616 11.500) 14.910 3.535 ( 5.399 -4.154 0.621) 6.840 3.565 ( 1.756 3.190 5.006) 6.190 3.669 ( -15.184 -0.518 6.148) 16.390 3.737 ( -4.489 1.009 8.363) 9.545 3.963 ( -5.237 9.882 5.647) 12.529 4.133 ( 7.748 11.798 -7.962) 16.206 4.226 ( -0.356 -1.644 6.008) 6.239 4.531 ( -8.706 -2.935 0.839) 9.226 4.615 ( 0.780 -7.878 6.858) 10.474 4.746 ( 5.611 -3.201 -5.561) 8.524 4.974 ( 6.214 -6.986 -2.720) 9.737 5.000 ( 1.429 -0.924 18.583) 18.660 5.238 ( -1.114 -11.070 1.926) 11.292 5.610 ( 2.093 9.071 -6.097) 11.128 5.754 ( -0.860 6.314 -9.499) 11.439 5.873 ( -0.010 10.757 -3.826) 11.417 6.015 ( 0.725 5.864 -2.136) 6.283 6.097 ( -2.290 3.342 -0.019) 4.051 6.297 ( 3.270 -2.807 -10.404) 11.261 6.738 ( 0.918 1.543 15.024) 15.131 6.941 ( -1.706 7.944 15.489) 17.491 6.977 ( -2.020 -2.378 13.931) 14.276 7.143 ( -1.592 -0.302 5.669) 5.896 7.323 ( -1.137 -2.429 18.092) 18.290 7.398 ( 3.223 -5.289 5.215) 8.096 7.560 ( -8.135 5.027 3.328) 10.126 7.650 ( -1.020 6.952 6.955) 9.887 7.694 ( -7.214 0.301 18.000) 19.395 7.744 ( 5.240 -0.727 -7.212) 8.945 7.903 ( -1.691 4.691 2.900) 5.768 7.971 ( -0.363 0.482 6.436) 6.465 8.062 ( -9.052 0.239 15.560) 18.003 8.090 ( -5.398 0.310 7.339) 9.116 8.207 ( -6.359 3.899 0.813) 7.503 8.389 ( -6.921 -1.920 0.144) 7.184 8.421 ( -1.256 3.124 14.317) 14.708 8.592 ( -2.632 -0.210 3.951) 4.752 8.678 ( 14.836 1.152 -9.890) 17.868 8.699 ( 7.249 -3.464 -4.919) 9.421 8.828 ( 3.775 0.852 -0.722) 3.936 8.996 ( -1.237 -4.811 -1.626) 5.227 9.146 ( -2.452 -2.018 -9.979) 10.472 9.237 ( 0.510 0.867 1.632) 1.917 9.386 ( 2.099 -0.689 -3.492) 4.132 9.424 ( -5.448 -1.447 2.632) 6.221 9.532 ( 3.204 4.526 -11.508) 12.774 9.648 ( 1.315 2.137 -1.341) 2.845 9.699 ( 0.128 -3.107 -4.155) 5.190 10.012 ( 4.462 -0.546 -7.067) 8.376 10.034 ( -4.251 5.490 -4.167) 8.098 10.106 ( 1.860 -1.158 -9.066) 9.327 10.154 ( 1.027 -2.122 -0.095) 2.360 10.317 ( 1.820 -2.113 6.871) 7.416 10.592 ( 7.932 5.694 -14.749) 17.688 10.737 ( 0.250 5.651 -1.466) 5.844 10.826 ( -3.924 -3.092 -8.488) 9.850 10.895 ( 2.536 11.539 -2.756) 12.131 11.147 ( -6.279 1.523 -1.354) 6.602 11.242 ( 2.422 -10.242 -4.454) 11.428 11.424 ( -2.780 -3.737 -0.878) 4.739 11.513 ( 1.928 -0.955 0.139) 2.156 11.644 ( -2.547 -16.609 -0.544) 16.812 11.894 ( 9.258 -11.279 -7.355) 16.341 12.451 ( -0.502 -1.563 15.081) 15.170 12.502 ( -2.361 -1.604 12.029) 12.363 12.695 ( 2.683 2.660 1.680) 4.134 12.740 ( -1.471 0.867 4.248) 4.578 12.859 ( -4.478 -2.368 5.629) 7.573 12.918 ( -2.715 -4.584 -1.351) 5.497 13.266 ( 4.455 3.884 -3.970) 7.120 13.328 ( 3.546 -0.946 -5.586) 6.684 13.845 ( -4.174 6.525 4.910) 9.171 14.045 ( 2.837 -2.133 1.726) 3.947 14.120 ( 1.108 0.911 1.190) 1.864 14.257 ( -1.055 -1.200 -6.967) 7.148 14.667 ( 5.684 0.015 -6.710) 8.794 14.737 ( 4.094 -3.362 -7.072) 8.836 14.872 ( -1.048 -1.448 -10.114) 10.271 15.013 ( -3.926 -4.381 -12.188) 13.533 15.975 ( 4.826 3.973 5.176) 8.116 16.095 ( 0.429 1.494 1.612) 2.239 16.136 ( 0.851 1.082 6.470) 6.615 16.275 ( -4.805 -1.964 3.327) 6.165 16.447 ( -0.012 3.941 5.355) 6.649 16.591 ( -0.751 -2.775 -1.249) 3.135 16.658 ( -6.565 -4.058 2.741) 8.190 16.722 ( 3.993 -6.486 2.103) 7.901 19.593 ( -9.961 8.364 30.094) 32.785 19.782 ( -0.085 0.083 36.638) 36.638 20.521 ( -5.486 0.824 20.264) 21.009 20.685 ( -2.856 -5.984 23.961) 24.862 21.027 ( 11.165 10.262 -37.227) 40.197 21.315 ( 4.312 -2.617 -37.053) 37.395 21.557 ( 4.537 5.706 -29.814) 30.693 21.845 ( 3.064 -6.846 -29.964) 30.889 24.889 ( 9.412 1.789 9.299) 13.351 24.979 ( 9.423 -2.445 9.534) 13.626 25.376 ( -11.287 2.461 -15.197) 19.089 25.515 ( -11.356 -4.175 -17.859) 21.571 26.250 ( -10.380 2.073 13.792) 17.386 26.348 ( -11.856 -2.621 13.780) 18.366 26.769 ( 13.834 1.874 -11.794) 18.275 26.899 ( 12.936 -4.333 -13.820) 19.419 29.386 ( 3.642 6.023 0.562) 7.061 29.440 ( -6.049 8.179 -2.150) 10.398 29.683 ( 6.637 -6.208 3.765) 9.837 29.805 ( -4.488 -7.431 -2.190) 8.953 30.318 ( -2.199 11.129 5.865) 12.771 30.539 ( 1.788 10.160 -3.082) 10.766 30.868 ( -5.017 -7.635 7.913) 12.087 31.080 ( 6.689 -9.177 -0.021) 11.356 31.307 ( -2.445 5.185 10.425) 11.897 31.540 ( -1.583 -5.709 9.843) 11.488 31.667 ( -6.032 6.107 -7.476) 11.383 31.839 ( -13.150 -2.068 -4.384) 14.015 32.087 ( 1.980 1.951 7.343) 7.852 32.235 ( 1.658 -2.563 5.171) 6.005 32.477 ( 2.472 3.131 0.400) 4.009 32.675 ( 10.578 -4.409 -3.677) 12.036 ======================= Grid point 191 (105/128) ======================= q-point: (-0.33 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 184 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.101 ( -8.849 5.224 14.100) 17.447 3.365 ( -17.253 17.600 18.380) 30.745 3.476 ( -8.666 -4.423 1.832) 9.900 3.635 ( 3.292 -2.326 -2.239) 4.611 3.871 ( 9.279 -6.552 1.043) 11.407 3.927 ( -1.705 1.551 10.121) 10.380 4.191 ( -1.171 -3.392 3.378) 4.929 4.267 ( 4.998 8.586 -0.302) 9.939 4.372 ( -8.197 -4.201 5.436) 10.695 4.646 ( 0.149 -8.539 0.927) 8.591 4.834 ( 7.441 -1.565 -4.045) 8.613 5.059 ( 4.589 -2.598 5.269) 7.454 5.220 ( 11.613 2.200 4.001) 12.478 5.328 ( 7.487 -3.188 7.489) 11.059 5.548 ( -3.695 4.491 -8.763) 10.517 5.737 ( 4.513 7.412 -12.384) 15.122 5.842 ( -6.376 9.575 0.931) 11.541 5.956 ( -0.755 7.986 -2.541) 8.415 6.129 ( 2.143 4.233 2.287) 5.267 6.315 ( 3.940 -7.983 -13.438) 16.119 6.767 ( -3.313 -2.311 10.717) 11.453 6.893 ( -9.592 -1.751 6.862) 11.923 6.950 ( -8.238 3.781 21.223) 23.077 7.077 ( -9.626 1.127 8.760) 13.064 7.291 ( -10.910 1.819 19.884) 22.753 7.349 ( -7.162 0.069 -5.216) 8.860 7.489 ( -4.528 4.281 11.202) 12.818 7.551 ( -7.322 5.475 12.649) 15.607 7.659 ( -2.435 -0.790 7.404) 7.834 7.784 ( 3.198 -3.476 -4.534) 6.547 7.851 ( -7.460 3.667 3.564) 9.044 7.910 ( -9.913 -0.393 5.276) 11.237 7.941 ( -5.015 4.647 10.391) 12.439 8.076 ( -5.121 1.053 4.909) 7.171 8.176 ( 5.962 1.186 5.522) 8.212 8.264 ( -0.753 1.886 -3.536) 4.078 8.504 ( -0.784 1.205 10.943) 11.037 8.589 ( 0.274 0.272 2.565) 2.594 8.800 ( 3.610 2.844 2.942) 5.457 8.889 ( 3.210 -0.408 -1.944) 3.775 8.949 ( 8.645 -0.903 -2.170) 8.959 9.003 ( 8.823 -3.717 -7.551) 12.194 9.088 ( 0.016 -1.669 -2.040) 2.635 9.218 ( -3.441 -4.995 -1.663) 6.290 9.329 ( -2.813 0.658 3.735) 4.721 9.383 ( 0.382 2.596 -2.537) 3.650 9.551 ( -2.170 -3.008 -5.838) 6.917 9.629 ( -2.697 -1.974 -9.782) 10.337 9.709 ( 7.231 4.108 -2.187) 8.599 9.973 ( 3.808 -3.494 -8.082) 9.593 10.120 ( 7.575 8.529 -5.336) 12.594 10.166 ( 7.192 -3.212 -6.418) 10.160 10.232 ( 3.932 -2.496 4.115) 6.215 10.403 ( 4.720 0.027 2.935) 5.558 10.606 ( -2.191 4.913 -6.127) 8.153 10.711 ( -3.295 9.001 1.419) 9.690 10.801 ( 8.540 0.343 -17.816) 19.760 10.940 ( 2.289 8.439 -1.932) 8.955 11.043 ( -2.515 3.987 -4.374) 6.431 11.286 ( 2.756 -14.004 -5.494) 15.293 11.350 ( -4.390 -13.130 4.649) 14.605 11.470 ( -2.903 -3.461 -0.418) 4.537 11.751 ( 10.201 -5.480 -3.557) 12.114 12.013 ( 5.219 -11.196 -4.599) 13.181 12.397 ( -4.083 3.296 10.664) 11.885 12.541 ( -2.550 -4.776 7.351) 9.130 12.655 ( -7.216 -0.641 4.881) 8.735 12.730 ( -4.753 -2.363 4.435) 6.917 12.846 ( 3.293 0.693 0.812) 3.462 12.942 ( 4.830 -1.216 1.736) 5.274 13.302 ( 1.102 2.134 -3.732) 4.438 13.373 ( 2.980 -1.414 -5.030) 6.015 13.765 ( -5.920 8.247 5.256) 11.431 14.056 ( -2.473 -4.406 2.098) 5.471 14.123 ( -1.463 2.597 0.028) 2.981 14.241 ( 2.086 -1.720 -5.769) 6.371 14.605 ( -3.606 3.612 -13.750) 14.667 14.841 ( 4.059 -4.739 -8.757) 10.753 14.924 ( 5.403 -3.626 -6.787) 9.402 14.947 ( 7.817 -4.120 -4.376) 9.861 16.040 ( -1.339 3.090 1.147) 3.558 16.046 ( -2.721 4.280 1.237) 5.221 16.174 ( -2.238 -0.639 4.370) 4.951 16.207 ( -3.467 -1.472 3.071) 4.860 16.425 ( -2.526 2.802 6.678) 7.670 16.552 ( -4.735 -1.920 1.639) 5.366 16.645 ( 6.050 -2.121 -0.278) 6.417 16.837 ( 5.597 -9.625 2.869) 11.498 19.556 ( -7.540 10.709 29.454) 32.235 19.919 ( -1.738 -6.402 35.086) 35.708 20.547 ( -0.863 3.327 21.938) 22.206 20.736 ( -1.976 -5.237 22.229) 22.922 21.096 ( 11.531 8.440 -34.164) 37.032 21.221 ( 3.697 4.793 -38.756) 39.226 21.590 ( 11.177 0.331 -28.510) 30.624 21.788 ( 4.120 -7.001 -29.967) 31.049 25.006 ( -5.089 0.794 1.873) 5.481 25.048 ( -7.905 -0.258 -4.152) 8.932 25.126 ( -7.704 -0.269 0.908) 7.762 25.192 ( -11.037 -2.133 -5.886) 12.689 26.143 ( -5.664 1.838 13.655) 14.897 26.234 ( -5.060 -2.398 14.190) 15.255 26.992 ( 14.177 1.321 -14.658) 20.435 27.085 ( 12.154 -3.285 -15.119) 19.674 29.335 ( -3.901 8.565 -0.932) 9.458 29.481 ( 5.319 6.439 1.646) 8.513 29.689 ( -6.191 -7.246 -3.883) 10.292 29.799 ( 4.011 -7.397 3.176) 8.994 30.321 ( 0.214 8.963 5.872) 10.717 30.579 ( 3.421 8.922 -2.650) 9.916 30.776 ( -7.665 -2.527 5.006) 9.497 31.151 ( 0.124 -8.528 -1.516) 8.662 31.294 ( -3.925 5.165 11.110) 12.865 31.502 ( -5.456 -2.575 11.392) 12.891 31.539 ( -5.872 2.962 -1.713) 6.796 31.689 ( -2.591 -4.172 5.458) 7.342 32.130 ( -0.138 1.538 5.423) 5.638 32.269 ( 0.422 -3.898 5.025) 6.373 32.559 ( 7.167 7.103 -7.677) 12.679 32.857 ( 10.414 -6.786 -8.780) 15.218 ======================= Grid point 192 (106/128) ======================= q-point: (-0.17 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.020 ( -6.317 6.485 15.942) 18.333 3.227 ( -6.994 18.286 26.091) 32.620 3.343 ( -6.426 -3.642 3.593) 8.214 3.656 ( 0.959 -4.107 -3.570) 5.526 3.907 ( -0.626 -9.561 -5.447) 11.021 3.997 ( -3.702 -16.217 10.275) 19.552 4.200 ( 5.768 6.147 3.103) 8.982 4.337 ( -0.193 -0.435 11.671) 11.681 4.352 ( 4.085 10.905 -2.032) 11.820 4.641 ( -0.943 -7.503 1.853) 7.785 4.976 ( 7.519 4.158 -4.404) 9.655 5.171 ( 6.400 1.108 -2.114) 6.830 5.317 ( -3.582 10.483 -4.455) 11.940 5.450 ( 7.680 -1.069 4.747) 9.092 5.548 ( -1.983 -1.783 9.599) 9.962 5.694 ( -2.808 4.210 1.144) 5.188 5.851 ( 10.970 2.571 -11.348) 15.992 5.951 ( -1.746 13.840 0.961) 13.983 6.155 ( 0.610 6.618 0.133) 6.647 6.334 ( 4.125 -10.540 -12.328) 16.736 6.678 ( -14.010 -1.562 5.928) 15.293 6.691 ( -8.038 -2.573 4.713) 9.666 6.861 ( -13.801 0.042 11.081) 17.699 6.896 ( -7.172 -5.225 9.957) 13.337 7.160 ( -10.069 -0.116 15.771) 18.712 7.193 ( -7.804 -0.156 3.157) 8.420 7.420 ( -6.200 5.202 9.442) 12.436 7.550 ( -1.302 3.558 -0.767) 3.865 7.595 ( -6.437 3.626 8.628) 11.359 7.743 ( -3.388 3.665 10.753) 11.855 7.758 ( -5.182 -0.327 8.897) 10.302 7.853 ( 1.094 1.424 0.201) 1.807 7.972 ( 3.888 4.095 3.788) 6.800 8.061 ( 0.439 -2.267 9.553) 9.828 8.223 ( 1.939 6.584 -0.595) 6.889 8.362 ( 4.576 -3.124 3.600) 6.608 8.513 ( 0.442 1.751 6.701) 6.940 8.564 ( -3.283 0.464 0.031) 3.315 8.825 ( -4.930 4.887 11.939) 13.811 8.898 ( 0.306 5.034 -2.536) 5.645 9.001 ( 0.514 0.788 -2.118) 2.317 9.083 ( -1.753 -7.954 0.935) 8.199 9.100 ( 1.607 -6.939 -2.682) 7.611 9.284 ( 6.677 -4.382 -6.870) 10.535 9.314 ( 4.403 2.095 0.002) 4.876 9.382 ( -1.047 3.628 -0.838) 3.868 9.478 ( -0.551 -4.184 -7.445) 8.558 9.571 ( 0.933 0.744 -2.204) 2.506 9.866 ( 9.223 1.101 -7.287) 11.806 10.023 ( 3.359 -3.471 -9.224) 10.412 10.200 ( -0.145 1.123 3.205) 3.399 10.246 ( 2.505 -1.773 1.926) 3.623 10.327 ( 6.262 5.023 -2.921) 8.542 10.488 ( 5.065 3.403 -5.972) 8.538 10.568 ( 1.841 1.601 -7.857) 8.227 10.649 ( -3.752 8.833 5.386) 11.005 10.845 ( -1.731 -5.027 -12.448) 13.536 10.958 ( 7.338 6.764 -12.388) 15.908 11.080 ( 6.444 10.317 -3.425) 12.637 11.237 ( -3.845 -17.038 4.044) 17.928 11.362 ( 0.143 -5.595 -3.502) 6.602 11.446 ( 2.243 -10.021 -1.886) 10.441 11.900 ( 5.125 -3.013 2.845) 6.590 12.022 ( -2.266 -8.923 1.843) 9.389 12.423 ( 0.693 1.514 3.190) 3.598 12.482 ( -8.332 -3.325 5.064) 10.302 12.543 ( -1.218 0.223 0.411) 1.304 12.670 ( -2.042 -1.822 3.559) 4.489 12.923 ( 4.332 1.662 -0.405) 4.658 13.036 ( 3.280 -1.511 2.647) 4.477 13.278 ( -2.682 1.040 -0.629) 2.944 13.370 ( -1.757 -2.491 -2.855) 4.176 13.701 ( -2.926 7.738 5.464) 9.914 13.992 ( -3.822 -2.406 -2.494) 5.159 14.096 ( -1.473 0.260 2.833) 3.203 14.253 ( -0.267 -5.782 1.833) 6.071 14.495 ( -1.052 4.786 -16.314) 17.035 14.798 ( 0.368 -8.085 -14.362) 16.485 15.085 ( 10.869 -1.270 -3.421) 11.465 15.100 ( 7.786 -2.118 -2.996) 8.607 15.986 ( -3.418 3.942 1.123) 5.337 15.990 ( -3.695 2.439 -0.505) 4.456 16.103 ( -5.839 -0.070 2.556) 6.374 16.159 ( -2.255 -0.358 0.135) 2.287 16.439 ( 0.211 2.125 6.570) 6.908 16.515 ( -0.661 0.362 2.189) 2.315 16.757 ( 5.027 -3.466 2.546) 6.615 16.922 ( 2.391 -10.468 1.678) 10.868 19.548 ( -6.455 11.724 29.431) 32.331 19.975 ( -6.961 -8.541 31.836) 33.689 20.638 ( -0.600 1.937 23.129) 23.218 20.775 ( -3.785 -4.362 20.994) 21.774 21.092 ( 4.917 9.446 -38.529) 39.974 21.230 ( 12.053 4.671 -33.372) 35.788 21.706 ( 13.300 -2.257 -28.052) 31.127 21.761 ( 6.225 -4.988 -29.371) 30.435 24.828 ( -4.382 0.325 -6.958) 8.229 24.870 ( -5.099 -1.626 -7.221) 8.988 24.967 ( -10.403 2.303 4.796) 11.685 25.041 ( -12.305 -1.172 5.310) 13.453 26.182 ( 2.220 2.380 16.965) 17.274 26.297 ( 4.156 -2.976 15.863) 16.667 27.120 ( 6.761 0.719 -18.626) 19.828 27.180 ( 4.491 -2.488 -15.822) 16.634 29.296 ( -0.137 7.968 0.197) 7.971 29.525 ( -4.501 3.131 -2.370) 5.973 29.628 ( 4.524 -1.736 0.590) 4.881 29.844 ( -0.277 -5.808 1.685) 6.054 30.375 ( 3.316 5.532 4.540) 7.888 30.624 ( -3.045 -5.950 5.932) 8.937 30.662 ( -0.605 11.950 -3.972) 12.608 31.048 ( -9.236 -5.922 -1.365) 11.056 31.268 ( -3.260 5.649 11.742) 13.432 31.475 ( -0.951 3.622 0.223) 3.751 31.532 ( 2.862 -3.949 12.256) 13.191 31.691 ( -1.836 -6.479 9.371) 11.539 32.137 ( -0.929 2.474 4.464) 5.187 32.310 ( 1.689 -4.763 5.484) 7.457 32.632 ( 4.195 7.565 -10.774) 13.817 32.943 ( 3.135 -7.150 -12.031) 14.342 ======================= Grid point 193 (107/128) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.173 ( 0.240 -8.529 6.989) 11.029 3.173 ( 0.240 8.529 6.989) 11.029 3.617 ( -2.951 -14.758 13.091) 19.947 3.617 ( -2.951 14.758 13.091) 19.947 3.668 ( 0.798 -6.161 0.995) 6.292 3.668 ( 0.798 6.161 0.995) 6.292 4.435 ( 2.191 -3.125 7.458) 8.378 4.435 ( 2.191 3.125 7.458) 8.378 4.554 ( 2.885 -5.246 1.600) 6.197 4.554 ( 2.885 5.246 1.600) 6.197 5.118 ( -5.673 -5.577 -11.094) 13.652 5.118 ( -5.673 5.577 -11.094) 13.652 5.406 ( -3.242 -2.896 1.484) 4.593 5.406 ( -3.242 2.896 1.484) 4.593 5.623 ( 1.283 -2.895 9.016) 9.556 5.623 ( 1.283 2.895 9.016) 9.556 6.073 ( 4.435 -5.817 -9.345) 11.868 6.073 ( 4.435 5.817 -9.345) 11.868 6.289 ( 1.227 -1.397 -2.847) 3.400 6.289 ( 1.227 1.397 -2.847) 3.400 6.532 ( -3.013 -4.989 8.670) 10.446 6.532 ( -3.013 4.989 8.670) 10.446 6.704 ( -2.921 -4.569 6.568) 8.518 6.704 ( -2.921 4.569 6.568) 8.518 7.070 ( -4.642 -1.730 11.011) 12.074 7.070 ( -4.642 1.730 11.011) 12.074 7.415 ( -5.339 -2.530 -1.748) 6.162 7.415 ( -5.339 2.530 -1.748) 6.162 7.710 ( -0.474 -4.156 16.699) 17.215 7.710 ( -0.474 4.156 16.699) 17.215 7.882 ( -0.392 -0.689 7.018) 7.063 7.882 ( -0.392 0.689 7.018) 7.063 8.113 ( 4.507 -1.789 8.958) 10.186 8.113 ( 4.507 1.789 8.958) 10.186 8.378 ( 1.322 -4.044 -0.613) 4.298 8.378 ( 1.322 4.044 -0.613) 4.298 8.555 ( 2.047 -2.760 5.393) 6.394 8.555 ( 2.047 2.760 5.393) 6.394 8.824 ( -7.978 -5.429 2.201) 9.898 8.824 ( -7.978 5.429 2.201) 9.898 9.022 ( -1.319 -0.964 -1.068) 1.951 9.022 ( -1.319 0.964 -1.068) 1.951 9.068 ( 0.033 -11.296 -6.121) 12.848 9.068 ( 0.033 11.296 -6.121) 12.848 9.418 ( 3.124 -2.098 -3.011) 4.820 9.418 ( 3.124 2.098 -3.011) 4.820 9.598 ( 4.631 -2.584 -3.295) 6.243 9.598 ( 4.631 2.584 -3.295) 6.243 9.935 ( -1.089 -2.485 -5.827) 6.427 9.935 ( -1.089 2.485 -5.827) 6.427 10.203 ( -3.067 -2.565 5.306) 6.644 10.203 ( -3.067 2.565 5.306) 6.644 10.520 ( 4.058 -3.915 -7.331) 9.249 10.520 ( 4.058 3.915 -7.331) 9.249 10.664 ( -0.221 -5.028 -12.681) 13.644 10.664 ( -0.221 5.028 -12.681) 13.644 10.868 ( -1.559 -15.427 4.053) 16.027 10.868 ( -1.559 15.427 4.053) 16.027 11.196 ( 3.726 -6.376 -4.590) 8.695 11.196 ( 3.726 6.376 -4.590) 8.695 11.330 ( 4.025 -5.869 -8.159) 10.827 11.330 ( 4.025 5.869 -8.159) 10.827 11.934 ( -0.743 -2.658 3.558) 4.503 11.934 ( -0.743 2.658 3.558) 4.503 12.304 ( -7.957 -3.130 5.926) 10.403 12.304 ( -7.957 3.130 5.926) 10.403 12.682 ( 5.558 -3.008 -0.417) 6.334 12.682 ( 5.558 3.008 -0.417) 6.334 13.022 ( -0.158 -3.235 1.475) 3.559 13.022 ( -0.158 3.235 1.475) 3.559 13.243 ( -4.112 -2.243 1.312) 4.865 13.243 ( -4.112 2.243 1.312) 4.865 13.838 ( -1.842 -7.103 4.514) 8.616 13.838 ( -1.842 7.103 4.514) 8.616 14.124 ( -0.429 -4.445 4.590) 6.404 14.124 ( -0.429 4.445 4.590) 6.404 14.596 ( 2.460 -8.405 -16.360) 18.556 14.596 ( 2.460 8.405 -16.360) 18.556 15.186 ( 4.169 -1.506 -6.468) 7.841 15.186 ( 4.169 1.506 -6.468) 7.841 15.939 ( -5.016 -2.046 3.428) 6.411 15.939 ( -5.016 2.046 3.428) 6.411 16.117 ( 2.550 -3.990 -2.514) 5.362 16.117 ( 2.550 3.990 -2.514) 5.362 16.506 ( -1.153 -2.138 5.258) 5.792 16.506 ( -1.153 2.138 5.258) 5.792 16.808 ( 0.423 -3.146 1.684) 3.594 16.808 ( 0.423 3.146 1.684) 3.594 19.772 ( -8.035 -10.214 31.962) 34.503 19.772 ( -8.035 10.214 31.962) 34.503 20.687 ( -7.417 -2.455 21.346) 22.731 20.687 ( -7.417 2.455 21.346) 22.731 21.230 ( 7.206 -7.974 -36.519) 38.068 21.230 ( 7.206 7.974 -36.519) 38.068 21.777 ( 10.747 -2.803 -28.394) 30.489 21.777 ( 10.747 2.803 -28.394) 30.489 24.741 ( -8.976 -0.801 0.999) 9.067 24.741 ( -8.976 0.801 0.999) 9.067 24.962 ( 10.880 -0.886 -3.463) 11.452 24.962 ( 10.880 0.886 -3.463) 11.452 26.374 ( 3.075 -3.911 17.624) 18.313 26.374 ( 3.075 3.911 17.624) 18.313 27.091 ( -2.995 -0.865 -18.364) 18.627 27.091 ( -2.995 0.865 -18.364) 18.627 29.423 ( -0.709 -2.608 -1.204) 2.959 29.423 ( -0.709 2.608 -1.204) 2.959 29.758 ( 1.608 -2.150 1.280) 2.974 29.758 ( 1.608 2.150 1.280) 2.974 30.523 ( 1.066 -5.202 5.556) 7.686 30.523 ( 1.066 5.202 5.556) 7.686 30.784 ( -4.412 -5.212 -2.468) 7.261 30.784 ( -4.412 5.212 -2.468) 7.261 31.424 ( -1.918 -8.475 10.502) 13.631 31.424 ( -1.918 8.475 10.502) 13.631 31.631 ( 5.179 -5.658 4.194) 8.742 31.631 ( 5.179 5.658 4.194) 8.742 32.234 ( -1.059 -6.120 6.334) 8.871 32.234 ( -1.059 6.120 6.334) 8.871 32.748 ( -2.995 -6.916 -11.093) 13.411 32.748 ( -2.995 6.916 -11.093) 13.411 ======================= Grid point 195 (108/128) ======================= q-point: ( 0.17 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.244 ( 4.451 -7.297 6.271) 10.601 3.244 ( 4.451 7.297 6.271) 10.601 3.547 ( -4.587 -7.363 3.425) 9.327 3.547 ( -4.587 7.363 3.425) 9.327 3.834 ( 10.748 -3.241 9.797) 14.900 3.834 ( 10.748 3.241 9.797) 14.900 4.410 ( -5.410 -1.348 -0.171) 5.578 4.410 ( -5.410 1.348 -0.171) 5.578 4.604 ( -1.485 -3.816 5.015) 6.474 4.604 ( -1.485 3.816 5.015) 6.474 4.945 ( -6.681 -4.510 -5.325) 9.660 4.945 ( -6.681 4.510 -5.325) 9.660 5.270 ( -12.066 -13.349 1.216) 18.035 5.270 ( -12.066 13.349 1.216) 18.035 5.660 ( 0.338 -5.971 5.212) 7.933 5.660 ( 0.338 5.971 5.212) 7.933 6.090 ( 1.460 -4.024 -11.650) 12.412 6.090 ( 1.460 4.024 -11.650) 12.412 6.279 ( 0.041 -2.829 -2.169) 3.565 6.279 ( 0.041 2.829 -2.169) 3.565 6.597 ( 5.017 -6.389 11.323) 13.935 6.597 ( 5.017 6.389 11.323) 13.935 6.835 ( 10.505 -2.783 7.499) 13.204 6.835 ( 10.505 2.783 7.499) 13.204 7.100 ( 3.101 -0.484 12.643) 13.026 7.100 ( 3.101 0.484 12.643) 13.026 7.358 ( 0.093 -2.396 1.241) 2.700 7.358 ( 0.093 2.396 1.241) 2.700 7.766 ( -1.564 -3.273 14.748) 15.188 7.766 ( -1.564 3.273 14.748) 15.188 7.913 ( 1.812 -4.536 6.804) 8.376 7.913 ( 1.812 4.536 6.804) 8.376 8.177 ( -2.926 -2.464 11.617) 12.231 8.177 ( -2.926 2.464 11.617) 12.231 8.418 ( 5.830 -4.013 -7.072) 10.006 8.418 ( 5.830 4.013 -7.072) 10.006 8.590 ( -5.961 -2.979 9.457) 11.569 8.590 ( -5.961 2.979 9.457) 11.569 8.689 ( -5.004 -0.981 1.017) 5.199 8.689 ( -5.004 0.982 1.017) 5.199 8.969 ( -2.840 -1.970 -3.061) 4.617 8.969 ( -2.840 1.970 -3.061) 4.617 9.087 ( 5.371 -9.678 -7.559) 13.404 9.087 ( 5.371 9.678 -7.559) 13.404 9.436 ( -0.609 -3.420 -0.125) 3.476 9.436 ( -0.609 3.420 -0.125) 3.476 9.611 ( -1.349 -3.414 -4.242) 5.610 9.611 ( -1.349 3.414 -4.242) 5.610 9.895 ( 0.550 -4.363 -7.476) 8.673 9.895 ( 0.550 4.363 -7.476) 8.673 10.159 ( -4.340 -2.404 8.435) 9.786 10.159 ( -4.340 2.404 8.435) 9.786 10.495 ( -4.591 -4.235 -9.212) 11.130 10.495 ( -4.591 4.235 -9.212) 11.130 10.625 ( 2.633 -4.231 -11.604) 12.629 10.625 ( 2.633 4.231 -11.604) 12.629 10.870 ( 0.601 -14.800 0.491) 14.821 10.870 ( 0.601 14.800 0.491) 14.821 11.224 ( 1.825 -5.459 -4.771) 7.477 11.224 ( 1.825 5.459 -4.771) 7.477 11.398 ( 7.035 -11.526 -8.529) 15.972 11.398 ( 7.035 11.526 -8.529) 15.972 11.832 ( -12.196 -3.090 2.642) 12.856 11.832 ( -12.196 3.090 2.642) 12.856 12.273 ( 1.251 -8.474 10.834) 13.811 12.273 ( 1.251 8.474 10.834) 13.811 12.761 ( 2.798 -3.499 -1.875) 4.856 12.761 ( 2.798 3.499 -1.875) 4.856 12.972 ( -5.297 -4.685 3.021) 7.690 12.972 ( -5.297 4.685 3.021) 7.690 13.221 ( 0.867 -2.138 1.612) 2.815 13.221 ( 0.867 2.138 1.612) 2.815 13.850 ( 1.382 -5.493 4.147) 7.020 13.850 ( 1.382 5.493 4.147) 7.020 14.155 ( 0.912 -5.303 6.102) 8.136 14.155 ( 0.912 5.303 6.102) 8.136 14.590 ( 3.906 -8.026 -15.743) 18.097 14.590 ( 3.906 8.026 -15.743) 18.097 15.171 ( -1.961 -3.129 -9.352) 10.055 15.171 ( -1.961 3.129 -9.352) 10.055 15.897 ( -0.741 -2.668 3.818) 4.717 15.897 ( -0.741 2.668 3.818) 4.717 16.182 ( 4.517 -5.016 -0.453) 6.765 16.182 ( 4.517 5.016 -0.453) 6.765 16.492 ( -2.386 -2.174 5.198) 6.118 16.492 ( -2.386 2.174 5.198) 6.118 16.791 ( -2.920 -1.854 1.069) 3.621 16.791 ( -2.920 1.854 1.069) 3.621 19.748 ( -8.838 -6.389 33.277) 35.018 19.748 ( -8.838 6.389 33.277) 35.018 20.621 ( -8.468 -1.524 21.088) 22.776 20.621 ( -8.468 1.524 21.088) 22.776 21.213 ( 7.217 -9.339 -36.804) 38.650 21.213 ( 7.217 9.339 -36.804) 38.650 21.823 ( 6.555 -4.869 -29.104) 30.228 21.823 ( 6.555 4.869 -29.104) 30.228 24.638 ( -1.574 -0.672 3.618) 4.003 24.638 ( -1.574 0.672 3.618) 4.003 25.260 ( 21.058 -2.303 -8.054) 22.663 25.260 ( 21.058 2.303 -8.054) 22.663 26.457 ( -2.165 -4.158 17.206) 17.833 26.457 ( -2.165 4.158 17.206) 17.833 26.909 ( -7.880 -1.806 -17.642) 19.406 26.909 ( -7.880 1.806 -17.642) 19.406 29.418 ( 0.536 -2.555 -0.120) 2.613 29.418 ( 0.536 2.555 -0.120) 2.613 29.774 ( -0.442 -4.328 -0.419) 4.371 29.774 ( -0.442 4.328 -0.419) 4.371 30.557 ( -0.156 -10.003 4.999) 11.183 30.557 ( -0.156 10.003 4.999) 11.183 30.742 ( 0.790 -4.527 0.061) 4.596 30.742 ( 0.790 4.527 0.061) 4.596 31.419 ( -2.476 -6.937 8.625) 11.342 31.419 ( -2.476 6.937 8.625) 11.342 31.781 ( 9.377 -8.109 1.337) 12.469 31.781 ( 9.377 8.109 1.337) 12.469 32.206 ( -5.045 -5.912 4.719) 9.093 32.206 ( -5.045 5.912 4.719) 9.093 32.620 ( -6.225 -4.238 -5.475) 9.311 32.620 ( -6.225 4.238 -5.475) 9.311 ======================= Grid point 197 (109/128) ======================= q-point: ( 0.33 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.364 ( 5.032 -5.386 3.971) 8.373 3.364 ( 5.032 5.386 3.971) 8.373 3.495 ( -2.442 -9.497 5.330) 11.161 3.495 ( -2.442 9.497 5.330) 11.161 4.072 ( 9.241 -2.694 4.640) 10.686 4.072 ( 9.241 2.694 4.640) 10.686 4.274 ( -8.718 -8.747 4.312) 13.080 4.274 ( -8.718 8.747 4.312) 13.080 4.530 ( -6.093 -8.761 1.583) 10.788 4.530 ( -6.093 8.761 1.583) 10.788 4.844 ( -3.507 -1.098 -3.892) 5.353 4.844 ( -3.507 1.098 -3.892) 5.353 5.067 ( -9.064 -13.566 5.625) 17.258 5.067 ( -9.064 13.566 5.625) 17.258 5.714 ( 3.879 -7.778 2.592) 9.070 5.714 ( 3.879 7.778 2.592) 9.070 6.036 ( -0.000 -1.451 -15.422) 15.490 6.036 ( -0.000 1.451 -15.422) 15.490 6.268 ( -0.998 -2.911 -3.331) 4.534 6.268 ( -0.998 2.911 -3.331) 4.534 6.759 ( 4.618 -8.856 16.352) 19.161 6.759 ( 4.618 8.856 16.352) 19.161 7.018 ( 5.634 -6.824 10.727) 13.906 7.018 ( 5.634 6.824 10.727) 13.906 7.215 ( 1.322 -3.427 12.302) 12.839 7.215 ( 1.322 3.427 12.302) 12.839 7.500 ( 14.422 -2.029 3.552) 14.991 7.500 ( 14.422 2.029 3.552) 14.991 7.755 ( -5.444 -3.016 12.002) 13.520 7.755 ( -5.444 3.016 12.002) 13.520 7.982 ( 2.152 -2.325 -0.144) 3.172 7.982 ( 2.152 2.325 -0.144) 3.172 8.141 ( -6.958 -2.582 21.001) 22.274 8.141 ( -6.958 2.582 21.001) 22.274 8.417 ( -9.187 -2.595 2.047) 9.764 8.417 ( -9.187 2.595 2.047) 9.764 8.521 ( 5.298 -2.241 -6.160) 8.428 8.521 ( 5.298 2.241 -6.160) 8.428 8.625 ( -4.300 -3.751 1.483) 5.896 8.625 ( -4.300 3.751 1.483) 5.896 8.909 ( -1.779 -6.398 -4.288) 7.905 8.909 ( -1.779 6.398 -4.288) 7.905 9.175 ( 5.454 -6.017 -7.669) 11.169 9.175 ( 5.454 6.017 -7.669) 11.169 9.413 ( -1.345 -4.151 1.854) 4.741 9.413 ( -1.345 4.151 1.854) 4.741 9.576 ( 0.962 -3.010 -4.112) 5.186 9.576 ( 0.962 3.010 -4.112) 5.186 9.871 ( -0.449 -7.641 -8.731) 11.611 9.871 ( -0.449 7.641 -8.731) 11.611 10.135 ( -2.311 -4.870 10.999) 12.249 10.135 ( -2.311 4.870 10.999) 12.249 10.315 ( -8.389 -3.960 -11.573) 14.832 10.315 ( -8.389 3.960 -11.573) 14.832 10.659 ( 5.313 -8.256 -10.176) 14.140 10.659 ( 5.313 8.256 -10.176) 14.140 10.882 ( 0.780 -12.262 -1.573) 12.387 10.882 ( 0.780 12.262 -1.573) 12.387 11.235 ( 1.939 -7.732 -6.282) 10.149 11.235 ( 1.939 7.732 -6.282) 10.149 11.510 ( 7.647 -12.866 -8.247) 17.089 11.510 ( 7.647 12.866 -8.247) 17.089 11.580 ( -13.961 -6.236 3.490) 15.684 11.580 ( -13.961 6.236 3.490) 15.684 12.378 ( 3.481 -7.308 12.850) 15.187 12.378 ( 3.481 7.308 12.850) 15.187 12.761 ( -1.483 -2.642 -0.736) 3.118 12.761 ( -1.483 2.642 -0.736) 3.118 12.898 ( -4.438 -2.775 5.282) 7.436 12.898 ( -4.438 2.775 5.282) 7.436 13.262 ( 3.213 -2.228 -1.697) 4.262 13.262 ( 3.213 2.228 -1.697) 4.262 13.912 ( 2.931 -4.249 4.613) 6.923 13.912 ( 2.931 4.249 4.613) 6.923 14.185 ( -0.333 -6.544 4.977) 8.228 14.185 ( -0.333 6.544 4.977) 8.228 14.614 ( 5.444 -6.211 -13.627) 15.934 14.614 ( 5.444 6.211 -13.627) 15.934 15.059 ( -5.053 -4.419 -11.981) 13.734 15.059 ( -5.053 4.419 -11.981) 13.734 15.946 ( 3.887 -3.378 4.805) 7.044 15.946 ( 3.887 3.378 4.805) 7.044 16.242 ( 0.723 -5.444 2.016) 5.850 16.242 ( 0.723 5.444 2.016) 5.850 16.485 ( 0.249 -3.099 4.158) 5.192 16.485 ( 0.249 3.099 4.158) 5.192 16.716 ( -5.350 -1.430 0.362) 5.550 16.716 ( -5.350 1.430 0.362) 5.550 19.727 ( -8.084 -0.700 34.312) 35.259 19.727 ( -8.084 0.700 34.312) 35.259 20.571 ( -6.167 -2.421 21.676) 22.666 20.571 ( -6.167 2.421 21.676) 22.666 21.201 ( 7.992 -9.332 -37.074) 39.056 21.201 ( 7.992 9.332 -37.074) 39.056 21.781 ( 2.467 -6.824 -30.272) 31.129 21.781 ( 2.467 6.824 -30.272) 31.129 24.723 ( 7.978 -1.939 6.667) 10.577 24.723 ( 7.978 1.939 6.667) 10.577 25.532 ( 9.824 -3.314 -14.028) 17.443 25.532 ( 9.824 3.314 -14.028) 17.443 26.424 ( -8.426 -3.502 15.196) 17.725 26.424 ( -8.426 3.502 15.196) 17.725 26.741 ( -0.691 -3.259 -13.888) 14.282 26.741 ( -0.691 3.259 -13.888) 14.282 29.447 ( 2.538 -5.869 0.970) 6.467 29.447 ( 2.538 5.869 0.970) 6.467 29.733 ( -3.449 -8.043 -1.806) 8.935 29.733 ( -3.449 8.043 -1.806) 8.935 30.559 ( -1.692 -9.450 5.458) 11.043 30.559 ( -1.692 9.450 5.458) 11.043 30.798 ( 4.450 -4.345 0.495) 6.239 30.798 ( 4.450 4.345 0.495) 6.239 31.414 ( -1.757 -6.038 8.981) 10.964 31.414 ( -1.757 6.038 8.981) 10.964 31.922 ( 3.218 -9.448 -9.042) 13.468 31.922 ( 3.218 9.448 -9.042) 13.468 32.107 ( -5.098 -3.471 9.805) 11.583 32.107 ( -5.098 3.471 9.805) 11.583 32.528 ( -1.542 -3.489 -0.696) 3.877 32.528 ( -1.542 3.489 -0.696) 3.877 ======================= Grid point 199 (110/128) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.358 ( -5.958 -10.460 5.241) 13.130 3.358 ( -5.958 10.460 5.241) 13.130 3.577 ( 7.867 -3.324 1.069) 8.607 3.577 ( 7.867 3.324 1.069) 8.607 3.988 ( -15.610 -13.101 10.992) 23.155 3.988 ( -15.610 13.101 10.992) 23.155 4.282 ( -0.181 -7.594 7.178) 10.451 4.282 ( -0.181 7.594 7.178) 10.451 4.456 ( -0.726 -5.376 -2.606) 6.018 4.456 ( -0.726 5.376 -2.606) 6.018 4.808 ( 3.243 -8.618 -6.548) 11.299 4.808 ( 3.243 8.618 -6.548) 11.299 5.055 ( 4.527 -6.404 11.122) 13.609 5.055 ( 4.527 6.404 11.122) 13.609 5.757 ( 0.302 -4.999 -7.874) 9.332 5.757 ( 0.302 4.999 -7.874) 9.332 6.028 ( 4.885 -3.986 -7.818) 10.043 6.028 ( 4.885 3.986 -7.818) 10.043 6.208 ( -3.066 -5.604 -5.812) 8.636 6.208 ( -3.066 5.604 -5.812) 8.636 6.842 ( -3.164 -8.691 17.459) 19.758 6.842 ( -3.164 8.691 17.459) 19.758 7.107 ( -3.392 -6.596 17.032) 18.577 7.107 ( -3.392 6.596 17.032) 18.577 7.306 ( 5.207 -2.972 7.489) 9.593 7.306 ( 5.207 2.972 7.489) 9.593 7.661 ( -9.464 -4.165 11.248) 15.279 7.661 ( -9.464 4.165 11.248) 15.279 7.729 ( 3.554 -1.713 3.555) 5.310 7.729 ( 3.554 1.713 3.555) 5.310 7.961 ( -0.922 -1.491 0.150) 1.759 7.961 ( -0.922 1.491 0.150) 1.759 8.087 ( -8.972 -1.561 18.094) 20.256 8.087 ( -8.972 1.561 18.094) 20.256 8.298 ( -5.795 -5.319 2.546) 8.268 8.298 ( -5.795 5.319 2.546) 8.268 8.521 ( -0.523 -5.873 4.208) 7.244 8.521 ( -0.523 5.873 4.208) 7.244 8.685 ( 11.260 -0.790 -10.232) 15.235 8.685 ( 11.260 0.790 -10.232) 15.235 8.884 ( 1.321 -4.976 -3.930) 6.477 8.884 ( 1.321 4.976 -3.930) 6.477 9.178 ( -1.683 -4.537 -5.463) 7.298 9.178 ( -1.683 4.537 -5.463) 7.298 9.405 ( -1.001 -1.415 3.151) 3.596 9.405 ( -1.001 1.415 3.151) 3.596 9.609 ( 2.107 -4.459 -5.117) 7.107 9.609 ( 2.107 4.459 -5.117) 7.107 9.820 ( -0.555 -12.007 -7.984) 14.430 9.820 ( -0.555 12.007 -7.984) 14.430 10.110 ( -1.794 -2.549 -0.608) 3.176 10.110 ( -1.794 2.549 -0.608) 3.176 10.228 ( 2.699 -6.517 -0.617) 7.081 10.228 ( 2.699 6.517 -0.617) 7.081 10.721 ( 5.361 -6.505 -10.530) 13.489 10.721 ( 5.361 6.505 -10.530) 13.489 10.893 ( 1.695 -10.115 -1.654) 10.389 10.893 ( 1.695 10.115 -1.654) 10.389 11.233 ( -0.736 -3.867 -6.557) 7.648 11.233 ( -0.736 3.867 -6.557) 7.648 11.334 ( -10.252 -8.614 3.891) 13.944 11.334 ( -10.252 8.614 3.891) 13.944 11.665 ( 10.336 -11.374 -9.035) 17.827 11.665 ( 10.336 11.374 -9.035) 17.827 12.455 ( -1.559 -2.001 13.749) 13.981 12.455 ( -1.559 2.001 13.749) 13.981 12.742 ( -0.974 -1.445 1.380) 2.223 12.742 ( -0.974 1.445 1.380) 2.223 12.849 ( -2.253 -1.862 4.111) 5.044 12.849 ( -2.253 1.862 4.111) 5.044 13.311 ( 3.131 -1.155 -3.580) 4.894 13.311 ( 3.131 1.155 -3.580) 4.894 13.963 ( -0.740 -5.406 6.451) 8.449 13.963 ( -0.740 5.406 6.451) 8.449 14.189 ( 0.110 -4.989 -0.212) 4.995 14.189 ( 0.110 4.989 -0.212) 4.995 14.687 ( 7.427 -2.177 -8.625) 11.589 14.687 ( 7.427 2.177 -8.625) 11.589 14.914 ( -4.486 -4.936 -13.788) 15.316 14.914 ( -4.486 4.936 -13.788) 15.316 16.051 ( 4.379 -3.602 5.260) 7.734 16.051 ( 4.379 3.602 5.260) 7.734 16.218 ( -3.462 -4.324 2.047) 5.906 16.218 ( -3.462 4.324 2.047) 5.906 16.524 ( -0.389 -3.702 4.987) 6.223 16.524 ( -0.389 3.702 4.987) 6.223 16.631 ( -1.522 -2.194 -0.975) 2.843 16.631 ( -1.522 2.194 -0.975) 2.843 19.734 ( -6.382 -5.274 34.127) 35.117 19.734 ( -6.382 5.274 34.127) 35.117 20.575 ( -3.170 -4.674 22.619) 23.314 20.575 ( -3.170 4.674 22.619) 23.314 21.209 ( 9.105 -7.929 -36.906) 38.830 21.209 ( 9.105 7.929 -36.906) 38.830 21.698 ( 2.570 -8.016 -30.773) 31.904 21.698 ( 2.570 8.016 -30.773) 31.904 24.931 ( 9.435 -2.403 9.169) 13.374 24.931 ( 9.435 2.403 9.169) 13.374 25.437 ( -11.502 -3.714 -16.204) 20.216 25.437 ( -11.502 3.714 -16.204) 20.216 26.296 ( -11.045 -2.635 13.527) 17.661 26.296 ( -11.045 2.635 13.527) 17.661 26.822 ( 13.474 -3.466 -12.372) 18.618 26.822 ( 13.474 3.466 -12.372) 18.618 29.507 ( 2.737 -5.088 1.514) 5.973 29.507 ( 2.737 5.088 1.514) 5.973 29.653 ( -3.428 -6.838 -2.093) 7.931 29.653 ( -3.428 6.838 -2.093) 7.931 30.540 ( -2.980 -10.060 6.337) 12.257 30.540 ( -2.980 10.060 6.337) 12.257 30.885 ( 4.845 -9.513 -1.408) 10.768 30.885 ( 4.845 9.513 -1.408) 10.768 31.423 ( -2.106 -6.287 11.442) 13.225 31.423 ( -2.106 6.287 11.442) 13.225 31.773 ( -10.401 -4.597 -5.958) 12.838 31.773 ( -10.401 4.597 -5.958) 12.838 32.154 ( 1.283 -4.568 8.591) 9.814 32.154 ( 1.283 4.568 8.591) 9.814 32.574 ( 7.346 -5.731 -4.455) 10.328 32.574 ( 7.346 5.731 -4.455) 10.328 ======================= Grid point 201 (111/128) ======================= q-point: (-0.33 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.260 ( -6.468 -11.149 5.312) 13.941 3.260 ( -6.468 11.149 5.312) 13.941 3.672 ( -2.407 -6.390 3.390) 7.623 3.672 ( -2.407 6.390 3.390) 7.623 3.789 ( -6.721 -10.228 9.090) 15.245 3.789 ( -6.721 10.228 9.090) 15.245 4.260 ( -3.806 -9.280 14.330) 17.492 4.260 ( -3.806 9.280 14.330) 17.492 4.468 ( 2.608 -9.655 -4.131) 10.821 4.468 ( 2.608 9.655 -4.131) 10.821 4.916 ( 10.338 -9.483 -4.639) 14.776 4.916 ( 10.338 9.483 -4.639) 14.776 5.261 ( 11.018 -3.933 8.996) 14.758 5.261 ( 11.018 3.933 8.996) 14.758 5.688 ( -2.231 -7.512 -12.678) 14.904 5.688 ( -2.231 7.512 -12.678) 14.904 6.039 ( -2.602 -6.015 -5.491) 8.550 6.039 ( -2.602 6.015 -5.491) 8.550 6.192 ( 4.854 -3.182 -4.756) 7.504 6.192 ( 4.854 3.182 -4.756) 7.504 6.791 ( -9.046 -5.643 13.863) 17.489 6.791 ( -9.046 5.643 13.863) 17.489 7.040 ( -11.336 -4.399 17.249) 21.104 7.040 ( -11.336 4.399 17.249) 21.104 7.336 ( -9.133 -2.191 10.031) 13.742 7.336 ( -9.133 2.191 10.031) 13.742 7.585 ( -2.445 -5.603 9.321) 11.147 7.585 ( -2.445 5.603 9.321) 11.147 7.686 ( -1.586 -5.898 -0.219) 6.112 7.686 ( -1.586 5.898 -0.219) 6.112 7.892 ( -10.538 -1.189 6.180) 12.274 7.892 ( -10.538 1.189 6.180) 12.274 8.055 ( -1.595 -4.489 10.016) 11.092 8.055 ( -1.595 4.489 10.016) 11.092 8.223 ( 0.140 -4.286 0.568) 4.325 8.223 ( 0.140 4.286 0.568) 4.325 8.569 ( -0.036 -3.107 6.251) 6.981 8.569 ( -0.036 3.107 6.251) 6.981 8.849 ( 8.895 -2.902 -4.441) 10.357 8.849 ( 8.895 2.902 -4.441) 10.357 8.950 ( 6.359 -1.232 -3.297) 7.269 8.950 ( 6.359 1.232 -3.297) 7.269 9.117 ( -1.406 -4.583 -3.769) 6.098 9.117 ( -1.406 4.583 -3.769) 6.098 9.379 ( -3.286 -3.319 3.288) 5.712 9.379 ( -3.286 3.319 3.288) 5.712 9.562 ( -2.650 -3.991 -8.927) 10.131 9.562 ( -2.650 3.991 -8.927) 10.131 9.832 ( 5.505 -8.237 -4.969) 11.083 9.832 ( 5.505 8.237 -4.969) 11.083 10.163 ( 5.807 -2.040 -2.814) 6.767 10.163 ( 5.807 2.040 -2.814) 6.767 10.312 ( 6.054 -7.252 0.578) 9.465 10.312 ( 6.054 7.252 0.578) 9.465 10.745 ( 1.586 -5.598 -8.940) 10.666 10.745 ( 1.586 5.598 -8.940) 10.666 10.932 ( 1.516 -11.995 -0.848) 12.120 10.932 ( 1.516 11.995 -0.848) 12.120 11.121 ( -4.725 -7.887 -1.566) 9.327 11.121 ( -4.725 7.887 -1.566) 9.327 11.289 ( 1.719 -13.300 -4.804) 14.246 11.289 ( 1.719 13.300 -4.804) 14.246 11.803 ( 7.756 -8.973 -5.723) 13.169 11.803 ( 7.756 8.973 -5.723) 13.169 12.455 ( -2.288 -3.520 8.522) 9.500 12.455 ( -2.288 3.520 8.522) 9.500 12.680 ( -7.013 -2.496 6.667) 9.993 12.680 ( -7.013 2.496 6.667) 9.993 12.891 ( 4.642 -3.274 0.643) 5.717 12.891 ( 4.642 3.274 0.643) 5.717 13.339 ( 1.237 -1.960 -3.386) 4.103 13.339 ( 1.237 1.960 -3.386) 4.103 13.931 ( -4.705 -8.021 6.144) 11.146 13.931 ( -4.705 8.021 6.144) 11.146 14.184 ( -0.979 -3.423 -1.036) 3.708 14.184 ( -0.979 3.423 -1.036) 3.708 14.723 ( -1.124 -6.958 -15.330) 16.873 14.723 ( -1.124 6.958 -15.330) 16.873 14.894 ( 9.275 -0.771 -4.729) 10.439 14.894 ( 9.275 0.771 -4.729) 10.439 16.088 ( -2.520 -1.247 1.168) 3.044 16.088 ( -2.520 1.247 1.168) 3.044 16.177 ( -2.131 -1.753 3.366) 4.352 16.177 ( -2.131 1.753 3.366) 4.352 16.485 ( -2.517 -3.721 3.257) 5.549 16.485 ( -2.517 3.721 3.257) 5.549 16.684 ( 4.561 -5.670 1.586) 7.447 16.684 ( 4.561 5.670 1.586) 7.447 19.760 ( -5.745 -9.776 32.773) 34.679 19.760 ( -5.745 9.776 32.773) 34.679 20.632 ( -1.096 -5.183 23.208) 23.805 20.632 ( -1.096 5.183 23.208) 23.805 21.230 ( 9.176 -4.180 -36.616) 37.979 21.230 ( 9.176 4.180 -36.616) 37.979 21.652 ( 6.343 -6.089 -30.080) 31.339 21.652 ( 6.343 6.089 -30.080) 31.339 25.027 ( -6.743 -1.350 -0.762) 6.919 25.027 ( -6.743 1.350 -0.762) 6.919 25.148 ( -8.742 -2.101 -2.730) 9.396 25.148 ( -8.742 2.101 -2.730) 9.396 26.186 ( -5.321 -2.450 13.672) 14.874 26.186 ( -5.321 2.450 13.672) 14.874 27.029 ( 13.216 -2.468 -14.649) 19.884 27.029 ( 13.216 2.468 -14.649) 19.884 29.504 ( -2.669 -7.958 -1.709) 8.566 29.504 ( -2.669 7.958 -1.709) 8.566 29.650 ( 2.835 -7.050 1.737) 7.795 29.650 ( 2.835 7.050 1.737) 7.795 30.508 ( -2.988 -9.625 6.241) 11.854 30.508 ( -2.988 9.625 6.241) 11.854 30.939 ( 1.504 -12.613 -4.287) 13.406 30.939 ( 1.504 12.613 -4.287) 13.406 31.412 ( -4.593 -6.102 13.199) 15.249 31.412 ( -4.593 6.102 13.199) 15.249 31.608 ( -5.426 -3.935 1.259) 6.820 31.608 ( -5.426 3.935 1.259) 6.820 32.188 ( -0.224 -4.012 6.574) 7.705 32.188 ( -0.224 4.012 6.574) 7.705 32.710 ( 9.169 -8.078 -9.682) 15.591 32.710 ( 9.169 8.078 -9.682) 15.591 ======================= Grid point 203 (112/128) ======================= q-point: (-0.17 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.183 ( -4.092 -9.884 5.891) 12.213 3.183 ( -4.092 9.884 5.891) 12.213 3.595 ( -5.787 -15.952 16.990) 24.012 3.595 ( -5.787 15.952 16.990) 24.012 3.745 ( -3.214 -3.104 -3.876) 5.915 3.745 ( -3.214 3.104 -3.876) 5.915 4.317 ( 3.199 -3.763 15.013) 15.805 4.317 ( 3.199 3.763 15.013) 15.805 4.508 ( 3.086 -6.234 -2.781) 7.491 4.508 ( 3.086 6.234 -2.781) 7.491 5.101 ( 10.011 -7.813 -4.754) 13.559 5.101 ( 10.011 7.813 -4.754) 13.559 5.437 ( 3.138 -4.995 1.890) 6.195 5.437 ( 3.138 4.995 1.890) 6.195 5.590 ( -3.310 -10.731 -1.335) 11.309 5.590 ( -3.310 10.731 -1.335) 11.309 6.013 ( 4.177 -9.787 -7.584) 13.067 6.013 ( 4.177 9.787 -7.584) 13.067 6.256 ( 3.338 -1.744 -3.732) 5.301 6.256 ( 3.338 1.744 -3.732) 5.301 6.645 ( -11.188 -0.602 9.343) 14.589 6.645 ( -11.188 0.602 9.343) 14.589 6.850 ( -14.179 -0.199 11.087) 18.001 6.850 ( -14.179 0.199 11.087) 18.001 7.170 ( -10.981 -1.572 11.583) 16.038 7.170 ( -10.981 1.572 11.583) 16.038 7.531 ( -5.351 -4.032 -0.628) 6.729 7.531 ( -5.351 4.032 -0.628) 6.729 7.691 ( -3.900 -5.220 9.812) 11.778 7.691 ( -3.900 5.220 9.812) 11.778 7.825 ( 2.955 -3.112 6.270) 7.598 7.825 ( 2.955 3.112 6.270) 7.598 8.039 ( -2.254 -0.970 11.106) 11.374 8.039 ( -2.254 0.970 11.106) 11.374 8.307 ( 5.987 -3.160 0.683) 6.805 8.307 ( 5.987 3.160 0.683) 6.805 8.551 ( -3.094 -1.857 5.089) 6.238 8.551 ( -3.094 1.857 5.089) 6.238 8.927 ( -2.280 -6.453 -0.552) 6.866 8.927 ( -2.280 6.453 -0.552) 6.866 8.998 ( 1.923 -3.552 4.103) 5.758 8.998 ( 1.923 3.552 4.103) 5.758 9.114 ( 0.757 -10.826 -9.647) 14.520 9.114 ( 0.757 10.826 -9.647) 14.520 9.363 ( 2.263 -2.817 -0.048) 3.614 9.363 ( 2.263 2.817 -0.048) 3.614 9.527 ( 3.180 -4.947 -6.192) 8.540 9.527 ( 3.180 4.947 -6.192) 8.540 9.926 ( 4.902 -4.872 -4.634) 8.321 9.926 ( 4.902 4.872 -4.634) 8.321 10.217 ( 0.223 -1.056 1.868) 2.157 10.217 ( 0.223 1.056 1.868) 2.157 10.437 ( 7.604 -5.014 -5.053) 10.416 10.437 ( 7.604 5.014 -5.053) 10.416 10.716 ( -0.247 -8.231 -10.492) 13.338 10.716 ( -0.247 8.231 -10.492) 13.338 10.899 ( -3.943 -16.339 4.847) 17.494 10.899 ( -3.943 16.339 4.847) 17.494 11.130 ( 5.121 -10.175 -5.793) 12.780 11.130 ( 5.121 10.175 -5.793) 12.780 11.306 ( 2.415 -7.666 -6.574) 10.384 11.306 ( 2.415 7.666 -6.574) 10.384 11.894 ( 3.445 -3.234 0.751) 4.785 11.894 ( 3.445 3.234 0.751) 4.785 12.427 ( -5.076 -1.280 2.388) 5.754 12.427 ( -5.076 1.280 2.388) 5.754 12.611 ( -0.903 -4.145 5.825) 7.206 12.611 ( -0.903 4.145 5.825) 7.206 12.977 ( 3.856 -3.663 1.152) 5.442 12.977 ( 3.856 3.663 1.152) 5.442 13.317 ( -2.729 -2.754 -1.712) 4.238 13.317 ( -2.729 2.754 -1.712) 4.238 13.872 ( -3.834 -8.686 4.973) 10.719 13.872 ( -3.834 8.686 4.973) 10.719 14.144 ( -2.985 -4.492 2.345) 5.881 14.144 ( -2.985 4.492 2.345) 5.881 14.638 ( 0.146 -8.307 -17.197) 19.099 14.638 ( 0.146 8.307 -17.197) 19.099 15.073 ( 10.034 -0.386 -3.741) 10.715 15.073 ( 10.034 0.386 -3.741) 10.715 16.022 ( -4.520 -0.882 1.298) 4.785 16.022 ( -4.520 0.882 1.298) 4.785 16.129 ( -2.956 -2.423 -0.213) 3.828 16.129 ( -2.956 2.423 -0.213) 3.828 16.490 ( 0.474 -2.749 4.388) 5.200 16.490 ( 0.474 2.749 4.388) 5.200 16.766 ( 3.209 -4.895 2.109) 6.222 16.766 ( 3.209 4.895 2.109) 6.222 19.778 ( -6.656 -11.432 31.650) 34.304 19.778 ( -6.656 11.432 31.650) 34.304 20.695 ( -2.932 -3.724 22.529) 23.022 20.695 ( -2.932 3.724 22.529) 23.022 21.240 ( 7.980 -4.384 -36.534) 37.651 21.240 ( 7.980 4.384 -36.534) 37.651 21.690 ( 10.504 -1.567 -28.842) 30.735 21.690 ( 10.504 1.567 -28.842) 30.735 24.842 ( -4.606 -1.133 -7.095) 8.534 24.842 ( -4.606 1.133 -7.095) 8.534 25.010 ( -11.044 -2.018 4.999) 12.289 25.010 ( -11.044 2.018 4.999) 12.289 26.236 ( 3.233 -3.109 16.178) 16.788 26.236 ( 3.233 3.109 16.178) 16.788 27.141 ( 5.597 -1.505 -17.060) 18.017 27.141 ( 5.597 1.505 -17.060) 18.017 29.452 ( -1.793 -7.538 -2.066) 8.019 29.452 ( -1.793 7.538 -2.066) 8.019 29.713 ( 2.558 -7.226 2.462) 8.051 29.713 ( 2.558 7.226 2.462) 8.051 30.495 ( -0.856 -6.762 5.808) 8.955 30.495 ( -0.856 6.762 5.808) 8.955 30.889 ( -4.419 -10.404 -4.810) 12.284 30.889 ( -4.419 10.404 -4.810) 12.284 31.402 ( -1.613 -7.479 12.539) 14.689 31.402 ( -1.613 7.479 12.539) 14.689 31.574 ( -0.564 -5.407 5.008) 7.392 31.574 ( -0.564 5.407 5.008) 7.392 32.213 ( 0.164 -4.934 6.265) 7.976 32.213 ( 0.164 4.934 6.265) 7.976 32.789 ( 3.906 -8.395 -12.305) 15.399 32.789 ( 3.906 8.395 -12.305) 15.399 ======================= Grid point 217 (113/128) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 64 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.454 ( 8.913 0.000 -6.754) 11.183 3.454 ( -8.913 0.000 6.754) 11.183 3.551 ( 6.593 0.000 -7.455) 9.952 3.551 ( -6.593 0.000 7.455) 9.952 3.876 ( -5.134 0.000 -3.042) 5.967 3.876 ( 5.134 0.000 3.042) 5.967 4.180 ( 4.456 0.000 -4.830) 6.572 4.180 ( -4.456 0.000 4.830) 6.572 4.600 ( -9.784 0.000 2.826) 10.184 4.600 ( 9.784 0.000 -2.826) 10.184 5.025 ( 0.813 0.000 -8.119) 8.160 5.025 ( -0.813 0.000 8.119) 8.160 5.262 ( -3.980 0.000 0.136) 3.982 5.262 ( 3.980 0.000 -0.136) 3.982 5.507 ( 9.270 0.000 -3.768) 10.007 5.507 ( -9.270 0.000 3.768) 10.007 5.713 ( 8.247 0.000 -7.503) 11.150 5.713 ( -8.247 0.000 7.503) 11.150 6.234 ( -5.514 0.000 -8.590) 10.207 6.234 ( 5.514 0.000 8.590) 10.207 6.725 ( 9.865 0.000 -3.470) 10.457 6.725 ( -9.865 0.000 3.470) 10.457 7.037 ( 5.168 0.000 -7.264) 8.915 7.037 ( -5.168 0.000 7.264) 8.915 7.186 ( -6.139 0.000 -0.740) 6.184 7.186 ( 6.139 0.000 0.740) 6.184 7.438 ( -3.476 0.000 -3.083) 4.646 7.438 ( 3.476 0.000 3.083) 4.646 7.625 ( -1.706 0.000 0.345) 1.741 7.625 ( 1.706 0.000 -0.345) 1.741 7.738 ( 2.290 0.000 -17.358) 17.509 7.738 ( -2.290 0.000 17.358) 17.509 8.007 ( 1.855 0.000 -22.806) 22.882 8.007 ( -1.855 0.000 22.806) 22.882 8.403 ( 2.728 0.000 -2.136) 3.465 8.403 ( -2.728 0.000 2.136) 3.465 8.575 ( -0.388 0.000 -29.339) 29.342 8.575 ( 0.388 0.000 29.339) 29.342 8.708 ( -6.901 0.000 -3.368) 7.679 8.708 ( 6.901 0.000 3.368) 7.679 9.222 ( 11.796 0.000 -18.070) 21.580 9.222 ( -11.796 0.000 18.070) 21.580 9.261 ( -1.427 0.000 -5.154) 5.348 9.261 ( 1.427 0.000 5.154) 5.348 9.355 ( -2.759 0.000 -0.024) 2.759 9.355 ( 2.759 0.000 0.024) 2.759 9.605 ( 0.459 0.000 -16.580) 16.586 9.605 ( -0.459 0.000 16.580) 16.586 9.661 ( 8.463 0.000 -23.399) 24.882 9.661 ( -8.463 0.000 23.399) 24.882 10.275 ( -7.620 0.000 -6.065) 9.739 10.275 ( 7.620 0.000 6.065) 9.739 10.455 ( 1.497 0.000 -1.039) 1.823 10.455 ( -1.497 0.000 1.039) 1.823 10.547 ( 11.630 0.000 -15.360) 19.266 10.547 ( -11.630 0.000 15.360) 19.266 10.664 ( -11.604 0.000 3.821) 12.217 10.664 ( 11.604 0.000 -3.821) 12.217 11.135 ( -11.446 0.000 -5.010) 12.494 11.135 ( 11.446 0.000 5.010) 12.494 11.753 ( -1.309 0.000 -2.861) 3.147 11.753 ( 1.309 0.000 2.861) 3.147 12.265 ( 3.592 0.000 -13.612) 14.078 12.265 ( -3.592 0.000 13.612) 14.078 12.456 ( 10.665 0.000 -8.568) 13.680 12.456 ( -10.664 0.000 8.568) 13.680 12.510 ( -1.302 0.000 -5.879) 6.021 12.510 ( 1.302 0.000 5.879) 6.021 13.012 ( 5.311 0.000 -10.333) 11.618 13.012 ( -5.311 0.000 10.333) 11.618 13.334 ( 2.524 0.000 -4.962) 5.567 13.334 ( -2.524 0.000 4.962) 5.567 13.720 ( -1.160 0.000 -6.969) 7.065 13.720 ( 1.160 0.000 6.969) 7.065 14.035 ( 5.537 0.000 -5.684) 7.935 14.035 ( -5.537 0.000 5.684) 7.935 14.876 ( -0.510 0.000 -8.315) 8.330 14.876 ( 0.510 0.000 8.315) 8.330 15.127 ( -3.356 0.000 0.409) 3.381 15.127 ( 3.356 0.000 -0.409) 3.381 15.853 ( -5.417 0.000 1.206) 5.550 15.853 ( 5.417 0.000 -1.206) 5.550 16.102 ( 7.562 0.000 -4.578) 8.839 16.102 ( -7.562 0.000 4.578) 8.840 16.492 ( -0.721 0.000 -0.235) 0.759 16.492 ( 0.721 0.000 0.235) 0.759 17.129 ( -2.132 0.000 -6.617) 6.952 17.129 ( 2.132 0.000 6.617) 6.952 19.938 ( 4.559 0.000 -38.935) 39.201 19.938 ( -4.559 0.000 38.935) 39.201 20.578 ( 18.045 0.000 -30.956) 35.831 20.578 ( -18.045 0.000 30.956) 35.831 21.262 ( 2.781 0.000 -28.780) 28.914 21.262 ( -2.781 0.000 28.780) 28.914 21.372 ( 11.864 0.000 -27.064) 29.550 21.372 ( -11.864 0.000 27.064) 29.550 24.802 ( 9.938 0.000 -4.130) 10.762 24.802 ( -9.938 0.000 4.130) 10.762 24.871 ( -15.671 0.000 4.745) 16.374 24.871 ( 15.671 0.000 -4.745) 16.374 26.646 ( -0.890 0.000 -21.629) 21.648 26.646 ( 0.890 0.000 21.629) 21.648 26.867 ( -4.787 0.000 -16.962) 17.625 26.867 ( 4.787 0.000 16.962) 17.625 29.246 ( -4.547 0.000 -4.476) 6.381 29.246 ( 4.547 0.000 4.476) 6.381 29.760 ( -6.036 0.000 -2.386) 6.491 29.760 ( 6.036 0.000 2.386) 6.491 30.432 ( -13.260 0.000 2.590) 13.510 30.432 ( 13.260 0.000 -2.590) 13.510 30.925 ( -10.588 0.000 -3.062) 11.022 30.925 ( 10.588 0.000 3.062) 11.022 31.292 ( 0.642 0.000 -5.041) 5.082 31.292 ( -0.642 0.000 5.041) 5.082 31.924 ( -8.984 0.000 -3.308) 9.574 31.924 ( 8.984 0.000 3.308) 9.574 32.183 ( -1.384 0.000 -9.296) 9.398 32.183 ( 1.384 0.000 9.296) 9.398 32.771 ( -5.376 0.000 -11.508) 12.701 32.771 ( 5.376 0.000 11.508) 12.701 ======================= Grid point 219 (114/128) ======================= q-point: ( 0.17 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.271 ( -3.889 0.000 -12.348) 12.946 3.453 ( 3.605 0.000 -23.021) 23.302 3.563 ( -3.203 0.000 17.956) 18.240 3.644 ( -0.198 0.000 -20.678) 20.679 3.942 ( 12.218 0.000 20.361) 23.745 3.949 ( 0.436 0.000 3.346) 3.375 4.150 ( -2.589 0.000 15.037) 15.258 4.224 ( 0.324 0.000 -3.690) 3.705 4.422 ( -9.778 0.000 4.698) 10.848 4.721 ( 3.982 0.000 -2.745) 4.836 5.044 ( 4.599 0.000 -8.696) 9.837 5.063 ( 0.330 0.000 4.921) 4.932 5.197 ( -0.406 0.000 -0.899) 0.986 5.220 ( -8.663 0.000 -2.059) 8.905 5.331 ( -6.615 0.000 0.631) 6.645 5.537 ( 1.743 0.000 5.990) 6.238 5.773 ( 4.023 0.000 0.930) 4.129 5.852 ( 5.139 0.000 -6.007) 7.905 6.100 ( -5.260 0.000 -1.022) 5.359 6.331 ( -0.018 0.000 12.838) 12.838 6.602 ( -3.040 0.000 7.642) 8.225 6.845 ( 5.823 0.000 -7.341) 9.370 7.029 ( -3.285 0.000 5.582) 6.477 7.126 ( 2.717 0.000 0.368) 2.742 7.168 ( 6.158 0.000 -6.165) 8.714 7.322 ( 7.518 0.000 -2.924) 8.067 7.363 ( 3.448 0.000 -9.281) 9.901 7.466 ( 1.408 0.000 -5.946) 6.111 7.659 ( 3.469 0.000 4.752) 5.884 7.702 ( 6.245 0.000 -0.213) 6.249 7.777 ( 8.314 0.000 -12.142) 14.716 7.822 ( 2.867 0.000 16.357) 16.606 7.963 ( 2.620 0.000 -17.817) 18.008 8.068 ( -1.175 0.000 20.728) 20.761 8.336 ( -4.771 0.000 2.313) 5.302 8.366 ( -5.790 0.000 -8.388) 10.192 8.477 ( 3.993 0.000 -22.837) 23.184 8.664 ( 3.947 0.000 -7.467) 8.446 8.695 ( 2.066 0.000 21.665) 21.763 8.885 ( 8.425 0.000 6.536) 10.663 9.068 ( -11.680 0.000 15.889) 19.720 9.197 ( -1.962 0.000 -6.353) 6.649 9.287 ( -2.221 0.000 -0.103) 2.224 9.327 ( 3.104 0.000 7.005) 7.662 9.388 ( 10.071 0.000 -20.302) 22.663 9.401 ( -0.035 0.000 1.348) 1.349 9.502 ( -17.080 0.000 20.844) 26.948 9.534 ( -2.137 0.000 -14.637) 14.792 9.646 ( 2.954 0.000 -22.346) 22.541 9.646 ( -3.043 0.000 17.475) 17.738 10.060 ( -11.992 0.000 -5.064) 13.017 10.296 ( -11.412 0.000 4.193) 12.158 10.335 ( -9.250 0.000 8.350) 12.461 10.434 ( -3.698 0.000 11.568) 12.145 10.467 ( -0.219 0.000 0.553) 0.595 10.613 ( 1.737 0.000 6.883) 7.099 10.632 ( 6.034 0.000 -20.129) 21.013 10.841 ( -0.787 0.000 -0.651) 1.021 10.966 ( 3.331 0.000 -5.008) 6.014 11.328 ( 6.910 0.000 1.402) 7.050 11.721 ( -0.631 0.000 -1.893) 1.995 11.770 ( -0.416 0.000 1.519) 1.575 12.199 ( -10.855 0.000 3.227) 11.324 12.337 ( 8.441 0.000 -14.670) 16.925 12.373 ( 3.000 0.000 19.670) 19.897 12.379 ( -4.294 0.000 -4.026) 5.886 12.617 ( 4.730 0.000 8.067) 9.352 12.667 ( 9.560 0.000 -4.723) 10.663 12.928 ( -7.848 0.000 8.330) 11.445 13.032 ( 1.856 0.000 -12.291) 12.430 13.276 ( -6.236 0.000 7.921) 10.081 13.331 ( -0.711 0.000 -2.548) 2.645 13.708 ( 2.849 0.000 -10.219) 10.609 13.806 ( 4.563 0.000 4.755) 6.590 13.960 ( -4.676 0.000 6.004) 7.610 14.103 ( 3.972 0.000 -5.086) 6.453 14.829 ( -0.872 0.000 -7.827) 7.876 14.903 ( -1.209 0.000 6.881) 6.986 15.046 ( -4.624 0.000 0.887) 4.709 15.113 ( -4.989 0.000 -1.176) 5.126 15.810 ( 0.041 0.000 2.819) 2.819 15.970 ( 7.053 0.000 -0.332) 7.061 16.056 ( 1.841 0.000 5.837) 6.121 16.201 ( 2.945 0.000 -3.548) 4.611 16.476 ( -1.068 0.000 -1.248) 1.643 16.543 ( 6.464 0.000 -1.762) 6.700 17.011 ( -8.013 0.000 -5.358) 9.639 17.139 ( -3.949 0.000 6.857) 7.913 19.894 ( 7.539 0.000 -38.048) 38.788 20.045 ( -0.859 0.000 39.701) 39.710 20.351 ( -20.248 0.000 33.035) 38.747 20.737 ( 12.954 0.000 -30.639) 33.265 21.144 ( -3.691 0.000 -29.136) 29.369 21.232 ( -13.644 0.000 26.647) 29.937 21.318 ( -4.444 0.000 28.910) 29.249 21.444 ( 8.199 0.000 -28.735) 29.882 24.710 ( -1.512 0.000 5.117) 5.335 24.775 ( 3.449 0.000 6.414) 7.283 25.025 ( 14.945 0.000 -6.868) 16.448 25.188 ( 19.095 0.000 -7.277) 20.434 26.506 ( -4.674 0.000 -19.758) 20.303 26.689 ( -5.438 0.000 -17.120) 17.963 26.699 ( -4.546 0.000 20.565) 21.061 26.952 ( -3.410 0.000 16.264) 16.617 29.176 ( -1.150 0.000 -3.722) 3.896 29.352 ( 3.705 0.000 3.238) 4.920 29.664 ( -2.123 0.000 0.871) 2.295 29.870 ( 4.455 0.000 3.417) 5.614 30.230 ( -8.763 0.000 -0.561) 8.781 30.564 ( -3.867 0.000 -6.003) 7.141 30.840 ( 8.955 0.000 -3.340) 9.558 31.138 ( 10.479 0.000 4.546) 11.422 31.287 ( 0.864 0.000 -3.878) 3.973 31.302 ( -0.557 0.000 4.901) 4.933 31.766 ( -6.029 0.000 -5.855) 8.404 32.071 ( -0.154 0.000 -11.802) 11.803 32.116 ( 4.163 0.000 2.811) 5.023 32.208 ( -2.505 0.000 8.559) 8.918 32.606 ( -7.405 0.000 -6.214) 9.667 32.862 ( -1.238 0.000 13.208) 13.266 ======================= Grid point 220 (115/128) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.254 ( 5.916 0.000 -6.747) 8.973 3.441 ( 4.360 0.000 -18.379) 18.889 3.529 ( -3.118 0.000 -15.791) 16.096 3.535 ( -6.434 0.000 13.732) 15.164 3.948 ( -1.585 0.000 5.244) 5.479 4.097 ( -9.205 0.000 -4.081) 10.070 4.185 ( -1.548 0.000 18.448) 18.513 4.221 ( 7.136 0.000 1.259) 7.246 4.394 ( 5.417 0.000 8.458) 10.044 4.708 ( -3.501 0.000 -3.813) 5.177 5.020 ( -5.614 0.000 1.040) 5.709 5.028 ( -2.880 0.000 -3.574) 4.590 5.170 ( 6.612 0.000 -2.958) 7.244 5.278 ( 8.337 0.000 -1.290) 8.436 5.313 ( 0.879 0.000 5.669) 5.737 5.588 ( -2.588 0.000 4.589) 5.269 5.764 ( -1.337 0.000 -0.110) 1.342 5.829 ( -1.284 0.000 -10.516) 10.594 6.073 ( 0.741 0.000 3.432) 3.511 6.296 ( -9.151 0.000 11.004) 14.312 6.715 ( 8.558 0.000 11.037) 13.966 6.900 ( 3.797 0.000 -9.556) 10.283 7.004 ( 0.717 0.000 5.410) 5.457 7.160 ( 0.711 0.000 -12.101) 12.122 7.196 ( 0.775 0.000 3.554) 3.637 7.274 ( -3.358 0.000 -12.418) 12.864 7.493 ( 4.467 0.000 -4.589) 6.404 7.557 ( 6.356 0.000 3.698) 7.353 7.759 ( 3.817 0.000 10.938) 11.585 7.831 ( 7.478 0.000 -1.539) 7.635 7.887 ( 5.346 0.000 -11.968) 13.108 7.927 ( 2.730 0.000 9.007) 9.412 8.026 ( 14.066 0.000 -9.686) 17.078 8.093 ( -3.285 0.000 5.427) 6.344 8.215 ( -5.164 0.000 -10.686) 11.869 8.305 ( -1.219 0.000 13.448) 13.503 8.499 ( 8.037 0.000 -22.505) 23.897 8.763 ( 9.178 0.000 -5.931) 10.928 8.786 ( -3.166 0.000 11.398) 11.830 8.948 ( -6.767 0.000 21.424) 22.468 9.036 ( 5.885 0.000 -2.361) 6.341 9.150 ( -0.658 0.000 -7.139) 7.170 9.185 ( -20.061 0.000 23.863) 31.175 9.223 ( -3.742 0.000 -1.118) 3.905 9.354 ( -3.982 0.000 -28.241) 28.520 9.365 ( -8.398 0.000 15.938) 18.015 9.466 ( 4.058 0.000 -11.746) 12.427 9.471 ( 5.662 0.000 3.517) 6.665 9.622 ( -5.779 0.000 10.949) 12.381 9.690 ( 6.123 0.000 -10.044) 11.764 9.855 ( -4.431 0.000 -10.671) 11.554 10.088 ( -10.686 0.000 3.805) 11.343 10.253 ( -3.935 0.000 12.030) 12.657 10.428 ( -4.508 0.000 -1.917) 4.899 10.450 ( 0.438 0.000 12.153) 12.161 10.619 ( 0.612 0.000 -12.222) 12.238 10.663 ( -0.351 0.000 6.472) 6.481 10.713 ( -4.195 0.000 -11.790) 12.514 11.128 ( 9.257 0.000 0.829) 9.294 11.370 ( -2.535 0.000 0.992) 2.722 11.708 ( -0.515 0.000 0.598) 0.789 11.756 ( -1.139 0.000 -1.061) 1.557 12.086 ( -1.404 0.000 1.017) 1.734 12.236 ( -6.178 0.000 -5.024) 7.963 12.493 ( 10.169 0.000 -7.940) 12.901 12.578 ( 8.941 0.000 18.068) 20.160 12.739 ( 4.665 0.000 9.282) 10.389 12.783 ( 5.768 0.000 -5.322) 7.848 12.808 ( -7.889 0.000 6.680) 10.337 12.981 ( -1.723 0.000 -13.918) 14.025 13.193 ( -5.980 0.000 9.649) 11.352 13.282 ( -3.886 0.000 -4.059) 5.619 13.724 ( 3.798 0.000 -11.707) 12.308 13.830 ( -4.846 0.000 7.334) 8.790 13.985 ( 4.922 0.000 3.621) 6.110 14.126 ( 0.396 0.000 -4.237) 4.255 14.792 ( 0.093 0.000 -5.307) 5.308 14.873 ( -4.654 0.000 3.380) 5.752 14.987 ( -2.172 0.000 0.587) 2.250 15.002 ( -4.231 0.000 -0.368) 4.247 15.864 ( 4.048 0.000 4.232) 5.856 16.056 ( 0.236 0.000 -0.994) 1.022 16.201 ( 8.707 0.000 7.401) 11.427 16.206 ( 2.286 0.000 -2.683) 3.524 16.447 ( -0.216 0.000 -2.763) 2.771 16.701 ( 10.937 0.000 -4.080) 11.673 16.806 ( -12.168 0.000 -3.380) 12.628 17.048 ( -8.603 0.000 5.989) 10.482 19.906 ( 10.468 0.000 -37.159) 38.605 20.125 ( -16.794 0.000 34.172) 38.076 20.242 ( 2.629 0.000 41.264) 41.347 20.773 ( 1.480 0.000 -36.827) 36.857 20.943 ( -0.197 0.000 -26.269) 26.269 21.090 ( -13.015 0.000 25.548) 28.673 21.360 ( -4.127 0.000 30.117) 30.398 21.445 ( 5.215 0.000 -29.858) 30.310 24.822 ( 9.560 0.000 9.446) 13.440 24.982 ( 13.871 0.000 10.570) 17.439 25.187 ( 4.082 0.000 -10.925) 11.663 25.397 ( 5.754 0.000 -12.724) 13.964 26.389 ( 2.166 0.000 -14.776) 14.934 26.599 ( 4.175 0.000 -16.488) 17.008 26.641 ( -10.286 0.000 17.609) 20.393 26.874 ( -11.415 0.000 15.297) 19.087 29.176 ( 2.420 0.000 -2.366) 3.385 29.338 ( -4.871 0.000 -0.098) 4.872 29.761 ( 9.902 0.000 6.129) 11.646 29.945 ( 2.240 0.000 3.283) 3.974 30.114 ( -3.475 0.000 -2.197) 4.111 30.353 ( -12.885 0.000 -5.915) 14.178 31.084 ( 15.677 0.000 -6.746) 17.067 31.292 ( 1.823 0.000 -3.992) 4.388 31.308 ( -0.676 0.000 3.645) 3.707 31.312 ( 3.467 0.000 8.987) 9.633 31.680 ( 0.284 0.000 -5.254) 5.261 31.935 ( -7.220 0.000 -8.033) 10.801 32.173 ( -3.729 0.000 5.111) 6.327 32.186 ( -1.117 0.000 -1.289) 1.706 32.547 ( 4.760 0.000 -2.222) 5.253 32.828 ( -7.629 0.000 11.136) 13.499 ======================= Grid point 221 (116/128) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 64 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.390 ( -7.933 0.000 -3.842) 8.814 3.390 ( 7.933 0.000 3.842) 8.814 3.471 ( 6.197 0.000 -14.744) 15.993 3.471 ( -6.197 0.000 14.744) 15.993 3.963 ( -1.949 0.000 -6.590) 6.872 3.963 ( 1.949 0.000 6.590) 6.872 4.233 ( 0.334 0.000 -12.260) 12.265 4.233 ( -0.334 0.000 12.260) 12.265 4.581 ( -8.105 0.000 -6.278) 10.253 4.581 ( 8.105 0.000 6.278) 10.253 4.980 ( 0.548 0.000 -6.407) 6.431 4.980 ( -0.548 0.000 6.407) 6.431 5.292 ( 6.489 0.000 -5.170) 8.297 5.292 ( -6.489 0.000 5.170) 8.297 5.453 ( -10.773 0.000 2.176) 10.991 5.453 ( 10.773 0.000 -2.176) 10.991 5.785 ( -0.510 0.000 -5.533) 5.557 5.785 ( 0.510 0.000 5.533) 5.557 6.149 ( 7.982 0.000 -3.226) 8.609 6.149 ( -7.982 0.000 3.226) 8.609 6.875 ( -2.608 0.000 -11.393) 11.687 6.875 ( 2.608 0.000 11.393) 11.687 7.118 ( -6.402 0.000 -12.378) 13.936 7.118 ( 6.402 0.000 12.378) 13.936 7.171 ( 3.570 0.000 -5.294) 6.385 7.171 ( -3.570 0.000 5.294) 6.385 7.569 ( 4.111 0.000 -2.339) 4.730 7.569 ( -4.111 0.000 2.339) 4.730 7.870 ( -2.146 0.000 -11.238) 11.441 7.870 ( 2.146 0.000 11.238) 11.441 7.946 ( 5.519 0.000 -4.367) 7.038 7.946 ( -5.519 0.000 4.367) 7.038 8.079 ( -3.212 0.000 -2.939) 4.354 8.079 ( 3.212 0.000 2.939) 4.354 8.286 ( 11.648 0.000 -17.208) 20.779 8.286 ( -11.648 0.000 17.208) 20.779 8.621 ( 13.941 0.000 -11.276) 17.930 8.621 ( -13.941 0.000 11.276) 17.930 8.908 ( 9.382 0.000 -12.529) 15.652 8.908 ( -9.382 0.000 12.529) 15.652 9.077 ( -3.441 0.000 -5.779) 6.726 9.077 ( 3.441 0.000 5.779) 6.726 9.147 ( -1.415 0.000 -18.351) 18.405 9.147 ( 1.415 0.000 18.351) 18.405 9.257 ( 6.687 0.000 -16.615) 17.910 9.257 ( -6.687 0.000 16.615) 17.910 9.527 ( 6.947 0.000 -11.036) 13.041 9.527 ( -6.947 0.000 11.036) 13.041 9.619 ( -6.847 0.000 -1.954) 7.121 9.619 ( 6.847 0.000 1.954) 7.121 9.922 ( 11.775 0.000 -13.517) 17.927 9.922 ( -11.775 0.000 13.517) 17.927 10.309 ( -5.098 0.000 -6.095) 7.946 10.309 ( 5.098 0.000 6.095) 7.946 10.542 ( -4.167 0.000 -9.399) 10.282 10.542 ( 4.167 0.000 9.399) 10.282 10.659 ( 2.954 0.000 -11.299) 11.678 10.659 ( -2.954 0.000 11.299) 11.678 11.277 ( -7.020 0.000 0.264) 7.025 11.277 ( 7.020 0.000 -0.264) 7.025 11.723 ( -1.337 0.000 -2.544) 2.875 11.723 ( 1.337 0.000 2.544) 2.875 12.125 ( -4.358 0.000 -0.928) 4.456 12.125 ( 4.358 0.000 0.928) 4.456 12.636 ( 8.417 0.000 -7.443) 11.236 12.636 ( -8.417 0.000 7.443) 11.236 12.813 ( -1.311 0.000 -7.463) 7.577 12.813 ( 1.311 0.000 7.463) 7.577 12.860 ( -4.717 0.000 -14.284) 15.042 12.860 ( 4.717 0.000 14.284) 15.042 13.181 ( -1.726 0.000 -9.114) 9.276 13.181 ( 1.726 0.000 9.114) 9.276 13.764 ( 5.421 0.000 -9.825) 11.221 13.764 ( -5.421 0.000 9.825) 11.221 14.082 ( -3.449 0.000 -3.383) 4.831 14.082 ( 3.449 0.000 3.383) 4.831 14.803 ( 3.047 0.000 -2.514) 3.950 14.803 ( -3.047 0.000 2.514) 3.950 14.969 ( 0.230 0.000 -0.481) 0.533 14.969 ( -0.230 0.000 0.481) 0.533 15.975 ( -5.832 0.000 -3.384) 6.743 15.975 ( 5.832 0.000 3.384) 6.743 16.273 ( 3.868 0.000 -3.800) 5.423 16.273 ( -3.868 0.000 3.800) 5.423 16.557 ( -12.611 0.000 -1.067) 12.656 16.557 ( 12.611 0.000 1.067) 12.656 16.889 ( 10.911 0.000 -4.675) 11.870 16.889 ( -10.911 0.000 4.675) 11.870 19.980 ( 13.989 0.000 -36.043) 38.663 19.980 ( -13.989 0.000 36.043) 38.663 20.510 ( -7.706 0.000 -40.467) 41.194 20.510 ( 7.706 0.000 40.467) 41.194 20.974 ( 10.709 0.000 -25.224) 27.403 20.974 ( -10.709 0.000 25.224) 27.403 21.407 ( 4.155 0.000 -30.328) 30.611 21.407 ( -4.155 0.000 30.328) 30.611 25.066 ( -10.183 0.000 -12.069) 15.791 25.066 ( 10.183 0.000 12.069) 15.791 25.279 ( -10.768 0.000 -14.558) 18.108 25.279 ( 10.768 0.000 14.558) 18.108 26.485 ( 12.446 0.000 -13.864) 18.631 26.485 ( -12.446 0.000 13.864) 18.631 26.703 ( 12.754 0.000 -15.397) 19.993 26.703 ( -12.754 0.000 15.397) 19.993 29.240 ( -5.115 0.000 0.727) 5.166 29.240 ( 5.115 0.000 -0.727) 5.166 29.953 ( -4.488 0.000 -1.693) 4.797 29.953 ( 4.488 0.000 1.693) 4.797 30.120 ( -7.478 0.000 -2.099) 7.767 30.120 ( 7.478 0.000 2.099) 7.767 31.291 ( 9.147 0.000 -7.499) 11.828 31.291 ( -9.147 0.000 7.499) 11.828 31.304 ( 1.073 0.000 -2.368) 2.599 31.304 ( -1.073 0.000 2.368) 2.599 31.765 ( -8.296 0.000 -2.354) 8.623 31.765 ( 8.296 0.000 2.354) 8.623 32.147 ( -0.390 0.000 -1.023) 1.095 32.147 ( 0.390 0.000 1.023) 1.095 32.691 ( 10.587 0.000 -6.554) 12.451 32.691 ( -10.587 0.000 6.554) 12.451 ======================= Grid point 225 (117/128) ======================= q-point: ( 0.00 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.380 ( -2.588 -5.764 -10.670) 12.401 3.380 ( 2.588 -5.764 10.670) 12.401 3.590 ( -2.897 2.560 -11.150) 11.801 3.590 ( 2.897 2.560 11.150) 11.801 3.883 ( 0.855 -0.004 -5.940) 6.002 3.883 ( -0.855 -0.004 5.940) 6.002 4.226 ( -5.032 4.904 -4.398) 8.289 4.226 ( 5.032 4.904 4.399) 8.289 4.600 ( -7.941 0.555 -6.018) 9.979 4.600 ( 7.941 0.555 6.018) 9.979 4.935 ( -4.255 -3.570 -6.758) 8.748 4.935 ( 4.255 -3.570 6.758) 8.748 5.459 ( -5.527 3.888 -1.810) 6.996 5.459 ( 5.527 3.888 1.810) 6.996 5.563 ( -2.029 14.433 -1.092) 14.616 5.563 ( 2.029 14.433 1.092) 14.616 5.755 ( 9.134 3.678 -6.282) 11.680 5.755 ( -9.134 3.678 6.282) 11.680 6.173 ( -6.084 -4.919 -8.670) 11.678 6.173 ( 6.084 -4.919 8.670) 11.678 6.720 ( -7.209 -1.925 0.033) 7.461 6.720 ( 7.209 -1.925 -0.033) 7.461 6.984 ( -1.867 -7.051 -6.388) 9.696 6.984 ( 1.867 -7.051 6.388) 9.696 7.125 ( -5.516 -0.466 -5.267) 7.641 7.125 ( 5.516 -0.466 5.267) 7.641 7.426 ( -0.203 -2.157 -3.449) 4.073 7.426 ( 0.203 -2.157 3.449) 4.073 7.701 ( -1.421 6.722 -2.878) 7.449 7.701 ( 1.421 6.722 2.878) 7.449 7.802 ( -0.530 5.103 -8.925) 10.294 7.802 ( 0.530 5.103 8.925) 10.294 8.057 ( -0.370 4.869 -14.362) 15.169 8.057 ( 0.370 4.869 14.362) 15.169 8.376 ( -4.650 -1.945 -2.841) 5.786 8.376 ( 4.650 -1.945 2.841) 5.786 8.557 ( 3.122 0.661 -19.703) 19.960 8.557 ( -3.122 0.661 19.703) 19.960 8.813 ( -3.375 7.022 -4.364) 8.930 8.813 ( 3.375 7.022 4.364) 8.930 9.152 ( 5.297 -7.061 -3.986) 9.685 9.152 ( -5.297 -7.061 3.986) 9.685 9.239 ( 6.101 -0.660 -7.793) 9.920 9.239 ( -6.101 -0.660 7.793) 9.920 9.376 ( 2.673 0.355 -6.669) 7.193 9.376 ( -2.673 0.355 6.669) 7.193 9.549 ( 2.470 -3.604 -5.845) 7.298 9.549 ( -2.470 -3.604 5.845) 7.298 9.740 ( 3.674 5.794 -5.188) 8.602 9.740 ( -3.674 5.794 5.188) 8.602 10.277 ( -3.142 0.991 -5.557) 6.460 10.277 ( 3.142 0.991 5.557) 6.460 10.439 ( 2.539 -2.274 -7.782) 8.496 10.439 ( -2.539 -2.274 7.782) 8.496 10.544 ( -1.206 -1.789 -11.506) 11.707 10.544 ( 1.206 -1.789 11.506) 11.707 10.667 ( -1.579 2.980 -4.810) 5.874 10.667 ( 1.579 2.980 4.810) 5.874 11.157 ( -8.803 1.723 -4.925) 10.233 11.157 ( 8.803 1.723 4.925) 10.233 11.651 ( -0.055 -9.663 -5.463) 11.101 11.651 ( 0.055 -9.663 5.463) 11.101 12.170 ( -1.631 -8.829 -4.582) 10.080 12.170 ( 1.631 -8.829 4.582) 10.080 12.458 ( 9.747 0.560 -7.709) 12.440 12.458 ( -9.747 0.560 7.709) 12.440 12.545 ( -7.319 2.686 -1.607) 7.960 12.545 ( 7.319 2.686 1.607) 7.960 13.022 ( 1.971 0.751 -6.746) 7.068 13.022 ( -1.971 0.751 6.746) 7.068 13.319 ( 1.380 -1.443 -3.996) 4.467 13.319 ( -1.380 -1.443 3.996) 4.467 13.751 ( -0.343 3.063 -8.617) 9.152 13.751 ( 0.343 3.063 8.617) 9.152 14.081 ( 4.529 4.397 -6.200) 8.848 14.081 ( -4.529 4.397 6.200) 8.848 14.729 ( 1.555 -12.050 -10.717) 16.201 14.729 ( -1.555 -12.050 10.717) 16.201 15.156 ( 1.139 0.762 -1.488) 2.023 15.156 ( -1.139 0.762 1.488) 2.023 15.880 ( 4.816 2.672 -1.696) 5.763 15.880 ( -4.816 2.672 1.696) 5.763 16.104 ( 6.085 -0.005 -4.780) 7.738 16.104 ( -6.085 -0.005 4.780) 7.738 16.503 ( 0.344 1.215 -1.372) 1.865 16.503 ( -0.344 1.215 1.372) 1.865 17.054 ( -2.230 -6.991 -5.442) 9.136 17.054 ( 2.230 -6.991 5.442) 9.136 20.032 ( 5.129 9.056 -39.048) 40.411 20.032 ( -5.129 9.056 39.048) 40.411 20.588 ( 16.318 0.629 -31.640) 35.606 20.588 ( -16.318 0.629 31.640) 35.606 21.230 ( 3.391 -3.104 -27.594) 27.974 21.230 ( -3.391 -3.104 27.594) 27.974 21.356 ( 11.068 -1.585 -25.545) 27.885 21.356 ( -11.068 -1.585 25.545) 27.885 24.784 ( 1.099 -1.361 -1.791) 2.503 24.784 ( -1.099 -1.361 1.791) 2.503 24.890 ( -5.399 1.456 0.511) 5.615 24.890 ( 5.399 1.456 -0.511) 5.615 26.653 ( -1.232 0.750 -20.825) 20.875 26.653 ( 1.232 0.750 20.825) 20.875 26.845 ( -4.511 -2.118 -16.588) 17.320 26.845 ( 4.511 -2.118 16.588) 17.320 29.283 ( -4.677 3.536 -3.858) 7.018 29.283 ( 4.677 3.536 3.858) 7.018 29.775 ( -6.335 1.049 -2.604) 6.929 29.775 ( 6.335 1.049 2.604) 6.929 30.448 ( -8.939 1.962 0.929) 9.199 30.448 ( 8.939 1.962 -0.929) 9.199 30.896 ( -9.508 -3.004 -3.740) 10.649 30.896 ( 9.508 -3.004 3.740) 10.649 31.330 ( 0.782 3.828 -5.318) 6.599 31.330 ( -0.782 3.828 5.318) 6.599 31.889 ( -8.730 -3.769 -1.120) 9.574 31.889 ( 8.730 -3.769 1.120) 9.574 32.201 ( -1.120 2.112 -9.287) 9.589 32.201 ( 1.120 2.112 9.287) 9.589 32.743 ( -4.522 -2.724 -11.095) 12.287 32.743 ( 4.522 -2.724 11.095) 12.287 ======================= Grid point 227 (118/128) ======================= q-point: ( 0.17 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.282 ( -0.949 0.338 -8.903) 8.959 3.462 ( 3.956 -0.686 -8.526) 9.424 3.541 ( 2.587 -2.504 -6.064) 7.052 3.630 ( -0.928 0.433 -6.142) 6.227 3.931 ( 2.074 -0.809 7.224) 7.559 3.989 ( 7.140 0.332 17.877) 19.253 4.091 ( -6.879 3.460 -1.788) 7.905 4.262 ( -5.246 0.254 2.083) 5.651 4.447 ( -3.569 2.541 -1.922) 4.784 4.767 ( 4.854 4.869 3.473) 7.702 4.851 ( -0.986 -8.869 -3.724) 9.669 5.031 ( 2.679 -3.245 6.005) 7.333 5.270 ( -7.319 -0.374 -1.355) 7.452 5.410 ( -9.414 10.345 1.716) 14.092 5.466 ( -3.650 16.425 -3.841) 17.258 5.686 ( 4.645 11.046 -0.052) 11.983 5.728 ( 1.725 -1.485 2.761) 3.578 5.878 ( 1.797 0.499 -9.344) 9.529 6.062 ( -0.478 -1.257 0.317) 1.381 6.270 ( -1.262 -5.789 12.476) 13.811 6.630 ( 0.132 1.732 7.587) 7.783 6.874 ( 5.580 2.378 -2.404) 6.524 6.956 ( 4.200 -9.989 -9.849) 14.643 7.028 ( -0.722 -1.182 5.558) 5.728 7.141 ( 7.234 -1.636 -4.185) 8.516 7.293 ( 11.259 -1.063 2.756) 11.640 7.448 ( 2.758 2.939 -2.230) 4.607 7.487 ( 6.084 -1.155 0.275) 6.198 7.700 ( 2.046 5.357 -0.881) 5.802 7.757 ( 2.714 3.767 -1.213) 4.799 7.798 ( 4.698 3.728 -4.957) 7.781 7.871 ( 2.563 3.960 6.641) 8.146 7.960 ( -1.349 1.790 -9.018) 9.293 8.129 ( 0.508 5.308 2.971) 6.104 8.279 ( -3.042 -3.193 1.292) 4.595 8.426 ( -2.917 3.140 -4.281) 6.058 8.514 ( 3.616 3.489 -18.495) 19.165 8.566 ( 0.021 -3.040 5.908) 6.645 8.801 ( 3.119 4.663 3.093) 6.406 8.929 ( 1.031 1.667 13.599) 13.740 9.040 ( -7.126 -1.524 7.470) 10.436 9.192 ( -0.501 -3.387 0.666) 3.488 9.200 ( -0.581 -4.676 1.638) 4.989 9.289 ( 1.046 -3.564 -2.332) 4.386 9.385 ( 1.278 -0.131 -8.836) 8.929 9.390 ( 0.214 -1.254 -6.831) 6.948 9.462 ( -8.664 -1.309 9.585) 12.986 9.538 ( -1.204 -3.421 -0.745) 3.703 9.677 ( 0.743 6.333 -4.815) 7.990 9.759 ( -1.381 6.307 -0.614) 6.486 10.111 ( -11.242 5.447 -1.815) 12.624 10.267 ( -6.039 -2.533 7.523) 9.974 10.308 ( -10.770 0.593 -2.217) 11.012 10.408 ( -5.631 -1.355 13.016) 14.246 10.529 ( -3.202 -1.866 0.133) 3.709 10.564 ( 7.334 1.422 -2.299) 7.816 10.691 ( 2.908 2.567 -6.846) 7.868 10.817 ( 6.601 -1.050 -0.375) 6.695 10.981 ( -4.244 2.651 -5.884) 7.724 11.304 ( 4.145 -2.520 2.524) 5.468 11.639 ( 1.061 -8.405 -3.340) 9.106 11.672 ( 0.446 -9.402 0.710) 9.439 12.059 ( -8.341 -9.341 -0.468) 12.531 12.239 ( -0.474 -11.895 1.049) 11.951 12.390 ( 0.032 1.568 14.529) 14.614 12.451 ( 1.400 5.400 -6.032) 8.216 12.608 ( 8.040 0.136 -0.055) 8.042 12.678 ( 6.438 0.707 -1.433) 6.634 12.931 ( -6.018 0.024 0.716) 6.060 13.054 ( 0.470 1.602 -4.076) 4.405 13.271 ( -4.705 -0.868 5.713) 7.452 13.320 ( -1.348 -0.683 0.221) 1.527 13.742 ( 3.276 3.389 -9.183) 10.322 13.839 ( 5.252 2.618 4.843) 7.609 14.017 ( -5.047 6.000 6.084) 9.924 14.133 ( 3.462 2.805 -5.969) 7.448 14.715 ( 1.470 -10.331 -9.511) 14.119 14.749 ( -0.585 -11.392 9.785) 15.029 15.070 ( -7.499 -0.578 0.416) 7.532 15.129 ( -3.764 0.778 -2.257) 4.457 15.843 ( -0.057 3.116 3.426) 4.631 15.981 ( 5.670 1.228 -0.098) 5.803 16.070 ( 2.515 1.083 5.160) 5.841 16.208 ( 4.155 0.486 -3.922) 5.734 16.490 ( -1.152 1.411 -0.837) 2.004 16.534 ( 4.548 -0.711 -1.246) 4.769 16.944 ( -7.448 -6.147 -4.677) 10.730 17.066 ( -3.262 -6.893 5.431) 9.362 19.992 ( 7.317 9.391 -37.103) 38.966 20.127 ( -1.632 7.847 38.644) 39.466 20.393 ( -18.622 3.896 33.331) 38.379 20.718 ( 11.703 -2.247 -31.220) 33.417 21.132 ( -2.929 -1.084 -24.778) 24.974 21.217 ( -11.727 -1.488 23.303) 26.130 21.280 ( -5.429 -3.505 27.354) 28.107 21.419 ( 7.607 -2.457 -28.264) 29.373 24.709 ( -1.074 -0.014 5.063) 5.175 24.765 ( 3.192 -0.956 6.122) 6.970 25.040 ( 14.771 1.450 -6.669) 16.271 25.180 ( 18.465 -0.838 -7.066) 19.789 26.509 ( -4.889 0.424 -19.241) 19.857 26.662 ( -5.360 -2.180 -12.859) 14.101 26.718 ( -4.530 1.386 16.066) 16.750 26.926 ( -3.431 -2.476 16.143) 16.688 29.214 ( -1.184 3.766 -3.043) 4.984 29.395 ( 4.698 4.030 2.962) 6.862 29.660 ( -3.933 -0.473 -0.140) 3.964 29.885 ( 4.208 0.524 2.871) 5.121 30.272 ( -7.457 4.866 0.245) 8.907 30.571 ( -3.312 1.064 -5.056) 6.138 30.809 ( 7.680 -3.196 -3.276) 8.941 31.088 ( 8.682 -4.777 5.426) 11.298 31.329 ( 1.167 3.898 -2.980) 5.043 31.348 ( 0.946 4.569 2.358) 5.228 31.741 ( -5.885 -2.571 -4.203) 7.676 32.024 ( 4.045 -5.158 -9.717) 11.721 32.139 ( 0.061 2.655 -0.978) 2.830 32.225 ( -2.642 1.794 9.087) 9.632 32.595 ( -6.619 -0.972 -5.844) 8.884 32.823 ( -1.480 -3.883 12.556) 13.226 ======================= Grid point 228 (119/128) ======================= q-point: ( 0.33 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.301 ( 5.740 3.410 -4.605) 8.110 3.480 ( 3.077 1.657 -14.730) 15.139 3.560 ( 1.053 4.157 -10.432) 11.279 3.598 ( -0.366 3.253 5.955) 6.795 3.928 ( -4.643 2.414 2.181) 5.669 4.023 ( 0.459 -9.218 8.014) 12.223 4.064 ( -9.848 -4.388 1.024) 10.830 4.190 ( -1.085 0.806 4.284) 4.492 4.464 ( 7.098 1.659 3.594) 8.127 4.761 ( -2.844 2.036 1.082) 3.661 4.903 ( 3.762 -6.759 -0.692) 7.766 5.047 ( -4.216 -1.762 5.252) 6.961 5.223 ( 2.618 4.755 -3.940) 6.707 5.308 ( -1.627 3.922 2.792) 5.081 5.420 ( -0.600 6.887 0.374) 6.924 5.641 ( -7.927 0.826 -2.636) 8.394 5.765 ( 2.307 1.142 0.400) 2.605 5.840 ( 0.509 4.454 -7.116) 8.410 6.105 ( 2.278 2.992 0.376) 3.779 6.225 ( -6.994 -6.239 9.218) 13.146 6.770 ( 7.842 4.698 11.116) 14.392 6.920 ( 1.602 2.704 -4.721) 5.671 7.003 ( 4.660 1.275 -1.038) 4.941 7.090 ( 2.620 -3.625 1.610) 4.754 7.225 ( 6.030 4.345 -6.645) 9.970 7.450 ( 1.254 8.749 -3.468) 9.495 7.505 ( 5.959 0.942 -4.040) 7.261 7.590 ( -0.090 4.172 1.556) 4.454 7.734 ( 2.712 -1.801 5.448) 6.346 7.815 ( 1.422 -4.959 5.570) 7.592 7.864 ( 4.660 0.350 -7.115) 8.512 7.949 ( 9.938 4.573 -4.710) 11.911 8.029 ( 6.221 0.283 2.204) 6.606 8.130 ( 3.430 4.012 -6.602) 8.453 8.255 ( -4.770 2.372 2.594) 5.925 8.324 ( -1.163 1.848 -4.140) 4.681 8.511 ( 3.555 0.478 -13.200) 13.678 8.642 ( 3.803 -3.773 1.897) 5.683 8.862 ( -7.443 -4.150 18.718) 20.567 8.900 ( 2.767 -0.129 1.632) 3.215 9.031 ( -0.626 -1.584 -3.032) 3.478 9.144 ( -8.507 -3.577 7.636) 11.978 9.166 ( -13.004 -0.520 9.946) 16.379 9.197 ( -2.261 0.650 -3.597) 4.298 9.251 ( 0.779 -5.268 -12.902) 13.958 9.376 ( -2.825 0.760 9.400) 9.845 9.472 ( 5.145 0.823 -11.493) 12.619 9.531 ( 0.234 1.238 2.381) 2.694 9.703 ( -3.707 6.778 0.429) 7.737 9.758 ( 9.911 2.529 -8.271) 13.155 9.895 ( -11.226 6.289 -1.092) 12.914 10.082 ( -10.638 -0.684 4.207) 11.460 10.260 ( 0.668 2.439 2.955) 3.889 10.369 ( -5.244 -0.068 16.329) 17.150 10.461 ( -2.025 -3.936 -5.508) 7.066 10.619 ( -3.421 -1.244 -7.593) 8.421 10.700 ( 1.790 5.449 4.684) 7.405 10.792 ( -0.388 6.535 -9.306) 11.379 11.066 ( 9.057 -5.216 -0.974) 10.497 11.319 ( -3.405 -4.565 2.878) 6.381 11.643 ( -0.113 -7.690 -1.179) 7.781 11.666 ( -1.339 -7.365 -0.997) 7.552 11.938 ( -1.554 -12.338 -1.102) 12.484 12.141 ( -8.611 -10.546 2.012) 13.763 12.510 ( 8.310 2.160 -3.775) 9.379 12.588 ( 9.738 -0.214 11.167) 14.818 12.732 ( 0.960 -1.277 0.605) 1.708 12.753 ( 4.030 -0.105 4.187) 5.813 12.846 ( -0.726 1.898 -3.292) 3.869 13.003 ( -3.787 1.213 -6.808) 7.884 13.207 ( -4.813 0.788 7.908) 9.291 13.273 ( -3.671 -0.110 -1.415) 3.936 13.779 ( 4.893 5.225 -10.201) 12.462 13.910 ( -3.656 7.205 6.101) 10.124 13.995 ( 3.592 1.490 4.846) 6.214 14.146 ( 0.126 1.877 -5.231) 5.559 14.713 ( 2.140 -7.394 -6.578) 10.126 14.785 ( -0.268 -7.772 8.007) 11.161 14.924 ( -6.342 -3.349 -0.013) 7.172 15.031 ( -5.268 -0.546 -3.331) 6.257 15.897 ( 3.875 3.058 4.474) 6.662 16.065 ( 1.557 0.869 -0.695) 1.914 16.192 ( 5.266 -0.368 5.837) 7.870 16.233 ( 3.823 1.884 -2.680) 5.034 16.460 ( -0.785 1.256 -1.646) 2.214 16.665 ( 9.803 -3.569 -2.734) 10.785 16.756 ( -10.998 -4.321 -3.748) 12.397 16.985 ( -7.701 -6.096 4.719) 10.896 20.001 ( 9.931 9.042 -36.480) 38.874 20.191 ( -15.430 6.321 33.930) 37.806 20.303 ( 1.066 5.771 40.763) 41.184 20.741 ( 3.325 -3.323 -36.316) 36.619 20.965 ( -1.055 2.047 -23.826) 23.937 21.081 ( -12.209 -0.650 22.390) 25.510 21.314 ( -4.115 -4.619 29.863) 30.497 21.411 ( 4.615 -3.450 -29.658) 30.212 24.826 ( 9.768 0.475 9.276) 13.479 24.963 ( 13.358 -1.885 9.944) 16.759 25.202 ( 4.094 1.402 -10.622) 11.469 25.381 ( 5.366 -1.570 -12.366) 13.571 26.394 ( 2.246 0.548 -14.470) 14.654 26.571 ( 3.100 -2.487 -14.108) 14.657 26.657 ( -9.536 1.323 15.393) 18.156 26.850 ( -11.205 -2.333 15.065) 18.920 29.217 ( 2.480 4.103 -1.668) 5.076 29.389 ( -4.987 5.072 -0.830) 7.161 29.718 ( 8.060 -4.001 4.945) 10.268 29.938 ( 0.376 -2.310 1.014) 2.550 30.188 ( -1.772 8.208 0.434) 8.408 30.392 ( -10.266 4.285 -4.739) 12.091 31.020 ( 13.128 -5.950 -5.396) 15.390 31.215 ( 1.390 -6.545 6.720) 9.483 31.351 ( 2.344 4.892 -1.997) 5.781 31.386 ( 1.821 4.880 1.745) 5.493 31.666 ( 0.539 -1.403 -3.560) 3.864 31.923 ( -6.681 -1.633 -9.825) 11.993 32.186 ( -0.901 0.417 0.860) 1.314 32.192 ( -2.403 1.758 4.041) 5.019 32.533 ( 3.347 -1.227 -2.040) 4.107 32.787 ( -7.378 -4.119 10.572) 13.534 ======================= Grid point 229 (120/128) ======================= q-point: (-0.50 0.17 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.414 ( -1.577 1.623 -8.204) 8.510 3.414 ( 1.577 1.623 8.204) 8.510 3.585 ( 4.666 9.907 -11.099) 15.591 3.585 ( -4.665 9.907 11.099) 15.591 3.913 ( -0.227 -3.840 -1.566) 4.154 3.913 ( 0.227 -3.840 1.566) 4.154 4.106 ( -0.888 -6.168 -12.218) 13.715 4.106 ( 0.888 -6.168 12.218) 13.715 4.660 ( -4.975 1.526 -7.404) 9.050 4.660 ( 4.975 1.526 7.404) 9.050 4.966 ( 2.954 -1.635 -6.943) 7.721 4.966 ( -2.954 -1.635 6.943) 7.721 5.284 ( 3.903 0.890 -8.548) 9.439 5.284 ( -3.903 0.890 8.548) 9.439 5.482 ( -5.320 0.664 -3.464) 6.383 5.482 ( 5.320 0.664 3.464) 6.383 5.812 ( -0.151 3.525 -6.258) 7.185 5.812 ( 0.151 3.525 6.258) 7.185 6.146 ( 3.334 -0.020 -5.005) 6.014 6.146 ( -3.334 -0.020 5.005) 6.014 6.898 ( -1.499 3.119 -8.391) 9.077 6.898 ( 1.499 3.119 8.391) 9.077 7.089 ( -0.868 1.417 -6.460) 6.670 7.089 ( 0.868 1.417 6.460) 6.670 7.355 ( -7.974 11.792 0.121) 14.235 7.355 ( 7.974 11.792 -0.121) 14.235 7.552 ( 2.342 -1.524 -2.755) 3.924 7.552 ( -2.342 -1.524 2.755) 3.924 7.811 ( -1.095 -2.957 -6.441) 7.172 7.811 ( 1.095 -2.957 6.441) 7.172 7.978 ( -5.835 1.905 1.571) 6.336 7.978 ( 5.835 1.905 -1.571) 6.336 8.129 ( -5.749 3.471 -1.745) 6.939 8.129 ( 5.749 3.471 1.745) 6.939 8.286 ( 6.215 0.521 -15.166) 16.399 8.286 ( -6.215 0.521 15.166) 16.399 8.583 ( 7.122 -2.740 -5.812) 9.592 8.583 ( -7.122 -2.740 5.812) 9.592 8.894 ( -4.587 -3.621 -3.119) 6.625 8.894 ( 4.587 -3.621 3.119) 6.625 8.989 ( 0.766 -5.330 -17.730) 18.529 8.989 ( -0.766 -5.330 17.730) 18.529 9.135 ( 3.229 -0.472 -14.483) 14.846 9.135 ( -3.229 -0.472 14.483) 14.846 9.301 ( 7.035 3.428 -9.001) 11.927 9.301 ( -7.035 3.428 9.001) 11.927 9.533 ( 5.141 0.143 -9.966) 11.215 9.533 ( -5.141 0.143 9.966) 11.215 9.713 ( 6.643 6.815 -4.268) 10.430 9.713 ( -6.643 6.815 4.268) 10.430 9.924 ( 7.945 0.763 -9.605) 12.489 9.924 ( -7.945 0.763 9.605) 12.489 10.317 ( -3.185 0.068 -1.088) 3.366 10.317 ( 3.185 0.068 1.088) 3.366 10.486 ( -5.200 -1.209 -4.784) 7.168 10.486 ( 5.200 -1.209 4.784) 7.168 10.757 ( -0.888 6.396 -5.845) 8.709 10.757 ( 0.888 6.396 5.845) 8.709 11.218 ( 0.655 -5.079 -5.158) 7.268 11.218 ( -0.655 -5.079 5.158) 7.268 11.639 ( 0.761 -8.070 -2.495) 8.481 11.639 ( -0.761 -8.070 2.495) 8.481 11.997 ( 2.205 -11.715 -3.262) 12.359 11.997 ( -2.205 -11.715 3.262) 12.359 12.635 ( 5.494 0.029 -3.585) 6.560 12.635 ( -5.494 0.029 3.585) 6.560 12.806 ( -3.062 -1.719 -6.857) 7.704 12.806 ( 3.062 -1.719 6.857) 7.704 12.877 ( -4.380 1.658 -5.726) 7.397 12.877 ( 4.380 1.658 5.726) 7.397 13.197 ( -1.124 1.635 -6.522) 6.817 13.197 ( 1.125 1.635 6.522) 6.817 13.839 ( 5.347 7.156 -11.100) 14.248 13.839 ( -5.347 7.156 11.100) 14.248 14.093 ( -3.611 1.086 -4.324) 5.737 14.093 ( 3.611 1.086 4.324) 5.737 14.750 ( 3.549 -4.839 -4.225) 7.339 14.750 ( -3.549 -4.839 4.225) 7.339 14.927 ( -3.832 -4.163 -4.358) 7.142 14.927 ( 3.832 -4.163 4.358) 7.142 16.002 ( -5.286 2.621 -3.468) 6.844 16.002 ( 5.286 2.621 3.468) 6.844 16.275 ( 0.623 -0.076 -4.156) 4.203 16.275 ( -0.623 -0.076 4.156) 4.203 16.539 ( -6.702 -1.383 -4.394) 8.133 16.539 ( 6.702 -1.383 4.394) 8.133 16.837 ( 3.613 -4.987 -2.504) 6.648 16.837 ( -3.613 -4.987 2.504) 6.648 20.064 ( 13.162 8.060 -36.097) 39.258 20.064 ( -13.162 8.060 36.097) 39.258 20.535 ( -5.293 2.133 -40.268) 40.670 20.535 ( 5.293 2.133 40.268) 40.670 20.971 ( 9.530 -0.094 -25.470) 27.195 20.971 ( -9.530 -0.094 25.470) 27.195 21.364 ( 3.801 -4.335 -30.331) 30.874 21.364 ( -3.801 -4.335 30.331) 30.874 25.071 ( -9.876 0.496 -11.556) 15.210 25.071 ( 9.876 0.496 11.556) 15.210 25.262 ( -10.384 -1.631 -13.665) 17.240 25.262 ( 10.384 -1.631 13.665) 17.240 26.491 ( 12.223 0.603 -13.358) 18.116 26.491 ( -12.223 0.603 13.358) 18.116 26.681 ( 12.358 -2.048 -14.636) 19.265 26.681 ( -12.358 -2.048 14.636) 19.265 29.286 ( -5.114 4.542 -0.049) 6.840 29.286 ( 5.114 4.542 0.049) 6.840 29.884 ( -6.219 -5.743 -3.440) 9.137 29.884 ( 6.219 -5.743 3.440) 9.137 30.224 ( -3.542 9.177 -5.066) 11.065 30.224 ( 3.542 9.177 5.066) 11.065 31.186 ( 5.408 -7.352 -6.526) 11.220 31.186 ( -5.408 -7.352 6.526) 11.220 31.388 ( 2.128 5.167 -8.545) 10.210 31.388 ( -2.128 5.167 8.545) 10.210 31.755 ( -6.548 -1.186 -5.011) 8.330 31.755 ( 6.548 -1.186 5.011) 8.330 32.167 ( 0.212 2.031 -3.605) 4.144 32.167 ( -0.212 2.031 3.605) 4.144 32.657 ( 7.097 -3.353 -6.607) 10.260 32.657 ( -7.097 -3.353 6.607) 10.260 ======================= Grid point 233 (121/128) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.283 ( -0.332 -3.426 -7.133) 7.920 3.283 ( 0.332 -3.426 7.133) 7.920 3.624 ( -2.977 0.724 -0.971) 3.214 3.624 ( 2.977 0.724 0.971) 3.214 3.851 ( -5.354 -2.794 -9.187) 10.994 3.851 ( 5.354 -2.794 9.187) 10.994 4.356 ( 1.941 7.381 -1.699) 7.819 4.356 ( -1.941 7.381 1.699) 7.819 4.646 ( -6.554 3.412 -5.335) 9.114 4.646 ( 6.554 3.412 5.335) 9.114 4.915 ( -2.586 0.995 -4.162) 5.000 4.915 ( 2.586 0.995 4.162) 5.000 5.438 ( -9.920 -2.212 -0.400) 10.171 5.438 ( 9.920 -2.212 0.400) 10.171 5.789 ( 6.100 1.741 -7.288) 9.662 5.789 ( -6.100 1.741 7.288) 9.662 5.875 ( -0.747 6.071 -11.223) 12.782 5.875 ( 0.747 6.071 11.223) 12.782 6.145 ( -5.266 5.792 -3.134) 8.432 6.145 ( 5.266 5.792 3.134) 8.432 6.649 ( -3.728 -3.755 0.002) 5.291 6.649 ( 3.728 -3.755 -0.002) 5.291 6.828 ( -3.712 -6.890 -6.106) 9.926 6.828 ( 3.712 -6.890 6.106) 9.926 7.182 ( -0.612 3.496 -3.253) 4.815 7.182 ( 0.612 3.496 3.253) 4.815 7.366 ( 0.965 -2.983 -5.525) 6.353 7.366 ( -0.965 -2.983 5.525) 6.353 7.835 ( -0.411 5.721 -6.712) 8.829 7.835 ( 0.411 5.721 6.712) 8.829 7.893 ( -0.893 3.728 -1.112) 3.992 7.893 ( 0.893 3.728 1.112) 3.992 8.165 ( -4.739 5.875 -5.798) 9.518 8.165 ( 4.739 5.875 5.798) 9.518 8.367 ( -6.115 0.829 -7.908) 10.031 8.367 ( 6.115 0.829 7.908) 10.031 8.610 ( 3.774 4.608 -10.826) 12.357 8.610 ( -3.774 4.608 10.826) 12.357 8.882 ( -1.681 -1.502 -5.670) 6.102 8.882 ( 1.681 -1.502 5.670) 6.102 8.993 ( 0.564 -8.440 -3.822) 9.283 8.993 ( -0.564 -8.440 3.822) 9.283 9.226 ( 6.533 -0.662 -15.437) 16.776 9.226 ( -6.533 -0.662 15.437) 16.776 9.372 ( 0.971 0.643 -2.996) 3.215 9.372 ( -0.971 0.643 2.996) 3.215 9.491 ( 2.951 -2.383 -13.004) 13.546 9.491 ( -2.951 -2.383 13.004) 13.546 9.842 ( 1.177 3.970 -4.289) 5.962 9.842 ( -1.177 3.970 4.289) 5.962 10.295 ( 2.862 -1.368 -5.535) 6.380 10.295 ( -2.862 -1.368 5.535) 6.380 10.404 ( 6.053 1.470 -7.522) 9.767 10.404 ( -6.053 1.470 7.522) 9.767 10.509 ( -2.574 -0.922 -8.504) 8.933 10.509 ( 2.574 -0.922 8.504) 8.933 10.783 ( 3.845 8.190 -9.399) 13.046 10.783 ( -3.845 8.190 9.399) 13.046 11.180 ( -3.360 0.348 -3.342) 4.752 11.180 ( 3.360 0.348 3.342) 4.752 11.410 ( 3.344 -14.170 -7.176) 16.232 11.410 ( -3.344 -14.170 7.176) 16.232 12.014 ( -0.487 -5.529 -1.134) 5.665 12.014 ( 0.487 -5.529 1.134) 5.665 12.425 ( 5.205 -3.489 -3.388) 7.123 12.425 ( -5.205 -3.489 3.388) 7.123 12.611 ( -2.065 3.253 -2.584) 4.639 12.611 ( 2.065 3.253 2.584) 4.639 13.041 ( -1.351 1.330 -3.208) 3.726 13.041 ( 1.351 1.330 3.208) 3.726 13.283 ( -0.592 -2.030 -2.233) 3.076 13.283 ( 0.592 -2.030 2.233) 3.076 13.827 ( 0.311 4.172 -6.584) 7.800 13.827 ( -0.311 4.172 6.584) 7.800 14.183 ( 2.301 5.576 -8.615) 10.517 14.183 ( -2.301 5.576 8.615) 10.517 14.488 ( 2.054 -11.596 -13.928) 18.239 14.488 ( -2.054 -11.596 13.928) 18.239 15.139 ( 1.959 -1.852 -1.887) 3.290 15.139 ( -1.959 -1.852 1.887) 3.290 15.946 ( 3.852 3.843 -2.833) 6.135 15.946 ( -3.852 3.843 2.833) 6.135 16.091 ( 4.563 -1.572 -4.923) 6.895 16.091 ( -4.563 -1.572 4.923) 6.895 16.538 ( 0.661 2.195 -1.735) 2.875 16.538 ( -0.661 2.195 1.735) 2.875 16.904 ( -1.641 -7.250 -3.239) 8.108 16.904 ( 1.641 -7.250 3.239) 8.108 20.248 ( 6.286 12.096 -38.776) 41.102 20.248 ( -6.286 12.096 38.776) 41.102 20.576 ( 11.913 -2.671 -33.876) 36.009 20.576 ( -11.913 -2.671 33.876) 36.009 21.163 ( 3.717 -3.050 -19.895) 20.468 21.163 ( -3.717 -3.050 19.895) 20.468 21.319 ( 7.683 -1.870 -17.987) 19.649 21.319 ( -7.683 -1.870 17.987) 19.649 24.761 ( -0.109 -0.899 -0.871) 1.257 24.761 ( 0.109 -0.899 0.871) 1.257 24.915 ( -2.942 0.975 0.158) 3.103 24.915 ( 2.942 0.975 -0.158) 3.103 26.675 ( -1.802 1.383 -17.524) 17.671 26.675 ( 1.802 1.383 17.524) 17.671 26.795 ( -3.589 -2.633 -14.877) 15.529 26.795 ( 3.589 -2.633 14.877) 15.529 29.364 ( -4.015 4.175 -2.317) 6.238 29.364 ( 4.015 4.175 2.317) 6.238 29.781 ( -5.185 -0.496 -1.946) 5.560 29.781 ( 5.185 -0.496 1.946) 5.560 30.516 ( -1.892 4.939 -3.159) 6.161 30.516 ( 1.892 4.939 3.159) 6.161 30.814 ( -6.871 -5.112 -4.646) 9.743 30.814 ( 6.871 -5.112 4.646) 9.743 31.433 ( 1.500 6.456 -5.198) 8.423 31.433 ( -1.500 6.456 5.198) 8.423 31.780 ( -2.418 -6.998 -0.832) 7.451 31.780 ( 2.418 -6.998 0.832) 7.451 32.261 ( -0.465 3.518 -7.751) 8.524 32.261 ( 0.465 3.518 7.751) 8.524 32.677 ( -2.486 -3.627 -8.629) 9.685 32.677 ( 2.486 -3.627 8.629) 9.685 ======================= Grid point 235 (122/128) ======================= q-point: ( 0.17 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.273 ( 2.945 -0.702 -6.662) 7.318 3.359 ( 5.017 -6.085 3.064) 8.461 3.559 ( -2.569 1.017 -1.762) 3.277 3.692 ( 5.533 7.207 -10.129) 13.607 3.792 ( 0.360 -9.046 1.889) 9.248 4.041 ( 10.484 -2.791 8.651) 13.876 4.239 ( -9.682 9.547 -2.140) 13.765 4.300 ( -6.721 7.894 0.533) 10.381 4.551 ( -0.931 5.789 -7.400) 9.442 4.701 ( -1.030 -5.399 -5.012) 7.438 4.878 ( -4.037 3.222 5.263) 7.375 4.994 ( 1.479 -0.527 11.102) 11.213 5.246 ( -6.915 0.485 4.064) 8.036 5.518 ( -4.198 -6.365 -1.165) 7.713 5.621 ( -10.499 6.941 7.259) 14.529 5.759 ( 1.294 3.589 -8.355) 9.185 5.824 ( -5.612 -2.453 -11.677) 13.185 5.959 ( 2.434 5.179 3.511) 6.713 6.094 ( 0.721 4.297 1.606) 4.643 6.199 ( -0.333 3.415 1.541) 3.761 6.660 ( 6.397 2.164 5.065) 8.441 6.808 ( 11.596 -5.015 -2.714) 12.922 6.901 ( 10.304 0.438 0.100) 10.313 6.974 ( 6.217 -3.610 3.183) 7.862 7.187 ( 5.027 5.138 0.207) 7.191 7.297 ( 9.247 0.409 0.273) 9.260 7.422 ( 3.404 -3.592 6.824) 8.429 7.432 ( 7.431 -3.162 2.822) 8.555 7.810 ( -0.139 4.440 -5.183) 6.826 7.837 ( -1.106 4.755 -3.242) 5.860 7.880 ( -0.051 2.276 -0.913) 2.453 7.940 ( 3.134 2.216 -0.874) 3.936 8.076 ( -0.982 9.712 -4.044) 10.566 8.232 ( -2.243 0.910 -6.607) 7.036 8.256 ( 2.235 5.181 -1.158) 5.760 8.453 ( -1.740 -1.350 -0.491) 2.257 8.571 ( 1.215 3.756 0.831) 4.034 8.606 ( -0.584 5.689 -10.599) 12.043 8.861 ( -2.318 -1.013 7.006) 7.449 8.870 ( -3.819 -3.050 4.928) 6.941 8.990 ( -1.586 -6.820 4.201) 8.166 9.042 ( 1.475 -7.974 7.136) 10.802 9.191 ( -1.547 -0.782 12.713) 12.831 9.217 ( -1.855 -1.551 -11.735) 11.981 9.349 ( -2.317 -1.366 5.655) 6.262 9.396 ( -3.060 -1.024 -7.742) 8.387 9.437 ( 2.046 0.263 -3.446) 4.016 9.488 ( 0.748 -1.393 -5.867) 6.077 9.779 ( -3.176 4.010 -0.963) 5.205 9.846 ( -2.236 1.949 1.980) 3.566 10.203 ( -9.305 2.675 1.368) 9.778 10.310 ( -6.147 5.547 0.634) 8.303 10.324 ( 0.177 -1.107 0.443) 1.205 10.392 ( -2.388 1.412 1.469) 3.139 10.495 ( 0.580 1.125 1.267) 1.791 10.542 ( -1.938 -3.487 5.153) 6.517 10.737 ( 0.056 4.456 1.567) 4.724 10.884 ( 7.629 6.536 -6.793) 12.127 11.068 ( -6.088 5.422 -2.023) 8.400 11.239 ( 0.836 -3.736 0.185) 3.833 11.386 ( -0.893 -15.671 3.820) 16.155 11.463 ( 5.658 -11.916 -8.909) 15.918 11.912 ( -10.688 -5.167 1.095) 11.922 12.003 ( -3.825 -10.498 2.675) 11.488 12.396 ( 1.935 -0.100 9.802) 9.991 12.493 ( 2.219 -1.934 -0.150) 2.948 12.635 ( 6.870 2.770 -5.275) 9.094 12.691 ( 4.561 0.378 -2.055) 5.017 12.950 ( -4.918 2.389 -1.819) 5.762 13.064 ( -1.481 -1.000 0.200) 1.798 13.250 ( -2.236 -0.378 2.786) 3.592 13.306 ( -0.512 -1.181 3.204) 3.453 13.828 ( 3.034 4.936 -3.890) 6.979 13.891 ( 4.002 2.347 3.743) 5.961 14.164 ( -2.853 7.673 5.286) 9.745 14.204 ( 2.186 4.843 -6.866) 8.682 14.489 ( 3.873 -11.609 -9.178) 15.297 14.531 ( 1.100 -10.500 10.727) 15.051 15.045 ( -8.211 -1.092 -0.148) 8.285 15.107 ( -4.154 -2.780 -3.533) 6.121 15.915 ( -0.225 4.009 4.405) 5.960 16.009 ( 2.315 0.850 1.729) 3.012 16.091 ( 4.793 1.524 2.075) 5.441 16.201 ( 6.503 -1.694 -4.018) 7.829 16.523 ( -1.407 1.399 1.665) 2.591 16.533 ( 0.205 1.191 -2.343) 2.636 16.821 ( -5.658 -5.183 -3.270) 8.341 16.910 ( -2.389 -8.152 2.481) 8.850 20.215 ( 6.160 12.467 -32.205) 35.079 20.313 ( -2.962 10.337 33.877) 35.543 20.467 ( -13.903 2.520 32.565) 35.498 20.638 ( 8.985 -6.101 -31.486) 33.307 21.103 ( -5.306 -1.800 -1.268) 5.744 21.159 ( -5.356 -4.528 21.296) 22.422 21.237 ( -5.874 0.433 3.480) 6.841 21.355 ( 5.618 -3.884 -25.815) 26.703 24.711 ( -0.024 0.297 5.002) 5.011 24.743 ( 2.391 -1.203 5.559) 6.170 25.076 ( 14.775 2.160 -6.373) 16.236 25.156 ( 16.995 -1.633 -6.629) 18.316 26.525 ( -5.294 1.296 -18.035) 18.841 26.612 ( -5.513 -2.793 -15.238) 16.444 26.753 ( -4.147 2.239 17.442) 18.067 26.867 ( -3.541 -3.346 16.293) 17.006 29.311 ( -0.823 5.888 -1.385) 6.104 29.468 ( 6.066 1.605 2.909) 6.916 29.662 ( -6.496 1.968 -2.264) 7.155 29.855 ( 1.887 -3.757 0.445) 4.228 30.417 ( -3.396 9.119 0.686) 9.755 30.627 ( -2.011 5.297 -1.273) 5.807 30.719 ( 5.381 -5.870 -3.480) 8.691 30.961 ( 5.825 -8.248 6.373) 11.940 31.418 ( -0.035 5.149 1.282) 5.306 31.471 ( 3.198 7.315 -3.683) 8.792 31.673 ( -4.081 -3.792 -2.380) 6.058 31.884 ( 5.202 -8.870 -8.730) 13.489 32.209 ( -1.526 4.080 -3.092) 5.342 32.268 ( -3.099 2.054 7.705) 8.555 32.579 ( -4.721 -0.125 -3.033) 5.612 32.723 ( -2.098 -5.953 10.294) 12.075 ======================= Grid point 236 (123/128) ======================= q-point: ( 0.33 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.333 ( 6.269 0.271 -7.047) 9.436 3.471 ( 2.837 -5.495 3.788) 7.252 3.522 ( 1.253 -0.160 0.244) 1.286 3.758 ( 4.582 6.506 -11.715) 14.162 3.814 ( 1.189 -6.235 1.003) 6.426 4.085 ( -4.712 9.629 -0.124) 10.721 4.152 ( -7.841 12.471 3.186) 15.072 4.250 ( 4.654 1.334 5.131) 7.055 4.482 ( -0.769 4.658 -9.480) 10.590 4.659 ( -2.794 -9.686 1.610) 10.208 4.808 ( -1.058 -5.827 -1.068) 6.017 4.989 ( -7.004 -6.329 9.765) 13.582 5.254 ( 1.336 2.752 12.971) 13.326 5.384 ( -5.344 -4.651 -2.875) 7.646 5.495 ( -5.703 6.568 1.030) 8.759 5.635 ( -7.982 -1.137 -13.571) 15.785 5.816 ( 5.198 4.242 1.452) 6.864 5.967 ( -1.053 2.852 -0.958) 3.188 6.113 ( 0.081 -0.637 3.083) 3.150 6.189 ( -0.882 3.560 -2.491) 4.434 6.858 ( 10.239 4.513 5.866) 12.634 6.987 ( 5.389 0.667 -3.081) 6.243 7.050 ( 6.908 3.754 4.315) 8.968 7.090 ( 5.326 3.363 3.844) 7.379 7.304 ( 7.124 4.515 -3.397) 9.093 7.472 ( 4.439 -3.576 3.192) 6.533 7.533 ( 7.095 0.556 1.526) 7.279 7.647 ( 11.417 -4.189 5.815) 13.480 7.723 ( -5.000 5.743 -3.054) 8.204 7.826 ( -0.961 2.808 -4.549) 5.431 7.868 ( 4.540 2.410 -5.654) 7.641 8.016 ( 4.600 -0.490 1.170) 4.771 8.110 ( 3.327 9.713 0.246) 10.270 8.231 ( 5.872 5.028 -10.187) 12.788 8.270 ( -0.462 -0.059 -2.453) 2.497 8.348 ( -4.034 -0.622 -9.025) 9.905 8.537 ( -2.947 3.717 1.612) 5.010 8.633 ( 0.791 1.063 0.092) 1.328 8.741 ( -7.576 -5.264 12.206) 15.300 8.883 ( -2.994 -2.441 3.032) 4.911 8.945 ( -4.560 -5.594 2.532) 7.648 9.025 ( -8.215 -10.355 -3.307) 13.625 9.129 ( -2.532 0.556 5.423) 6.011 9.202 ( -2.870 0.607 -0.115) 2.936 9.285 ( 2.810 3.963 -3.363) 5.908 9.382 ( 0.076 -0.600 5.900) 5.931 9.479 ( 3.172 -0.068 -8.309) 8.894 9.518 ( 3.315 -1.862 0.773) 3.880 9.736 ( 0.412 0.370 -8.540) 8.558 9.819 ( 0.010 -0.452 4.232) 4.256 9.999 ( -11.676 6.053 1.176) 13.204 10.163 ( -8.142 6.717 -4.094) 11.321 10.313 ( -1.712 -1.650 1.954) 3.078 10.406 ( -7.313 2.227 6.936) 10.322 10.436 ( 1.170 6.041 11.821) 13.327 10.559 ( 2.266 -3.870 -8.354) 9.481 10.774 ( 3.184 2.653 -0.527) 4.178 10.949 ( -6.016 3.688 0.547) 7.078 11.016 ( 9.029 5.639 -6.149) 12.294 11.225 ( -2.055 -4.603 -0.236) 5.046 11.397 ( 1.309 -14.031 0.165) 14.093 11.550 ( 5.717 -7.101 -6.378) 11.126 11.687 ( -11.047 -10.290 1.631) 15.185 11.895 ( -9.565 -13.118 6.151) 17.361 12.543 ( 7.034 0.205 4.524) 8.366 12.561 ( 7.562 -1.513 -0.302) 7.718 12.718 ( -2.537 -0.228 2.438) 3.526 12.743 ( 5.178 -0.731 -2.168) 5.660 12.891 ( 0.731 2.552 -4.783) 5.470 12.995 ( -5.405 -2.068 -1.172) 5.904 13.226 ( -1.647 1.935 4.098) 4.822 13.285 ( -2.830 0.503 2.399) 3.744 13.896 ( 5.951 6.017 -4.482) 9.577 13.993 ( 4.984 1.067 4.157) 6.578 14.107 ( -5.272 8.621 5.004) 11.276 14.191 ( -0.851 2.538 -6.989) 7.484 14.554 ( 6.164 -7.512 -5.654) 11.242 14.621 ( 3.811 -8.362 10.798) 14.179 14.872 ( -9.046 -1.314 -1.459) 9.257 14.978 ( -7.438 -4.395 -5.493) 10.238 15.969 ( 3.745 4.170 4.912) 7.453 16.082 ( 3.724 0.146 1.518) 4.024 16.190 ( 2.977 0.732 2.953) 4.256 16.262 ( 2.995 0.408 -4.343) 5.292 16.491 ( -1.599 1.700 0.565) 2.401 16.581 ( 5.536 -4.170 -1.157) 7.027 16.684 ( -7.164 -2.024 -3.677) 8.303 16.841 ( -6.068 -7.917 2.087) 10.191 20.215 ( 8.080 11.893 -32.142) 35.212 20.338 ( -12.252 7.768 31.181) 34.391 20.427 ( -2.058 5.659 37.643) 38.121 20.645 ( 5.724 -6.548 -34.477) 35.557 21.001 ( -4.809 1.331 3.066) 5.856 21.094 ( -5.938 2.685 -3.427) 7.363 21.196 ( -4.357 -6.683 26.638) 27.807 21.319 ( 2.784 -5.739 -28.394) 29.102 24.842 ( 10.355 1.185 8.927) 13.723 24.918 ( 12.320 -2.488 9.091) 15.512 25.238 ( 3.984 2.289 -10.470) 11.434 25.340 ( 4.573 -2.563 -11.566) 12.698 26.413 ( 2.436 1.553 -13.921) 14.218 26.513 ( 2.832 -3.198 -13.702) 14.353 26.689 ( -9.942 2.065 15.170) 18.254 26.795 ( -10.795 -3.121 14.825) 18.603 29.326 ( 2.754 6.883 -0.099) 7.414 29.521 ( -5.678 7.924 -2.262) 10.007 29.615 ( 6.252 -6.284 3.537) 9.544 29.846 ( -2.735 -6.814 -1.535) 7.501 30.397 ( 0.819 11.894 0.106) 11.922 30.524 ( -5.669 8.857 -0.136) 10.517 30.877 ( 9.946 -8.036 -4.512) 13.559 31.048 ( -0.144 -10.566 7.574) 13.001 31.446 ( 1.989 4.822 3.312) 6.179 31.513 ( 3.002 7.239 -5.825) 9.764 31.630 ( 0.950 -1.790 -2.118) 2.932 31.852 ( -3.723 -5.843 -11.382) 13.325 32.208 ( 0.778 2.008 -0.434) 2.197 32.236 ( -2.276 2.072 5.902) 6.656 32.516 ( -0.359 0.168 -0.423) 0.580 32.681 ( -6.532 -6.377 8.693) 12.606 ======================= Grid point 237 (124/128) ======================= q-point: (-0.50 0.33 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.424 ( 4.988 0.087 -9.081) 10.361 3.424 ( -4.988 0.087 9.081) 10.361 3.655 ( -5.412 -6.279 -3.269) 8.911 3.655 ( 5.412 -6.279 3.269) 8.911 3.942 ( 11.476 10.927 -9.525) 18.488 3.942 ( -11.476 10.927 9.525) 18.488 4.180 ( -1.035 11.979 -10.368) 15.877 4.180 ( 1.035 11.979 10.368) 15.877 4.571 ( 0.687 -8.793 -4.661) 9.976 4.571 ( -0.687 -8.793 4.661) 9.976 4.865 ( 5.074 -9.343 -8.437) 13.572 4.865 ( -5.074 -9.343 8.437) 13.572 5.328 ( 0.799 1.522 -16.014) 16.106 5.328 ( -0.799 1.522 16.014) 16.106 5.470 ( -0.780 -0.284 -16.027) 16.049 5.470 ( 0.780 -0.284 16.027) 16.049 5.918 ( -2.707 6.488 -6.786) 9.771 5.918 ( 2.707 6.488 6.786) 9.771 6.144 ( -1.433 -0.711 -5.119) 5.363 6.144 ( 1.433 -0.711 5.119) 5.363 6.998 ( 1.293 5.570 -8.475) 10.223 6.998 ( -1.293 5.570 8.475) 10.223 7.145 ( 0.732 3.605 -2.521) 4.460 7.145 ( -0.732 3.605 2.521) 4.460 7.441 ( -6.934 -2.343 0.780) 7.361 7.441 ( 6.934 -2.343 -0.780) 7.361 7.607 ( 3.410 5.507 -4.258) 7.751 7.607 ( -3.410 5.507 4.258) 7.751 7.818 ( 1.822 4.329 -5.429) 7.179 7.818 ( -1.822 4.329 5.429) 7.179 7.997 ( 5.837 -0.653 -3.363) 6.768 7.997 ( -5.837 -0.653 3.363) 6.768 8.182 ( -3.204 2.576 -5.081) 6.536 8.182 ( 3.204 2.576 5.081) 6.536 8.315 ( 4.489 1.756 -10.027) 11.125 8.315 ( -4.489 1.756 10.027) 11.125 8.549 ( 1.439 -0.416 -1.885) 2.408 8.549 ( -1.439 -0.416 1.885) 2.408 8.787 ( 5.753 -5.296 -7.228) 10.648 8.787 ( -5.753 -5.296 7.228) 10.648 8.886 ( -1.868 -5.632 -11.204) 12.678 8.886 ( 1.868 -5.632 11.204) 12.678 9.154 ( -1.400 1.491 -5.261) 5.644 9.154 ( 1.400 1.491 5.261) 5.644 9.360 ( 4.724 2.517 -4.166) 6.783 9.360 ( -4.724 2.517 4.166) 6.783 9.526 ( 3.376 -1.010 -7.816) 8.574 9.526 ( -3.376 -1.010 7.816) 8.574 9.769 ( 8.758 -0.600 -13.072) 15.746 9.769 ( -8.758 -0.600 13.072) 15.746 9.987 ( -8.461 4.454 -0.476) 9.574 9.987 ( 8.461 4.454 0.476) 9.574 10.316 ( 3.306 1.242 -12.101) 12.606 10.316 ( -3.306 1.242 12.101) 12.606 10.525 ( -0.591 2.830 -12.567) 12.895 10.525 ( 0.591 2.830 12.567) 12.895 10.846 ( 2.024 2.409 -2.808) 4.217 10.846 ( -2.024 2.409 2.808) 4.217 11.152 ( 0.913 -0.110 -2.231) 2.413 11.152 ( -0.913 -0.110 2.231) 2.413 11.461 ( 1.401 -8.136 -3.040) 8.797 11.461 ( -1.401 -8.136 3.040) 8.797 11.733 ( 9.526 -14.239 -7.778) 18.815 11.733 ( -9.526 -14.239 7.778) 18.815 12.641 ( 3.606 0.629 -4.494) 5.796 12.641 ( -3.606 0.629 4.494) 5.796 12.738 ( -3.651 -4.474 -6.473) 8.674 12.738 ( 3.651 -4.474 6.473) 8.674 12.910 ( 0.409 1.311 -0.419) 1.436 12.910 ( -0.409 1.311 0.419) 1.436 13.238 ( -1.094 2.244 -2.241) 3.355 13.238 ( 1.094 2.244 2.241) 3.355 13.995 ( 3.354 7.436 -9.685) 12.662 13.995 ( -3.354 7.436 9.685) 12.662 14.119 ( -3.596 1.315 -5.828) 6.973 14.119 ( 3.596 1.315 5.828) 6.973 14.655 ( 2.934 -3.770 -4.010) 6.237 14.655 ( -2.934 -3.770 4.010) 6.237 14.823 ( -5.331 -5.883 -5.839) 9.855 14.823 ( 5.331 -5.883 5.839) 9.855 16.067 ( -4.103 3.817 -3.623) 6.673 16.067 ( 4.103 3.817 3.623) 6.673 16.257 ( -2.597 -1.984 -4.655) 5.688 16.257 ( 2.597 -1.984 4.655) 5.688 16.531 ( -4.337 1.138 -3.514) 5.696 16.531 ( 4.337 1.138 3.514) 5.696 16.718 ( -3.354 -6.626 -0.284) 7.432 16.718 ( 3.354 -6.626 0.284) 7.432 20.254 ( 10.833 10.381 -34.871) 37.961 20.254 ( -10.833 10.381 34.871) 37.961 20.558 ( 1.292 -0.871 -37.639) 37.672 20.558 ( -1.292 -0.871 37.639) 37.672 20.993 ( 5.446 3.086 -26.626) 27.352 20.993 ( -5.446 3.086 26.626) 27.352 21.249 ( 2.938 -7.185 -29.983) 30.971 21.249 ( -2.938 -7.185 29.983) 30.971 25.084 ( -7.845 0.795 -8.966) 11.940 25.084 ( 7.845 0.795 8.966) 11.940 25.225 ( -8.138 -1.926 -10.127) 13.134 25.225 ( 8.138 -1.926 10.127) 13.134 26.508 ( 10.451 1.111 -11.111) 15.294 26.508 ( -10.451 1.111 11.111) 15.294 26.634 ( 10.397 -2.435 -11.803) 15.916 26.634 ( -10.397 -2.435 11.803) 15.916 29.405 ( -5.384 7.368 -1.375) 9.228 29.405 ( 5.384 7.368 1.375) 9.228 29.751 ( -6.187 -7.684 -3.178) 10.364 29.751 ( 6.187 -7.684 3.178) 10.364 30.439 ( 0.866 12.224 -6.133) 13.704 30.439 ( -0.866 12.224 6.133) 13.704 31.010 ( 6.497 -10.394 -6.111) 13.696 31.010 ( -6.497 -10.394 6.111) 13.696 31.501 ( -0.098 6.260 -9.022) 10.981 31.501 ( 0.098 6.260 9.022) 10.981 31.712 ( -4.963 -3.310 -7.496) 9.580 31.712 ( 4.963 -3.310 7.496) 9.580 32.220 ( 0.901 3.105 -5.027) 5.977 32.220 ( -0.901 3.105 5.027) 5.977 32.576 ( 3.868 -4.418 -6.188) 8.531 32.576 ( -3.868 -4.418 6.188) 8.531 ======================= Grid point 241 (125/128) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 64 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.252 ( -0.000 0.000 0.000) 0.000 3.252 ( 0.000 0.000 0.000) 0.000 3.626 ( -0.000 0.000 0.000) 0.000 3.626 ( -0.000 0.000 0.000) 0.000 3.818 ( -0.000 -0.000 0.000) 0.000 3.818 ( -0.000 0.000 0.000) 0.000 4.444 ( 0.000 0.000 0.000) 0.000 4.444 ( -0.000 0.000 0.000) 0.000 4.681 ( -0.000 0.000 0.000) 0.000 4.681 ( -0.000 0.000 0.000) 0.000 4.937 ( 0.000 0.000 0.000) 0.000 4.937 ( -0.000 0.000 0.000) 0.000 5.415 ( -0.000 0.000 0.000) 0.000 5.415 ( 0.000 0.000 0.000) 0.000 5.797 ( -0.000 -0.000 0.000) 0.000 5.797 ( -0.000 0.000 0.000) 0.000 5.882 ( -0.000 0.000 -0.000) 0.000 5.882 ( 0.000 0.000 -0.000) 0.000 6.263 ( -0.000 0.000 0.000) 0.000 6.263 ( 0.000 0.000 0.000) 0.000 6.617 ( -0.000 0.000 0.000) 0.000 6.617 ( -0.000 0.000 0.000) 0.000 6.752 ( 0.000 0.000 0.000) 0.000 6.752 ( 0.000 0.000 0.000) 0.000 7.211 ( -0.000 0.000 0.000) 0.000 7.211 ( 0.000 0.000 0.000) 0.000 7.338 ( -0.000 0.000 0.000) 0.000 7.338 ( -0.000 0.000 0.000) 0.000 7.900 ( 0.000 0.000 0.000) 0.000 7.900 ( -0.000 -0.000 0.000) 0.000 7.920 ( 0.000 0.000 -0.000) 0.000 7.920 ( -0.000 0.000 0.000) 0.000 8.254 ( 0.000 -0.000 0.000) 0.000 8.254 ( 0.000 0.000 0.000) 0.000 8.366 ( -0.000 -0.000 0.000) 0.000 8.366 ( 0.000 0.000 0.000) 0.000 8.710 ( 0.000 -0.000 0.000) 0.000 8.710 ( 0.000 0.000 0.000) 0.000 8.812 ( -0.000 0.000 0.000) 0.000 8.812 ( -0.000 0.000 0.000) 0.000 8.877 ( -0.000 0.000 0.000) 0.000 8.877 ( -0.000 0.000 0.000) 0.000 9.223 ( 0.000 0.000 0.000) 0.000 9.223 ( -0.000 0.000 0.000) 0.000 9.396 ( 0.000 -0.000 0.000) 0.000 9.396 ( 0.000 0.000 0.000) 0.000 9.459 ( 0.000 -0.000 0.000) 0.000 9.459 ( 0.000 0.000 0.000) 0.000 9.881 ( -0.000 0.000 0.000) 0.000 9.881 ( 0.000 0.000 0.000) 0.000 10.265 ( -0.000 0.000 0.000) 0.000 10.265 ( 0.000 0.000 0.000) 0.000 10.437 ( -0.000 0.000 -0.000) 0.000 10.437 ( -0.000 0.000 0.000) 0.000 10.507 ( 0.000 -0.000 0.000) 0.000 10.507 ( 0.000 0.000 0.000) 0.000 10.922 ( -0.000 -0.000 0.000) 0.000 10.922 ( -0.000 0.000 0.000) 0.000 11.156 ( 0.000 0.000 0.000) 0.000 11.156 ( 0.000 0.000 0.000) 0.000 11.228 ( -0.000 -0.000 0.000) 0.000 11.228 ( 0.000 0.000 0.000) 0.000 11.966 ( -0.000 0.000 0.000) 0.000 11.966 ( 0.000 0.000 0.000) 0.000 12.379 ( -0.000 0.000 0.000) 0.000 12.379 ( 0.000 0.000 0.000) 0.000 12.645 ( 0.000 0.000 0.000) 0.000 12.645 ( 0.000 0.000 0.000) 0.000 13.060 ( -0.000 0.000 0.000) 0.000 13.060 ( -0.000 0.000 0.000) 0.000 13.258 ( 0.000 -0.000 0.000) 0.000 13.258 ( 0.000 0.000 0.000) 0.000 13.877 ( -0.000 0.000 0.000) 0.000 13.877 ( -0.000 0.000 0.000) 0.000 14.276 ( -0.000 -0.000 0.000) 0.000 14.276 ( -0.000 0.000 0.000) 0.000 14.329 ( 0.000 -0.000 -0.000) 0.000 14.329 ( 0.000 0.000 -0.000) 0.000 15.115 ( 0.000 0.000 0.000) 0.000 15.115 ( 0.000 0.000 0.000) 0.000 16.002 ( 0.000 0.000 0.000) 0.000 16.002 ( 0.000 0.000 0.000) 0.000 16.058 ( -0.000 -0.000 0.000) 0.000 16.058 ( -0.000 0.000 0.000) 0.000 16.567 ( -0.000 0.000 0.000) 0.000 16.567 ( -0.000 0.000 0.000) 0.000 16.822 ( 0.000 -0.000 0.000) 0.000 16.822 ( 0.000 0.000 0.000) 0.000 20.449 ( -0.000 -0.000 0.000) 0.000 20.449 ( -0.000 0.000 0.000) 0.000 20.475 ( 0.000 -0.000 -0.000) 0.000 20.475 ( 0.000 0.000 -0.000) 0.000 21.132 ( -0.000 0.000 0.000) 0.000 21.132 ( -0.000 -0.000 0.000) 0.000 21.298 ( 0.000 0.000 -0.000) 0.000 21.298 ( 0.000 -0.000 -0.000) 0.000 24.752 ( 0.000 0.000 0.000) 0.000 24.752 ( 0.000 0.000 0.000) 0.000 24.924 ( -0.000 0.000 0.000) 0.000 24.924 ( -0.000 0.000 0.000) 0.000 26.695 ( -0.000 0.000 -0.000) 0.000 26.695 ( -0.000 -0.000 -0.000) 0.000 26.762 ( -0.000 0.000 0.000) 0.000 26.762 ( 0.000 0.000 0.000) 0.000 29.412 ( -0.000 0.000 0.000) 0.000 29.412 ( 0.000 0.000 0.000) 0.000 29.771 ( -0.000 0.000 0.000) 0.000 29.771 ( 0.000 0.000 0.000) 0.000 30.593 ( -0.000 -0.000 0.000) 0.000 30.593 ( -0.000 0.000 0.000) 0.000 30.738 ( 0.000 -0.000 0.000) 0.000 30.738 ( 0.000 0.000 0.000) 0.000 31.533 ( -0.000 -0.000 0.000) 0.000 31.533 ( 0.000 0.000 0.000) 0.000 31.673 ( 0.000 -0.000 0.000) 0.000 31.673 ( 0.000 0.000 0.000) 0.000 32.304 ( -0.000 0.000 0.000) 0.000 32.304 ( -0.000 0.000 0.000) 0.000 32.633 ( 0.000 -0.000 0.000) 0.000 32.633 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 245 (126/128) ======================= q-point: ( 0.17 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.280 ( 3.708 -1.999 -2.602) 4.951 3.280 ( 3.708 1.999 -2.602) 4.951 3.621 ( -1.251 -6.249 4.305) 7.691 3.621 ( -1.251 6.249 4.305) 7.691 3.888 ( 7.978 -10.192 -6.156) 14.333 3.888 ( 7.978 10.192 -6.156) 14.333 4.408 ( -3.633 -2.326 1.088) 4.449 4.408 ( -3.633 2.326 1.088) 4.449 4.601 ( -4.137 -4.272 -7.590) 9.642 4.601 ( -4.137 4.272 -7.590) 9.642 4.954 ( -4.237 -4.185 7.924) 9.912 4.954 ( -4.237 4.185 7.924) 9.912 5.344 ( -6.373 -8.810 6.053) 12.445 5.344 ( -6.373 8.810 6.053) 12.445 5.739 ( -3.769 -4.746 -6.212) 8.679 5.739 ( -3.769 4.746 -6.212) 8.679 5.855 ( -2.082 -7.208 0.132) 7.503 5.855 ( -2.082 7.208 0.132) 7.503 6.243 ( -1.237 -3.493 -1.200) 3.895 6.243 ( -1.237 3.493 -1.200) 3.895 6.723 ( 10.499 -4.065 1.768) 11.396 6.723 ( 10.499 4.065 1.768) 11.396 6.924 ( 13.729 -1.799 0.946) 13.879 6.924 ( 13.729 1.799 0.946) 13.879 7.269 ( 6.368 -3.157 1.117) 7.195 7.269 ( 6.368 3.157 1.117) 7.195 7.391 ( 4.275 -0.834 6.649) 7.949 7.391 ( 4.275 0.834 6.649) 7.949 7.870 ( -2.944 -1.820 -3.192) 4.708 7.870 ( -2.944 1.820 -3.192) 4.708 7.928 ( 2.162 -3.139 -3.897) 5.451 7.928 ( 2.162 3.139 -3.897) 5.451 8.231 ( 1.135 -3.145 -4.983) 6.001 8.231 ( 1.135 3.145 -4.983) 6.001 8.369 ( -1.840 -6.097 -1.685) 6.588 8.369 ( -1.840 6.097 -1.685) 6.588 8.668 ( -0.369 -3.208 -5.576) 6.444 8.668 ( -0.369 3.208 -5.576) 6.444 8.829 ( -5.786 -5.434 8.312) 11.493 8.829 ( -5.786 5.434 8.312) 11.493 8.905 ( 3.953 -4.956 3.354) 7.172 8.905 ( 3.953 4.956 3.354) 7.172 9.191 ( -4.309 -1.518 8.277) 9.455 9.191 ( -4.309 1.518 8.277) 9.455 9.364 ( -1.196 -2.104 -5.318) 5.843 9.364 ( -1.196 2.104 -5.318) 5.843 9.462 ( 1.880 -1.605 -7.730) 8.115 9.462 ( 1.880 1.605 -7.730) 8.115 9.839 ( -4.556 -2.125 2.875) 5.791 9.839 ( -4.556 2.125 2.875) 5.791 10.261 ( -1.707 -3.543 -2.259) 4.535 10.261 ( -1.707 3.543 -2.259) 4.535 10.391 ( -4.062 -3.082 2.232) 5.567 10.391 ( -4.062 3.082 2.232) 5.567 10.520 ( 0.336 -0.813 3.397) 3.509 10.520 ( 0.336 0.813 3.397) 3.509 10.905 ( -1.976 -9.713 2.447) 10.209 10.905 ( -1.976 9.713 2.447) 10.209 11.149 ( 0.626 -6.928 -3.911) 7.980 11.149 ( 0.626 6.928 -3.911) 7.980 11.257 ( 3.398 -7.362 -3.359) 8.776 11.257 ( 3.398 7.362 -3.359) 8.776 11.877 ( -9.395 -2.160 1.891) 9.824 11.877 ( -9.395 2.160 1.891) 9.824 12.425 ( 4.014 -3.377 3.947) 6.565 12.425 ( 4.014 3.377 3.947) 6.565 12.682 ( 4.183 -1.509 -3.619) 5.734 12.682 ( 4.183 1.509 -3.619) 5.734 13.014 ( -4.014 -3.643 -0.680) 5.463 13.014 ( -4.014 3.643 -0.680) 5.463 13.271 ( 0.054 -2.061 2.980) 3.624 13.271 ( 0.054 2.061 2.980) 3.624 13.902 ( 2.631 -1.850 1.166) 3.421 13.902 ( 2.631 1.850 1.166) 3.421 14.285 ( -0.307 -5.398 -7.368) 9.139 14.285 ( -0.307 5.398 -7.368) 9.139 14.357 ( 3.874 -6.224 7.293) 10.341 14.357 ( 3.874 6.224 7.293) 10.341 15.052 ( -6.165 -2.028 -2.324) 6.894 15.052 ( -6.165 2.028 -2.324) 6.894 15.986 ( -0.074 -2.914 4.571) 5.422 15.986 ( -0.074 2.914 4.571) 5.422 16.145 ( 6.914 -3.522 -2.405) 8.123 16.145 ( 6.914 3.522 -2.405) 8.123 16.546 ( -1.917 -0.673 -0.348) 2.062 16.546 ( -1.917 0.673 -0.348) 2.062 16.792 ( -3.083 -2.887 -0.656) 4.275 16.792 ( -3.083 2.887 -0.656) 4.275 20.427 ( -1.755 -7.328 0.913) 7.591 20.427 ( -1.755 7.328 0.913) 7.591 20.495 ( 1.209 -7.707 0.344) 7.809 20.495 ( 1.209 7.707 0.344) 7.809 21.092 ( -6.967 -1.513 16.936) 18.376 21.092 ( -6.967 1.513 16.936) 18.376 21.281 ( 1.480 -3.483 -18.151) 18.541 21.281 ( 1.480 3.483 -18.151) 18.541 24.722 ( 1.226 -0.838 5.135) 5.345 24.722 ( 1.226 0.838 5.135) 5.345 25.119 ( 15.547 -2.152 -6.334) 16.925 25.119 ( 15.547 2.152 -6.334) 16.925 26.561 ( -5.533 -2.318 -16.667) 17.714 26.561 ( -5.533 2.318 -16.667) 17.714 26.804 ( -3.785 -3.006 16.991) 17.665 26.804 ( -3.785 3.006 16.991) 17.665 29.424 ( 1.325 -5.092 0.821) 5.325 29.424 ( 1.325 5.092 0.821) 5.325 29.753 ( -1.761 -6.121 -1.623) 6.573 29.753 ( -1.761 6.121 -1.623) 6.573 30.585 ( 0.443 -7.782 -2.666) 8.238 30.585 ( 0.443 7.782 -2.666) 8.238 30.781 ( 2.552 -9.616 4.899) 11.090 30.781 ( 2.552 9.616 4.899) 11.090 31.516 ( -0.987 -4.055 0.861) 4.261 31.516 ( -0.987 4.055 0.861) 4.261 31.705 ( 3.904 -8.352 -7.626) 11.965 31.705 ( 3.904 8.352 -7.626) 11.965 32.274 ( -2.758 -1.908 0.746) 3.435 32.274 ( -2.758 1.908 0.746) 3.435 32.617 ( -3.004 -4.237 4.787) 7.063 32.617 ( -3.004 4.237 4.787) 7.063 ======================= Grid point 247 (127/128) ======================= q-point: ( 0.33 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.362 ( 6.360 -3.698 -3.793) 8.278 3.362 ( 6.360 3.698 -3.793) 8.278 3.601 ( -3.729 -7.595 5.504) 10.094 3.601 ( -3.729 7.595 5.504) 10.094 4.027 ( 10.376 -12.275 -9.181) 18.510 4.027 ( 10.376 12.275 -9.181) 18.510 4.348 ( -3.915 -1.990 3.035) 5.339 4.348 ( -3.915 1.990 3.035) 5.339 4.522 ( -1.195 -2.856 -5.321) 6.156 4.522 ( -1.195 2.856 -5.321) 6.156 4.809 ( -11.561 -10.138 3.642) 15.802 4.809 ( -11.561 10.138 3.642) 15.802 5.302 ( -2.672 -2.456 14.591) 15.035 5.302 ( -2.672 2.456 14.591) 15.035 5.595 ( -6.373 -3.358 -14.294) 16.007 5.595 ( -6.373 3.358 -14.294) 16.007 5.903 ( 5.424 -5.374 5.633) 9.488 5.903 ( 5.424 5.374 5.633) 9.488 6.194 ( -3.526 -3.933 -3.271) 6.213 6.194 ( -3.526 3.933 -3.271) 6.213 6.942 ( 10.721 -3.813 1.192) 11.441 6.942 ( 10.721 3.813 1.192) 11.441 7.122 ( 7.038 -1.749 1.091) 7.334 7.122 ( 7.038 1.749 1.091) 7.334 7.389 ( 2.669 -3.938 5.216) 7.059 7.389 ( 2.669 3.938 5.216) 7.059 7.571 ( 11.121 -3.342 3.946) 12.264 7.571 ( 11.121 3.342 3.946) 12.264 7.806 ( 1.072 -2.895 -6.775) 7.445 7.806 ( 1.072 2.895 -6.775) 7.445 7.968 ( 2.529 -4.468 -0.686) 5.180 7.968 ( 2.529 4.468 -0.686) 5.180 8.277 ( 1.789 -0.419 -6.502) 6.757 8.277 ( 1.789 0.419 -6.502) 6.757 8.283 ( -0.666 -5.741 -5.673) 8.098 8.283 ( -0.666 5.741 -5.673) 8.098 8.624 ( -5.926 -2.806 5.327) 8.448 8.624 ( -5.926 2.806 5.327) 8.448 8.754 ( -3.261 -8.021 2.277) 8.953 8.754 ( -3.261 8.021 2.277) 8.953 8.900 ( -6.453 -1.516 3.617) 7.551 8.900 ( -6.453 1.516 3.617) 7.551 9.168 ( -0.825 -3.106 3.323) 4.623 9.168 ( -0.825 3.106 3.323) 4.623 9.355 ( 2.706 -2.541 -3.189) 4.894 9.355 ( 2.706 2.541 -3.189) 4.894 9.484 ( 3.121 -1.269 -3.941) 5.185 9.484 ( 3.121 1.269 -3.941) 5.185 9.770 ( -2.781 -2.835 0.401) 3.991 9.770 ( -2.781 2.835 0.401) 3.991 10.142 ( -8.360 -7.044 -3.677) 11.534 10.142 ( -8.360 7.044 -3.677) 11.534 10.358 ( -1.538 -6.290 4.372) 7.813 10.358 ( -1.538 6.290 4.372) 7.813 10.536 ( -0.499 -3.586 3.673) 5.158 10.536 ( -0.499 3.586 3.673) 5.158 10.883 ( -1.102 -8.499 1.622) 8.722 10.883 ( -1.102 8.499 1.622) 8.722 11.154 ( 1.000 -3.920 -2.084) 4.551 11.154 ( 1.000 3.920 -2.084) 4.551 11.324 ( 6.949 -11.383 -8.150) 15.630 11.324 ( 6.949 11.383 -8.150) 15.630 11.683 ( -12.532 -7.421 5.970) 15.740 11.683 ( -12.532 7.421 5.970) 15.740 12.540 ( 6.853 -0.712 1.721) 7.102 12.540 ( 6.853 0.712 1.721) 7.102 12.727 ( 0.368 -0.923 -0.588) 1.155 12.727 ( 0.368 0.923 -0.588) 1.155 12.943 ( -2.366 -2.855 -2.148) 4.285 12.943 ( -2.366 2.855 -2.148) 4.285 13.271 ( -1.159 -1.980 2.790) 3.612 13.271 ( -1.159 1.980 2.790) 3.612 13.983 ( 5.343 -2.481 1.810) 6.163 13.983 ( 5.343 2.481 1.810) 6.163 14.218 ( -4.139 -1.440 -3.832) 5.821 14.218 ( -4.139 1.440 -3.832) 5.821 14.495 ( 7.596 -2.913 5.293) 9.705 14.495 ( 7.596 2.913 5.293) 9.705 14.893 ( -9.076 -3.410 -4.501) 10.689 14.893 ( -9.076 3.410 -4.501) 10.689 16.047 ( 4.100 -3.424 4.715) 7.125 16.047 ( 4.100 3.424 4.715) 7.125 16.233 ( 2.373 -2.927 -2.305) 4.417 16.233 ( 2.373 2.927 -2.305) 4.417 16.523 ( 0.834 -2.032 -0.391) 2.231 16.523 ( 0.834 2.032 -0.391) 2.231 16.710 ( -5.392 -4.734 -0.804) 7.221 16.710 ( -5.392 4.734 -0.804) 7.221 20.404 ( -1.307 -4.819 2.248) 5.476 20.404 ( -1.307 4.819 2.248) 5.476 20.510 ( 0.656 -5.621 -1.347) 5.817 20.510 ( 0.656 5.621 -1.347) 5.817 21.055 ( -5.012 -4.979 22.073) 23.176 21.055 ( -5.012 4.979 22.073) 23.176 21.202 ( -0.469 -5.816 -23.059) 23.786 21.202 ( -0.469 5.816 -23.059) 23.786 24.873 ( 11.244 -2.029 8.762) 14.398 24.873 ( 11.244 2.029 8.762) 14.398 25.288 ( 4.036 -2.740 -10.829) 11.877 25.288 ( 4.036 2.740 -10.829) 11.877 26.455 ( 2.643 -2.681 -13.634) 14.144 26.455 ( 2.643 2.681 -13.634) 14.144 26.736 ( -10.395 -2.770 14.944) 18.413 26.736 ( -10.395 2.770 14.944) 18.413 29.471 ( 3.266 -7.717 1.509) 8.514 29.471 ( 3.266 7.717 1.509) 8.514 29.691 ( -3.923 -8.684 -2.272) 9.796 29.691 ( -3.923 8.684 -2.272) 9.796 30.598 ( 1.823 -6.682 -2.131) 7.246 30.598 ( 1.823 6.682 -2.131) 7.246 30.837 ( 1.039 -8.613 4.561) 9.801 30.837 ( 1.039 8.613 4.561) 9.801 31.533 ( 2.460 -3.817 2.519) 5.193 31.533 ( 2.460 3.817 2.519) 5.193 31.709 ( -0.107 -8.231 -10.745) 13.536 31.709 ( -0.107 8.231 -10.745) 13.536 32.246 ( -0.295 -1.183 2.082) 2.412 32.246 ( -0.295 1.183 2.082) 2.412 32.564 ( -4.501 -4.873 4.693) 8.126 32.564 ( -4.501 4.873 4.693) 8.126 ======================= Grid point 249 (128/128) ======================= q-point: (-0.50 -0.50 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 64 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.439 ( 0.000 -0.000 -0.000) 0.000 3.439 ( 0.000 0.000 -0.000) 0.000 3.552 ( 0.000 -0.000 -0.000) 0.000 3.552 ( -0.000 0.000 0.000) 0.000 4.141 ( 0.000 -0.000 -0.000) 0.000 4.141 ( 0.000 0.000 -0.000) 0.000 4.291 ( 0.000 -0.000 0.000) 0.000 4.291 ( -0.000 0.000 0.000) 0.000 4.515 ( 0.000 -0.000 -0.000) 0.000 4.515 ( 0.000 0.000 -0.000) 0.000 4.682 ( -0.000 0.000 -0.000) 0.000 4.682 ( 0.000 -0.000 0.000) 0.000 5.333 ( 0.000 0.000 -0.000) 0.000 5.333 ( 0.000 0.000 -0.000) 0.000 5.475 ( 0.000 0.000 -0.000) 0.000 5.475 ( 0.000 0.000 0.000) 0.000 6.006 ( -0.000 0.000 -0.000) 0.000 6.006 ( 0.000 0.000 -0.000) 0.000 6.121 ( -0.000 -0.000 -0.000) 0.000 6.121 ( 0.000 0.000 0.000) 0.000 7.052 ( 0.000 0.000 -0.000) 0.000 7.052 ( 0.000 0.000 -0.000) 0.000 7.193 ( 0.000 0.000 -0.000) 0.000 7.193 ( 0.000 0.000 0.000) 0.000 7.416 ( 0.000 -0.000 -0.000) 0.000 7.416 ( 0.000 0.000 -0.000) 0.000 7.648 ( 0.000 -0.000 -0.000) 0.000 7.648 ( 0.000 0.000 0.000) 0.000 7.927 ( -0.000 -0.000 0.000) 0.000 7.927 ( -0.000 0.000 -0.000) 0.000 7.940 ( -0.000 0.000 0.000) 0.000 7.940 ( 0.000 0.000 -0.000) 0.000 8.217 ( 0.000 0.000 -0.000) 0.000 8.217 ( 0.000 -0.000 0.000) 0.000 8.339 ( 0.000 -0.000 -0.000) 0.000 8.339 ( 0.000 0.000 0.000) 0.000 8.555 ( -0.000 0.000 -0.000) 0.000 8.555 ( -0.000 0.000 0.000) 0.000 8.723 ( 0.000 0.000 -0.000) 0.000 8.723 ( 0.000 0.000 0.000) 0.000 8.821 ( 0.000 0.000 -0.000) 0.000 8.821 ( -0.000 0.000 0.000) 0.000 9.167 ( 0.000 0.000 -0.000) 0.000 9.167 ( 0.000 0.000 -0.000) 0.000 9.395 ( 0.000 -0.000 -0.000) 0.000 9.395 ( 0.000 0.000 -0.000) 0.000 9.504 ( 0.000 0.000 -0.000) 0.000 9.504 ( 0.000 0.000 0.000) 0.000 9.758 ( 0.000 -0.000 -0.000) 0.000 9.758 ( 0.000 0.000 -0.000) 0.000 10.030 ( 0.000 0.000 -0.000) 0.000 10.030 ( 0.000 0.000 -0.000) 0.000 10.353 ( 0.000 -0.000 -0.000) 0.000 10.353 ( 0.000 0.000 -0.000) 0.000 10.535 ( 0.000 0.000 -0.000) 0.000 10.535 ( 0.000 0.000 0.000) 0.000 10.878 ( 0.000 -0.000 -0.000) 0.000 10.878 ( 0.000 0.000 -0.000) 0.000 11.160 ( 0.000 -0.000 -0.000) 0.000 11.160 ( 0.000 -0.000 -0.000) 0.000 11.417 ( 0.000 0.000 -0.000) 0.000 11.417 ( -0.000 0.000 0.000) 0.000 11.532 ( 0.000 -0.000 -0.000) 0.000 11.532 ( -0.000 -0.000 0.000) 0.000 12.665 ( 0.000 0.000 -0.000) 0.000 12.665 ( 0.000 -0.000 0.000) 0.000 12.669 ( -0.000 0.000 -0.000) 0.000 12.669 ( -0.000 0.000 0.000) 0.000 12.923 ( 0.000 0.000 -0.000) 0.000 12.923 ( 0.000 0.000 -0.000) 0.000 13.264 ( 0.000 0.000 -0.000) 0.000 13.264 ( 0.000 0.000 -0.000) 0.000 14.075 ( 0.000 0.000 -0.000) 0.000 14.075 ( 0.000 0.000 -0.000) 0.000 14.133 ( -0.000 0.000 -0.000) 0.000 14.133 ( 0.000 -0.000 0.000) 0.000 14.625 ( -0.000 0.000 -0.000) 0.000 14.625 ( 0.000 0.000 -0.000) 0.000 14.749 ( 0.000 0.000 -0.000) 0.000 14.749 ( 0.000 0.000 -0.000) 0.000 16.122 ( 0.000 0.000 -0.000) 0.000 16.122 ( 0.000 -0.000 0.000) 0.000 16.220 ( -0.000 0.000 -0.000) 0.000 16.220 ( 0.000 0.000 -0.000) 0.000 16.574 ( -0.000 0.000 -0.000) 0.000 16.574 ( -0.000 0.000 -0.000) 0.000 16.619 ( 0.000 -0.000 -0.000) 0.000 16.619 ( 0.000 0.000 -0.000) 0.000 20.397 ( 0.000 0.000 -0.000) 0.000 20.397 ( 0.000 0.000 -0.000) 0.000 20.512 ( -0.000 0.000 0.000) 0.000 20.512 ( -0.000 -0.000 0.000) 0.000 21.080 ( 0.000 -0.000 -0.000) 0.000 21.080 ( 0.000 0.000 -0.000) 0.000 21.121 ( -0.000 -0.000 0.000) 0.000 21.121 ( -0.000 0.000 0.000) 0.000 25.094 ( 0.000 0.000 0.000) 0.000 25.094 ( 0.000 0.000 0.000) 0.000 25.203 ( -0.000 -0.000 -0.000) 0.000 25.203 ( -0.000 0.000 -0.000) 0.000 26.524 ( -0.000 0.000 0.000) 0.000 26.524 ( -0.000 0.000 0.000) 0.000 26.605 ( 0.000 0.000 -0.000) 0.000 26.605 ( 0.000 0.000 -0.000) 0.000 29.525 ( -0.000 0.000 -0.000) 0.000 29.525 ( 0.000 0.000 -0.000) 0.000 29.629 ( -0.000 -0.000 -0.000) 0.000 29.629 ( 0.000 0.000 -0.000) 0.000 30.615 ( -0.000 -0.000 -0.000) 0.000 30.615 ( 0.000 0.000 -0.000) 0.000 30.854 ( 0.000 0.000 -0.000) 0.000 30.854 ( 0.000 0.000 -0.000) 0.000 31.603 ( 0.000 -0.000 -0.000) 0.000 31.603 ( 0.000 0.000 -0.000) 0.000 31.641 ( -0.000 -0.000 0.000) 0.000 31.641 ( -0.000 0.000 0.000) 0.000 32.259 ( 0.000 0.000 -0.000) 0.000 32.259 ( 0.000 0.000 -0.000) 0.000 32.523 ( -0.000 0.000 -0.000) 0.000 32.523 ( 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 3/43200 10.0 1805.047 1671.236 704.967 0.000 -7.007 0.000 3/43200 20.0 635.870 620.928 449.568 0.000 -101.285 0.000 3/43200 30.0 236.943 214.606 198.612 0.000 -35.887 0.000 3/43200 40.0 113.586 103.822 107.174 0.000 -17.646 0.000 3/43200 50.0 65.185 60.148 66.365 0.000 -10.476 0.000 3/43200 60.0 42.071 39.098 45.249 0.000 -6.978 0.000 3/43200 70.0 29.515 27.582 33.169 0.000 -5.044 0.000 3/43200 80.0 22.039 20.684 25.689 0.000 -3.874 0.000 3/43200 90.0 17.264 16.254 20.752 0.000 -3.115 0.000 3/43200 100.0 14.038 13.248 17.317 0.000 -2.595 0.000 3/43200 110.0 11.757 11.114 14.826 0.000 -2.221 0.000 3/43200 120.0 10.081 9.542 12.954 0.000 -1.942 0.000 3/43200 130.0 8.810 8.348 11.508 0.000 -1.728 0.000 3/43200 140.0 7.820 7.415 10.363 0.000 -1.559 0.000 3/43200 150.0 7.031 6.670 9.438 0.000 -1.423 0.000 3/43200 160.0 6.390 6.063 8.677 0.000 -1.312 0.000 3/43200 170.0 5.859 5.561 8.043 0.000 -1.219 0.000 3/43200 180.0 5.415 5.138 7.507 0.000 -1.140 0.000 3/43200 190.0 5.037 4.778 7.049 0.000 -1.073 0.000 3/43200 200.0 4.712 4.469 6.653 0.000 -1.015 0.000 3/43200 210.0 4.430 4.199 6.308 0.000 -0.964 0.000 3/43200 220.0 4.184 3.962 6.004 0.000 -0.920 0.000 3/43200 230.0 3.966 3.753 5.735 0.000 -0.880 0.000 3/43200 240.0 3.773 3.566 5.494 0.000 -0.845 0.000 3/43200 250.0 3.600 3.399 5.278 0.000 -0.813 0.000 3/43200 260.0 3.445 3.248 5.082 0.000 -0.784 0.000 3/43200 270.0 3.304 3.111 4.904 0.000 -0.757 0.000 3/43200 280.0 3.176 2.986 4.740 0.000 -0.733 0.000 3/43200 290.0 3.059 2.872 4.590 0.000 -0.711 0.000 3/43200 300.0 2.951 2.767 4.452 0.000 -0.690 0.000 3/43200 310.0 2.852 2.671 4.323 0.000 -0.671 0.000 3/43200 320.0 2.761 2.581 4.204 0.000 -0.652 0.000 3/43200 330.0 2.676 2.498 4.092 0.000 -0.636 0.000 3/43200 340.0 2.597 2.421 3.987 0.000 -0.620 0.000 3/43200 350.0 2.523 2.348 3.888 0.000 -0.605 0.000 3/43200 360.0 2.453 2.280 3.795 0.000 -0.591 0.000 3/43200 370.0 2.388 2.217 3.707 0.000 -0.577 0.000 3/43200 380.0 2.327 2.157 3.624 0.000 -0.564 0.000 3/43200 390.0 2.269 2.101 3.544 0.000 -0.552 0.000 3/43200 400.0 2.215 2.047 3.469 0.000 -0.541 0.000 3/43200 410.0 2.163 1.997 3.397 0.000 -0.530 0.000 3/43200 420.0 2.114 1.949 3.329 0.000 -0.519 0.000 3/43200 430.0 2.067 1.904 3.263 0.000 -0.509 0.000 3/43200 440.0 2.022 1.861 3.200 0.000 -0.499 0.000 3/43200 450.0 1.980 1.819 3.140 0.000 -0.490 0.000 3/43200 460.0 1.939 1.780 3.082 0.000 -0.481 0.000 3/43200 470.0 1.901 1.743 3.026 0.000 -0.473 0.000 3/43200 480.0 1.863 1.707 2.972 0.000 -0.464 0.000 3/43200 490.0 1.828 1.673 2.921 0.000 -0.456 0.000 3/43200 500.0 1.794 1.640 2.871 0.000 -0.449 0.000 3/43200 510.0 1.761 1.608 2.823 0.000 -0.441 0.000 3/43200 520.0 1.729 1.578 2.776 0.000 -0.434 0.000 3/43200 530.0 1.699 1.549 2.731 0.000 -0.427 0.000 3/43200 540.0 1.669 1.521 2.688 0.000 -0.420 0.000 3/43200 550.0 1.641 1.494 2.645 0.000 -0.414 0.000 3/43200 560.0 1.614 1.468 2.605 0.000 -0.407 0.000 3/43200 570.0 1.587 1.442 2.565 0.000 -0.401 0.000 3/43200 580.0 1.562 1.418 2.527 0.000 -0.395 0.000 3/43200 590.0 1.537 1.395 2.489 0.000 -0.389 0.000 3/43200 600.0 1.513 1.372 2.453 0.000 -0.384 0.000 3/43200 610.0 1.490 1.350 2.418 0.000 -0.378 0.000 3/43200 620.0 1.467 1.329 2.384 0.000 -0.373 0.000 3/43200 630.0 1.446 1.309 2.351 0.000 -0.368 0.000 3/43200 640.0 1.424 1.289 2.318 0.000 -0.363 0.000 3/43200 650.0 1.404 1.270 2.287 0.000 -0.358 0.000 3/43200 660.0 1.384 1.251 2.256 0.000 -0.353 0.000 3/43200 670.0 1.365 1.233 2.226 0.000 -0.348 0.000 3/43200 680.0 1.346 1.215 2.197 0.000 -0.344 0.000 3/43200 690.0 1.328 1.198 2.169 0.000 -0.339 0.000 3/43200 700.0 1.310 1.181 2.141 0.000 -0.335 0.000 3/43200 710.0 1.292 1.165 2.114 0.000 -0.331 0.000 3/43200 720.0 1.276 1.150 2.088 0.000 -0.327 0.000 3/43200 730.0 1.259 1.134 2.063 0.000 -0.323 0.000 3/43200 740.0 1.243 1.119 2.038 0.000 -0.319 0.000 3/43200 750.0 1.228 1.105 2.013 0.000 -0.315 0.000 3/43200 760.0 1.212 1.091 1.989 0.000 -0.311 0.000 3/43200 770.0 1.197 1.077 1.966 0.000 -0.308 0.000 3/43200 780.0 1.183 1.064 1.943 0.000 -0.304 0.000 3/43200 790.0 1.169 1.050 1.921 0.000 -0.300 0.000 3/43200 800.0 1.155 1.038 1.899 0.000 -0.297 0.000 3/43200 810.0 1.141 1.025 1.878 0.000 -0.294 0.000 3/43200 820.0 1.128 1.013 1.857 0.000 -0.290 0.000 3/43200 830.0 1.115 1.001 1.836 0.000 -0.287 0.000 3/43200 840.0 1.103 0.990 1.816 0.000 -0.284 0.000 3/43200 850.0 1.091 0.978 1.797 0.000 -0.281 0.000 3/43200 860.0 1.078 0.967 1.778 0.000 -0.278 0.000 3/43200 870.0 1.067 0.956 1.759 0.000 -0.275 0.000 3/43200 880.0 1.055 0.946 1.740 0.000 -0.272 0.000 3/43200 890.0 1.044 0.935 1.722 0.000 -0.269 0.000 3/43200 900.0 1.033 0.925 1.705 0.000 -0.267 0.000 3/43200 910.0 1.022 0.915 1.687 0.000 -0.264 0.000 3/43200 920.0 1.011 0.906 1.671 0.000 -0.261 0.000 3/43200 930.0 1.001 0.896 1.654 0.000 -0.259 0.000 3/43200 940.0 0.991 0.887 1.638 0.000 -0.256 0.000 3/43200 950.0 0.981 0.878 1.622 0.000 -0.254 0.000 3/43200 960.0 0.971 0.869 1.606 0.000 -0.251 0.000 3/43200 970.0 0.962 0.860 1.590 0.000 -0.249 0.000 3/43200 980.0 0.952 0.852 1.575 0.000 -0.246 0.000 3/43200 990.0 0.943 0.843 1.561 0.000 -0.244 0.000 3/43200 1000.0 0.934 0.835 1.546 0.000 -0.242 0.000 3/43200 Thermal conductivity related properties were written into "kappa-m6610.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 22:11:30]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|