----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 20:42:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.262742441199689 0.000000000000000 0.000000000000000 b 0.000000000000000 7.533533780000000 0.000000000000000 c -2.241061864318618 0.000000000000000 6.600106089816574 Atomic positions (fractional): *1 O 0.11205644953176 0.12609498793905 0.45305876917624 15.999 2 O 0.88794355046825 0.62609498793905 0.04694123082376 15.999 3 O 0.88794355046825 0.87390501206095 0.54694123082376 15.999 4 O 0.11205644953176 0.37390501206095 0.95305876917624 15.999 *5 O 0.41020016224166 0.75631384213199 0.05369565261253 15.999 6 O 0.58979983775834 0.25631384213198 0.44630434738746 15.999 7 O 0.58979983775834 0.24368615786802 0.94630434738747 15.999 8 O 0.41020016224166 0.74368615786801 0.55369565261253 15.999 *9 O 0.11854882013587 0.86779239687838 0.99342107279897 15.999 10 O 0.88145117986413 0.36779239687838 0.50657892720103 15.999 11 O 0.88145117986413 0.13220760312162 0.00657892720103 15.999 12 O 0.11854882013587 0.63220760312162 0.49342107279897 15.999 *13 O 0.29116734581430 0.42517925758367 0.36630410675992 15.999 14 O 0.70883265418569 0.92517925758368 0.13369589324008 15.999 15 O 0.70883265418569 0.57482074241632 0.63369589324008 15.999 16 O 0.29116734581430 0.07482074241632 0.86630410675992 15.999 *17 O 0.36657061376842 0.46168763794552 0.75396899302834 15.999 18 O 0.63342938623158 0.96168763794552 0.74603100697166 15.999 19 O 0.63342938623158 0.53831236205448 0.24603100697166 15.999 20 O 0.36657061376842 0.03831236205448 0.25396899302834 15.999 *21 Si 0.29891598312238 0.92381821326558 0.04256147132392 28.085 22 Si 0.70108401687762 0.42381821326558 0.45743852867608 28.085 23 Si 0.70108401687762 0.07618178673442 0.95743852867608 28.085 24 Si 0.29891598312238 0.57618178673442 0.54256147132392 28.085 *25 La 0.98782259287719 0.87487311147607 0.26647633261910 138.905 26 La 0.01217740712281 0.37487311147607 0.23352366738090 138.905 27 La 0.01217740712281 0.12512688852393 0.73352366738090 138.905 28 La 0.98782259287719 0.62512688852393 0.76647633261910 138.905 *29 La 0.38914003322049 0.34355296187291 0.09414861149218 138.905 30 La 0.61085996677951 0.84355296187291 0.40585138850782 138.905 31 La 0.61085996677951 0.65644703812709 0.90585138850782 138.905 32 La 0.38914003322049 0.15644703812709 0.59414861149218 138.905 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.262742441199689 0.000000000000000 0.000000000000000 b 0.000000000000000 7.533533780000000 0.000000000000000 c -2.241061864318618 0.000000000000000 6.600106089816574 Atomic positions (fractional): *1 O 0.11205644953176 0.12609498793905 0.45305876917624 15.999 > 1 2 O 0.88794355046825 0.62609498793905 0.04694123082376 15.999 > 2 3 O 0.88794355046825 0.87390501206095 0.54694123082376 15.999 > 3 4 O 0.11205644953176 0.37390501206095 0.95305876917624 15.999 > 4 *5 O 0.41020016224166 0.75631384213199 0.05369565261253 15.999 > 5 6 O 0.58979983775834 0.25631384213198 0.44630434738746 15.999 > 6 7 O 0.58979983775834 0.24368615786802 0.94630434738747 15.999 > 7 8 O 0.41020016224166 0.74368615786801 0.55369565261253 15.999 > 8 *9 O 0.11854882013587 0.86779239687838 0.99342107279897 15.999 > 9 10 O 0.88145117986413 0.36779239687838 0.50657892720103 15.999 > 10 11 O 0.88145117986413 0.13220760312162 0.00657892720103 15.999 > 11 12 O 0.11854882013587 0.63220760312162 0.49342107279897 15.999 > 12 *13 O 0.29116734581430 0.42517925758367 0.36630410675992 15.999 > 13 14 O 0.70883265418569 0.92517925758368 0.13369589324008 15.999 > 14 15 O 0.70883265418569 0.57482074241632 0.63369589324008 15.999 > 15 16 O 0.29116734581430 0.07482074241632 0.86630410675992 15.999 > 16 *17 O 0.36657061376842 0.46168763794552 0.75396899302834 15.999 > 17 18 O 0.63342938623158 0.96168763794552 0.74603100697166 15.999 > 18 19 O 0.63342938623158 0.53831236205448 0.24603100697166 15.999 > 19 20 O 0.36657061376842 0.03831236205448 0.25396899302834 15.999 > 20 *21 Si 0.29891598312238 0.92381821326558 0.04256147132392 28.085 > 21 22 Si 0.70108401687762 0.42381821326558 0.45743852867608 28.085 > 22 23 Si 0.70108401687762 0.07618178673442 0.95743852867608 28.085 > 23 24 Si 0.29891598312238 0.57618178673442 0.54256147132392 28.085 > 24 *25 La 0.98782259287719 0.87487311147607 0.26647633261910 138.905 > 25 26 La 0.01217740712281 0.37487311147607 0.23352366738090 138.905 > 26 27 La 0.01217740712281 0.12512688852393 0.73352366738090 138.905 > 27 28 La 0.98782259287719 0.62512688852393 0.76647633261910 138.905 > 28 *29 La 0.38914003322049 0.34355296187291 0.09414861149218 138.905 > 29 30 La 0.61085996677951 0.84355296187291 0.40585138850782 138.905 > 30 31 La 0.61085996677951 0.65644703812709 0.90585138850782 138.905 > 31 32 La 0.38914003322049 0.15644703812709 0.59414861149218 138.905 > 32 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.262742441199689 0.000000000000000 0.000000000000000 b 0.000000000000000 15.067067560000000 0.000000000000000 c -4.482123728637236 0.000000000000000 13.200212179633148 Atomic positions (fractional): *1 O 0.11205644953176 0.06304749396953 0.22652938458812 15.999 > 1 2 O 0.11205644953176 0.56304749396953 0.22652938458812 15.999 > 1 3 O 0.11205644953176 0.06304749396953 0.72652938458812 15.999 > 1 4 O 0.11205644953176 0.56304749396953 0.72652938458812 15.999 > 1 5 O 0.88794355046825 0.31304749396953 0.02347061541188 15.999 > 2 6 O 0.88794355046825 0.81304749396953 0.02347061541188 15.999 > 2 7 O 0.88794355046825 0.31304749396953 0.52347061541188 15.999 > 2 8 O 0.88794355046825 0.81304749396953 0.52347061541188 15.999 > 2 9 O 0.88794355046825 0.43695250603047 0.27347061541188 15.999 > 3 10 O 0.88794355046825 0.93695250603047 0.27347061541188 15.999 > 3 11 O 0.88794355046825 0.43695250603047 0.77347061541188 15.999 > 3 12 O 0.88794355046825 0.93695250603047 0.77347061541188 15.999 > 3 13 O 0.11205644953176 0.18695250603047 0.47652938458812 15.999 > 4 14 O 0.11205644953176 0.68695250603047 0.47652938458812 15.999 > 4 15 O 0.11205644953176 0.18695250603047 0.97652938458812 15.999 > 4 16 O 0.11205644953176 0.68695250603047 0.97652938458812 15.999 > 4 *17 O 0.41020016224166 0.37815692106599 0.02684782630627 15.999 > 5 18 O 0.41020016224166 0.87815692106599 0.02684782630627 15.999 > 5 19 O 0.41020016224166 0.37815692106599 0.52684782630627 15.999 > 5 20 O 0.41020016224166 0.87815692106599 0.52684782630627 15.999 > 5 21 O 0.58979983775834 0.12815692106599 0.22315217369373 15.999 > 6 22 O 0.58979983775834 0.62815692106599 0.22315217369373 15.999 > 6 23 O 0.58979983775834 0.12815692106599 0.72315217369373 15.999 > 6 24 O 0.58979983775834 0.62815692106599 0.72315217369373 15.999 > 6 25 O 0.58979983775834 0.12184307893401 0.47315217369373 15.999 > 7 26 O 0.58979983775834 0.62184307893401 0.47315217369373 15.999 > 7 27 O 0.58979983775834 0.12184307893401 0.97315217369373 15.999 > 7 28 O 0.58979983775834 0.62184307893401 0.97315217369373 15.999 > 7 29 O 0.41020016224166 0.37184307893401 0.27684782630627 15.999 > 8 30 O 0.41020016224166 0.87184307893401 0.27684782630627 15.999 > 8 31 O 0.41020016224166 0.37184307893401 0.77684782630627 15.999 > 8 32 O 0.41020016224166 0.87184307893401 0.77684782630627 15.999 > 8 *33 O 0.11854882013587 0.43389619843919 0.49671053639948 15.999 > 9 34 O 0.11854882013587 0.93389619843919 0.49671053639948 15.999 > 9 35 O 0.11854882013587 0.43389619843919 0.99671053639948 15.999 > 9 36 O 0.11854882013587 0.93389619843919 0.99671053639948 15.999 > 9 37 O 0.88145117986413 0.18389619843919 0.25328946360052 15.999 > 10 38 O 0.88145117986413 0.68389619843919 0.25328946360052 15.999 > 10 39 O 0.88145117986413 0.18389619843919 0.75328946360052 15.999 > 10 40 O 0.88145117986413 0.68389619843919 0.75328946360052 15.999 > 10 41 O 0.88145117986413 0.06610380156081 0.00328946360052 15.999 > 11 42 O 0.88145117986413 0.56610380156081 0.00328946360052 15.999 > 11 43 O 0.88145117986413 0.06610380156081 0.50328946360052 15.999 > 11 44 O 0.88145117986413 0.56610380156081 0.50328946360052 15.999 > 11 45 O 0.11854882013587 0.31610380156081 0.24671053639948 15.999 > 12 46 O 0.11854882013587 0.81610380156081 0.24671053639948 15.999 > 12 47 O 0.11854882013587 0.31610380156081 0.74671053639948 15.999 > 12 48 O 0.11854882013587 0.81610380156081 0.74671053639948 15.999 > 12 *49 O 0.29116734581430 0.21258962879184 0.18315205337996 15.999 > 13 50 O 0.29116734581430 0.71258962879184 0.18315205337996 15.999 > 13 51 O 0.29116734581430 0.21258962879184 0.68315205337996 15.999 > 13 52 O 0.29116734581430 0.71258962879184 0.68315205337996 15.999 > 13 53 O 0.70883265418569 0.46258962879184 0.06684794662004 15.999 > 14 54 O 0.70883265418569 0.96258962879184 0.06684794662004 15.999 > 14 55 O 0.70883265418569 0.46258962879184 0.56684794662004 15.999 > 14 56 O 0.70883265418569 0.96258962879184 0.56684794662004 15.999 > 14 57 O 0.70883265418569 0.28741037120816 0.31684794662004 15.999 > 15 58 O 0.70883265418569 0.78741037120816 0.31684794662004 15.999 > 15 59 O 0.70883265418569 0.28741037120816 0.81684794662004 15.999 > 15 60 O 0.70883265418569 0.78741037120816 0.81684794662004 15.999 > 15 61 O 0.29116734581430 0.03741037120816 0.43315205337996 15.999 > 16 62 O 0.29116734581430 0.53741037120816 0.43315205337996 15.999 > 16 63 O 0.29116734581430 0.03741037120816 0.93315205337996 15.999 > 16 64 O 0.29116734581430 0.53741037120816 0.93315205337996 15.999 > 16 *65 O 0.36657061376842 0.23084381897276 0.37698449651417 15.999 > 17 66 O 0.36657061376842 0.73084381897276 0.37698449651417 15.999 > 17 67 O 0.36657061376842 0.23084381897276 0.87698449651417 15.999 > 17 68 O 0.36657061376842 0.73084381897276 0.87698449651417 15.999 > 17 69 O 0.63342938623158 0.48084381897276 0.37301550348583 15.999 > 18 70 O 0.63342938623158 0.98084381897276 0.37301550348583 15.999 > 18 71 O 0.63342938623158 0.48084381897276 0.87301550348583 15.999 > 18 72 O 0.63342938623158 0.98084381897276 0.87301550348583 15.999 > 18 73 O 0.63342938623158 0.26915618102724 0.12301550348583 15.999 > 19 74 O 0.63342938623158 0.76915618102724 0.12301550348583 15.999 > 19 75 O 0.63342938623158 0.26915618102724 0.62301550348583 15.999 > 19 76 O 0.63342938623158 0.76915618102724 0.62301550348583 15.999 > 19 77 O 0.36657061376842 0.01915618102724 0.12698449651417 15.999 > 20 78 O 0.36657061376842 0.51915618102724 0.12698449651417 15.999 > 20 79 O 0.36657061376842 0.01915618102724 0.62698449651417 15.999 > 20 80 O 0.36657061376842 0.51915618102724 0.62698449651417 15.999 > 20 *81 Si 0.29891598312238 0.46190910663279 0.02128073566196 28.085 > 21 82 Si 0.29891598312238 0.96190910663279 0.02128073566196 28.085 > 21 83 Si 0.29891598312238 0.46190910663279 0.52128073566196 28.085 > 21 84 Si 0.29891598312238 0.96190910663279 0.52128073566196 28.085 > 21 85 Si 0.70108401687762 0.21190910663279 0.22871926433804 28.085 > 22 86 Si 0.70108401687762 0.71190910663279 0.22871926433804 28.085 > 22 87 Si 0.70108401687762 0.21190910663279 0.72871926433804 28.085 > 22 88 Si 0.70108401687762 0.71190910663279 0.72871926433804 28.085 > 22 89 Si 0.70108401687762 0.03809089336721 0.47871926433804 28.085 > 23 90 Si 0.70108401687762 0.53809089336721 0.47871926433804 28.085 > 23 91 Si 0.70108401687762 0.03809089336721 0.97871926433804 28.085 > 23 92 Si 0.70108401687762 0.53809089336721 0.97871926433804 28.085 > 23 93 Si 0.29891598312238 0.28809089336721 0.27128073566196 28.085 > 24 94 Si 0.29891598312238 0.78809089336721 0.27128073566196 28.085 > 24 95 Si 0.29891598312238 0.28809089336721 0.77128073566196 28.085 > 24 96 Si 0.29891598312238 0.78809089336721 0.77128073566196 28.085 > 24 *97 La 0.98782259287719 0.43743655573804 0.13323816630955 138.905 > 25 98 La 0.98782259287719 0.93743655573804 0.13323816630955 138.905 > 25 99 La 0.98782259287719 0.43743655573804 0.63323816630955 138.905 > 25 100 La 0.98782259287719 0.93743655573804 0.63323816630955 138.905 > 25 101 La 0.01217740712281 0.18743655573804 0.11676183369045 138.905 > 26 102 La 0.01217740712281 0.68743655573804 0.11676183369045 138.905 > 26 103 La 0.01217740712281 0.18743655573804 0.61676183369045 138.905 > 26 104 La 0.01217740712281 0.68743655573804 0.61676183369045 138.905 > 26 105 La 0.01217740712281 0.06256344426196 0.36676183369045 138.905 > 27 106 La 0.01217740712281 0.56256344426196 0.36676183369045 138.905 > 27 107 La 0.01217740712281 0.06256344426196 0.86676183369045 138.905 > 27 108 La 0.01217740712281 0.56256344426196 0.86676183369045 138.905 > 27 109 La 0.98782259287719 0.31256344426196 0.38323816630955 138.905 > 28 110 La 0.98782259287719 0.81256344426196 0.38323816630955 138.905 > 28 111 La 0.98782259287719 0.31256344426196 0.88323816630955 138.905 > 28 112 La 0.98782259287719 0.81256344426196 0.88323816630955 138.905 > 28 *113 La 0.38914003322049 0.17177648093646 0.04707430574609 138.905 > 29 114 La 0.38914003322049 0.67177648093646 0.04707430574609 138.905 > 29 115 La 0.38914003322049 0.17177648093646 0.54707430574609 138.905 > 29 116 La 0.38914003322049 0.67177648093646 0.54707430574609 138.905 > 29 117 La 0.61085996677951 0.42177648093646 0.20292569425391 138.905 > 30 118 La 0.61085996677951 0.92177648093646 0.20292569425391 138.905 > 30 119 La 0.61085996677951 0.42177648093646 0.70292569425391 138.905 > 30 120 La 0.61085996677951 0.92177648093646 0.70292569425391 138.905 > 30 121 La 0.61085996677951 0.32822351906354 0.45292569425391 138.905 > 31 122 La 0.61085996677951 0.82822351906354 0.45292569425391 138.905 > 31 123 La 0.61085996677951 0.32822351906354 0.95292569425391 138.905 > 31 124 La 0.61085996677951 0.82822351906354 0.95292569425391 138.905 > 31 125 La 0.38914003322049 0.07822351906354 0.29707430574609 138.905 > 32 126 La 0.38914003322049 0.57822351906354 0.29707430574609 138.905 > 32 127 La 0.38914003322049 0.07822351906354 0.79707430574609 138.905 > 32 128 La 0.38914003322049 0.57822351906354 0.79707430574609 138.905 > 32 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.8771659 0.0000000 0.0499361 0.0000000 3.8859502 0.0000000 0.0499278 0.0000000 4.0184053 -------------------------- Born effective charges -------------------------- 1 O -2.5827816 -0.3603062 -0.1441783 -0.3018684 -2.6641099 -0.0500753 -0.1378663 -0.0029560 -2.7111163 2 O -2.5827816 0.3603062 -0.1441783 0.3018684 -2.6641099 0.0500753 -0.1378663 0.0029560 -2.7111163 3 O -2.5827816 -0.3603062 -0.1441783 -0.3018684 -2.6641099 -0.0500753 -0.1378663 -0.0029560 -2.7111163 4 O -2.5827816 0.3603062 -0.1441783 0.3018684 -2.6641099 0.0500753 -0.1378663 0.0029560 -2.7111163 5 O -2.2962206 0.5952809 -0.0717598 0.6371869 -2.1010311 -0.1655993 -0.0514092 -0.1916006 -1.7882579 6 O -2.2962206 -0.5952809 -0.0717598 -0.6371869 -2.1010311 0.1655993 -0.0514092 0.1916006 -1.7882579 7 O -2.2962206 0.5952809 -0.0717598 0.6371869 -2.1010311 -0.1655993 -0.0514092 -0.1916006 -1.7882579 8 O -2.2962206 -0.5952809 -0.0717598 -0.6371869 -2.1010311 0.1655993 -0.0514092 0.1916006 -1.7882579 9 O -2.5143975 -0.3948661 -0.1047323 -0.4587159 -2.0195854 -0.1335134 -0.0965034 -0.0808799 -2.0170420 10 O -2.5143975 0.3948661 -0.1047323 0.4587159 -2.0195854 0.1335134 -0.0965034 0.0808799 -2.0170420 11 O -2.5143975 -0.3948661 -0.1047323 -0.4587159 -2.0195854 -0.1335134 -0.0965034 -0.0808799 -2.0170420 12 O -2.5143975 0.3948661 -0.1047323 0.4587159 -2.0195854 0.1335134 -0.0965034 0.0808799 -2.0170420 13 O -2.1598085 0.2156280 0.1397082 0.2569437 -1.9910883 -0.3972689 0.1408294 -0.4311795 -2.4531125 14 O -2.1598085 -0.2156280 0.1397082 -0.2569437 -1.9910883 0.3972689 0.1408294 0.4311795 -2.4531125 15 O -2.1598085 0.2156280 0.1397082 0.2569437 -1.9910883 -0.3972689 0.1408294 -0.4311795 -2.4531125 16 O -2.1598085 -0.2156280 0.1397082 -0.2569437 -1.9910883 0.3972689 0.1408294 0.4311795 -2.4531125 17 O -1.6095899 -0.2846084 -0.0429113 -0.2019598 -2.2619849 0.2602907 -0.0616827 0.2598890 -2.7070693 18 O -1.6095899 0.2846084 -0.0429113 0.2019598 -2.2619849 -0.2602907 -0.0616827 -0.2598890 -2.7070693 19 O -1.6095899 -0.2846084 -0.0429113 -0.2019598 -2.2619849 0.2602907 -0.0616827 0.2598890 -2.7070693 20 O -1.6095899 0.2846084 -0.0429113 0.2019598 -2.2619849 -0.2602907 -0.0616827 -0.2598890 -2.7070693 21 Si 3.2495696 -0.2681920 0.4322468 -0.0329705 3.2229656 -0.1347607 0.4345789 -0.1747565 2.9338624 22 Si 3.2495696 0.2681920 0.4322468 0.0329705 3.2229656 0.1347607 0.4345789 0.1747565 2.9338624 23 Si 3.2495696 -0.2681920 0.4322468 -0.0329705 3.2229656 -0.1347607 0.4345789 -0.1747565 2.9338624 24 Si 3.2495696 0.2681920 0.4322468 0.0329705 3.2229656 0.1347607 0.4345789 0.1747565 2.9338624 25 La 3.5559541 0.0370266 -0.1027097 0.2091202 4.2251262 0.3621243 -0.1100916 0.3932067 4.3135689 26 La 3.5559541 -0.0370266 -0.1027097 -0.2091202 4.2251262 -0.3621243 -0.1100916 -0.3932067 4.3135689 27 La 3.5559541 0.0370266 -0.1027097 0.2091202 4.2251262 0.3621243 -0.1100916 0.3932067 4.3135689 28 La 3.5559541 -0.0370266 -0.1027097 -0.2091202 4.2251262 -0.3621243 -0.1100916 -0.3932067 4.3135689 29 La 4.3572744 0.1109358 -0.1056636 0.0501803 3.5897078 0.0651132 -0.1178551 0.0534754 4.4291667 30 La 4.3572744 -0.1109358 -0.1056636 -0.0501803 3.5897078 -0.0651132 -0.1178551 -0.0534754 4.4291667 31 La 4.3572744 0.1109358 -0.1056636 0.0501803 3.5897078 0.0651132 -0.1178551 0.0534754 4.4291667 32 La 4.3572744 -0.1109358 -0.1056636 -0.0501803 3.5897078 -0.0651132 -0.1178551 -0.0534754 4.4291667 ---------------------------------------------------------------------------- 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: 384/384 Permutation basis: 18816/18816 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4704 Number of blocks in projector: 4704 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: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 261 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 510 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 261 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 510 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 239 eigenvectors found. (2) Block: 524 / 524 (2) 265 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4704, 4633), data: False |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (1024, 1009), data: False |-- (1024, 11), data: (1024, 26) @ (26, 11) |-- (524, 513), data: False |-- (524, 9), data: (524, 20) @ (20, 9) |-- (274, 265), data: True |-- (250, 239), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1024, 1008), data: False |-- (1024, 14), data: (1024, 30) @ (30, 14) |-- (524, 510), data: False |-- (524, 11), data: (524, 25) @ (25, 11) |-- (274, 261), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1024, 1008), data: False |-- (1024, 14), data: (1024, 30) @ (30, 14) |-- (524, 510), data: False |-- (524, 11), data: (524, 25) @ (25, 11) |-- (274, 261), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True ----- Solver_atoms: 1 -- 128 / 128 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 960 - Time: 1.424 Solver_block: 200 / 960 - Time: 1.263 Solver_block: 300 / 960 - Time: 1.268 Solver_block: 400 / 960 - Time: 1.264 Solver_block: 500 / 960 - Time: 1.269 Solver_block: 600 / 960 - Time: 1.266 Solver_block: 700 / 960 - Time: 1.270 Solver_block: 800 / 960 - Time: 1.268 Solver_block: 900 / 960 - Time: 1.266 Solver_block: 960 / 960 - Time: 0.857 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 12.741 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 384/384 Permutation basis: 18816/18816 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4704 Number of blocks in projector: 4704 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: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 261 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 510 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 261 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 510 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 239 eigenvectors found. (2) Block: 524 / 524 (2) 265 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 544 Use submatrix version of eigh solver. (1) Block: 544 / 544 (2) Block: 250 / 544 (2) 242 eigenvectors found. (2) Block: 544 / 544 (2) 286 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 536 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4704, 4633), data: False |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (544, 536), data: False |-- (544, 536), data: False |-- (544, 8), data: (544, 16) @ (16, 8) |-- (294, 286), data: True |-- (250, 242), data: True |-- (1024, 1009), data: False |-- (1024, 11), data: (1024, 26) @ (26, 11) |-- (524, 513), data: False |-- (524, 9), data: (524, 20) @ (20, 9) |-- (274, 265), data: True |-- (250, 239), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1024, 1008), data: False |-- (1024, 14), data: (1024, 30) @ (30, 14) |-- (524, 510), data: False |-- (524, 11), data: (524, 25) @ (25, 11) |-- (274, 261), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1024, 1008), data: False |-- (1024, 14), data: (1024, 30) @ (30, 14) |-- (524, 510), data: False |-- (524, 11), data: (524, 25) @ (25, 11) |-- (274, 261), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) 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 20:43:04]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:43:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.262742441199689 0.000000000000000 0.000000000000000 b 0.000000000000000 7.533533780000000 0.000000000000000 c -2.241061864318618 0.000000000000000 6.600106089816574 Atomic positions (fractional): 1 O 0.11205644953176 0.12609498793905 0.45305876917624 15.999 2 O 0.88794355046825 0.62609498793905 0.04694123082376 15.999 3 O 0.88794355046825 0.87390501206095 0.54694123082376 15.999 4 O 0.11205644953176 0.37390501206095 0.95305876917624 15.999 5 O 0.41020016224166 0.75631384213199 0.05369565261253 15.999 6 O 0.58979983775834 0.25631384213198 0.44630434738746 15.999 7 O 0.58979983775834 0.24368615786802 0.94630434738747 15.999 8 O 0.41020016224166 0.74368615786801 0.55369565261253 15.999 9 O 0.11854882013587 0.86779239687838 0.99342107279897 15.999 10 O 0.88145117986413 0.36779239687838 0.50657892720103 15.999 11 O 0.88145117986413 0.13220760312162 0.00657892720103 15.999 12 O 0.11854882013587 0.63220760312162 0.49342107279897 15.999 13 O 0.29116734581430 0.42517925758367 0.36630410675992 15.999 14 O 0.70883265418569 0.92517925758368 0.13369589324008 15.999 15 O 0.70883265418569 0.57482074241632 0.63369589324008 15.999 16 O 0.29116734581430 0.07482074241632 0.86630410675992 15.999 17 O 0.36657061376842 0.46168763794552 0.75396899302834 15.999 18 O 0.63342938623158 0.96168763794552 0.74603100697166 15.999 19 O 0.63342938623158 0.53831236205448 0.24603100697166 15.999 20 O 0.36657061376842 0.03831236205448 0.25396899302834 15.999 21 Si 0.29891598312238 0.92381821326558 0.04256147132392 28.085 22 Si 0.70108401687762 0.42381821326558 0.45743852867608 28.085 23 Si 0.70108401687762 0.07618178673442 0.95743852867608 28.085 24 Si 0.29891598312238 0.57618178673442 0.54256147132392 28.085 25 La 0.98782259287719 0.87487311147607 0.26647633261910 138.905 26 La 0.01217740712281 0.37487311147607 0.23352366738090 138.905 27 La 0.01217740712281 0.12512688852393 0.73352366738090 138.905 28 La 0.98782259287719 0.62512688852393 0.76647633261910 138.905 29 La 0.38914003322049 0.34355296187291 0.09414861149218 138.905 30 La 0.61085996677951 0.84355296187291 0.40585138850782 138.905 31 La 0.61085996677951 0.65644703812709 0.90585138850782 138.905 32 La 0.38914003322049 0.15644703812709 0.59414861149218 138.905 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.262742441199689 0.000000000000000 0.000000000000000 b 0.000000000000000 15.067067560000000 0.000000000000000 c -4.482123728637236 0.000000000000000 13.200212179633148 Atomic positions (fractional): 1 O 0.11205644953176 0.06304749396953 0.22652938458812 15.999 > 1 2 O 0.11205644953176 0.56304749396953 0.22652938458812 15.999 > 1 3 O 0.11205644953176 0.06304749396953 0.72652938458812 15.999 > 1 4 O 0.11205644953176 0.56304749396953 0.72652938458812 15.999 > 1 5 O 0.88794355046825 0.31304749396953 0.02347061541188 15.999 > 5 6 O 0.88794355046825 0.81304749396953 0.02347061541188 15.999 > 5 7 O 0.88794355046825 0.31304749396953 0.52347061541188 15.999 > 5 8 O 0.88794355046825 0.81304749396953 0.52347061541188 15.999 > 5 9 O 0.88794355046825 0.43695250603047 0.27347061541188 15.999 > 9 10 O 0.88794355046825 0.93695250603047 0.27347061541188 15.999 > 9 11 O 0.88794355046825 0.43695250603047 0.77347061541188 15.999 > 9 12 O 0.88794355046825 0.93695250603047 0.77347061541188 15.999 > 9 13 O 0.11205644953176 0.18695250603047 0.47652938458812 15.999 > 13 14 O 0.11205644953176 0.68695250603047 0.47652938458812 15.999 > 13 15 O 0.11205644953176 0.18695250603047 0.97652938458812 15.999 > 13 16 O 0.11205644953176 0.68695250603047 0.97652938458812 15.999 > 13 17 O 0.41020016224166 0.37815692106599 0.02684782630627 15.999 > 17 18 O 0.41020016224166 0.87815692106599 0.02684782630627 15.999 > 17 19 O 0.41020016224166 0.37815692106599 0.52684782630627 15.999 > 17 20 O 0.41020016224166 0.87815692106599 0.52684782630627 15.999 > 17 21 O 0.58979983775834 0.12815692106599 0.22315217369373 15.999 > 21 22 O 0.58979983775834 0.62815692106599 0.22315217369373 15.999 > 21 23 O 0.58979983775834 0.12815692106599 0.72315217369373 15.999 > 21 24 O 0.58979983775834 0.62815692106599 0.72315217369373 15.999 > 21 25 O 0.58979983775834 0.12184307893401 0.47315217369373 15.999 > 25 26 O 0.58979983775834 0.62184307893401 0.47315217369373 15.999 > 25 27 O 0.58979983775834 0.12184307893401 0.97315217369373 15.999 > 25 28 O 0.58979983775834 0.62184307893401 0.97315217369373 15.999 > 25 29 O 0.41020016224166 0.37184307893401 0.27684782630627 15.999 > 29 30 O 0.41020016224166 0.87184307893401 0.27684782630627 15.999 > 29 31 O 0.41020016224166 0.37184307893401 0.77684782630627 15.999 > 29 32 O 0.41020016224166 0.87184307893401 0.77684782630627 15.999 > 29 33 O 0.11854882013587 0.43389619843919 0.49671053639948 15.999 > 33 34 O 0.11854882013587 0.93389619843919 0.49671053639948 15.999 > 33 35 O 0.11854882013587 0.43389619843919 0.99671053639948 15.999 > 33 36 O 0.11854882013587 0.93389619843919 0.99671053639948 15.999 > 33 37 O 0.88145117986413 0.18389619843919 0.25328946360052 15.999 > 37 38 O 0.88145117986413 0.68389619843919 0.25328946360052 15.999 > 37 39 O 0.88145117986413 0.18389619843919 0.75328946360052 15.999 > 37 40 O 0.88145117986413 0.68389619843919 0.75328946360052 15.999 > 37 41 O 0.88145117986413 0.06610380156081 0.00328946360052 15.999 > 41 42 O 0.88145117986413 0.56610380156081 0.00328946360052 15.999 > 41 43 O 0.88145117986413 0.06610380156081 0.50328946360052 15.999 > 41 44 O 0.88145117986413 0.56610380156081 0.50328946360052 15.999 > 41 45 O 0.11854882013587 0.31610380156081 0.24671053639948 15.999 > 45 46 O 0.11854882013587 0.81610380156081 0.24671053639948 15.999 > 45 47 O 0.11854882013587 0.31610380156081 0.74671053639948 15.999 > 45 48 O 0.11854882013587 0.81610380156081 0.74671053639948 15.999 > 45 49 O 0.29116734581430 0.21258962879184 0.18315205337996 15.999 > 49 50 O 0.29116734581430 0.71258962879184 0.18315205337996 15.999 > 49 51 O 0.29116734581430 0.21258962879184 0.68315205337996 15.999 > 49 52 O 0.29116734581430 0.71258962879184 0.68315205337996 15.999 > 49 53 O 0.70883265418569 0.46258962879184 0.06684794662004 15.999 > 53 54 O 0.70883265418569 0.96258962879184 0.06684794662004 15.999 > 53 55 O 0.70883265418569 0.46258962879184 0.56684794662004 15.999 > 53 56 O 0.70883265418569 0.96258962879184 0.56684794662004 15.999 > 53 57 O 0.70883265418569 0.28741037120816 0.31684794662004 15.999 > 57 58 O 0.70883265418569 0.78741037120816 0.31684794662004 15.999 > 57 59 O 0.70883265418569 0.28741037120816 0.81684794662004 15.999 > 57 60 O 0.70883265418569 0.78741037120816 0.81684794662004 15.999 > 57 61 O 0.29116734581430 0.03741037120816 0.43315205337996 15.999 > 61 62 O 0.29116734581430 0.53741037120816 0.43315205337996 15.999 > 61 63 O 0.29116734581430 0.03741037120816 0.93315205337996 15.999 > 61 64 O 0.29116734581430 0.53741037120816 0.93315205337996 15.999 > 61 65 O 0.36657061376842 0.23084381897276 0.37698449651417 15.999 > 65 66 O 0.36657061376842 0.73084381897276 0.37698449651417 15.999 > 65 67 O 0.36657061376842 0.23084381897276 0.87698449651417 15.999 > 65 68 O 0.36657061376842 0.73084381897276 0.87698449651417 15.999 > 65 69 O 0.63342938623158 0.48084381897276 0.37301550348583 15.999 > 69 70 O 0.63342938623158 0.98084381897276 0.37301550348583 15.999 > 69 71 O 0.63342938623158 0.48084381897276 0.87301550348583 15.999 > 69 72 O 0.63342938623158 0.98084381897276 0.87301550348583 15.999 > 69 73 O 0.63342938623158 0.26915618102724 0.12301550348583 15.999 > 73 74 O 0.63342938623158 0.76915618102724 0.12301550348583 15.999 > 73 75 O 0.63342938623158 0.26915618102724 0.62301550348583 15.999 > 73 76 O 0.63342938623158 0.76915618102724 0.62301550348583 15.999 > 73 77 O 0.36657061376842 0.01915618102724 0.12698449651417 15.999 > 77 78 O 0.36657061376842 0.51915618102724 0.12698449651417 15.999 > 77 79 O 0.36657061376842 0.01915618102724 0.62698449651417 15.999 > 77 80 O 0.36657061376842 0.51915618102724 0.62698449651417 15.999 > 77 81 Si 0.29891598312238 0.46190910663279 0.02128073566196 28.085 > 81 82 Si 0.29891598312238 0.96190910663279 0.02128073566196 28.085 > 81 83 Si 0.29891598312238 0.46190910663279 0.52128073566196 28.085 > 81 84 Si 0.29891598312238 0.96190910663279 0.52128073566196 28.085 > 81 85 Si 0.70108401687762 0.21190910663279 0.22871926433804 28.085 > 85 86 Si 0.70108401687762 0.71190910663279 0.22871926433804 28.085 > 85 87 Si 0.70108401687762 0.21190910663279 0.72871926433804 28.085 > 85 88 Si 0.70108401687762 0.71190910663279 0.72871926433804 28.085 > 85 89 Si 0.70108401687762 0.03809089336721 0.47871926433804 28.085 > 89 90 Si 0.70108401687762 0.53809089336721 0.47871926433804 28.085 > 89 91 Si 0.70108401687762 0.03809089336721 0.97871926433804 28.085 > 89 92 Si 0.70108401687762 0.53809089336721 0.97871926433804 28.085 > 89 93 Si 0.29891598312238 0.28809089336721 0.27128073566196 28.085 > 93 94 Si 0.29891598312238 0.78809089336721 0.27128073566196 28.085 > 93 95 Si 0.29891598312238 0.28809089336721 0.77128073566196 28.085 > 93 96 Si 0.29891598312238 0.78809089336721 0.77128073566196 28.085 > 93 97 La 0.98782259287719 0.43743655573804 0.13323816630955 138.905 > 97 98 La 0.98782259287719 0.93743655573804 0.13323816630955 138.905 > 97 99 La 0.98782259287719 0.43743655573804 0.63323816630955 138.905 > 97 100 La 0.98782259287719 0.93743655573804 0.63323816630955 138.905 > 97 101 La 0.01217740712281 0.18743655573804 0.11676183369045 138.905 > 101 102 La 0.01217740712281 0.68743655573804 0.11676183369045 138.905 > 101 103 La 0.01217740712281 0.18743655573804 0.61676183369045 138.905 > 101 104 La 0.01217740712281 0.68743655573804 0.61676183369045 138.905 > 101 105 La 0.01217740712281 0.06256344426196 0.36676183369045 138.905 > 105 106 La 0.01217740712281 0.56256344426196 0.36676183369045 138.905 > 105 107 La 0.01217740712281 0.06256344426196 0.86676183369045 138.905 > 105 108 La 0.01217740712281 0.56256344426196 0.86676183369045 138.905 > 105 109 La 0.98782259287719 0.31256344426196 0.38323816630955 138.905 > 109 110 La 0.98782259287719 0.81256344426196 0.38323816630955 138.905 > 109 111 La 0.98782259287719 0.31256344426196 0.88323816630955 138.905 > 109 112 La 0.98782259287719 0.81256344426196 0.88323816630955 138.905 > 109 113 La 0.38914003322049 0.17177648093646 0.04707430574609 138.905 > 113 114 La 0.38914003322049 0.67177648093646 0.04707430574609 138.905 > 113 115 La 0.38914003322049 0.17177648093646 0.54707430574609 138.905 > 113 116 La 0.38914003322049 0.67177648093646 0.54707430574609 138.905 > 113 117 La 0.61085996677951 0.42177648093646 0.20292569425391 138.905 > 117 118 La 0.61085996677951 0.92177648093646 0.20292569425391 138.905 > 117 119 La 0.61085996677951 0.42177648093646 0.70292569425391 138.905 > 117 120 La 0.61085996677951 0.92177648093646 0.70292569425391 138.905 > 117 121 La 0.61085996677951 0.32822351906354 0.45292569425391 138.905 > 121 122 La 0.61085996677951 0.82822351906354 0.45292569425391 138.905 > 121 123 La 0.61085996677951 0.32822351906354 0.95292569425391 138.905 > 121 124 La 0.61085996677951 0.82822351906354 0.95292569425391 138.905 > 121 125 La 0.38914003322049 0.07822351906354 0.29707430574609 138.905 > 125 126 La 0.38914003322049 0.57822351906354 0.29707430574609 138.905 > 125 127 La 0.38914003322049 0.07822351906354 0.79707430574609 138.905 > 125 128 La 0.38914003322049 0.57822351906354 0.79707430574609 138.905 > 125 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.8771659 0.0000000 0.0499361 0.0000000 3.8859502 0.0000000 0.0499278 0.0000000 4.0184053 -------------------------- Born effective charges -------------------------- 1 O -2.5827816 -0.3603062 -0.1441783 -0.3018684 -2.6641099 -0.0500753 -0.1378663 -0.0029560 -2.7111163 2 O -2.5827816 0.3603062 -0.1441783 0.3018684 -2.6641099 0.0500753 -0.1378663 0.0029560 -2.7111163 3 O -2.5827816 -0.3603062 -0.1441783 -0.3018684 -2.6641099 -0.0500753 -0.1378663 -0.0029560 -2.7111163 4 O -2.5827816 0.3603062 -0.1441783 0.3018684 -2.6641099 0.0500753 -0.1378663 0.0029560 -2.7111163 5 O -2.2962206 0.5952809 -0.0717598 0.6371869 -2.1010311 -0.1655993 -0.0514092 -0.1916006 -1.7882579 6 O -2.2962206 -0.5952809 -0.0717598 -0.6371869 -2.1010311 0.1655993 -0.0514092 0.1916006 -1.7882579 7 O -2.2962206 0.5952809 -0.0717598 0.6371869 -2.1010311 -0.1655993 -0.0514092 -0.1916006 -1.7882579 8 O -2.2962206 -0.5952809 -0.0717598 -0.6371869 -2.1010311 0.1655993 -0.0514092 0.1916006 -1.7882579 9 O -2.5143975 -0.3948661 -0.1047323 -0.4587159 -2.0195854 -0.1335134 -0.0965034 -0.0808799 -2.0170420 10 O -2.5143975 0.3948661 -0.1047323 0.4587159 -2.0195854 0.1335134 -0.0965034 0.0808799 -2.0170420 11 O -2.5143975 -0.3948661 -0.1047323 -0.4587159 -2.0195854 -0.1335134 -0.0965034 -0.0808799 -2.0170420 12 O -2.5143975 0.3948661 -0.1047323 0.4587159 -2.0195854 0.1335134 -0.0965034 0.0808799 -2.0170420 13 O -2.1598085 0.2156280 0.1397082 0.2569437 -1.9910883 -0.3972689 0.1408294 -0.4311795 -2.4531125 14 O -2.1598085 -0.2156280 0.1397082 -0.2569437 -1.9910883 0.3972689 0.1408294 0.4311795 -2.4531125 15 O -2.1598085 0.2156280 0.1397082 0.2569437 -1.9910883 -0.3972689 0.1408294 -0.4311795 -2.4531125 16 O -2.1598085 -0.2156280 0.1397082 -0.2569437 -1.9910883 0.3972689 0.1408294 0.4311795 -2.4531125 17 O -1.6095899 -0.2846084 -0.0429113 -0.2019598 -2.2619849 0.2602907 -0.0616827 0.2598890 -2.7070693 18 O -1.6095899 0.2846084 -0.0429113 0.2019598 -2.2619849 -0.2602907 -0.0616827 -0.2598890 -2.7070693 19 O -1.6095899 -0.2846084 -0.0429113 -0.2019598 -2.2619849 0.2602907 -0.0616827 0.2598890 -2.7070693 20 O -1.6095899 0.2846084 -0.0429113 0.2019598 -2.2619849 -0.2602907 -0.0616827 -0.2598890 -2.7070693 21 Si 3.2495696 -0.2681920 0.4322468 -0.0329705 3.2229656 -0.1347607 0.4345789 -0.1747565 2.9338624 22 Si 3.2495696 0.2681920 0.4322468 0.0329705 3.2229656 0.1347607 0.4345789 0.1747565 2.9338624 23 Si 3.2495696 -0.2681920 0.4322468 -0.0329705 3.2229656 -0.1347607 0.4345789 -0.1747565 2.9338624 24 Si 3.2495696 0.2681920 0.4322468 0.0329705 3.2229656 0.1347607 0.4345789 0.1747565 2.9338624 25 La 3.5559541 0.0370266 -0.1027097 0.2091202 4.2251262 0.3621243 -0.1100916 0.3932067 4.3135689 26 La 3.5559541 -0.0370266 -0.1027097 -0.2091202 4.2251262 -0.3621243 -0.1100916 -0.3932067 4.3135689 27 La 3.5559541 0.0370266 -0.1027097 0.2091202 4.2251262 0.3621243 -0.1100916 0.3932067 4.3135689 28 La 3.5559541 -0.0370266 -0.1027097 -0.2091202 4.2251262 -0.3621243 -0.1100916 -0.3932067 4.3135689 29 La 4.3572744 0.1109358 -0.1056636 0.0501803 3.5897078 0.0651132 -0.1178551 0.0534754 4.4291667 30 La 4.3572744 -0.1109358 -0.1056636 -0.0501803 3.5897078 -0.0651132 -0.1178551 -0.0534754 4.4291667 31 La 4.3572744 0.1109358 -0.1056636 0.0501803 3.5897078 0.0651132 -0.1178551 0.0534754 4.4291667 32 La 4.3572744 -0.1109358 -0.1056636 -0.0501803 3.5897078 -0.0651132 -0.1178551 -0.0534754 4.4291667 ---------------------------------------------------------------------------- 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] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] 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] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 81, 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] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Computing fc3[ 113, 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] [-0.0032 0.0000 0.0095] [ 0.0032 0.0000 -0.0095] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000002 (xxx) -0.00000002 (xxx) -0.00000002 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (zx) 0.00000001 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:43:49]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:43:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.262742441199689 0.000000000000000 0.000000000000000 b 0.000000000000000 7.533533780000000 0.000000000000000 c -2.241061864318618 0.000000000000000 6.600106089816574 Atomic positions (fractional): 1 O 0.11205644953176 0.12609498793905 0.45305876917624 15.999 2 O 0.88794355046825 0.62609498793905 0.04694123082376 15.999 3 O 0.88794355046825 0.87390501206095 0.54694123082376 15.999 4 O 0.11205644953176 0.37390501206095 0.95305876917624 15.999 5 O 0.41020016224166 0.75631384213199 0.05369565261253 15.999 6 O 0.58979983775834 0.25631384213198 0.44630434738746 15.999 7 O 0.58979983775834 0.24368615786802 0.94630434738747 15.999 8 O 0.41020016224166 0.74368615786801 0.55369565261253 15.999 9 O 0.11854882013587 0.86779239687838 0.99342107279897 15.999 10 O 0.88145117986413 0.36779239687838 0.50657892720103 15.999 11 O 0.88145117986413 0.13220760312162 0.00657892720103 15.999 12 O 0.11854882013587 0.63220760312162 0.49342107279897 15.999 13 O 0.29116734581430 0.42517925758367 0.36630410675992 15.999 14 O 0.70883265418569 0.92517925758368 0.13369589324008 15.999 15 O 0.70883265418569 0.57482074241632 0.63369589324008 15.999 16 O 0.29116734581430 0.07482074241632 0.86630410675992 15.999 17 O 0.36657061376842 0.46168763794552 0.75396899302834 15.999 18 O 0.63342938623158 0.96168763794552 0.74603100697166 15.999 19 O 0.63342938623158 0.53831236205448 0.24603100697166 15.999 20 O 0.36657061376842 0.03831236205448 0.25396899302834 15.999 21 Si 0.29891598312238 0.92381821326558 0.04256147132392 28.085 22 Si 0.70108401687762 0.42381821326558 0.45743852867608 28.085 23 Si 0.70108401687762 0.07618178673442 0.95743852867608 28.085 24 Si 0.29891598312238 0.57618178673442 0.54256147132392 28.085 25 La 0.98782259287719 0.87487311147607 0.26647633261910 138.905 26 La 0.01217740712281 0.37487311147607 0.23352366738090 138.905 27 La 0.01217740712281 0.12512688852393 0.73352366738090 138.905 28 La 0.98782259287719 0.62512688852393 0.76647633261910 138.905 29 La 0.38914003322049 0.34355296187291 0.09414861149218 138.905 30 La 0.61085996677951 0.84355296187291 0.40585138850782 138.905 31 La 0.61085996677951 0.65644703812709 0.90585138850782 138.905 32 La 0.38914003322049 0.15644703812709 0.59414861149218 138.905 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.262742441199689 0.000000000000000 0.000000000000000 b 0.000000000000000 15.067067560000000 0.000000000000000 c -4.482123728637236 0.000000000000000 13.200212179633148 Atomic positions (fractional): 1 O 0.11205644953176 0.06304749396953 0.22652938458812 15.999 > 1 2 O 0.11205644953176 0.56304749396953 0.22652938458812 15.999 > 1 3 O 0.11205644953176 0.06304749396953 0.72652938458812 15.999 > 1 4 O 0.11205644953176 0.56304749396953 0.72652938458812 15.999 > 1 5 O 0.88794355046825 0.31304749396953 0.02347061541188 15.999 > 5 6 O 0.88794355046825 0.81304749396953 0.02347061541188 15.999 > 5 7 O 0.88794355046825 0.31304749396953 0.52347061541188 15.999 > 5 8 O 0.88794355046825 0.81304749396953 0.52347061541188 15.999 > 5 9 O 0.88794355046825 0.43695250603047 0.27347061541188 15.999 > 9 10 O 0.88794355046825 0.93695250603047 0.27347061541188 15.999 > 9 11 O 0.88794355046825 0.43695250603047 0.77347061541188 15.999 > 9 12 O 0.88794355046825 0.93695250603047 0.77347061541188 15.999 > 9 13 O 0.11205644953176 0.18695250603047 0.47652938458812 15.999 > 13 14 O 0.11205644953176 0.68695250603047 0.47652938458812 15.999 > 13 15 O 0.11205644953176 0.18695250603047 0.97652938458812 15.999 > 13 16 O 0.11205644953176 0.68695250603047 0.97652938458812 15.999 > 13 17 O 0.41020016224166 0.37815692106599 0.02684782630627 15.999 > 17 18 O 0.41020016224166 0.87815692106599 0.02684782630627 15.999 > 17 19 O 0.41020016224166 0.37815692106599 0.52684782630627 15.999 > 17 20 O 0.41020016224166 0.87815692106599 0.52684782630627 15.999 > 17 21 O 0.58979983775834 0.12815692106599 0.22315217369373 15.999 > 21 22 O 0.58979983775834 0.62815692106599 0.22315217369373 15.999 > 21 23 O 0.58979983775834 0.12815692106599 0.72315217369373 15.999 > 21 24 O 0.58979983775834 0.62815692106599 0.72315217369373 15.999 > 21 25 O 0.58979983775834 0.12184307893401 0.47315217369373 15.999 > 25 26 O 0.58979983775834 0.62184307893401 0.47315217369373 15.999 > 25 27 O 0.58979983775834 0.12184307893401 0.97315217369373 15.999 > 25 28 O 0.58979983775834 0.62184307893401 0.97315217369373 15.999 > 25 29 O 0.41020016224166 0.37184307893401 0.27684782630627 15.999 > 29 30 O 0.41020016224166 0.87184307893401 0.27684782630627 15.999 > 29 31 O 0.41020016224166 0.37184307893401 0.77684782630627 15.999 > 29 32 O 0.41020016224166 0.87184307893401 0.77684782630627 15.999 > 29 33 O 0.11854882013587 0.43389619843919 0.49671053639948 15.999 > 33 34 O 0.11854882013587 0.93389619843919 0.49671053639948 15.999 > 33 35 O 0.11854882013587 0.43389619843919 0.99671053639948 15.999 > 33 36 O 0.11854882013587 0.93389619843919 0.99671053639948 15.999 > 33 37 O 0.88145117986413 0.18389619843919 0.25328946360052 15.999 > 37 38 O 0.88145117986413 0.68389619843919 0.25328946360052 15.999 > 37 39 O 0.88145117986413 0.18389619843919 0.75328946360052 15.999 > 37 40 O 0.88145117986413 0.68389619843919 0.75328946360052 15.999 > 37 41 O 0.88145117986413 0.06610380156081 0.00328946360052 15.999 > 41 42 O 0.88145117986413 0.56610380156081 0.00328946360052 15.999 > 41 43 O 0.88145117986413 0.06610380156081 0.50328946360052 15.999 > 41 44 O 0.88145117986413 0.56610380156081 0.50328946360052 15.999 > 41 45 O 0.11854882013587 0.31610380156081 0.24671053639948 15.999 > 45 46 O 0.11854882013587 0.81610380156081 0.24671053639948 15.999 > 45 47 O 0.11854882013587 0.31610380156081 0.74671053639948 15.999 > 45 48 O 0.11854882013587 0.81610380156081 0.74671053639948 15.999 > 45 49 O 0.29116734581430 0.21258962879184 0.18315205337996 15.999 > 49 50 O 0.29116734581430 0.71258962879184 0.18315205337996 15.999 > 49 51 O 0.29116734581430 0.21258962879184 0.68315205337996 15.999 > 49 52 O 0.29116734581430 0.71258962879184 0.68315205337996 15.999 > 49 53 O 0.70883265418569 0.46258962879184 0.06684794662004 15.999 > 53 54 O 0.70883265418569 0.96258962879184 0.06684794662004 15.999 > 53 55 O 0.70883265418569 0.46258962879184 0.56684794662004 15.999 > 53 56 O 0.70883265418569 0.96258962879184 0.56684794662004 15.999 > 53 57 O 0.70883265418569 0.28741037120816 0.31684794662004 15.999 > 57 58 O 0.70883265418569 0.78741037120816 0.31684794662004 15.999 > 57 59 O 0.70883265418569 0.28741037120816 0.81684794662004 15.999 > 57 60 O 0.70883265418569 0.78741037120816 0.81684794662004 15.999 > 57 61 O 0.29116734581430 0.03741037120816 0.43315205337996 15.999 > 61 62 O 0.29116734581430 0.53741037120816 0.43315205337996 15.999 > 61 63 O 0.29116734581430 0.03741037120816 0.93315205337996 15.999 > 61 64 O 0.29116734581430 0.53741037120816 0.93315205337996 15.999 > 61 65 O 0.36657061376842 0.23084381897276 0.37698449651417 15.999 > 65 66 O 0.36657061376842 0.73084381897276 0.37698449651417 15.999 > 65 67 O 0.36657061376842 0.23084381897276 0.87698449651417 15.999 > 65 68 O 0.36657061376842 0.73084381897276 0.87698449651417 15.999 > 65 69 O 0.63342938623158 0.48084381897276 0.37301550348583 15.999 > 69 70 O 0.63342938623158 0.98084381897276 0.37301550348583 15.999 > 69 71 O 0.63342938623158 0.48084381897276 0.87301550348583 15.999 > 69 72 O 0.63342938623158 0.98084381897276 0.87301550348583 15.999 > 69 73 O 0.63342938623158 0.26915618102724 0.12301550348583 15.999 > 73 74 O 0.63342938623158 0.76915618102724 0.12301550348583 15.999 > 73 75 O 0.63342938623158 0.26915618102724 0.62301550348583 15.999 > 73 76 O 0.63342938623158 0.76915618102724 0.62301550348583 15.999 > 73 77 O 0.36657061376842 0.01915618102724 0.12698449651417 15.999 > 77 78 O 0.36657061376842 0.51915618102724 0.12698449651417 15.999 > 77 79 O 0.36657061376842 0.01915618102724 0.62698449651417 15.999 > 77 80 O 0.36657061376842 0.51915618102724 0.62698449651417 15.999 > 77 81 Si 0.29891598312238 0.46190910663279 0.02128073566196 28.085 > 81 82 Si 0.29891598312238 0.96190910663279 0.02128073566196 28.085 > 81 83 Si 0.29891598312238 0.46190910663279 0.52128073566196 28.085 > 81 84 Si 0.29891598312238 0.96190910663279 0.52128073566196 28.085 > 81 85 Si 0.70108401687762 0.21190910663279 0.22871926433804 28.085 > 85 86 Si 0.70108401687762 0.71190910663279 0.22871926433804 28.085 > 85 87 Si 0.70108401687762 0.21190910663279 0.72871926433804 28.085 > 85 88 Si 0.70108401687762 0.71190910663279 0.72871926433804 28.085 > 85 89 Si 0.70108401687762 0.03809089336721 0.47871926433804 28.085 > 89 90 Si 0.70108401687762 0.53809089336721 0.47871926433804 28.085 > 89 91 Si 0.70108401687762 0.03809089336721 0.97871926433804 28.085 > 89 92 Si 0.70108401687762 0.53809089336721 0.97871926433804 28.085 > 89 93 Si 0.29891598312238 0.28809089336721 0.27128073566196 28.085 > 93 94 Si 0.29891598312238 0.78809089336721 0.27128073566196 28.085 > 93 95 Si 0.29891598312238 0.28809089336721 0.77128073566196 28.085 > 93 96 Si 0.29891598312238 0.78809089336721 0.77128073566196 28.085 > 93 97 La 0.98782259287719 0.43743655573804 0.13323816630955 138.905 > 97 98 La 0.98782259287719 0.93743655573804 0.13323816630955 138.905 > 97 99 La 0.98782259287719 0.43743655573804 0.63323816630955 138.905 > 97 100 La 0.98782259287719 0.93743655573804 0.63323816630955 138.905 > 97 101 La 0.01217740712281 0.18743655573804 0.11676183369045 138.905 > 101 102 La 0.01217740712281 0.68743655573804 0.11676183369045 138.905 > 101 103 La 0.01217740712281 0.18743655573804 0.61676183369045 138.905 > 101 104 La 0.01217740712281 0.68743655573804 0.61676183369045 138.905 > 101 105 La 0.01217740712281 0.06256344426196 0.36676183369045 138.905 > 105 106 La 0.01217740712281 0.56256344426196 0.36676183369045 138.905 > 105 107 La 0.01217740712281 0.06256344426196 0.86676183369045 138.905 > 105 108 La 0.01217740712281 0.56256344426196 0.86676183369045 138.905 > 105 109 La 0.98782259287719 0.31256344426196 0.38323816630955 138.905 > 109 110 La 0.98782259287719 0.81256344426196 0.38323816630955 138.905 > 109 111 La 0.98782259287719 0.31256344426196 0.88323816630955 138.905 > 109 112 La 0.98782259287719 0.81256344426196 0.88323816630955 138.905 > 109 113 La 0.38914003322049 0.17177648093646 0.04707430574609 138.905 > 113 114 La 0.38914003322049 0.67177648093646 0.04707430574609 138.905 > 113 115 La 0.38914003322049 0.17177648093646 0.54707430574609 138.905 > 113 116 La 0.38914003322049 0.67177648093646 0.54707430574609 138.905 > 113 117 La 0.61085996677951 0.42177648093646 0.20292569425391 138.905 > 117 118 La 0.61085996677951 0.92177648093646 0.20292569425391 138.905 > 117 119 La 0.61085996677951 0.42177648093646 0.70292569425391 138.905 > 117 120 La 0.61085996677951 0.92177648093646 0.70292569425391 138.905 > 117 121 La 0.61085996677951 0.32822351906354 0.45292569425391 138.905 > 121 122 La 0.61085996677951 0.82822351906354 0.45292569425391 138.905 > 121 123 La 0.61085996677951 0.32822351906354 0.95292569425391 138.905 > 121 124 La 0.61085996677951 0.82822351906354 0.95292569425391 138.905 > 121 125 La 0.38914003322049 0.07822351906354 0.29707430574609 138.905 > 125 126 La 0.38914003322049 0.57822351906354 0.29707430574609 138.905 > 125 127 La 0.38914003322049 0.07822351906354 0.79707430574609 138.905 > 125 128 La 0.38914003322049 0.57822351906354 0.79707430574609 138.905 > 125 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.8771659 0.0000000 0.0499361 0.0000000 3.8859502 0.0000000 0.0499278 0.0000000 4.0184053 -------------------------- Born effective charges -------------------------- 1 O -2.5827816 -0.3603062 -0.1441783 -0.3018684 -2.6641099 -0.0500753 -0.1378663 -0.0029560 -2.7111163 2 O -2.5827816 0.3603062 -0.1441783 0.3018684 -2.6641099 0.0500753 -0.1378663 0.0029560 -2.7111163 3 O -2.5827816 -0.3603062 -0.1441783 -0.3018684 -2.6641099 -0.0500753 -0.1378663 -0.0029560 -2.7111163 4 O -2.5827816 0.3603062 -0.1441783 0.3018684 -2.6641099 0.0500753 -0.1378663 0.0029560 -2.7111163 5 O -2.2962206 0.5952809 -0.0717598 0.6371869 -2.1010311 -0.1655993 -0.0514092 -0.1916006 -1.7882579 6 O -2.2962206 -0.5952809 -0.0717598 -0.6371869 -2.1010311 0.1655993 -0.0514092 0.1916006 -1.7882579 7 O -2.2962206 0.5952809 -0.0717598 0.6371869 -2.1010311 -0.1655993 -0.0514092 -0.1916006 -1.7882579 8 O -2.2962206 -0.5952809 -0.0717598 -0.6371869 -2.1010311 0.1655993 -0.0514092 0.1916006 -1.7882579 9 O -2.5143975 -0.3948661 -0.1047323 -0.4587159 -2.0195854 -0.1335134 -0.0965034 -0.0808799 -2.0170420 10 O -2.5143975 0.3948661 -0.1047323 0.4587159 -2.0195854 0.1335134 -0.0965034 0.0808799 -2.0170420 11 O -2.5143975 -0.3948661 -0.1047323 -0.4587159 -2.0195854 -0.1335134 -0.0965034 -0.0808799 -2.0170420 12 O -2.5143975 0.3948661 -0.1047323 0.4587159 -2.0195854 0.1335134 -0.0965034 0.0808799 -2.0170420 13 O -2.1598085 0.2156280 0.1397082 0.2569437 -1.9910883 -0.3972689 0.1408294 -0.4311795 -2.4531125 14 O -2.1598085 -0.2156280 0.1397082 -0.2569437 -1.9910883 0.3972689 0.1408294 0.4311795 -2.4531125 15 O -2.1598085 0.2156280 0.1397082 0.2569437 -1.9910883 -0.3972689 0.1408294 -0.4311795 -2.4531125 16 O -2.1598085 -0.2156280 0.1397082 -0.2569437 -1.9910883 0.3972689 0.1408294 0.4311795 -2.4531125 17 O -1.6095899 -0.2846084 -0.0429113 -0.2019598 -2.2619849 0.2602907 -0.0616827 0.2598890 -2.7070693 18 O -1.6095899 0.2846084 -0.0429113 0.2019598 -2.2619849 -0.2602907 -0.0616827 -0.2598890 -2.7070693 19 O -1.6095899 -0.2846084 -0.0429113 -0.2019598 -2.2619849 0.2602907 -0.0616827 0.2598890 -2.7070693 20 O -1.6095899 0.2846084 -0.0429113 0.2019598 -2.2619849 -0.2602907 -0.0616827 -0.2598890 -2.7070693 21 Si 3.2495696 -0.2681920 0.4322468 -0.0329705 3.2229656 -0.1347607 0.4345789 -0.1747565 2.9338624 22 Si 3.2495696 0.2681920 0.4322468 0.0329705 3.2229656 0.1347607 0.4345789 0.1747565 2.9338624 23 Si 3.2495696 -0.2681920 0.4322468 -0.0329705 3.2229656 -0.1347607 0.4345789 -0.1747565 2.9338624 24 Si 3.2495696 0.2681920 0.4322468 0.0329705 3.2229656 0.1347607 0.4345789 0.1747565 2.9338624 25 La 3.5559541 0.0370266 -0.1027097 0.2091202 4.2251262 0.3621243 -0.1100916 0.3932067 4.3135689 26 La 3.5559541 -0.0370266 -0.1027097 -0.2091202 4.2251262 -0.3621243 -0.1100916 -0.3932067 4.3135689 27 La 3.5559541 0.0370266 -0.1027097 0.2091202 4.2251262 0.3621243 -0.1100916 0.3932067 4.3135689 28 La 3.5559541 -0.0370266 -0.1027097 -0.2091202 4.2251262 -0.3621243 -0.1100916 -0.3932067 4.3135689 29 La 4.3572744 0.1109358 -0.1056636 0.0501803 3.5897078 0.0651132 -0.1178551 0.0534754 4.4291667 30 La 4.3572744 -0.1109358 -0.1056636 -0.0501803 3.5897078 -0.0651132 -0.1178551 -0.0534754 4.4291667 31 La 4.3572744 0.1109358 -0.1056636 0.0501803 3.5897078 0.0651132 -0.1178551 0.0534754 4.4291667 32 La 4.3572744 -0.1109358 -0.1056636 -0.0501803 3.5897078 -0.0651132 -0.1178551 -0.0534754 4.4291667 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000002 (xxx) -0.00000002 (xxx) -0.00000002 (xxx) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- 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 7 8 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.54, Number of G-points: 299, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/104) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 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 2.497 ( 0.000 0.000 0.000) 0.000 2.659 ( 0.000 0.000 0.000) 0.000 2.662 ( 0.000 0.000 0.000) 0.000 2.710 ( 0.000 0.000 0.000) 0.000 2.775 ( 0.000 0.000 0.000) 0.000 2.970 ( 0.000 0.000 0.000) 0.000 3.095 ( 0.000 0.000 0.000) 0.000 3.109 ( 0.000 0.000 0.000) 0.000 3.129 ( 0.000 0.000 0.000) 0.000 3.312 ( 0.000 0.000 0.000) 0.000 3.454 ( 0.000 0.000 0.000) 0.000 4.047 ( 0.000 0.000 0.000) 0.000 4.153 ( 0.000 0.000 0.000) 0.000 4.219 ( 0.000 0.000 0.000) 0.000 4.407 ( 0.000 0.000 0.000) 0.000 4.411 ( 0.000 0.000 0.000) 0.000 4.523 ( 0.000 0.000 0.000) 0.000 4.523 ( 0.000 0.000 0.000) 0.000 4.703 ( 0.000 0.000 0.000) 0.000 4.834 ( 0.000 0.000 0.000) 0.000 5.044 ( 0.000 0.000 0.000) 0.000 5.063 ( 0.000 0.000 0.000) 0.000 5.208 ( 0.000 0.000 0.000) 0.000 5.252 ( 0.000 0.000 0.000) 0.000 5.479 ( 0.000 0.000 0.000) 0.000 5.498 ( 0.000 0.000 0.000) 0.000 5.691 ( 0.000 0.000 0.000) 0.000 5.696 ( 0.000 0.000 0.000) 0.000 5.942 ( 0.000 0.000 0.000) 0.000 6.333 ( 0.000 0.000 0.000) 0.000 6.334 ( 0.000 0.000 0.000) 0.000 6.367 ( 0.000 0.000 0.000) 0.000 6.519 ( 0.000 0.000 0.000) 0.000 6.698 ( 0.000 0.000 0.000) 0.000 6.740 ( 0.000 0.000 0.000) 0.000 6.828 ( 0.000 0.000 0.000) 0.000 7.117 ( 0.000 0.000 0.000) 0.000 7.130 ( 0.000 0.000 0.000) 0.000 7.132 ( 0.000 0.000 0.000) 0.000 7.300 ( 0.000 0.000 0.000) 0.000 7.333 ( 0.000 0.000 0.000) 0.000 7.573 ( 0.000 0.000 0.000) 0.000 7.773 ( 0.000 0.000 0.000) 0.000 7.833 ( 0.000 0.000 0.000) 0.000 7.937 ( 0.000 0.000 0.000) 0.000 8.803 ( 0.000 0.000 0.000) 0.000 8.894 ( 0.000 0.000 0.000) 0.000 9.010 ( 0.000 0.000 0.000) 0.000 9.406 ( 0.000 0.000 0.000) 0.000 9.581 ( 0.000 0.000 0.000) 0.000 9.640 ( 0.000 0.000 0.000) 0.000 9.680 ( 0.000 0.000 0.000) 0.000 10.013 ( 0.000 0.000 0.000) 0.000 10.418 ( 0.000 0.000 0.000) 0.000 10.641 ( 0.000 0.000 0.000) 0.000 10.656 ( 0.000 0.000 0.000) 0.000 10.948 ( 0.000 0.000 0.000) 0.000 11.172 ( 0.000 0.000 0.000) 0.000 11.841 ( 0.000 0.000 0.000) 0.000 12.036 ( 0.000 0.000 0.000) 0.000 12.066 ( 0.000 0.000 0.000) 0.000 12.127 ( 0.000 0.000 0.000) 0.000 13.261 ( 0.000 0.000 0.000) 0.000 13.304 ( 0.000 0.000 0.000) 0.000 13.385 ( 0.000 0.000 0.000) 0.000 13.562 ( 0.000 0.000 0.000) 0.000 13.662 ( 0.000 0.000 0.000) 0.000 13.814 ( 0.000 0.000 0.000) 0.000 14.778 ( 0.000 0.000 0.000) 0.000 14.807 ( 0.000 0.000 0.000) 0.000 14.834 ( 0.000 0.000 0.000) 0.000 15.023 ( 0.000 0.000 0.000) 0.000 15.028 ( 0.000 0.000 0.000) 0.000 15.647 ( 0.000 0.000 0.000) 0.000 15.661 ( 0.000 0.000 0.000) 0.000 16.003 ( 0.000 0.000 0.000) 0.000 16.006 ( 0.000 0.000 0.000) 0.000 24.614 ( 0.000 0.000 0.000) 0.000 24.715 ( 0.000 0.000 0.000) 0.000 24.750 ( 0.000 0.000 0.000) 0.000 24.776 ( 0.000 0.000 0.000) 0.000 24.869 ( 0.000 0.000 0.000) 0.000 24.941 ( 0.000 0.000 0.000) 0.000 25.019 ( 0.000 0.000 0.000) 0.000 25.153 ( 0.000 0.000 0.000) 0.000 26.162 ( 0.000 0.000 0.000) 0.000 26.449 ( 0.000 0.000 0.000) 0.000 26.525 ( 0.000 0.000 0.000) 0.000 26.757 ( 0.000 0.000 0.000) 0.000 28.470 ( 0.000 0.000 0.000) 0.000 28.887 ( 0.000 0.000 0.000) 0.000 29.153 ( 0.000 0.000 0.000) 0.000 29.327 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/104) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.576 ( 39.015 0.000 -19.964) 43.826 0.668 ( 31.112 0.000 15.654) 34.828 0.919 ( 35.977 0.000 39.688) 53.568 2.523 ( -5.442 0.000 -0.654) 5.481 2.540 ( -16.526 0.000 4.584) 17.150 2.651 ( -0.282 0.000 2.731) 2.746 2.707 ( 2.912 0.000 1.005) 3.081 2.777 ( -0.031 0.000 -6.530) 6.530 2.797 ( -7.499 0.000 10.533) 12.930 3.104 ( 1.658 0.000 -4.342) 4.648 3.138 ( -0.219 0.000 3.914) 3.920 3.247 ( 8.216 0.000 -1.289) 8.317 3.339 ( 1.495 0.000 1.162) 1.893 3.478 ( 2.540 0.000 -0.689) 2.632 4.069 ( 1.276 0.000 2.565) 2.865 4.122 ( -3.052 0.000 -0.221) 3.060 4.212 ( 1.318 0.000 -5.393) 5.552 4.302 ( -10.352 0.000 -0.599) 10.370 4.402 ( -1.724 0.000 3.114) 3.559 4.495 ( -5.852 0.000 -3.359) 6.748 4.504 ( -1.069 0.000 -2.896) 3.087 4.616 ( -3.107 0.000 -5.966) 6.727 4.864 ( -0.398 0.000 9.272) 9.281 5.019 ( 0.783 0.000 -3.035) 3.135 5.090 ( -9.972 0.000 -8.786) 13.290 5.102 ( 2.893 0.000 -3.926) 4.877 5.238 ( -1.216 0.000 -2.024) 2.361 5.497 ( -0.195 0.000 -0.689) 0.716 5.513 ( -2.854 0.000 -0.881) 2.987 5.726 ( 2.166 0.000 1.125) 2.440 5.846 ( 5.756 0.000 8.512) 10.276 5.907 ( -1.649 0.000 -1.093) 1.979 6.270 ( -7.162 0.000 -0.475) 7.178 6.355 ( 1.445 0.000 1.620) 2.171 6.474 ( 9.561 0.000 3.086) 10.047 6.653 ( 2.321 0.000 -4.874) 5.399 6.729 ( 0.331 0.000 -2.031) 2.058 6.758 ( 3.945 0.000 -3.741) 5.437 7.024 ( -3.114 0.000 -10.730) 11.173 7.099 ( -1.713 0.000 -1.358) 2.186 7.176 ( 2.275 0.000 2.232) 3.187 7.274 ( 2.902 0.000 -0.478) 2.941 7.334 ( -0.510 0.000 1.565) 1.646 7.491 ( -1.213 0.000 1.482) 1.915 7.763 ( -1.116 0.000 -1.943) 2.240 7.876 ( 2.173 0.000 3.475) 4.099 8.043 ( 7.182 0.000 10.984) 13.124 8.787 ( -7.420 0.000 15.271) 16.979 8.812 ( 0.553 0.000 1.336) 1.446 8.879 ( -1.278 0.000 0.599) 1.411 9.011 ( 0.682 0.000 0.580) 0.895 9.459 ( 3.959 0.000 -23.725) 24.053 9.561 ( -2.231 0.000 -1.156) 2.513 9.637 ( -0.735 0.000 1.995) 2.126 10.017 ( 0.241 0.000 4.503) 4.509 10.061 ( 4.864 0.000 -8.249) 9.576 10.506 ( -12.361 0.000 -0.167) 12.362 10.623 ( -2.541 0.000 -2.986) 3.921 10.873 ( -6.810 0.000 -0.743) 6.851 11.261 ( 8.833 0.000 -2.461) 9.169 11.597 ( -3.592 0.000 12.522) 13.027 11.878 ( 2.939 0.000 2.091) 3.607 12.079 ( -4.230 0.000 -3.400) 5.427 12.154 ( 8.620 0.000 -1.136) 8.694 12.538 ( -8.632 0.000 43.190) 44.044 13.071 ( -10.737 0.000 -4.037) 11.471 13.463 ( -6.651 0.000 3.374) 7.458 13.466 ( -5.719 0.000 4.149) 7.066 13.650 ( 0.731 0.000 -7.266) 7.303 13.695 ( 9.400 0.000 -28.652) 30.154 13.907 ( 10.563 0.000 1.516) 10.672 14.667 ( -5.408 0.000 -5.496) 7.710 14.934 ( 6.058 0.000 5.015) 7.865 15.034 ( 1.423 0.000 -0.650) 1.564 15.155 ( 9.647 0.000 4.688) 10.726 15.222 ( -1.426 0.000 7.839) 7.967 15.609 ( -4.563 0.000 3.199) 5.573 15.946 ( -5.890 0.000 2.923) 6.575 16.018 ( 2.020 0.000 -6.178) 6.500 16.075 ( 2.412 0.000 2.792) 3.690 24.623 ( 0.632 0.000 1.143) 1.306 24.700 ( -1.270 0.000 -1.834) 2.231 24.756 ( 0.600 0.000 1.524) 1.638 24.784 ( 2.141 0.000 -10.426) 10.643 24.890 ( 1.089 0.000 -9.523) 9.585 24.923 ( -1.898 0.000 0.657) 2.009 25.045 ( 2.696 0.000 -1.204) 2.952 25.186 ( 2.744 0.000 0.658) 2.822 26.167 ( 0.926 0.000 -1.034) 1.388 26.450 ( -0.807 0.000 2.380) 2.513 26.793 ( 3.683 0.000 0.417) 3.707 27.687 ( -14.567 0.000 26.626) 30.350 28.485 ( 1.682 0.000 -0.309) 1.710 28.871 ( -1.700 0.000 -0.089) 1.702 29.184 ( 2.692 0.000 1.274) 2.978 30.120 ( 0.756 0.000 -8.243) 8.277 ======================= Grid point 2 (3/104) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( 37.313 0.000 -15.780) 40.512 1.298 ( 28.536 0.000 13.737) 31.671 1.732 ( 26.917 0.000 34.014) 43.375 2.202 ( -24.200 0.000 7.942) 25.470 2.284 ( -17.045 0.000 -7.706) 18.706 2.509 ( -9.006 0.000 4.218) 9.945 2.608 ( -5.957 0.000 -15.187) 16.313 2.839 ( 5.036 0.000 2.624) 5.679 3.024 ( 12.751 0.000 14.294) 19.154 3.112 ( 0.489 0.000 -2.227) 2.281 3.184 ( 2.958 0.000 4.926) 5.746 3.333 ( 2.552 0.000 -1.117) 2.785 3.373 ( 0.984 0.000 1.971) 2.203 3.500 ( -0.000 0.000 -2.974) 2.974 4.032 ( -7.760 0.000 -1.263) 7.863 4.102 ( -0.175 0.000 2.340) 2.347 4.114 ( -6.649 0.000 -0.435) 6.664 4.228 ( 4.153 0.000 -1.701) 4.488 4.278 ( -11.756 0.000 -6.053) 13.223 4.402 ( -0.791 0.000 4.222) 4.295 4.452 ( -1.391 0.000 -7.382) 7.512 4.532 ( -4.240 0.000 -7.050) 8.227 4.863 ( -5.958 0.000 -6.524) 8.835 4.905 ( -3.017 0.000 12.026) 12.398 5.034 ( 2.370 0.000 -4.149) 4.778 5.095 ( 0.163 0.000 -7.022) 7.024 5.207 ( -0.683 0.000 2.229) 2.331 5.466 ( -1.807 0.000 -4.209) 4.581 5.499 ( 0.783 0.000 -0.687) 1.042 5.760 ( 0.536 0.000 1.227) 1.338 5.901 ( 1.792 0.000 -1.720) 2.484 5.946 ( 1.547 0.000 3.101) 3.466 6.122 ( -7.669 0.000 -0.594) 7.692 6.401 ( 1.620 0.000 4.129) 4.435 6.657 ( 6.285 0.000 3.125) 7.019 6.706 ( 5.298 0.000 -5.832) 7.879 6.740 ( 2.009 0.000 -3.297) 3.861 6.797 ( 0.932 0.000 2.679) 2.836 6.971 ( 3.373 0.000 -0.696) 3.444 7.069 ( -0.750 0.000 -0.037) 0.750 7.206 ( 1.051 0.000 -3.005) 3.183 7.308 ( 2.141 0.000 -3.869) 4.422 7.359 ( 2.303 0.000 1.600) 2.805 7.475 ( -0.890 0.000 -0.035) 0.890 7.675 ( -6.458 0.000 -4.043) 7.620 7.911 ( -0.809 0.000 2.963) 3.071 8.283 ( 9.803 0.000 13.642) 16.799 8.705 ( -6.491 0.000 -1.332) 6.626 8.838 ( 1.132 0.000 1.452) 1.841 8.874 ( -0.470 0.000 2.821) 2.860 9.065 ( 4.635 0.000 1.595) 4.901 9.365 ( -0.612 0.000 -14.333) 14.346 9.480 ( -5.312 0.000 -2.456) 5.853 9.642 ( -0.330 0.000 2.807) 2.826 10.079 ( 1.122 0.000 8.458) 8.532 10.095 ( 3.226 0.000 -3.460) 4.731 10.278 ( -10.689 0.000 -1.003) 10.736 10.540 ( -3.569 0.000 -4.430) 5.689 10.745 ( -5.916 0.000 -0.216) 5.920 11.415 ( 8.953 0.000 -1.275) 9.044 11.609 ( -1.138 0.000 5.158) 5.282 11.937 ( -5.497 0.000 3.737) 6.646 11.952 ( 0.736 0.000 -6.351) 6.393 12.293 ( 5.816 0.000 0.049) 5.816 12.696 ( 4.092 0.000 19.549) 19.972 12.947 ( -1.474 0.000 -0.639) 1.606 13.309 ( -10.367 0.000 1.074) 10.423 13.322 ( -7.527 0.000 -5.669) 9.423 13.614 ( 0.430 0.000 -6.190) 6.205 13.694 ( 1.639 0.000 -4.858) 5.127 14.100 ( 7.145 0.000 2.230) 7.485 14.568 ( -2.189 0.000 -3.424) 4.064 15.061 ( 1.863 0.000 -0.861) 2.052 15.069 ( 5.039 0.000 3.518) 6.145 15.241 ( -0.350 0.000 2.933) 2.954 15.376 ( 10.804 0.000 5.052) 11.927 15.550 ( -3.613 0.000 2.990) 4.690 15.827 ( -8.048 0.000 -0.540) 8.066 16.010 ( 0.790 0.000 -4.083) 4.159 16.134 ( 2.642 0.000 0.040) 2.642 24.647 ( 0.822 0.000 1.916) 2.085 24.662 ( -1.418 0.000 -1.169) 1.838 24.753 ( -0.035 0.000 -5.144) 5.144 24.789 ( 1.770 0.000 1.722) 2.469 24.853 ( -0.418 0.000 -3.519) 3.543 24.886 ( -2.099 0.000 -0.851) 2.265 25.084 ( 1.873 0.000 -0.547) 1.951 25.238 ( 2.185 0.000 0.585) 2.262 26.179 ( 1.005 0.000 -1.122) 1.506 26.449 ( -0.895 0.000 2.446) 2.605 26.879 ( 4.841 0.000 0.310) 4.851 27.569 ( -9.397 0.000 8.521) 12.686 28.520 ( 2.149 0.000 -0.276) 2.167 28.832 ( -2.156 0.000 -0.114) 2.159 29.247 ( 2.747 0.000 1.296) 3.037 30.077 ( -1.118 0.000 -3.381) 3.562 ======================= Grid point 3 (4/104) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( -0.000 0.000 0.000) 0.000 1.708 ( 0.000 0.000 -0.000) 0.000 1.840 ( 0.000 0.000 0.000) 0.000 1.860 ( -0.000 0.000 -0.000) 0.000 2.272 ( 0.000 0.000 0.000) 0.000 2.376 ( 0.000 0.000 0.000) 0.000 2.441 ( 0.000 0.000 0.000) 0.000 2.911 ( 0.000 0.000 0.000) 0.000 3.100 ( 0.000 0.000 0.000) 0.000 3.245 ( 0.000 0.000 0.000) 0.000 3.250 ( 0.000 0.000 0.000) 0.000 3.331 ( -0.000 0.000 -0.000) 0.000 3.389 ( 0.000 0.000 0.000) 0.000 3.462 ( 0.000 0.000 0.000) 0.000 3.929 ( 0.000 0.000 -0.000) 0.000 4.039 ( 0.000 0.000 0.000) 0.000 4.100 ( 0.000 0.000 0.000) 0.000 4.135 ( 0.000 0.000 0.000) 0.000 4.336 ( 0.000 0.000 -0.000) 0.000 4.344 ( 0.000 0.000 0.000) 0.000 4.420 ( 0.000 0.000 -0.000) 0.000 4.449 ( 0.000 0.000 0.000) 0.000 4.804 ( 0.000 0.000 0.000) 0.000 4.904 ( 0.000 0.000 0.000) 0.000 5.030 ( 0.000 0.000 0.000) 0.000 5.081 ( 0.000 0.000 -0.000) 0.000 5.224 ( 0.000 0.000 0.000) 0.000 5.418 ( 0.000 0.000 -0.000) 0.000 5.507 ( 0.000 0.000 0.000) 0.000 5.766 ( 0.000 0.000 0.000) 0.000 5.927 ( 0.000 0.000 0.000) 0.000 5.964 ( 0.000 0.000 -0.000) 0.000 6.033 ( 0.000 0.000 0.000) 0.000 6.436 ( 0.000 0.000 0.000) 0.000 6.707 ( 0.000 0.000 -0.000) 0.000 6.736 ( -0.000 0.000 0.000) 0.000 6.753 ( 0.000 0.000 0.000) 0.000 6.815 ( 0.000 0.000 -0.000) 0.000 7.058 ( 0.000 0.000 0.000) 0.000 7.070 ( 0.000 0.000 0.000) 0.000 7.193 ( 0.000 0.000 0.000) 0.000 7.310 ( 0.000 0.000 -0.000) 0.000 7.405 ( 0.000 0.000 0.000) 0.000 7.466 ( 0.000 0.000 0.000) 0.000 7.561 ( -0.000 0.000 -0.000) 0.000 7.905 ( 0.000 0.000 0.000) 0.000 8.495 ( 0.000 0.000 -0.000) 0.000 8.567 ( 0.000 0.000 0.000) 0.000 8.855 ( 0.000 0.000 0.000) 0.000 8.882 ( 0.000 0.000 0.000) 0.000 9.141 ( 0.000 0.000 -0.000) 0.000 9.306 ( 0.000 0.000 -0.000) 0.000 9.396 ( 0.000 0.000 0.000) 0.000 9.652 ( 0.000 0.000 0.000) 0.000 10.103 ( 0.000 0.000 -0.000) 0.000 10.141 ( 0.000 0.000 0.000) 0.000 10.168 ( 0.000 0.000 0.000) 0.000 10.481 ( 0.000 0.000 0.000) 0.000 10.688 ( 0.000 0.000 -0.000) 0.000 11.517 ( 0.000 0.000 -0.000) 0.000 11.615 ( 0.000 0.000 0.000) 0.000 11.833 ( 0.000 0.000 0.000) 0.000 11.977 ( 0.000 0.000 -0.000) 0.000 12.346 ( 0.000 0.000 -0.000) 0.000 12.833 ( 0.000 0.000 0.000) 0.000 12.955 ( 0.000 0.000 0.000) 0.000 13.195 ( 0.000 0.000 0.000) 0.000 13.200 ( 0.000 0.000 0.000) 0.000 13.599 ( 0.000 0.000 0.000) 0.000 13.693 ( 0.000 0.000 0.000) 0.000 14.169 ( 0.000 0.000 0.000) 0.000 14.542 ( 0.000 0.000 0.000) 0.000 15.078 ( 0.000 0.000 0.000) 0.000 15.129 ( 0.000 0.000 0.000) 0.000 15.245 ( 0.000 0.000 0.000) 0.000 15.526 ( 0.000 0.000 0.000) 0.000 15.543 ( -0.000 0.000 -0.000) 0.000 15.700 ( 0.000 0.000 0.000) 0.000 16.004 ( 0.000 0.000 0.000) 0.000 16.160 ( 0.000 0.000 0.000) 0.000 24.645 ( 0.000 0.000 0.000) 0.000 24.665 ( 0.000 0.000 -0.000) 0.000 24.733 ( 0.000 0.000 -0.000) 0.000 24.827 ( 0.000 0.000 -0.000) 0.000 24.838 ( 0.000 0.000 0.000) 0.000 24.848 ( 0.000 0.000 0.000) 0.000 25.100 ( 0.000 0.000 -0.000) 0.000 25.261 ( 0.000 0.000 0.000) 0.000 26.186 ( 0.000 0.000 0.000) 0.000 26.448 ( 0.000 0.000 0.000) 0.000 26.933 ( 0.000 0.000 0.000) 0.000 27.500 ( 0.000 0.000 0.000) 0.000 28.543 ( 0.000 0.000 0.000) 0.000 28.809 ( 0.000 0.000 0.000) 0.000 29.279 ( 0.000 0.000 0.000) 0.000 30.054 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 7 (5/104) ======================= q-point: ( 0.00 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.585 ( 0.000 30.372 0.000) 30.372 0.684 ( 0.000 35.569 0.000) 35.569 0.717 ( 0.000 33.631 0.000) 33.631 2.524 ( 0.000 2.380 0.000) 2.380 2.636 ( 0.000 1.596 0.000) 1.596 2.661 ( 0.000 -8.797 0.000) 8.797 2.707 ( 0.000 -1.472 0.000) 1.472 2.785 ( 0.000 6.179 0.000) 6.179 3.017 ( 0.000 -7.108 0.000) 7.108 3.019 ( 0.000 -1.312 0.000) 1.312 3.130 ( 0.000 3.093 0.000) 3.093 3.166 ( 0.000 3.682 0.000) 3.682 3.230 ( 0.000 -7.463 0.000) 7.463 3.496 ( 0.000 1.547 0.000) 1.547 3.852 ( 0.000 -15.613 0.000) 15.613 3.871 ( 0.000 -13.415 0.000) 13.415 4.358 ( 0.000 2.529 0.000) 2.529 4.460 ( 0.000 4.172 0.000) 4.172 4.526 ( 0.000 -5.544 0.000) 5.544 4.596 ( 0.000 2.831 0.000) 2.831 4.722 ( 0.000 20.123 0.000) 20.123 4.765 ( 0.000 -7.134 0.000) 7.134 4.923 ( 0.000 9.787 0.000) 9.787 4.984 ( 0.000 -4.603 0.000) 4.603 5.176 ( 0.000 1.093 0.000) 1.093 5.277 ( 0.000 1.903 0.000) 1.903 5.342 ( 0.000 -11.587 0.000) 11.587 5.348 ( 0.000 -2.788 0.000) 2.788 5.458 ( 0.000 -1.625 0.000) 1.625 5.707 ( 0.000 0.784 0.000) 0.784 5.756 ( 0.000 4.597 0.000) 4.597 6.055 ( 0.000 8.567 0.000) 8.567 6.323 ( 0.000 -1.052 0.000) 1.052 6.351 ( 0.000 -1.526 0.000) 1.526 6.529 ( 0.000 0.349 0.000) 0.349 6.650 ( 0.000 -2.794 0.000) 2.794 6.761 ( 0.000 1.533 0.000) 1.533 6.793 ( 0.000 -3.399 0.000) 3.399 6.892 ( 0.000 -10.963 0.000) 10.963 7.072 ( 0.000 -1.228 0.000) 1.228 7.108 ( 0.000 -2.896 0.000) 2.896 7.216 ( 0.000 -3.708 0.000) 3.708 7.326 ( 0.000 -2.724 0.000) 2.724 7.368 ( 0.000 11.783 0.000) 11.783 7.670 ( 0.000 8.570 0.000) 8.570 7.847 ( 0.000 6.932 0.000) 6.932 7.861 ( 0.000 2.467 0.000) 2.467 8.005 ( 0.000 6.221 0.000) 6.221 8.847 ( 0.000 -2.545 0.000) 2.545 9.053 ( 0.000 4.420 0.000) 4.420 9.413 ( 0.000 -0.723 0.000) 0.723 9.505 ( 0.000 -4.224 0.000) 4.224 9.591 ( 0.000 -1.662 0.000) 1.662 9.823 ( 0.000 8.578 0.000) 8.578 10.005 ( 0.000 -0.923 0.000) 0.923 10.373 ( 0.000 -3.223 0.000) 3.223 10.592 ( 0.000 -7.543 0.000) 7.543 10.649 ( 0.000 0.564 0.000) 0.564 10.830 ( 0.000 -6.892 0.000) 6.892 11.114 ( 0.000 6.894 0.000) 6.894 11.724 ( 0.000 -10.925 0.000) 10.925 11.920 ( 0.000 -4.251 0.000) 4.251 12.023 ( 0.000 -1.139 0.000) 1.139 12.123 ( 0.000 -1.210 0.000) 1.210 12.373 ( 0.000 14.543 0.000) 14.543 13.201 ( 0.000 -6.189 0.000) 6.189 13.298 ( 0.000 -0.558 0.000) 0.558 13.358 ( 0.000 -2.080 0.000) 2.080 13.550 ( 0.000 -1.202 0.000) 1.202 13.678 ( 0.000 0.243 0.000) 0.243 13.803 ( 0.000 0.435 0.000) 0.435 14.588 ( 0.000 -12.020 0.000) 12.020 14.908 ( 0.000 2.583 0.000) 2.583 15.056 ( 0.000 2.877 0.000) 2.877 15.228 ( 0.000 14.711 0.000) 14.711 15.602 ( 0.000 -1.592 0.000) 1.592 15.666 ( 0.000 0.567 0.000) 0.567 15.718 ( 0.000 2.727 0.000) 2.727 15.986 ( 0.000 -2.172 0.000) 2.172 15.994 ( 0.000 -1.086 0.000) 1.086 24.625 ( 0.000 1.148 0.000) 1.148 24.731 ( 0.000 -0.811 0.000) 0.811 24.803 ( 0.000 1.534 0.000) 1.534 24.822 ( 0.000 0.634 0.000) 0.634 24.872 ( 0.000 0.050 0.000) 0.050 24.950 ( 0.000 1.242 0.000) 1.242 25.022 ( 0.000 -3.053 0.000) 3.053 25.157 ( 0.000 0.054 0.000) 0.054 26.442 ( 0.000 -0.419 0.000) 0.419 26.554 ( 0.000 2.695 0.000) 2.695 26.715 ( 0.000 -3.629 0.000) 3.629 26.826 ( 0.000 0.444 0.000) 0.444 28.806 ( 0.000 -6.538 0.000) 6.538 29.045 ( 0.000 -9.544 0.000) 9.544 29.432 ( 0.000 8.996 0.000) 8.996 29.710 ( 0.000 5.156 0.000) 5.156 ======================= Grid point 8 (6/104) ======================= q-point: ( 0.17 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.184 ( 18.622 -8.146 5.448) 21.043 0.891 ( 25.486 22.483 -2.544) 34.081 1.420 ( 32.209 29.035 23.445) 49.296 2.429 ( -13.233 -7.404 -1.629) 15.251 2.471 ( -11.859 -6.954 3.645) 14.222 2.635 ( -4.371 0.857 0.017) 4.454 2.697 ( -3.069 -0.485 -1.525) 3.461 2.813 ( -2.890 0.018 0.156) 2.894 2.940 ( 6.424 12.192 8.114) 15.992 3.090 ( 1.328 -1.556 -5.703) 6.059 3.119 ( -0.140 -2.186 1.646) 2.740 3.232 ( 6.198 -1.464 -1.723) 6.597 3.270 ( 1.333 -4.535 4.453) 6.494 3.493 ( -0.472 0.533 0.735) 1.023 3.845 ( 0.632 -14.572 -1.517) 14.665 3.882 ( 1.130 -14.186 0.019) 14.230 4.221 ( -9.753 -0.299 -7.202) 12.127 4.378 ( -9.447 -3.353 -1.978) 10.217 4.458 ( -2.340 5.073 2.688) 6.200 4.548 ( -5.836 1.260 -2.323) 6.407 4.641 ( -3.989 11.485 -4.855) 13.092 4.781 ( -2.370 8.661 7.537) 11.723 4.903 ( -0.213 7.795 1.499) 7.941 5.005 ( 3.033 -0.729 -4.642) 5.593 5.162 ( -1.860 5.985 -2.821) 6.872 5.171 ( -2.169 -0.805 -4.442) 5.008 5.265 ( -4.099 7.289 -3.748) 9.164 5.347 ( -0.103 -11.906 0.680) 11.926 5.450 ( -0.229 -6.296 -0.955) 6.372 5.737 ( 2.311 3.020 -6.383) 7.430 5.891 ( 6.787 4.248 6.482) 10.301 6.063 ( -0.641 9.748 2.098) 9.992 6.258 ( -9.000 -1.684 -2.377) 9.459 6.340 ( 2.132 -0.823 0.166) 2.291 6.468 ( 1.762 -0.162 1.224) 2.151 6.585 ( 3.400 -4.760 -3.808) 6.980 6.754 ( -0.339 0.054 -1.084) 1.137 6.762 ( 4.163 -0.026 -1.156) 4.321 6.892 ( -0.180 -5.640 -0.750) 5.692 7.121 ( 1.313 -2.604 0.987) 3.079 7.259 ( 1.706 -5.368 3.438) 6.599 7.292 ( -3.175 5.269 -2.196) 6.532 7.328 ( 3.493 8.139 -3.505) 9.526 7.560 ( 0.320 3.519 1.941) 4.031 7.761 ( 14.119 -20.619 11.155) 27.367 7.808 ( -0.289 2.725 0.258) 2.753 7.898 ( 1.064 0.323 2.030) 2.315 8.205 ( 13.583 -1.952 7.206) 15.500 8.842 ( -1.322 -1.059 -0.272) 1.716 9.007 ( -3.256 2.452 0.983) 4.192 9.377 ( -7.312 5.867 10.354) 13.968 9.479 ( -0.557 -1.902 -6.993) 7.269 9.573 ( 0.260 0.210 -6.793) 6.801 9.700 ( -7.276 10.586 -8.317) 15.303 10.012 ( 0.194 -0.894 4.868) 4.954 10.182 ( -3.889 5.507 -5.175) 8.499 10.462 ( -10.753 -4.163 0.865) 11.563 10.621 ( -1.491 -0.226 -2.579) 2.987 10.895 ( -3.981 0.697 -3.301) 5.219 11.253 ( 11.626 -0.479 0.099) 11.636 11.665 ( -5.883 -2.192 0.406) 6.292 11.817 ( -0.628 -7.686 6.187) 9.887 11.991 ( -3.037 -5.607 -6.959) 9.439 12.171 ( 1.595 -2.391 6.065) 6.711 12.362 ( -0.676 2.994 12.856) 13.217 13.127 ( -7.372 2.920 0.002) 7.929 13.203 ( -2.579 -12.324 -4.852) 13.493 13.551 ( -2.639 0.881 4.944) 5.673 13.600 ( 8.782 -2.933 -14.289) 17.027 13.664 ( -1.912 -0.408 4.330) 4.751 13.947 ( 14.539 1.154 4.732) 15.333 14.732 ( 7.320 -13.406 9.693) 18.091 14.910 ( -4.352 8.864 -5.746) 11.425 14.934 ( -5.303 -0.705 -1.811) 5.647 15.173 ( 2.092 9.868 0.298) 10.092 15.426 ( -3.642 5.455 1.240) 6.675 15.657 ( -3.108 3.430 3.540) 5.827 15.884 ( 3.429 -3.801 0.272) 5.126 15.995 ( 2.199 -1.399 -0.860) 2.744 16.121 ( 6.623 2.092 -1.103) 7.032 24.634 ( 0.700 1.153 0.934) 1.641 24.709 ( -2.316 0.167 0.549) 2.386 24.778 ( -0.782 2.066 1.895) 2.910 24.817 ( 2.300 2.254 -10.762) 11.233 24.862 ( -0.989 -1.112 -0.548) 1.585 24.955 ( -0.120 1.893 -2.290) 2.974 25.025 ( 1.521 -2.347 -0.462) 2.835 25.186 ( 2.381 -0.235 0.838) 2.535 26.294 ( -5.545 9.508 -5.044) 12.107 26.446 ( -1.046 -0.027 1.801) 2.083 26.749 ( 2.829 -4.419 0.323) 5.257 27.252 ( 11.835 -21.126 17.906) 30.117 28.687 ( -13.300 2.054 -1.740) 13.570 28.837 ( -5.671 -3.231 -1.107) 6.620 29.356 ( 0.889 14.838 1.599) 14.950 29.980 ( 9.673 -7.542 -2.037) 12.434 ======================= Grid point 9 (7/104) ======================= q-point: ( 0.33 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.823 ( 35.086 -26.113 6.766) 44.258 1.390 ( 28.505 12.566 0.920) 31.165 1.970 ( -10.003 -6.382 4.865) 12.824 2.148 ( 5.497 9.369 15.995) 19.335 2.298 ( -11.110 4.953 0.337) 12.169 2.440 ( -10.578 -3.167 -0.248) 11.045 2.683 ( -1.790 4.487 -8.282) 9.588 2.790 ( 3.424 -3.488 4.039) 6.340 3.090 ( 3.369 -0.851 -3.040) 4.617 3.122 ( -0.401 -5.554 4.844) 7.381 3.164 ( 3.712 8.379 5.223) 10.548 3.275 ( 2.568 -6.554 1.879) 7.286 3.328 ( 2.699 -1.922 -0.135) 3.316 3.486 ( -0.636 -0.906 0.182) 1.122 3.859 ( 0.801 -14.174 0.787) 14.219 3.904 ( 0.472 -11.481 -0.068) 11.491 4.020 ( -6.566 -3.826 -4.962) 9.076 4.205 ( -8.382 -5.598 -2.284) 10.335 4.268 ( -13.701 -1.654 -7.899) 15.901 4.491 ( -0.504 7.307 3.387) 8.070 4.597 ( 1.368 17.070 -1.387) 17.180 4.769 ( -2.273 11.166 0.362) 11.401 4.918 ( -1.490 3.952 6.012) 7.347 5.029 ( 2.613 6.017 -6.153) 8.994 5.092 ( -0.978 7.131 -3.220) 7.885 5.147 ( -0.166 5.226 -2.422) 5.763 5.181 ( -3.233 1.897 -0.451) 3.776 5.348 ( 0.576 -9.924 -2.596) 10.274 5.447 ( 0.017 -6.623 -0.457) 6.638 5.734 ( 1.010 2.035 -1.582) 2.769 5.984 ( 0.776 3.467 0.232) 3.560 6.055 ( -0.939 8.417 -0.914) 8.519 6.109 ( -5.555 0.213 0.991) 5.647 6.394 ( 2.121 -1.191 3.409) 4.188 6.510 ( 2.867 -7.876 -0.780) 8.418 6.675 ( 1.683 -2.545 -0.491) 3.091 6.760 ( 3.689 0.955 -1.474) 4.086 6.870 ( 4.064 1.300 0.452) 4.291 6.908 ( 5.301 -4.927 2.747) 7.741 7.128 ( -0.870 2.594 -1.140) 2.964 7.207 ( -1.880 4.417 -4.129) 6.331 7.290 ( 4.648 -1.682 -3.095) 5.832 7.427 ( 2.885 5.602 2.861) 6.920 7.511 ( -2.065 3.696 -0.580) 4.273 7.712 ( -5.967 2.825 -3.466) 7.457 7.880 ( -2.468 -2.522 0.528) 3.568 8.114 ( 11.001 -19.016 14.255) 26.189 8.409 ( 5.042 -9.081 1.144) 10.450 8.765 ( -5.281 0.444 -1.246) 5.444 9.033 ( 3.924 2.626 3.336) 5.781 9.320 ( -6.563 8.510 13.868) 17.544 9.378 ( -0.504 5.669 -18.706) 19.553 9.492 ( -2.468 3.513 -10.687) 11.518 9.624 ( -1.011 -1.354 4.027) 4.367 10.076 ( 2.092 -0.701 7.171) 7.503 10.143 ( -1.269 2.590 0.011) 2.885 10.265 ( -8.640 -1.104 -2.014) 8.940 10.565 ( -2.299 2.315 -3.130) 4.521 10.770 ( -5.906 2.651 -1.491) 6.643 11.407 ( 6.847 -1.298 -2.499) 7.404 11.629 ( -1.252 -1.856 3.290) 3.979 11.840 ( -1.952 -6.384 3.179) 7.394 11.897 ( -2.386 -8.182 -4.234) 9.516 12.243 ( 4.238 -19.150 1.220) 19.651 12.475 ( 4.372 5.119 6.879) 9.625 13.061 ( -0.889 4.115 1.598) 4.503 13.096 ( -5.268 -8.465 -1.159) 10.037 13.443 ( -8.372 3.650 -0.281) 9.137 13.620 ( 2.360 1.100 -6.783) 7.265 13.678 ( 0.559 -0.671 1.480) 1.718 14.223 ( 10.849 5.789 5.194) 13.349 14.656 ( -8.363 7.588 -5.459) 12.542 14.923 ( 3.315 -7.418 4.028) 9.069 14.996 ( 5.689 -12.227 1.762) 13.600 15.226 ( 2.241 6.739 -0.065) 7.102 15.371 ( -3.898 -0.275 1.468) 4.175 15.668 ( 1.567 4.234 3.841) 5.927 15.903 ( -0.083 3.593 -0.798) 3.682 16.027 ( 1.979 3.288 -2.964) 4.849 16.168 ( 0.722 4.246 -0.685) 4.361 24.658 ( 0.925 1.093 1.158) 1.842 24.672 ( -1.652 1.070 0.214) 1.980 24.784 ( 0.409 2.730 -5.050) 5.755 24.797 ( 1.010 0.615 -0.023) 1.182 24.839 ( -1.066 -0.510 -0.053) 1.183 24.924 ( -1.351 3.188 -1.750) 3.880 25.057 ( 1.759 -2.723 -0.615) 3.299 25.233 ( 1.943 -0.676 0.618) 2.148 26.238 ( -0.211 5.800 -1.690) 6.044 26.439 ( -1.100 -0.825 2.198) 2.593 26.811 ( 3.393 -6.505 0.065) 7.337 27.405 ( -0.519 -13.851 7.763) 15.887 28.524 ( -3.749 -0.265 -1.200) 3.946 28.769 ( -2.659 -5.997 -0.280) 6.566 29.407 ( 2.515 13.787 1.462) 14.091 30.041 ( 0.947 -2.903 -2.084) 3.697 ======================= Grid point 10 (8/104) ======================= q-point: (-0.50 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( 0.000 -20.989 0.000) 20.989 1.535 ( -0.000 -23.699 -0.000) 23.699 1.822 ( 0.000 6.662 0.000) 6.662 1.981 ( -0.000 8.735 -0.000) 8.735 2.350 ( 0.000 -8.035 0.000) 8.035 2.499 ( 0.000 8.368 0.000) 8.368 2.556 ( -0.000 22.360 -0.000) 22.360 2.889 ( 0.000 -3.240 0.000) 3.240 3.068 ( -0.000 -6.688 0.000) 6.688 3.137 ( 0.000 -8.843 0.000) 8.843 3.197 ( 0.000 -3.049 -0.000) 3.049 3.341 ( 0.000 -3.151 0.000) 3.151 3.370 ( 0.000 2.662 0.000) 2.662 3.482 ( 0.000 1.692 0.000) 1.692 3.843 ( 0.000 -7.736 -0.000) 7.736 3.886 ( 0.000 -11.832 -0.000) 11.832 3.981 ( 0.000 -11.572 0.000) 11.572 4.062 ( -0.000 -1.721 0.000) 1.721 4.123 ( 0.000 -1.937 -0.000) 1.937 4.503 ( 0.000 7.690 0.000) 7.690 4.641 ( 0.000 19.063 0.000) 19.063 4.715 ( 0.000 10.529 0.000) 10.529 4.921 ( 0.000 3.941 0.000) 3.941 5.022 ( 0.000 16.340 -0.000) 16.340 5.091 ( -0.000 3.172 0.000) 3.172 5.130 ( 0.000 8.979 -0.000) 8.979 5.157 ( 0.000 -6.303 -0.000) 6.303 5.340 ( 0.000 -7.276 -0.000) 7.276 5.446 ( 0.000 -7.441 -0.000) 7.441 5.744 ( 0.000 2.062 -0.000) 2.062 5.967 ( 0.000 -1.848 -0.000) 1.848 6.045 ( 0.000 3.251 -0.000) 3.251 6.069 ( 0.000 9.460 -0.000) 9.460 6.431 ( 0.000 -1.573 0.000) 1.573 6.538 ( 0.000 -8.872 0.000) 8.872 6.673 ( 0.000 -3.386 -0.000) 3.386 6.807 ( 0.000 3.292 -0.000) 3.292 6.864 ( 0.000 -0.964 0.000) 0.964 7.054 ( 0.000 -11.080 0.000) 11.080 7.110 ( 0.000 6.500 0.000) 6.500 7.162 ( 0.000 6.220 0.000) 6.220 7.366 ( 0.000 3.570 -0.000) 3.570 7.431 ( 0.000 3.479 0.000) 3.479 7.501 ( 0.000 3.102 -0.000) 3.102 7.616 ( 0.000 4.888 -0.000) 4.888 7.847 ( 0.000 -5.928 0.000) 5.928 8.299 ( 0.000 -21.168 -0.000) 21.168 8.424 ( 0.000 -7.362 0.000) 7.362 8.704 ( 0.000 1.440 0.000) 1.440 9.104 ( 0.000 4.286 -0.000) 4.286 9.277 ( 0.000 -2.515 0.000) 2.515 9.340 ( 0.000 17.186 -0.000) 17.186 9.412 ( 0.000 1.332 -0.000) 1.332 9.636 ( 0.000 -1.367 -0.000) 1.367 10.113 ( 0.000 -0.836 0.000) 0.836 10.133 ( 0.000 -1.164 0.000) 1.164 10.185 ( 0.000 2.123 0.000) 2.123 10.528 ( 0.000 4.482 0.000) 4.482 10.707 ( 0.000 2.258 0.000) 2.258 11.473 ( 0.000 -6.800 -0.000) 6.800 11.619 ( 0.000 -0.189 0.000) 0.189 11.818 ( -0.000 -10.308 0.000) 10.308 11.868 ( 0.000 2.948 -0.000) 2.948 12.296 ( 0.000 -31.443 -0.000) 31.443 12.544 ( 0.000 8.308 0.000) 8.308 13.032 ( 0.000 -7.553 0.000) 7.553 13.085 ( 0.000 4.937 0.000) 4.937 13.340 ( 0.000 5.727 0.000) 5.727 13.619 ( -0.000 2.303 0.000) 2.303 13.689 ( 0.000 -0.303 -0.000) 0.303 14.360 ( 0.000 13.425 0.000) 13.425 14.540 ( -0.000 -0.229 -0.000) 0.229 14.963 ( 0.000 -6.002 0.000) 6.002 15.068 ( 0.000 -14.577 -0.000) 14.577 15.245 ( 0.000 5.946 0.000) 5.946 15.332 ( 0.000 -2.882 0.000) 2.882 15.709 ( 0.000 1.014 0.000) 1.014 15.894 ( 0.000 10.427 0.000) 10.427 16.032 ( 0.000 7.580 0.000) 7.580 16.170 ( 0.000 1.444 0.000) 1.444 24.656 ( 0.000 1.307 0.000) 1.307 24.675 ( 0.000 1.011 0.000) 1.011 24.766 ( -0.000 2.895 -0.000) 2.895 24.813 ( 0.000 -0.856 0.000) 0.856 24.830 ( 0.000 0.338 -0.000) 0.338 24.902 ( 0.000 3.968 0.000) 3.968 25.071 ( 0.000 -2.841 -0.000) 2.841 25.253 ( 0.000 -0.878 0.000) 0.878 26.234 ( 0.000 4.956 0.000) 4.956 26.436 ( 0.000 -1.160 0.000) 1.160 26.847 ( 0.000 -7.998 0.000) 7.998 27.412 ( 0.000 -9.079 0.000) 9.079 28.495 ( 0.000 -3.373 0.000) 3.373 28.742 ( 0.000 -6.287 0.000) 6.287 29.437 ( 0.000 13.668 0.000) 13.668 30.037 ( 0.000 -1.414 0.000) 1.414 ======================= Grid point 14 (9/104) ======================= q-point: ( 0.00 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( 0.000 27.932 0.000) 27.932 1.231 ( 0.000 21.200 0.000) 21.200 1.338 ( 0.000 33.170 0.000) 33.170 2.431 ( 0.000 -14.600 0.000) 14.600 2.511 ( 0.000 -14.450 0.000) 14.450 2.592 ( 0.000 -1.895 0.000) 1.895 2.724 ( 0.000 -0.349 0.000) 0.349 2.810 ( 0.000 -5.275 0.000) 5.275 2.941 ( 0.000 1.107 0.000) 1.107 2.972 ( 0.000 3.070 0.000) 3.070 3.111 ( 0.000 -2.759 0.000) 2.759 3.209 ( 0.000 4.837 0.000) 4.837 3.275 ( 0.000 4.559 0.000) 4.559 3.570 ( 0.000 7.794 0.000) 7.794 3.655 ( 0.000 -8.880 0.000) 8.880 3.678 ( 0.000 0.212 0.000) 0.212 4.365 ( 0.000 -2.949 0.000) 2.949 4.479 ( 0.000 -6.232 0.000) 6.232 4.503 ( 0.000 6.355 0.000) 6.355 4.538 ( 0.000 -8.113 0.000) 8.113 4.600 ( 0.000 -9.082 0.000) 9.082 4.933 ( 0.000 -0.690 0.000) 0.690 5.039 ( 0.000 3.891 0.000) 3.891 5.118 ( 0.000 -10.840 0.000) 10.840 5.132 ( 0.000 13.824 0.000) 13.824 5.202 ( 0.000 6.409 0.000) 6.409 5.211 ( 0.000 -5.602 0.000) 5.602 5.358 ( 0.000 3.794 0.000) 3.794 5.483 ( 0.000 1.349 0.000) 1.349 5.707 ( 0.000 -0.578 0.000) 0.578 5.822 ( 0.000 2.583 0.000) 2.583 6.181 ( 0.000 2.484 0.000) 2.484 6.294 ( 0.000 -1.721 0.000) 1.721 6.321 ( 0.000 -0.771 0.000) 0.771 6.491 ( 0.000 -4.656 0.000) 4.656 6.610 ( 0.000 -2.554 0.000) 2.554 6.725 ( 0.000 -3.858 0.000) 3.858 6.733 ( 0.000 -1.769 0.000) 1.769 6.777 ( 0.000 -0.677 0.000) 0.677 7.066 ( 0.000 -1.409 0.000) 1.409 7.082 ( 0.000 2.139 0.000) 2.139 7.110 ( 0.000 -6.675 0.000) 6.675 7.339 ( 0.000 4.248 0.000) 4.248 7.540 ( 0.000 5.451 0.000) 5.451 7.823 ( 0.000 6.559 0.000) 6.559 7.908 ( 0.000 1.857 0.000) 1.857 8.011 ( 0.000 9.648 0.000) 9.648 8.135 ( 0.000 6.654 0.000) 6.654 8.842 ( 0.000 2.560 0.000) 2.560 9.142 ( 0.000 5.166 0.000) 5.166 9.304 ( 0.000 -8.962 0.000) 8.962 9.498 ( 0.000 -0.409 0.000) 0.409 9.595 ( 0.000 3.949 0.000) 3.949 9.921 ( 0.000 0.370 0.000) 0.370 9.976 ( 0.000 -2.206 0.000) 2.206 10.360 ( 0.000 -15.920 0.000) 15.920 10.395 ( 0.000 7.871 0.000) 7.871 10.659 ( 0.000 0.677 0.000) 0.677 10.729 ( 0.000 -3.909 0.000) 3.909 11.217 ( 0.000 0.557 0.000) 0.557 11.520 ( 0.000 -6.420 0.000) 6.420 11.885 ( 0.000 0.113 0.000) 0.113 11.994 ( 0.000 -2.185 0.000) 2.185 12.048 ( 0.000 -7.068 0.000) 7.068 12.627 ( 0.000 11.927 0.000) 11.927 13.063 ( 0.000 -7.128 0.000) 7.128 13.293 ( 0.000 0.220 0.000) 0.220 13.328 ( 0.000 -0.973 0.000) 0.973 13.520 ( 0.000 -1.809 0.000) 1.809 13.624 ( 0.000 -4.921 0.000) 4.921 13.882 ( 0.000 7.055 0.000) 7.055 14.384 ( 0.000 -9.705 0.000) 9.705 14.964 ( 0.000 3.326 0.000) 3.326 15.099 ( 0.000 0.960 0.000) 0.960 15.487 ( 0.000 11.957 0.000) 11.957 15.613 ( 0.000 2.956 0.000) 2.956 15.684 ( 0.000 1.297 0.000) 1.297 15.753 ( 0.000 0.896 0.000) 0.896 15.929 ( 0.000 -3.685 0.000) 3.685 15.957 ( 0.000 -3.010 0.000) 3.010 24.656 ( 0.000 2.056 0.000) 2.056 24.729 ( 0.000 0.494 0.000) 0.494 24.818 ( 0.000 -0.084 0.000) 0.084 24.837 ( 0.000 0.837 0.000) 0.837 24.868 ( 0.000 -0.158 0.000) 0.158 24.952 ( 0.000 -3.974 0.000) 3.974 24.993 ( 0.000 3.097 0.000) 3.097 25.147 ( 0.000 -1.192 0.000) 1.192 26.444 ( 0.000 0.835 0.000) 0.835 26.618 ( 0.000 3.946 0.000) 3.946 26.635 ( 0.000 -4.615 0.000) 4.615 26.817 ( 0.000 -1.460 0.000) 1.460 28.694 ( 0.000 -4.496 0.000) 4.496 28.853 ( 0.000 -9.681 0.000) 9.681 29.610 ( 0.000 8.856 0.000) 8.856 29.794 ( 0.000 3.023 0.000) 3.023 ======================= Grid point 15 (10/104) ======================= q-point: ( 0.17 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.591 ( -30.340 29.025 -6.648) 42.510 1.379 ( 17.012 27.327 -7.589) 33.072 1.840 ( 22.867 15.661 16.152) 32.079 2.136 ( -23.008 -21.120 1.062) 31.250 2.440 ( -7.217 0.237 -3.138) 7.873 2.682 ( 6.053 -4.698 -5.234) 9.279 2.688 ( -3.578 0.948 -1.000) 3.835 2.725 ( -4.154 -7.774 1.326) 8.914 2.991 ( -0.478 -6.359 0.914) 6.442 3.057 ( 3.347 2.112 -2.510) 4.687 3.115 ( 4.267 3.374 5.648) 7.842 3.237 ( -1.031 1.541 1.451) 2.354 3.282 ( 1.522 3.790 4.354) 5.970 3.548 ( -3.885 3.742 3.853) 6.629 3.662 ( -0.081 -2.197 -2.567) 3.380 3.689 ( 4.787 -2.589 -0.889) 5.515 4.215 ( -15.800 -5.296 -10.028) 19.449 4.283 ( -5.748 -1.628 -3.024) 6.696 4.493 ( -7.439 -1.502 -0.253) 7.593 4.554 ( 1.395 -0.721 3.578) 3.907 4.653 ( 2.094 -4.553 4.077) 6.461 4.926 ( -1.426 2.183 2.605) 3.686 5.041 ( 1.892 0.277 -3.100) 3.642 5.100 ( -2.564 -0.728 1.489) 3.053 5.161 ( 1.360 -0.738 1.039) 1.864 5.172 ( 0.725 10.360 -7.163) 12.616 5.227 ( 0.869 -2.572 1.726) 3.217 5.312 ( -1.299 2.430 -2.414) 3.663 5.446 ( -1.409 5.241 -3.317) 6.360 5.782 ( 3.713 1.224 -3.386) 5.172 5.939 ( 9.141 -0.029 4.064) 10.004 6.168 ( -4.196 -3.213 1.150) 5.408 6.245 ( -3.755 4.979 -4.844) 7.896 6.342 ( 3.021 0.577 -1.335) 3.353 6.434 ( -4.650 -3.671 -5.393) 8.012 6.525 ( 4.164 -2.252 2.865) 5.533 6.729 ( -2.253 -0.374 0.349) 2.311 6.770 ( 5.466 1.254 1.471) 5.798 6.829 ( 0.072 -2.200 8.052) 8.348 7.061 ( 0.478 -5.574 -3.033) 6.364 7.151 ( 3.466 -1.721 9.535) 10.290 7.362 ( 2.043 3.908 0.546) 4.444 7.394 ( 18.542 -9.541 8.988) 22.708 7.518 ( -0.455 7.751 -4.583) 9.016 7.744 ( -5.431 6.724 -4.206) 9.613 7.871 ( -2.927 1.737 -6.052) 6.943 7.959 ( -3.486 5.862 1.484) 6.980 8.229 ( 4.581 1.196 4.354) 6.432 8.858 ( 0.359 3.313 -0.018) 3.332 9.061 ( -3.803 3.528 -0.500) 5.211 9.340 ( 0.820 -5.976 0.736) 6.077 9.503 ( 0.633 0.758 -0.196) 1.007 9.571 ( -3.272 3.061 3.018) 5.403 9.873 ( -7.070 5.039 -4.959) 9.998 9.975 ( 1.546 -2.870 2.968) 4.409 10.207 ( -7.271 -3.271 1.941) 8.205 10.387 ( -5.364 0.126 -0.708) 5.412 10.627 ( -0.664 1.094 -1.763) 2.179 10.847 ( 5.835 -5.736 -2.430) 8.536 11.256 ( 5.801 -2.735 0.993) 6.490 11.394 ( -7.103 -12.707 -6.575) 15.974 11.740 ( -10.048 -2.357 -3.140) 10.788 11.965 ( -4.842 -0.431 -5.268) 7.168 12.110 ( 3.127 -4.333 3.506) 6.391 12.569 ( -2.414 12.846 3.730) 13.593 13.005 ( -3.600 -7.150 -1.242) 8.101 13.199 ( -1.860 3.708 0.013) 4.149 13.520 ( -1.587 -4.146 5.282) 6.900 13.570 ( 7.685 -0.623 -4.048) 8.708 13.632 ( 2.466 -2.522 2.257) 4.187 13.999 ( 11.236 5.077 6.549) 13.961 14.497 ( 7.398 -10.942 8.875) 15.913 14.921 ( -1.838 2.104 -4.318) 5.143 15.051 ( -6.977 2.501 -2.061) 7.693 15.368 ( -4.202 9.041 -4.768) 11.051 15.499 ( -6.548 3.354 -0.888) 7.411 15.697 ( -2.553 0.776 5.039) 5.701 15.834 ( 6.833 -1.922 -3.594) 7.957 15.978 ( 5.274 0.302 2.535) 5.860 16.137 ( 11.802 -0.535 0.077) 11.815 24.665 ( 0.796 1.997 0.517) 2.211 24.720 ( -1.129 1.101 0.767) 1.754 24.809 ( -0.355 0.590 -0.415) 0.804 24.830 ( -0.326 0.102 -0.976) 1.034 24.871 ( 0.760 1.137 -3.180) 3.462 24.962 ( 1.131 -3.875 0.184) 4.041 24.999 ( 0.502 2.945 -0.594) 3.046 25.169 ( 1.771 -1.573 1.031) 2.583 26.421 ( -2.564 2.363 -0.590) 3.536 26.498 ( -4.848 7.041 -3.310) 9.167 26.647 ( 1.268 -5.648 -0.266) 5.795 26.982 ( 8.271 -10.016 7.554) 15.027 28.644 ( -5.915 -3.349 -0.496) 6.815 28.738 ( -7.699 -6.273 -1.561) 10.053 29.613 ( 1.383 11.314 1.482) 11.495 29.904 ( 7.383 -1.729 0.310) 7.589 ======================= Grid point 16 (11/104) ======================= q-point: ( 0.33 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.406 ( 21.114 -10.909 6.270) 24.579 1.610 ( -23.149 -17.632 -8.269) 30.251 1.726 ( 13.902 14.262 2.681) 20.096 2.123 ( -0.716 -5.796 0.146) 5.842 2.439 ( -0.068 3.224 11.245) 11.698 2.552 ( -3.124 6.132 -6.011) 9.137 2.658 ( -1.001 -6.373 3.401) 7.293 2.843 ( 8.013 3.958 -1.482) 9.059 2.905 ( -3.454 -14.142 -3.406) 14.951 3.079 ( -0.065 4.274 0.815) 4.352 3.128 ( -4.040 -3.941 1.414) 5.819 3.274 ( 1.162 0.475 3.164) 3.404 3.381 ( 6.707 3.327 2.376) 7.855 3.503 ( -2.075 2.086 2.034) 3.577 3.657 ( 0.501 -4.083 -0.929) 4.218 3.796 ( 2.522 -0.469 7.080) 7.531 3.915 ( -7.992 -4.929 -11.506) 14.851 4.171 ( -4.537 1.365 -2.515) 5.364 4.279 ( -12.637 3.310 -2.734) 13.346 4.597 ( 0.761 1.806 3.823) 4.296 4.722 ( 3.325 -3.491 1.468) 5.040 4.916 ( -1.919 5.366 3.838) 6.870 5.047 ( -3.147 -3.671 -0.265) 4.842 5.070 ( 2.954 3.176 -2.906) 5.221 5.140 ( 1.761 2.801 -2.583) 4.197 5.224 ( 3.726 4.267 -4.085) 6.984 5.249 ( -0.180 -2.613 1.701) 3.123 5.285 ( -0.682 3.306 -0.945) 3.505 5.406 ( -1.460 10.351 -1.943) 10.632 5.796 ( 1.355 2.672 -1.027) 3.167 6.004 ( -7.690 -1.694 -1.687) 8.053 6.093 ( 2.464 -0.543 1.623) 3.000 6.211 ( -0.012 5.141 -1.747) 5.429 6.324 ( -0.631 -4.171 -2.744) 5.033 6.458 ( 3.417 1.264 3.645) 5.154 6.663 ( -0.089 1.014 0.951) 1.393 6.706 ( 7.636 -6.430 -1.246) 10.060 6.825 ( 1.016 -2.025 2.094) 3.086 6.898 ( 0.377 2.836 2.925) 4.091 7.113 ( 6.339 -3.957 0.145) 7.474 7.267 ( 4.462 3.431 2.763) 6.270 7.375 ( 0.450 6.394 -1.857) 6.674 7.518 ( 2.257 4.289 3.661) 6.073 7.611 ( -4.091 5.732 -3.457) 7.844 7.703 ( 3.668 -6.501 -2.036) 7.737 7.801 ( 1.322 -6.511 -0.032) 6.644 7.887 ( -3.909 1.290 3.494) 5.399 8.272 ( -1.976 -8.151 1.191) 8.471 8.812 ( -3.095 4.967 -1.122) 5.959 9.102 ( 5.203 4.506 3.408) 7.681 9.297 ( -3.917 -3.732 -3.675) 6.540 9.488 ( -4.148 4.878 4.378) 7.757 9.571 ( 3.463 -1.566 -1.992) 4.291 9.688 ( -6.585 8.428 -5.764) 12.150 10.043 ( 2.030 -2.681 5.553) 6.492 10.132 ( -4.930 -3.530 2.977) 6.755 10.266 ( -4.564 2.583 -2.348) 5.746 10.617 ( 0.516 3.246 -0.872) 3.401 10.829 ( -3.777 2.361 -1.892) 4.839 11.243 ( -5.591 -21.019 -4.408) 22.192 11.453 ( 12.278 -9.938 1.950) 15.916 11.628 ( -0.531 -7.787 0.323) 7.811 11.827 ( -6.004 0.927 -3.423) 6.973 12.053 ( -7.446 -5.515 -5.582) 10.818 12.654 ( 6.210 10.081 4.707) 12.741 12.955 ( -2.115 -3.546 1.953) 4.567 13.181 ( -0.592 6.031 0.518) 6.082 13.459 ( -5.852 -1.965 3.030) 6.877 13.644 ( 5.030 1.270 -6.037) 7.960 13.683 ( 0.352 1.015 2.952) 3.142 14.282 ( 12.578 2.325 8.617) 15.422 14.662 ( 1.486 -8.500 6.447) 10.771 14.839 ( -4.609 1.639 -1.962) 5.270 14.917 ( -0.976 0.546 -5.896) 6.001 15.325 ( -0.053 3.240 -2.699) 4.217 15.367 ( -6.361 -0.161 -0.257) 6.368 15.719 ( 1.006 2.159 2.652) 3.564 15.891 ( 2.550 -2.848 -2.044) 4.335 16.118 ( 7.317 5.361 2.149) 9.322 16.270 ( 3.059 4.341 -1.238) 5.453 24.687 ( 1.080 1.828 0.471) 2.174 24.704 ( -1.114 2.268 1.076) 2.746 24.797 ( -0.226 -0.589 -2.025) 2.121 24.827 ( 0.615 1.505 -0.253) 1.646 24.857 ( -0.515 2.127 -1.331) 2.561 24.985 ( -0.432 -2.239 3.967) 4.576 24.999 ( 1.542 2.192 -5.034) 5.703 25.207 ( 1.481 -2.113 0.692) 2.671 26.373 ( -0.940 6.823 -1.637) 7.079 26.437 ( -2.335 1.986 0.846) 3.180 26.670 ( 1.331 -7.300 -0.550) 7.441 27.129 ( 3.734 -14.594 4.515) 15.726 28.510 ( -5.904 -0.824 -1.149) 6.071 28.642 ( -3.220 -6.483 -0.291) 7.245 29.665 ( 2.509 12.061 1.479) 12.408 29.993 ( 2.585 -2.178 -0.461) 3.411 ======================= Grid point 17 (12/104) ======================= q-point: (-0.50 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.000 ( 0.001 -21.083 0.000) 21.083 1.003 ( -0.001 -29.501 -0.000) 29.501 2.024 ( 0.000 13.406 0.000) 13.406 2.060 ( -0.000 -4.392 -0.000) 4.392 2.298 ( -0.000 8.506 0.000) 8.506 2.615 ( -0.000 3.532 0.000) 3.532 2.720 ( 0.000 -23.632 0.000) 23.632 2.721 ( -0.000 -6.154 -0.000) 6.154 3.048 ( -0.000 15.702 0.000) 15.702 3.053 ( 0.000 -4.678 -0.000) 4.678 3.089 ( 0.000 -4.513 -0.000) 4.513 3.309 ( 0.000 0.076 0.000) 0.076 3.429 ( -0.000 1.552 -0.000) 1.552 3.522 ( 0.000 2.263 0.000) 2.263 3.658 ( 0.000 -6.085 0.000) 6.085 3.760 ( 0.000 -9.927 0.000) 9.927 3.873 ( 0.000 6.325 -0.000) 6.325 4.095 ( -0.000 6.731 0.000) 6.731 4.149 ( 0.000 2.101 0.000) 2.101 4.620 ( 0.000 2.361 0.000) 2.361 4.762 ( 0.000 -3.800 -0.000) 3.800 4.910 ( -0.000 8.281 0.000) 8.281 5.014 ( 0.000 -5.386 0.000) 5.386 5.092 ( 0.000 6.136 -0.000) 6.136 5.161 ( 0.000 3.587 -0.000) 3.587 5.234 ( 0.000 -10.387 -0.000) 10.387 5.245 ( 0.000 5.394 0.000) 5.394 5.286 ( 0.000 5.197 0.000) 5.197 5.380 ( 0.000 14.773 0.000) 14.773 5.830 ( 0.000 5.538 0.000) 5.538 5.897 ( -0.000 -4.663 -0.000) 4.663 6.115 ( 0.000 1.673 -0.000) 1.673 6.206 ( 0.000 4.583 -0.000) 4.583 6.310 ( 0.000 -7.248 0.000) 7.248 6.508 ( 0.000 2.328 0.000) 2.328 6.643 ( 0.000 0.913 -0.000) 0.913 6.825 ( -0.000 -10.560 0.000) 10.560 6.827 ( 0.000 -1.946 -0.000) 1.946 6.894 ( 0.000 4.691 -0.000) 4.691 7.183 ( 0.000 0.391 0.000) 0.391 7.299 ( 0.000 8.404 -0.000) 8.404 7.440 ( 0.000 4.374 0.000) 4.374 7.548 ( 0.000 7.429 -0.000) 7.429 7.564 ( -0.000 3.218 0.000) 3.218 7.701 ( 0.000 -8.401 0.000) 8.401 7.704 ( -0.000 3.336 -0.000) 3.336 7.968 ( 0.000 -12.856 -0.000) 12.856 8.230 ( 0.000 -12.361 0.000) 12.361 8.780 ( 0.000 5.977 0.000) 5.977 9.203 ( -0.000 6.924 -0.000) 6.924 9.208 ( 0.000 -5.188 0.000) 5.188 9.456 ( 0.000 3.718 -0.000) 3.718 9.608 ( -0.000 -1.724 0.000) 1.724 9.609 ( 0.000 9.959 -0.000) 9.959 10.077 ( 0.000 -2.074 0.000) 2.074 10.087 ( -0.000 -3.549 -0.000) 3.549 10.223 ( 0.000 2.482 0.000) 2.482 10.626 ( 0.000 5.528 0.000) 5.528 10.775 ( 0.000 4.447 0.000) 4.447 11.172 ( 0.000 -23.403 0.000) 23.403 11.586 ( 0.000 -3.741 0.000) 3.741 11.667 ( 0.000 -15.621 -0.000) 15.621 11.780 ( 0.000 -7.949 0.000) 7.949 11.895 ( 0.000 -1.056 -0.000) 1.056 12.741 ( 0.000 9.102 0.000) 9.102 12.944 ( 0.000 -1.721 0.000) 1.721 13.179 ( 0.000 5.559 0.000) 5.559 13.402 ( 0.000 0.731 0.000) 0.731 13.673 ( -0.000 2.856 0.000) 2.856 13.694 ( 0.000 1.023 -0.000) 1.023 14.531 ( 0.000 4.241 0.000) 4.241 14.534 ( -0.000 -0.209 -0.000) 0.209 14.860 ( -0.000 -6.601 -0.000) 6.601 14.881 ( 0.000 -2.903 0.000) 2.903 15.301 ( -0.000 -0.903 0.000) 0.903 15.316 ( 0.000 1.467 -0.000) 1.467 15.739 ( 0.000 2.083 0.000) 2.083 15.909 ( 0.000 -2.603 -0.000) 2.603 16.225 ( 0.000 4.282 0.000) 4.282 16.259 ( -0.000 9.689 -0.000) 9.689 24.696 ( 0.000 2.884 -0.000) 2.884 24.701 ( -0.000 1.620 0.000) 1.620 24.786 ( 0.000 -0.531 0.000) 0.531 24.840 ( -0.000 0.661 0.000) 0.661 24.841 ( 0.000 3.186 -0.000) 3.186 24.989 ( 0.000 4.960 0.000) 4.960 25.000 ( 0.000 -4.348 -0.000) 4.348 25.223 ( 0.000 -2.347 0.000) 2.347 26.364 ( -0.000 8.418 0.000) 8.418 26.415 ( 0.000 -0.617 0.000) 0.617 26.681 ( 0.000 -8.167 0.000) 8.167 27.175 ( 0.000 -15.006 0.000) 15.006 28.453 ( 0.000 -0.891 0.000) 0.891 28.611 ( 0.000 -6.585 0.000) 6.585 29.696 ( 0.000 12.151 0.000) 12.151 30.010 ( 0.000 -1.476 0.000) 1.476 ======================= Grid point 21 (13/104) ======================= q-point: ( 0.00 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( 0.000 18.181 0.000) 18.181 1.621 ( 0.000 20.765 0.000) 20.765 1.924 ( 0.000 26.949 0.000) 26.949 2.118 ( 0.000 -18.629 0.000) 18.629 2.120 ( 0.000 -17.261 0.000) 17.261 2.432 ( 0.000 -22.754 0.000) 22.754 2.622 ( 0.000 3.311 0.000) 3.311 2.717 ( 0.000 -5.990 0.000) 5.990 3.007 ( 0.000 4.391 0.000) 4.391 3.064 ( 0.000 -0.063 0.000) 0.063 3.146 ( 0.000 5.371 0.000) 5.371 3.257 ( 0.000 -4.574 0.000) 4.574 3.365 ( 0.000 9.481 0.000) 9.481 3.513 ( 0.000 -6.813 0.000) 6.813 3.747 ( 0.000 17.168 0.000) 17.168 3.959 ( 0.000 21.318 0.000) 21.318 4.168 ( 0.000 -22.741 0.000) 22.741 4.326 ( 0.000 -15.481 0.000) 15.481 4.348 ( 0.000 2.084 0.000) 2.084 4.444 ( 0.000 -7.501 0.000) 7.501 4.668 ( 0.000 9.668 0.000) 9.668 4.851 ( 0.000 -9.264 0.000) 9.264 5.043 ( 0.000 3.228 0.000) 3.228 5.063 ( 0.000 0.842 0.000) 0.842 5.131 ( 0.000 -2.567 0.000) 2.567 5.155 ( 0.000 -3.167 0.000) 3.167 5.400 ( 0.000 5.230 0.000) 5.230 5.469 ( 0.000 -2.372 0.000) 2.372 5.539 ( 0.000 12.486 0.000) 12.486 5.678 ( 0.000 -3.254 0.000) 3.254 5.897 ( 0.000 7.035 0.000) 7.035 6.091 ( 0.000 -10.498 0.000) 10.498 6.278 ( 0.000 0.474 0.000) 0.474 6.309 ( 0.000 -2.147 0.000) 2.147 6.444 ( 0.000 1.964 0.000) 1.964 6.520 ( 0.000 -5.202 0.000) 5.202 6.730 ( 0.000 0.927 0.000) 0.927 6.752 ( 0.000 -0.338 0.000) 0.338 6.773 ( 0.000 5.432 0.000) 5.432 6.925 ( 0.000 -9.126 0.000) 9.126 7.112 ( 0.000 1.979 0.000) 1.979 7.122 ( 0.000 1.174 0.000) 1.174 7.448 ( 0.000 6.560 0.000) 6.560 7.555 ( 0.000 -3.516 0.000) 3.516 7.909 ( 0.000 2.589 0.000) 2.589 7.928 ( 0.000 0.300 0.000) 0.300 8.174 ( 0.000 6.414 0.000) 6.414 8.222 ( 0.000 1.551 0.000) 1.551 8.943 ( 0.000 7.696 0.000) 7.696 9.117 ( 0.000 -10.121 0.000) 10.121 9.265 ( 0.000 7.967 0.000) 7.967 9.421 ( 0.000 -7.218 0.000) 7.218 9.755 ( 0.000 12.068 0.000) 12.068 9.902 ( 0.000 -0.069 0.000) 0.069 9.927 ( 0.000 -2.714 0.000) 2.714 10.039 ( 0.000 -16.644 0.000) 16.644 10.603 ( 0.000 7.677 0.000) 7.677 10.669 ( 0.000 -2.560 0.000) 2.560 10.722 ( 0.000 10.567 0.000) 10.567 11.024 ( 0.000 -16.647 0.000) 16.647 11.602 ( 0.000 11.200 0.000) 11.200 11.840 ( 0.000 -12.597 0.000) 12.597 11.912 ( 0.000 2.331 0.000) 2.331 11.961 ( 0.000 -2.612 0.000) 2.612 12.818 ( 0.000 8.189 0.000) 8.189 12.946 ( 0.000 -5.744 0.000) 5.744 13.306 ( 0.000 0.973 0.000) 0.973 13.319 ( 0.000 -0.283 0.000) 0.283 13.495 ( 0.000 -0.163 0.000) 0.163 13.532 ( 0.000 -3.989 0.000) 3.989 14.038 ( 0.000 8.858 0.000) 8.858 14.209 ( 0.000 -9.069 0.000) 9.069 15.029 ( 0.000 3.400 0.000) 3.400 15.085 ( 0.000 -2.175 0.000) 2.175 15.664 ( 0.000 5.850 0.000) 5.850 15.687 ( 0.000 2.986 0.000) 2.986 15.719 ( 0.000 2.911 0.000) 2.911 15.758 ( 0.000 0.084 0.000) 0.084 15.856 ( 0.000 -3.188 0.000) 3.188 15.882 ( 0.000 -4.456 0.000) 4.456 24.699 ( 0.000 2.351 0.000) 2.351 24.733 ( 0.000 -0.762 0.000) 0.762 24.817 ( 0.000 0.932 0.000) 0.932 24.845 ( 0.000 -0.569 0.000) 0.569 24.869 ( 0.000 0.174 0.000) 0.174 24.885 ( 0.000 -2.428 0.000) 2.428 25.056 ( 0.000 3.295 0.000) 3.295 25.112 ( 0.000 -2.484 0.000) 2.484 26.478 ( 0.000 2.796 0.000) 2.796 26.548 ( 0.000 -4.335 0.000) 4.335 26.698 ( 0.000 4.211 0.000) 4.211 26.771 ( 0.000 -3.314 0.000) 3.314 28.651 ( 0.000 0.161 0.000) 0.161 28.705 ( 0.000 -5.498 0.000) 5.498 29.749 ( 0.000 5.528 0.000) 5.528 29.813 ( 0.000 -1.168 0.000) 1.168 ======================= Grid point 22 (14/104) ======================= q-point: ( 0.17 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( -28.949 28.142 -2.864) 40.475 1.660 ( -23.911 -26.976 0.472) 36.051 1.890 ( 13.022 25.559 -11.591) 30.938 2.132 ( 7.041 15.460 8.717) 19.094 2.324 ( 7.126 -16.011 -8.875) 19.644 2.477 ( -0.198 -16.928 2.835) 17.165 2.554 ( 3.005 -1.188 -4.334) 5.406 2.621 ( -3.951 -5.794 -2.914) 7.594 2.994 ( -5.815 5.108 -0.442) 7.752 3.092 ( -1.890 -3.418 0.731) 3.973 3.204 ( 5.265 4.627 5.139) 8.691 3.252 ( -0.291 0.075 4.004) 4.015 3.381 ( -0.303 6.242 7.121) 9.474 3.493 ( -2.106 -5.515 2.565) 6.437 3.715 ( -1.466 12.731 -6.730) 14.475 3.920 ( -3.935 10.793 -1.327) 11.564 4.051 ( -7.936 -7.986 -7.330) 13.435 4.204 ( -3.133 -8.776 -0.707) 9.345 4.459 ( 3.052 -1.423 4.608) 5.707 4.493 ( 3.274 -3.926 2.693) 5.778 4.648 ( -3.992 6.748 0.123) 7.842 4.854 ( 0.728 -12.415 -1.893) 12.579 5.001 ( -3.761 2.244 4.696) 6.421 5.053 ( -2.943 -2.620 0.637) 3.991 5.132 ( 0.672 1.560 1.856) 2.516 5.185 ( 4.280 -1.651 -1.779) 4.921 5.379 ( 0.570 5.006 -4.679) 6.876 5.434 ( -0.411 0.817 -3.022) 3.157 5.580 ( 2.373 13.318 -1.463) 13.607 5.767 ( 5.288 -4.373 -0.847) 6.914 5.937 ( 3.433 2.015 1.808) 4.372 6.045 ( -4.302 -7.953 -0.028) 9.042 6.330 ( 0.924 1.972 -2.292) 3.162 6.343 ( 4.758 -0.525 -2.535) 5.417 6.392 ( -0.320 1.068 -2.448) 2.690 6.456 ( 0.239 -4.307 -0.843) 4.396 6.755 ( -1.865 1.970 5.164) 5.833 6.788 ( -1.418 -1.615 7.747) 8.039 6.832 ( 5.987 4.838 3.348) 8.395 6.942 ( 1.846 -6.243 0.502) 6.530 7.177 ( 5.202 3.129 6.674) 9.022 7.254 ( 9.704 -5.158 5.672) 12.367 7.471 ( 2.676 6.376 -1.048) 6.994 7.569 ( 1.785 -2.469 -1.913) 3.598 7.847 ( -4.312 3.650 -4.305) 7.103 7.882 ( -3.665 -0.354 -5.620) 6.718 8.094 ( -6.215 7.434 -1.914) 9.877 8.207 ( -3.204 -3.818 -0.263) 4.991 8.966 ( 0.973 7.441 0.562) 7.525 9.095 ( -0.846 -3.603 -0.071) 3.702 9.281 ( 1.417 3.667 0.188) 3.936 9.421 ( 1.093 -7.656 -0.557) 7.754 9.720 ( -5.727 10.300 4.176) 12.503 9.878 ( -5.849 -4.025 -0.622) 7.127 9.939 ( 2.279 0.437 3.879) 4.520 10.039 ( -1.705 -10.403 7.506) 12.941 10.549 ( -4.365 12.221 -5.454) 14.077 10.666 ( -0.360 1.723 1.085) 2.068 10.743 ( 4.696 -1.409 -6.552) 8.183 10.967 ( -4.077 -18.238 -6.224) 19.697 11.463 ( -7.285 9.941 -4.000) 12.958 11.650 ( -10.511 -8.086 -2.499) 13.495 11.966 ( -1.022 1.214 -5.650) 5.869 12.019 ( 2.142 -4.253 -1.512) 4.996 12.773 ( -2.812 8.526 4.182) 9.904 12.900 ( -2.465 -5.202 3.057) 6.518 13.289 ( 0.276 5.940 1.601) 6.158 13.412 ( -1.015 -6.588 3.761) 7.654 13.569 ( 7.332 0.413 -0.480) 7.359 13.589 ( 6.246 -1.764 1.048) 6.575 14.132 ( 7.872 8.420 6.668) 13.317 14.304 ( 6.974 -9.593 7.479) 14.022 14.982 ( -3.138 3.748 -3.791) 6.186 15.045 ( -4.170 -2.381 -2.414) 5.375 15.493 ( -8.542 4.456 -5.018) 10.863 15.540 ( -10.408 -0.061 -4.215) 11.229 15.719 ( 1.550 2.496 2.738) 4.016 15.784 ( 3.318 -3.530 -2.759) 5.575 16.023 ( 11.087 3.996 4.028) 12.454 16.099 ( 13.115 -3.341 2.254) 13.720 24.706 ( 0.564 2.158 0.416) 2.268 24.735 ( -0.032 -0.358 0.704) 0.790 24.811 ( -0.462 1.116 -0.448) 1.288 24.840 ( -0.601 -0.327 1.161) 1.348 24.881 ( 1.362 0.092 -1.979) 2.404 24.895 ( 1.452 -2.410 -1.113) 3.026 25.063 ( 0.623 3.564 0.342) 3.634 25.126 ( 1.147 -2.898 0.819) 3.222 26.463 ( -1.413 2.978 -0.305) 3.311 26.538 ( -1.045 -4.662 -0.717) 4.831 26.656 ( -1.829 8.041 -1.908) 8.465 26.813 ( 2.430 -8.417 1.780) 8.940 28.605 ( -4.601 -0.377 -0.290) 4.625 28.637 ( -5.764 -3.752 -0.767) 6.920 29.782 ( 2.939 6.599 1.274) 7.335 29.868 ( 4.508 -2.792 0.890) 5.376 ======================= Grid point 23 (15/104) ======================= q-point: ( 0.33 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.606 ( -22.698 24.936 -4.862) 34.068 1.131 ( -30.725 -28.133 -5.625) 42.037 2.089 ( 5.417 17.320 1.561) 18.215 2.135 ( 1.801 9.331 -7.468) 12.086 2.361 ( -2.330 -12.878 -1.585) 13.183 2.425 ( 2.205 -12.413 3.189) 13.005 2.639 ( 3.461 0.578 -6.647) 7.517 2.702 ( 8.744 -7.869 -7.104) 13.742 2.837 ( -8.294 5.836 5.068) 11.337 2.999 ( -7.240 -8.541 3.381) 11.696 3.287 ( 2.317 5.216 2.895) 6.399 3.326 ( 3.419 2.830 4.750) 6.501 3.407 ( -2.384 4.684 6.182) 8.114 3.511 ( 0.399 -2.298 6.806) 7.195 3.645 ( -0.486 2.809 -6.769) 7.345 3.741 ( -8.677 -5.423 -7.199) 12.511 4.005 ( 2.194 10.802 -0.911) 11.061 4.168 ( -0.581 -4.025 -1.282) 4.264 4.455 ( -6.753 15.044 1.730) 16.581 4.568 ( 2.565 -2.647 1.487) 3.974 4.600 ( 1.562 -5.110 0.785) 5.401 4.822 ( -2.655 -18.927 -0.989) 19.138 4.989 ( -0.280 1.933 2.631) 3.277 5.018 ( -0.889 -1.305 0.005) 1.579 5.177 ( 1.987 4.646 2.289) 5.547 5.254 ( 3.448 -1.256 -0.785) 3.753 5.367 ( 0.841 5.570 -3.967) 6.890 5.421 ( 0.701 2.798 -2.657) 3.921 5.600 ( 0.924 12.682 -0.448) 12.724 5.795 ( -0.006 -4.639 -0.492) 4.665 5.967 ( -4.086 -0.542 1.176) 4.286 6.021 ( 2.791 -5.272 2.085) 6.319 6.279 ( -1.411 2.109 -4.130) 4.847 6.294 ( -2.404 0.065 -4.271) 4.902 6.497 ( 5.355 2.467 2.100) 6.259 6.569 ( 7.557 -5.635 0.586) 9.444 6.726 ( -2.768 3.949 2.391) 5.382 6.793 ( -1.443 -2.487 3.478) 4.513 6.970 ( 3.996 4.145 3.476) 6.726 7.040 ( 8.778 -3.380 1.696) 9.558 7.342 ( 7.502 4.435 7.611) 11.571 7.432 ( 3.501 -1.916 6.162) 7.341 7.535 ( 5.880 -1.128 -1.793) 6.250 7.586 ( 1.837 -2.567 -2.532) 4.046 7.718 ( -5.056 5.196 -5.505) 9.103 7.773 ( -4.015 -0.223 -3.890) 5.595 7.953 ( -8.243 5.394 -1.053) 9.907 8.098 ( -7.536 -9.340 -1.475) 12.092 8.945 ( -2.104 8.414 -0.792) 8.709 9.100 ( -0.770 -6.520 0.247) 6.570 9.318 ( 3.258 7.611 0.270) 8.284 9.475 ( 3.626 -6.904 1.311) 7.908 9.625 ( -5.575 7.352 2.049) 9.452 9.743 ( -6.042 -3.183 -2.605) 7.309 10.004 ( 0.849 -0.240 5.393) 5.464 10.048 ( -2.047 -4.257 5.130) 6.974 10.421 ( -4.495 13.899 -5.165) 15.494 10.684 ( 1.406 -0.189 1.482) 2.052 10.773 ( 0.498 -9.621 -4.629) 10.688 10.853 ( -2.792 -10.951 -2.894) 11.666 11.392 ( 1.140 3.402 -1.859) 4.041 11.513 ( -3.561 -6.892 -1.278) 7.862 11.860 ( -4.924 2.791 -5.400) 7.823 11.939 ( -5.808 -5.565 -6.342) 10.243 12.819 ( 3.058 6.934 4.676) 8.905 12.910 ( 0.153 -2.797 3.898) 4.800 13.293 ( -0.703 5.596 1.376) 5.806 13.390 ( -2.523 -4.626 3.148) 6.138 13.672 ( 5.034 1.504 -2.285) 5.729 13.692 ( 3.159 -0.387 0.755) 3.271 14.356 ( 9.821 5.790 9.663) 14.945 14.493 ( 6.475 -8.343 9.426) 14.156 14.883 ( -5.080 2.579 -5.280) 7.768 14.921 ( -5.205 -0.996 -5.629) 7.731 15.357 ( -3.576 0.676 -4.089) 5.474 15.364 ( -6.155 -0.211 -2.663) 6.710 15.766 ( 1.840 2.876 1.109) 3.590 15.828 ( 2.377 -3.537 -0.683) 4.316 16.224 ( 8.122 5.311 2.396) 9.996 16.295 ( 6.950 -1.629 0.696) 7.172 24.721 ( 0.643 1.673 0.562) 1.878 24.740 ( -0.008 0.365 0.850) 0.925 24.799 ( -0.376 1.802 -0.728) 1.980 24.840 ( 0.023 -0.810 0.366) 0.889 24.888 ( 0.485 1.018 -1.044) 1.537 24.915 ( 1.232 -2.754 -0.982) 3.173 25.077 ( 0.582 4.294 0.089) 4.334 25.153 ( 1.031 -3.549 0.616) 3.746 26.436 ( -1.122 2.705 -0.228) 2.937 26.501 ( -1.932 -2.696 -1.121) 3.501 26.634 ( 0.010 8.511 -0.674) 8.537 26.860 ( 1.602 -13.551 1.200) 13.698 28.506 ( -4.777 0.713 -0.517) 4.857 28.545 ( -3.668 -3.531 -0.199) 5.095 29.847 ( 2.771 7.152 1.169) 7.759 29.944 ( 2.825 -3.435 0.517) 4.477 ======================= Grid point 24 (16/104) ======================= q-point: (-0.50 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.539 ( 0.000 -14.177 0.000) 14.177 0.615 ( -0.000 -17.608 -0.000) 17.608 2.031 ( 0.000 5.259 -0.000) 5.259 2.252 ( 0.000 -6.236 -0.000) 6.236 2.334 ( 0.000 0.738 -0.000) 0.738 2.476 ( -0.000 1.864 -0.000) 1.864 2.630 ( -0.000 0.576 0.000) 0.576 2.653 ( 0.000 1.119 0.000) 1.119 2.880 ( -0.000 -7.816 0.000) 7.816 2.919 ( 0.000 -8.561 -0.000) 8.561 3.340 ( 0.000 2.754 -0.000) 2.754 3.375 ( 0.000 11.145 0.000) 11.145 3.400 ( -0.000 -2.436 -0.000) 2.436 3.530 ( 0.000 -3.849 0.000) 3.849 3.626 ( 0.000 -0.104 -0.000) 0.104 3.627 ( -0.000 -2.335 0.000) 2.335 4.028 ( 0.000 9.541 -0.000) 9.541 4.162 ( 0.000 -2.404 0.000) 2.404 4.372 ( 0.000 20.751 0.000) 20.751 4.598 ( 0.000 -2.278 0.000) 2.278 4.630 ( 0.000 -6.746 0.000) 6.746 4.790 ( 0.000 -21.041 0.000) 21.041 5.001 ( 0.000 1.751 0.000) 1.751 5.010 ( 0.000 -0.581 -0.000) 0.581 5.204 ( 0.000 4.516 0.000) 4.516 5.284 ( 0.000 -1.428 0.000) 1.428 5.363 ( 0.000 7.149 -0.000) 7.149 5.420 ( 0.000 4.175 0.000) 4.175 5.609 ( 0.000 11.037 0.000) 11.037 5.792 ( 0.000 -7.134 -0.000) 7.134 5.929 ( 0.000 5.146 0.000) 5.146 6.047 ( 0.000 -7.142 0.000) 7.142 6.255 ( 0.000 1.056 0.000) 1.056 6.255 ( -0.000 0.390 -0.000) 0.390 6.558 ( 0.000 2.942 0.000) 2.942 6.644 ( 0.000 -6.578 0.000) 6.578 6.709 ( 0.000 4.342 -0.000) 4.342 6.787 ( 0.000 -2.937 0.000) 2.937 7.018 ( -0.000 7.465 -0.000) 7.465 7.145 ( 0.000 -4.678 0.000) 4.678 7.452 ( 0.000 6.622 -0.000) 6.622 7.501 ( 0.000 0.694 0.000) 0.694 7.563 ( 0.000 -1.962 0.000) 1.962 7.607 ( 0.000 -0.974 0.000) 0.974 7.684 ( 0.000 4.033 -0.000) 4.033 7.707 ( 0.000 -0.753 0.000) 0.753 7.851 ( -0.000 1.135 0.000) 1.135 7.989 ( 0.000 -11.862 0.000) 11.862 8.919 ( 0.000 8.323 -0.000) 8.323 9.079 ( 0.000 -8.065 -0.000) 8.065 9.364 ( 0.000 9.460 0.000) 9.460 9.510 ( 0.000 -3.138 0.000) 3.138 9.587 ( 0.000 3.313 0.000) 3.313 9.674 ( 0.000 -2.619 -0.000) 2.619 10.028 ( 0.000 -1.508 -0.000) 1.508 10.040 ( 0.000 -1.998 0.000) 1.998 10.362 ( 0.000 13.559 0.000) 13.559 10.710 ( -0.000 -21.990 -0.000) 21.990 10.741 ( 0.000 6.494 0.000) 6.494 10.831 ( 0.000 -1.382 0.000) 1.382 11.424 ( 0.000 -4.361 0.000) 4.361 11.477 ( 0.000 -6.743 0.000) 6.743 11.787 ( 0.000 2.668 0.000) 2.668 11.845 ( 0.000 -3.240 -0.000) 3.240 12.870 ( 0.000 4.726 0.000) 4.726 12.926 ( 0.000 -1.356 -0.000) 1.356 13.290 ( 0.000 5.583 0.000) 5.583 13.375 ( 0.000 -3.221 0.000) 3.221 13.714 ( -0.000 1.274 0.000) 1.274 13.717 ( 0.000 0.897 -0.000) 0.897 14.542 ( 0.000 0.983 -0.000) 0.983 14.558 ( 0.000 -0.330 0.000) 0.330 14.804 ( -0.000 -0.052 -0.000) 0.052 14.833 ( 0.000 -2.425 0.000) 2.425 15.297 ( 0.000 0.474 0.000) 0.474 15.314 ( 0.000 -1.028 -0.000) 1.028 15.787 ( 0.000 2.975 0.000) 2.975 15.849 ( 0.000 -3.423 0.000) 3.423 16.314 ( 0.000 4.246 0.000) 4.246 16.354 ( -0.000 0.774 -0.000) 0.774 24.730 ( 0.000 1.324 0.000) 1.324 24.743 ( 0.000 0.669 0.000) 0.669 24.793 ( 0.000 2.321 -0.000) 2.321 24.842 ( 0.000 -1.228 -0.000) 1.228 24.889 ( 0.000 1.664 -0.000) 1.664 24.923 ( 0.000 -3.021 0.000) 3.021 25.083 ( 0.000 4.740 -0.000) 4.740 25.164 ( 0.000 -3.795 0.000) 3.795 26.426 ( 0.000 1.932 0.000) 1.932 26.476 ( 0.000 -1.180 0.000) 1.180 26.634 ( 0.000 8.003 -0.000) 8.003 26.879 ( 0.000 -15.308 0.000) 15.308 28.459 ( 0.000 1.504 -0.000) 1.504 28.510 ( 0.000 -3.950 0.000) 3.950 29.878 ( 0.000 7.031 -0.000) 7.031 29.971 ( -0.000 -3.114 0.000) 3.114 ======================= Grid point 49 (17/104) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.646 ( -14.893 0.000 33.646) 36.795 0.658 ( 5.473 0.000 34.062) 34.499 1.233 ( 1.370 0.000 63.902) 63.917 2.535 ( 5.945 0.000 3.018) 6.667 2.666 ( 3.241 0.000 -2.872) 4.330 2.675 ( -0.111 0.000 2.301) 2.304 2.687 ( 3.272 0.000 2.196) 3.941 2.924 ( -11.068 0.000 10.647) 15.358 2.936 ( 15.843 0.000 -3.101) 16.143 3.048 ( -4.414 0.000 -5.316) 6.910 3.116 ( -8.725 0.000 1.707) 8.891 3.127 ( 3.401 0.000 0.662) 3.465 3.395 ( 1.765 0.000 -5.812) 6.074 3.485 ( -3.579 0.000 10.066) 10.684 3.981 ( 5.838 0.000 -11.375) 12.786 4.066 ( -1.898 0.000 -7.308) 7.551 4.098 ( 2.669 0.000 -5.643) 6.243 4.308 ( 0.791 0.000 -6.885) 6.930 4.421 ( 2.416 0.000 1.530) 2.860 4.491 ( -1.199 0.000 -2.366) 2.652 4.590 ( -2.006 0.000 4.169) 4.626 4.696 ( -6.700 0.000 -0.365) 6.710 4.945 ( 3.983 0.000 4.103) 5.718 5.007 ( -1.881 0.000 -0.927) 2.097 5.135 ( -8.112 0.000 -8.797) 11.966 5.175 ( -6.106 0.000 11.010) 12.590 5.303 ( -4.081 0.000 4.722) 6.242 5.479 ( 1.467 0.000 -2.775) 3.139 5.586 ( -4.069 0.000 7.706) 8.714 5.719 ( 6.955 0.000 3.969) 8.008 5.912 ( -0.849 0.000 -3.016) 3.133 6.098 ( -13.488 0.000 -2.281) 13.680 6.281 ( 4.571 0.000 -6.835) 8.223 6.365 ( 3.550 0.000 1.801) 3.981 6.369 ( 0.984 0.000 2.107) 2.325 6.525 ( 2.946 0.000 -0.595) 3.006 6.703 ( -1.323 0.000 -3.968) 4.183 6.708 ( -8.427 0.000 1.524) 8.564 6.917 ( -3.034 0.000 -12.532) 12.894 7.023 ( -0.745 0.000 -9.273) 9.303 7.161 ( 2.841 0.000 0.099) 2.843 7.238 ( 0.149 0.000 -5.500) 5.502 7.382 ( -5.270 0.000 0.130) 5.271 7.611 ( -4.654 0.000 3.602) 5.885 7.774 ( 1.025 0.000 2.505) 2.707 7.881 ( 1.041 0.000 3.122) 3.291 7.992 ( 8.324 0.000 4.117) 9.286 8.411 ( 16.096 0.000 -9.074) 18.478 8.853 ( -0.417 0.000 5.040) 5.057 8.906 ( 1.486 0.000 0.682) 1.635 9.021 ( -0.005 0.000 1.321) 1.321 9.545 ( -8.461 0.000 -5.252) 9.959 9.573 ( -1.181 0.000 -1.523) 1.927 9.677 ( 1.365 0.000 4.961) 5.145 10.055 ( 3.511 0.000 5.485) 6.513 10.157 ( -12.113 0.000 3.417) 12.586 10.634 ( 0.931 0.000 -0.664) 1.143 10.646 ( -2.586 0.000 -1.129) 2.822 10.957 ( -3.404 0.000 1.177) 3.602 11.192 ( -4.784 0.000 1.986) 5.180 11.541 ( 21.766 0.000 -8.318) 23.302 11.796 ( 3.797 0.000 -4.583) 5.952 12.101 ( -6.278 0.000 2.913) 6.921 12.104 ( -2.472 0.000 -2.461) 3.488 12.542 ( 35.300 0.000 4.178) 35.546 13.184 ( -0.274 0.000 -9.525) 9.529 13.208 ( -10.364 0.000 -6.469) 12.218 13.470 ( 12.234 0.000 4.804) 13.143 13.761 ( 2.364 0.000 -4.762) 5.316 13.767 ( -1.962 0.000 7.879) 8.120 14.206 ( -45.156 0.000 -2.487) 45.224 14.665 ( -4.174 0.000 -7.323) 8.429 14.941 ( 2.521 0.000 6.601) 7.066 15.046 ( -0.120 0.000 2.079) 2.082 15.065 ( 4.985 0.000 3.491) 6.085 15.237 ( 15.751 0.000 2.692) 15.979 15.624 ( 11.394 0.000 -1.445) 11.485 15.758 ( 4.184 0.000 3.594) 5.516 15.893 ( 2.817 0.000 -5.519) 6.197 16.098 ( -5.599 0.000 3.544) 6.626 24.662 ( 0.165 0.000 4.732) 4.735 24.723 ( -2.206 0.000 0.925) 2.392 24.780 ( -0.509 0.000 1.776) 1.847 24.860 ( -0.881 0.000 -0.837) 1.215 24.866 ( 3.158 0.000 -2.401) 3.967 25.136 ( -4.228 0.000 7.773) 8.849 25.152 ( 1.287 0.000 -0.055) 1.288 25.595 ( -67.955 0.000 -3.000) 68.022 26.162 ( -0.982 0.000 0.105) 0.988 26.497 ( 0.989 0.000 4.901) 5.000 26.723 ( 1.641 0.000 -3.553) 3.914 27.705 ( 59.477 0.000 -5.363) 59.718 28.490 ( -1.159 0.000 2.085) 2.386 28.894 ( -0.388 0.000 0.785) 0.876 29.132 ( 1.142 0.000 -2.143) 2.429 29.292 ( 13.232 0.000 -4.590) 14.006 ======================= Grid point 50 (18/104) ======================= q-point: ( 0.17 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.649 ( 4.591 0.000 25.032) 25.449 1.109 ( 19.764 0.000 27.150) 33.582 1.866 ( 20.125 0.000 52.906) 56.605 2.494 ( -11.893 0.000 -1.419) 11.977 2.562 ( -10.419 0.000 -8.809) 13.644 2.720 ( -9.406 0.000 8.041) 12.375 2.732 ( -3.295 0.000 4.784) 5.809 2.796 ( -1.631 0.000 7.131) 7.316 3.022 ( 3.782 0.000 -3.439) 5.112 3.022 ( 3.624 0.000 12.812) 13.314 3.196 ( 10.704 0.000 -4.294) 11.534 3.211 ( 4.587 0.000 2.652) 5.299 3.413 ( 3.347 0.000 -5.656) 6.572 3.454 ( -5.611 0.000 9.080) 10.674 3.972 ( 3.109 0.000 -15.709) 16.014 4.080 ( -0.528 0.000 -5.123) 5.150 4.082 ( 6.649 0.000 -2.209) 7.006 4.220 ( -6.498 0.000 -4.564) 7.941 4.407 ( -3.084 0.000 -2.819) 4.178 4.447 ( -13.934 0.000 -2.994) 14.252 4.475 ( -0.844 0.000 1.607) 1.816 4.588 ( -5.846 0.000 1.969) 6.169 4.883 ( -8.756 0.000 -10.638) 13.778 4.975 ( 1.732 0.000 -7.663) 7.857 5.000 ( -0.986 0.000 2.349) 2.548 5.172 ( -3.993 0.000 16.179) 16.665 5.279 ( -1.246 0.000 4.387) 4.560 5.474 ( 0.602 0.000 -2.651) 2.719 5.520 ( -6.492 0.000 1.630) 6.694 5.814 ( -1.289 0.000 5.623) 5.769 5.866 ( -0.598 0.000 -2.453) 2.525 5.970 ( 0.262 0.000 1.633) 1.654 6.228 ( -4.252 0.000 -3.125) 5.277 6.420 ( 0.847 0.000 2.337) 2.486 6.526 ( 9.988 0.000 2.095) 10.205 6.615 ( -1.531 0.000 0.388) 1.579 6.657 ( 0.230 0.000 -5.686) 5.691 6.704 ( 11.876 0.000 -1.517) 11.972 6.862 ( 4.383 0.000 -4.402) 6.212 6.979 ( 2.330 0.000 -10.160) 10.424 7.166 ( -3.596 0.000 -4.259) 5.574 7.232 ( 2.402 0.000 -2.717) 3.626 7.312 ( 2.763 0.000 -1.849) 3.324 7.542 ( -4.439 0.000 3.736) 5.802 7.747 ( -5.298 0.000 -0.721) 5.346 7.952 ( 2.347 0.000 4.271) 4.873 8.207 ( 11.514 0.000 4.500) 12.363 8.456 ( 4.278 0.000 -25.308) 25.667 8.851 ( -5.350 0.000 -0.904) 5.426 8.876 ( -0.547 0.000 4.948) 4.978 9.034 ( 1.077 0.000 1.910) 2.193 9.502 ( -0.220 0.000 4.907) 4.911 9.523 ( -3.131 0.000 -2.751) 4.168 9.728 ( -0.461 0.000 7.689) 7.703 10.087 ( -0.564 0.000 4.774) 4.807 10.179 ( 1.873 0.000 13.015) 13.149 10.511 ( -12.612 0.000 0.717) 12.632 10.557 ( -4.940 0.000 -3.868) 6.274 10.857 ( -6.773 0.000 -1.178) 6.874 11.225 ( 7.485 0.000 -1.487) 7.632 11.782 ( 0.131 0.000 7.547) 7.548 11.838 ( 2.851 0.000 -6.398) 7.005 12.027 ( -3.331 0.000 -1.713) 3.745 12.068 ( 9.413 0.000 -8.548) 12.715 12.801 ( 3.376 0.000 -6.284) 7.134 12.999 ( -7.440 0.000 -3.756) 8.335 13.216 ( 4.717 0.000 -7.577) 8.925 13.483 ( -7.673 0.000 -2.159) 7.971 13.622 ( -16.055 0.000 7.490) 17.716 13.810 ( -4.313 0.000 8.185) 9.252 13.947 ( 13.505 0.000 3.060) 13.847 14.550 ( -3.035 0.000 -6.621) 7.284 15.030 ( 3.889 0.000 4.520) 5.963 15.046 ( -0.166 0.000 1.794) 1.801 15.248 ( 10.250 0.000 4.706) 11.279 15.289 ( -1.395 0.000 1.444) 2.008 15.658 ( -3.362 0.000 2.096) 3.962 15.901 ( 0.488 0.000 -4.194) 4.222 15.981 ( 11.391 0.000 -5.847) 12.804 15.995 ( -5.875 0.000 0.533) 5.899 24.684 ( -2.239 0.000 0.093) 2.241 24.704 ( 0.217 0.000 7.180) 7.183 24.789 ( 0.997 0.000 0.260) 1.031 24.835 ( -0.707 0.000 -1.578) 1.730 24.897 ( 0.123 0.000 1.391) 1.397 24.926 ( -18.454 0.000 11.997) 22.010 25.122 ( -1.751 0.000 6.109) 6.354 25.203 ( 2.458 0.000 1.038) 2.668 26.157 ( 0.352 0.000 0.047) 0.355 26.527 ( -1.444 0.000 5.640) 5.822 26.762 ( 4.878 0.000 -3.705) 6.126 27.813 ( -10.726 0.000 -6.804) 12.702 28.498 ( 0.846 0.000 1.750) 1.944 28.876 ( -2.032 0.000 0.657) 2.136 29.178 ( 4.014 0.000 -1.865) 4.426 29.724 ( 23.345 0.000 -20.678) 31.186 ======================= Grid point 51 (19/104) ======================= q-point: ( 0.33 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.072 ( 26.651 0.000 8.655) 28.022 1.629 ( 21.167 0.000 19.828) 29.003 2.172 ( -21.289 0.000 -3.823) 21.630 2.224 ( -18.808 0.000 -12.368) 22.510 2.391 ( -1.135 0.000 25.620) 25.645 2.590 ( -10.909 0.000 4.227) 11.699 2.617 ( -2.986 0.000 27.745) 27.906 2.842 ( 2.847 0.000 -2.258) 3.634 3.074 ( 1.687 0.000 -1.791) 2.460 3.244 ( -0.998 0.000 -4.610) 4.717 3.282 ( 9.661 0.000 8.118) 12.619 3.317 ( 3.761 0.000 5.868) 6.969 3.405 ( -4.207 0.000 4.086) 5.865 3.427 ( 1.492 0.000 -3.679) 3.970 3.948 ( 4.370 0.000 -14.206) 14.863 4.033 ( -3.557 0.000 -7.193) 8.025 4.071 ( -6.759 0.000 4.714) 8.240 4.123 ( -11.445 0.000 -8.614) 14.324 4.209 ( 6.682 0.000 -7.008) 9.683 4.343 ( 0.338 0.000 1.806) 1.838 4.455 ( -2.374 0.000 1.406) 2.759 4.504 ( -2.661 0.000 3.629) 4.500 4.791 ( 0.299 0.000 -0.176) 0.347 4.904 ( -3.988 0.000 -9.120) 9.954 5.004 ( 1.402 0.000 -0.107) 1.406 5.212 ( -1.903 0.000 14.465) 14.589 5.271 ( -3.693 0.000 0.729) 3.765 5.447 ( -0.213 0.000 4.378) 4.383 5.494 ( 2.289 0.000 -0.416) 2.327 5.800 ( -2.288 0.000 2.715) 3.550 5.880 ( 2.513 0.000 0.228) 2.523 5.980 ( -0.495 0.000 0.163) 0.521 6.130 ( -5.767 0.000 1.315) 5.915 6.413 ( -0.747 0.000 -4.798) 4.856 6.648 ( 4.046 0.000 1.531) 4.326 6.657 ( 2.865 0.000 -4.086) 4.990 6.670 ( 6.285 0.000 -1.089) 6.379 6.869 ( 3.098 0.000 3.488) 4.665 6.980 ( 4.934 0.000 -8.456) 9.790 6.989 ( 4.517 0.000 -1.887) 4.895 7.115 ( 5.664 0.000 -2.272) 6.102 7.286 ( 3.630 0.000 1.412) 3.895 7.388 ( 4.212 0.000 1.608) 4.509 7.496 ( -2.574 0.000 2.334) 3.475 7.604 ( -7.571 0.000 -3.907) 8.520 7.961 ( -3.356 0.000 2.181) 4.002 8.313 ( 2.297 0.000 -32.451) 32.533 8.441 ( 8.235 0.000 3.803) 9.071 8.764 ( -2.816 0.000 -1.581) 3.229 8.891 ( -0.970 0.000 3.899) 4.018 9.098 ( 4.176 0.000 1.622) 4.479 9.432 ( -4.440 0.000 -2.264) 4.984 9.546 ( 0.280 0.000 10.541) 10.545 9.742 ( -3.443 0.000 7.708) 8.442 10.115 ( -0.021 0.000 4.279) 4.279 10.247 ( -4.295 0.000 9.353) 10.292 10.287 ( -10.835 0.000 1.784) 10.981 10.473 ( -0.298 0.000 -1.583) 1.611 10.739 ( -4.963 0.000 0.589) 4.998 11.397 ( 11.236 0.000 -0.747) 11.261 11.715 ( -7.411 0.000 4.933) 8.903 11.774 ( -2.765 0.000 -10.617) 10.971 12.010 ( 0.296 0.000 2.433) 2.451 12.256 ( 11.212 0.000 -5.365) 12.429 12.782 ( -2.130 0.000 -7.529) 7.824 12.915 ( -0.093 0.000 -3.144) 3.145 13.174 ( -1.533 0.000 -5.408) 5.621 13.301 ( -9.602 0.000 -1.584) 9.732 13.515 ( -0.313 0.000 -0.890) 0.943 13.822 ( -0.986 0.000 10.567) 10.613 14.138 ( 4.920 0.000 1.558) 5.160 14.504 ( 1.700 0.000 -3.028) 3.472 15.066 ( 1.226 0.000 1.403) 1.863 15.104 ( 2.029 0.000 -0.063) 2.030 15.263 ( -1.967 0.000 -0.576) 2.049 15.456 ( 9.311 0.000 3.232) 9.856 15.587 ( -4.911 0.000 1.079) 5.028 15.781 ( -8.853 0.000 -3.940) 9.690 15.985 ( 2.591 0.000 1.293) 2.896 16.101 ( 5.146 0.000 -1.946) 5.502 24.653 ( -1.099 0.000 0.279) 1.134 24.727 ( -3.862 0.000 6.754) 7.781 24.799 ( -1.463 0.000 2.008) 2.485 24.813 ( 1.707 0.000 -1.310) 2.152 24.851 ( 0.604 0.000 6.626) 6.653 24.890 ( -2.530 0.000 4.458) 5.126 25.142 ( -0.266 0.000 5.404) 5.410 25.248 ( 1.646 0.000 0.700) 1.789 26.173 ( 1.197 0.000 0.533) 1.311 26.510 ( -3.556 0.000 3.938) 5.306 26.837 ( 5.700 0.000 -4.747) 7.418 27.566 ( -10.533 0.000 -7.638) 13.011 28.536 ( 1.687 0.000 1.916) 2.553 28.837 ( -2.352 0.000 0.659) 2.443 29.230 ( 2.883 0.000 -2.862) 4.063 29.883 ( 9.267 0.000 -14.462) 17.177 ======================= Grid point 52 (20/104) ======================= q-point: (-0.50 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( 15.276 0.000 -3.878) 15.761 1.703 ( -27.423 0.000 -4.034) 27.718 1.764 ( -13.029 0.000 -8.903) 15.780 2.093 ( 18.469 0.000 13.601) 22.936 2.207 ( -25.090 0.000 20.113) 32.156 2.451 ( -5.521 0.000 1.195) 5.649 2.800 ( -1.889 0.000 13.914) 14.042 2.863 ( -0.067 0.000 3.213) 3.214 3.059 ( 1.052 0.000 -4.571) 4.691 3.061 ( -10.814 0.000 -13.790) 17.524 3.316 ( -8.089 0.000 0.980) 8.148 3.372 ( -2.012 0.000 -0.823) 2.174 3.375 ( -1.867 0.000 5.301) 5.621 3.491 ( 4.214 0.000 2.510) 4.905 3.920 ( 3.546 0.000 0.772) 3.629 3.946 ( 4.525 0.000 -13.231) 13.983 4.007 ( 2.173 0.000 -7.852) 8.147 4.188 ( 1.617 0.000 -9.444) 9.581 4.193 ( 8.324 0.000 11.445) 14.151 4.390 ( -3.462 0.000 -1.071) 3.624 4.478 ( 4.699 0.000 4.984) 6.850 4.556 ( 3.673 0.000 7.131) 8.022 4.792 ( -1.657 0.000 -6.000) 6.225 4.841 ( 3.822 0.000 4.989) 6.285 5.059 ( 4.361 0.000 1.843) 4.734 5.169 ( -3.704 0.000 0.166) 3.708 5.300 ( -1.017 0.000 13.735) 13.772 5.516 ( 1.772 0.000 6.683) 6.914 5.526 ( 0.587 0.000 1.053) 1.205 5.787 ( -0.772 0.000 3.395) 3.481 5.940 ( 2.257 0.000 1.408) 2.660 5.952 ( -2.254 0.000 -1.898) 2.947 6.056 ( -1.832 0.000 1.663) 2.474 6.353 ( -1.067 0.000 -7.058) 7.138 6.669 ( -0.546 0.000 -3.996) 4.033 6.733 ( 3.437 0.000 1.256) 3.659 6.756 ( 2.943 0.000 -0.073) 2.944 6.885 ( -1.541 0.000 2.701) 3.110 6.976 ( 1.126 0.000 -3.393) 3.575 7.005 ( 0.659 0.000 -3.715) 3.773 7.231 ( 1.916 0.000 1.274) 2.300 7.367 ( 2.740 0.000 5.040) 5.737 7.386 ( -5.167 0.000 -3.272) 6.116 7.480 ( -0.601 0.000 1.074) 1.231 7.599 ( 8.808 0.000 4.380) 9.837 7.895 ( -3.133 0.000 -0.931) 3.269 8.115 ( -1.851 0.000 -30.082) 30.139 8.548 ( 3.191 0.000 -6.575) 7.308 8.750 ( 1.798 0.000 1.079) 2.097 8.881 ( -2.468 0.000 2.744) 3.691 9.125 ( -2.796 0.000 -1.411) 3.132 9.412 ( 3.949 0.000 1.670) 4.287 9.654 ( 3.790 0.000 12.525) 13.086 9.692 ( -5.650 0.000 4.132) 7.000 10.085 ( -7.999 0.000 2.546) 8.394 10.191 ( -1.424 0.000 2.940) 3.266 10.205 ( 0.472 0.000 3.718) 3.748 10.509 ( 3.137 0.000 -0.256) 3.147 10.732 ( 1.136 0.000 9.821) 9.887 11.526 ( -1.081 0.000 0.557) 1.216 11.617 ( -4.874 0.000 -0.793) 4.938 11.727 ( 7.880 0.000 -8.657) 11.706 12.030 ( -0.265 0.000 3.642) 3.652 12.341 ( 0.738 0.000 -2.680) 2.780 12.581 ( -11.062 0.000 -16.563) 19.918 12.918 ( 1.568 0.000 -3.884) 4.188 13.180 ( -0.814 0.000 -1.828) 2.002 13.188 ( 5.926 0.000 -5.393) 8.012 13.541 ( 3.536 0.000 -1.722) 3.933 13.912 ( 1.818 0.000 17.138) 17.234 14.156 ( -2.094 0.000 -1.436) 2.539 14.551 ( 3.241 0.000 0.993) 3.390 15.090 ( -2.259 0.000 -3.642) 4.286 15.095 ( 0.379 0.000 1.581) 1.626 15.212 ( -2.024 0.000 -3.787) 4.294 15.495 ( -8.380 0.000 -4.569) 9.544 15.511 ( -3.000 0.000 -1.129) 3.206 15.698 ( 5.299 0.000 -0.516) 5.324 16.056 ( 2.559 0.000 5.012) 5.628 16.143 ( 0.298 0.000 -0.867) 0.917 24.653 ( 0.783 0.000 0.943) 1.226 24.684 ( -3.246 0.000 3.014) 4.429 24.808 ( 0.598 0.000 1.617) 1.724 24.819 ( -0.485 0.000 -0.965) 1.080 24.875 ( -1.568 0.000 3.353) 3.702 24.957 ( 3.403 0.000 14.996) 15.378 25.169 ( -1.113 0.000 6.706) 6.798 25.266 ( -0.367 0.000 1.686) 1.725 26.201 ( 0.917 0.000 1.707) 1.938 26.458 ( -3.458 0.000 0.897) 3.572 26.880 ( 1.722 0.000 -5.711) 5.965 27.369 ( -3.907 0.000 -13.057) 13.629 28.564 ( -0.439 0.000 2.334) 2.375 28.816 ( -0.093 0.000 0.836) 0.841 29.235 ( -0.001 0.000 -4.250) 4.250 29.936 ( 5.987 0.000 -11.901) 13.322 ======================= Grid point 53 (21/104) ======================= q-point: (-0.33 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.071 ( -31.063 0.000 -16.391) 35.122 1.161 ( -30.465 0.000 0.131) 30.465 1.792 ( -36.519 0.000 33.660) 49.665 2.148 ( 22.981 0.000 2.375) 23.103 2.431 ( 4.776 0.000 -3.275) 5.791 2.451 ( 13.139 0.000 8.613) 15.711 2.725 ( -3.901 0.000 -6.754) 7.799 2.749 ( -12.074 0.000 -14.083) 18.550 2.933 ( -0.939 0.000 16.399) 16.425 3.055 ( 1.537 0.000 -5.584) 5.792 3.203 ( -3.108 0.000 -0.564) 3.159 3.312 ( -2.442 0.000 -3.702) 4.435 3.363 ( -1.990 0.000 5.338) 5.697 3.511 ( -1.870 0.000 -1.628) 2.479 3.950 ( 4.328 0.000 -11.876) 12.640 4.016 ( 4.503 0.000 -5.950) 7.462 4.099 ( 10.403 0.000 1.819) 10.561 4.192 ( 2.844 0.000 -6.262) 6.878 4.325 ( -1.242 0.000 -2.195) 2.522 4.438 ( 9.174 0.000 9.457) 13.176 4.531 ( -0.156 0.000 1.214) 1.224 4.654 ( 2.443 0.000 4.443) 5.070 4.777 ( 1.891 0.000 -1.071) 2.173 5.012 ( 9.579 0.000 8.447) 12.772 5.099 ( -1.364 0.000 -0.733) 1.549 5.192 ( 2.331 0.000 7.545) 7.897 5.344 ( -2.941 0.000 12.624) 12.962 5.531 ( -0.891 0.000 2.196) 2.370 5.562 ( -0.746 0.000 6.424) 6.467 5.795 ( -3.131 0.000 0.709) 3.210 5.883 ( -1.627 0.000 1.729) 2.375 5.928 ( -2.801 0.000 0.998) 2.973 6.129 ( 7.134 0.000 -0.575) 7.157 6.323 ( 1.924 0.000 -3.467) 3.965 6.559 ( -6.936 0.000 -6.062) 9.212 6.755 ( -0.920 0.000 -1.703) 1.936 6.764 ( -1.563 0.000 -0.967) 1.837 6.840 ( -5.122 0.000 7.735) 9.277 7.015 ( 4.237 0.000 -4.204) 5.969 7.066 ( 4.766 0.000 7.551) 8.929 7.205 ( -3.216 0.000 -1.904) 3.738 7.289 ( -1.334 0.000 -5.480) 5.640 7.400 ( -4.460 0.000 3.589) 5.725 7.481 ( 0.838 0.000 0.614) 1.039 7.776 ( 4.880 0.000 6.034) 7.760 7.854 ( -0.690 0.000 -2.891) 2.973 7.921 ( -1.019 0.000 -20.103) 20.129 8.491 ( -1.270 0.000 -15.335) 15.387 8.812 ( 3.041 0.000 1.520) 3.399 8.847 ( -2.540 0.000 2.636) 3.660 9.045 ( -3.630 0.000 -0.415) 3.653 9.523 ( 4.857 0.000 2.444) 5.437 9.628 ( -2.339 0.000 0.989) 2.539 9.814 ( 5.809 0.000 9.299) 10.965 9.922 ( -8.844 0.000 -1.379) 8.951 10.227 ( 2.275 0.000 5.935) 6.356 10.321 ( 8.755 0.000 3.273) 9.347 10.583 ( 5.221 0.000 -0.673) 5.264 10.869 ( 3.933 0.000 17.682) 18.114 11.440 ( -6.423 0.000 0.923) 6.489 11.514 ( -4.975 0.000 -6.787) 8.416 11.817 ( 3.422 0.000 -7.109) 7.889 12.069 ( 2.317 0.000 4.796) 5.326 12.195 ( -12.061 0.000 -22.380) 25.423 12.310 ( -6.992 0.000 -0.502) 7.010 12.949 ( 5.657 0.000 -0.339) 5.668 13.249 ( 8.842 0.000 -5.297) 10.307 13.261 ( 6.400 0.000 -10.900) 12.640 13.615 ( 4.191 0.000 2.841) 5.064 14.049 ( -8.117 0.000 -3.589) 8.875 14.107 ( 6.090 0.000 25.297) 26.020 14.629 ( 4.368 0.000 2.951) 5.272 14.990 ( -5.639 0.000 -4.454) 7.186 15.074 ( -2.907 0.000 -3.362) 4.444 15.147 ( -2.525 0.000 -3.911) 4.656 15.277 ( -10.454 0.000 -4.833) 11.517 15.487 ( 1.967 0.000 -2.740) 3.373 15.803 ( 5.801 0.000 -2.720) 6.407 16.092 ( -5.106 0.000 -2.593) 5.726 16.122 ( 0.383 0.000 6.850) 6.861 24.653 ( -1.963 0.000 2.372) 3.079 24.692 ( 2.423 0.000 1.820) 3.030 24.791 ( -2.593 0.000 1.713) 3.108 24.836 ( 1.194 0.000 1.680) 2.061 24.867 ( -0.202 0.000 -1.640) 1.652 25.133 ( 3.617 0.000 10.063) 10.693 25.180 ( -2.890 0.000 8.407) 8.890 25.315 ( 3.983 0.000 23.589) 23.923 26.214 ( -1.275 0.000 2.430) 2.744 26.420 ( -0.239 0.000 -0.525) 0.577 26.826 ( -2.979 0.000 -5.382) 6.151 27.235 ( -0.699 0.000 -25.025) 25.034 28.547 ( -2.761 0.000 2.614) 3.802 28.842 ( 1.900 0.000 0.994) 2.144 29.188 ( -1.729 0.000 -4.409) 4.735 29.937 ( 2.561 0.000 -17.166) 17.356 ======================= Grid point 54 (22/104) ======================= q-point: (-0.17 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.568 ( -15.843 0.000 20.627) 26.009 0.680 ( -24.734 0.000 16.489) 29.726 1.338 ( -38.664 0.000 46.258) 60.289 2.501 ( -2.661 0.000 -2.766) 3.839 2.504 ( 14.723 0.000 0.917) 14.751 2.583 ( 9.959 0.000 -6.524) 11.906 2.649 ( -0.233 0.000 -2.804) 2.814 2.698 ( 10.102 0.000 2.091) 10.316 2.987 ( -3.907 0.000 12.381) 12.983 3.070 ( 3.205 0.000 -3.449) 4.708 3.157 ( -3.237 0.000 -0.204) 3.244 3.240 ( -3.956 0.000 -2.563) 4.714 3.409 ( 3.118 0.000 8.369) 8.932 3.439 ( -2.998 0.000 -4.024) 5.018 3.956 ( 4.327 0.000 -10.901) 11.728 4.061 ( 4.668 0.000 -6.319) 7.856 4.157 ( -2.214 0.000 -6.711) 7.067 4.269 ( 7.342 0.000 -2.862) 7.880 4.350 ( 4.329 0.000 -1.160) 4.482 4.520 ( -0.938 0.000 -0.574) 1.100 4.573 ( 1.476 0.000 3.878) 4.150 4.716 ( 1.516 0.000 3.485) 3.801 4.839 ( 3.820 0.000 4.035) 5.556 5.060 ( -2.598 0.000 -0.847) 2.733 5.195 ( 4.449 0.000 2.190) 4.959 5.216 ( -4.639 0.000 9.070) 10.188 5.351 ( -4.174 0.000 7.961) 8.989 5.514 ( -3.447 0.000 1.973) 3.971 5.585 ( -1.986 0.000 8.928) 9.146 5.668 ( -2.544 0.000 -7.320) 7.749 5.906 ( 1.099 0.000 -0.970) 1.466 6.012 ( 7.911 0.000 15.310) 17.233 6.230 ( 4.820 0.000 -4.505) 6.598 6.361 ( 1.307 0.000 1.466) 1.964 6.416 ( -4.535 0.000 -3.010) 5.443 6.642 ( -5.987 0.000 -8.581) 10.463 6.735 ( -0.446 0.000 -1.483) 1.548 6.862 ( -1.655 0.000 3.081) 3.497 7.060 ( -4.052 0.000 -8.516) 9.431 7.079 ( 2.570 0.000 -2.013) 3.264 7.151 ( -0.809 0.000 -3.276) 3.374 7.260 ( -5.846 0.000 -2.040) 6.192 7.348 ( 4.812 0.000 8.163) 9.476 7.530 ( 3.021 0.000 8.347) 8.877 7.795 ( -3.241 0.000 -1.589) 3.609 7.854 ( 0.556 0.000 3.450) 3.494 7.879 ( 4.210 0.000 -3.365) 5.390 8.325 ( -5.206 0.000 -14.306) 15.224 8.836 ( -0.943 0.000 3.937) 4.048 8.861 ( 2.107 0.000 -0.023) 2.108 9.012 ( -0.297 0.000 0.786) 0.840 9.585 ( 0.368 0.000 1.461) 1.506 9.628 ( 1.620 0.000 1.013) 1.911 9.762 ( -7.449 0.000 -5.798) 9.440 9.953 ( 4.749 0.000 4.421) 6.488 10.344 ( 5.318 0.000 -2.647) 5.940 10.515 ( 10.127 0.000 0.679) 10.150 10.654 ( 1.912 0.000 0.462) 1.967 11.029 ( -2.331 0.000 8.364) 8.683 11.318 ( -8.814 0.000 3.370) 9.436 11.323 ( -4.295 0.000 -7.225) 8.405 11.790 ( 0.488 0.000 -6.438) 6.456 11.964 ( 4.009 0.000 4.423) 5.970 12.126 ( 0.759 0.000 1.117) 1.350 12.206 ( -6.294 0.000 3.843) 7.375 13.154 ( 14.987 0.000 4.573) 15.669 13.262 ( 2.406 0.000 -15.026) 15.218 13.342 ( 3.069 0.000 -8.095) 8.657 13.712 ( 2.433 0.000 7.344) 7.737 13.854 ( -8.271 0.000 -5.019) 9.675 14.514 ( 23.426 0.000 33.095) 40.547 14.730 ( 3.249 0.000 -0.381) 3.271 14.874 ( -2.713 0.000 0.143) 2.716 14.888 ( -13.165 0.000 -20.938) 24.733 15.090 ( -3.114 0.000 3.198) 4.463 15.094 ( -7.067 0.000 -1.205) 7.169 15.535 ( 4.330 0.000 -3.324) 5.459 15.866 ( 3.951 0.000 -4.911) 6.303 15.911 ( -12.887 0.000 -3.736) 13.417 16.143 ( -2.674 0.000 6.103) 6.663 24.644 ( -0.850 0.000 3.119) 3.233 24.751 ( 0.934 0.000 1.463) 1.735 24.757 ( -1.354 0.000 3.711) 3.950 24.850 ( 0.844 0.000 -4.631) 4.707 24.863 ( 0.645 0.000 0.883) 1.094 25.151 ( -0.582 0.000 -1.270) 1.397 25.166 ( -4.409 0.000 8.772) 9.818 25.999 ( 49.905 0.000 67.816) 84.199 26.189 ( -2.182 0.000 0.989) 2.396 26.445 ( 1.952 0.000 2.103) 2.870 26.740 ( -3.578 0.000 -8.904) 9.596 26.855 ( -25.176 0.000 -42.507) 49.403 28.511 ( -2.669 0.000 2.539) 3.683 28.880 ( 1.313 0.000 0.936) 1.613 29.140 ( -0.634 0.000 -3.061) 3.126 29.709 ( -16.167 0.000 -30.909) 34.882 ======================= Grid point 55 (23/104) ======================= q-point: ( 0.00 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.511 ( 0.733 0.842 24.446) 24.472 0.878 ( -13.457 19.577 24.137) 33.867 1.592 ( 3.601 25.566 51.360) 57.484 2.486 ( -0.517 -2.117 -2.297) 3.166 2.603 ( 6.635 -6.685 -2.259) 9.686 2.656 ( -2.795 -1.727 0.614) 3.343 2.784 ( 5.496 4.550 2.253) 7.482 2.876 ( -4.993 -2.409 10.492) 11.866 2.949 ( 12.467 -0.249 -3.762) 13.025 2.992 ( -3.184 -5.083 -5.220) 7.951 3.084 ( -7.124 -2.571 2.456) 7.962 3.154 ( 1.039 3.772 -0.302) 3.924 3.331 ( 1.561 -2.598 -1.374) 3.328 3.500 ( -0.399 0.739 6.709) 6.761 3.726 ( 3.142 -13.675 -9.620) 17.012 3.885 ( -1.541 -11.584 -0.110) 11.686 4.237 ( -3.044 2.075 -8.467) 9.234 4.392 ( -0.566 6.757 -12.265) 14.014 4.468 ( 2.626 3.473 1.346) 4.557 4.633 ( -2.991 2.850 1.455) 4.380 4.643 ( 1.081 3.415 -0.721) 3.654 4.778 ( 0.251 9.303 -8.051) 12.305 4.944 ( 2.394 -3.190 7.895) 8.845 5.040 ( -2.720 3.548 2.782) 5.265 5.111 ( -3.913 4.864 -5.166) 8.103 5.239 ( -3.460 -3.768 1.308) 5.280 5.295 ( -1.687 4.129 2.293) 5.015 5.442 ( -2.693 -4.081 -0.247) 4.896 5.468 ( -5.382 -8.927 5.761) 11.910 5.706 ( 0.184 0.410 3.327) 3.357 5.891 ( 0.884 0.182 4.623) 4.710 6.092 ( 0.554 2.355 -0.724) 2.525 6.279 ( -2.238 -1.115 -5.612) 6.144 6.339 ( -3.116 -1.666 -0.971) 3.664 6.479 ( 1.842 2.391 -3.985) 4.999 6.536 ( 2.512 0.789 -0.034) 2.633 6.700 ( -1.457 1.932 -1.994) 3.135 6.743 ( -3.990 0.854 -1.163) 4.243 6.819 ( 0.932 -1.428 -7.326) 7.522 7.102 ( 1.715 -5.723 -1.243) 6.103 7.193 ( -1.388 7.869 -8.276) 11.504 7.253 ( 4.775 2.400 1.161) 5.469 7.366 ( -7.081 -0.897 -1.622) 7.320 7.661 ( -4.224 4.429 0.713) 6.162 7.733 ( 8.792 -23.163 21.346) 32.703 7.805 ( 0.189 1.260 0.940) 1.584 7.925 ( -0.584 4.219 2.617) 4.999 8.118 ( 8.439 1.103 11.827) 14.571 8.842 ( -0.064 -1.563 -0.470) 1.634 9.061 ( -0.561 3.149 0.455) 3.230 9.236 ( 5.289 11.725 -15.111) 19.844 9.506 ( -2.352 -1.835 -1.334) 3.268 9.531 ( -1.124 -3.078 -2.467) 4.102 9.780 ( -2.751 7.771 -1.762) 8.430 10.038 ( 3.784 -2.080 6.680) 7.954 10.251 ( -6.315 4.870 -3.957) 8.903 10.585 ( 3.751 -5.392 -1.680) 6.780 10.651 ( -4.105 0.074 0.240) 4.113 10.880 ( 1.354 -8.163 4.369) 9.357 11.137 ( -0.892 0.652 -0.461) 1.197 11.632 ( 5.533 6.064 -12.571) 15.014 11.683 ( 2.839 -11.947 -4.204) 12.980 12.036 ( -5.315 -1.116 -1.543) 5.646 12.198 ( 1.172 1.148 2.813) 3.256 12.494 ( 12.807 1.480 6.870) 14.609 13.115 ( -2.466 -6.421 -8.921) 11.265 13.193 ( -7.598 -0.843 -6.492) 10.030 13.469 ( 12.137 -0.003 6.085) 13.577 13.710 ( -3.457 -5.887 9.175) 11.436 13.760 ( -1.809 -1.500 -1.917) 3.033 13.899 ( -9.301 -7.190 11.580) 16.502 14.690 ( 9.883 -12.343 8.002) 17.722 14.877 ( -3.025 2.772 -2.408) 4.757 15.093 ( -4.924 4.523 0.989) 6.759 15.175 ( -3.971 12.132 -2.592) 13.026 15.470 ( 0.590 8.760 -6.599) 10.983 15.622 ( 10.293 0.081 -1.234) 10.367 15.779 ( 4.570 1.828 3.000) 5.765 15.893 ( 2.386 -0.055 -4.274) 4.895 16.080 ( -5.614 -1.879 3.614) 6.936 24.663 ( -0.324 0.467 3.577) 3.621 24.754 ( -1.277 1.793 0.687) 2.306 24.770 ( -0.557 0.140 2.424) 2.491 24.852 ( 1.911 -1.166 -0.802) 2.378 24.883 ( -0.067 1.643 -2.158) 2.713 25.094 ( -7.654 -4.368 8.715) 12.394 25.141 ( -2.617 -2.754 2.195) 4.388 25.252 ( -17.734 -12.775 13.408) 25.641 26.360 ( -10.897 10.291 -8.642) 17.301 26.484 ( 1.111 -0.900 3.950) 4.201 26.694 ( 1.092 -3.004 -3.163) 4.497 27.117 ( 26.011 -20.325 15.178) 36.333 28.805 ( -0.807 -6.864 -0.158) 6.913 28.911 ( -2.181 -0.752 -12.667) 12.875 29.378 ( -7.715 17.379 -9.006) 21.039 29.417 ( 22.732 15.361 -9.721) 29.107 ======================= Grid point 56 (24/104) ======================= q-point: ( 0.17 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.674 ( -0.465 -3.720 30.228) 30.459 1.047 ( 18.921 6.102 20.321) 28.429 2.114 ( 14.718 14.374 38.879) 43.987 2.405 ( -12.009 -4.414 1.633) 12.898 2.510 ( -4.622 -9.413 -2.865) 10.871 2.612 ( -9.266 -1.512 -1.085) 9.452 2.713 ( -6.496 -0.589 7.334) 9.815 2.896 ( -5.947 -0.297 5.920) 8.397 2.981 ( 3.648 -3.770 -3.420) 6.262 3.089 ( 8.726 3.205 3.949) 10.100 3.149 ( 7.681 2.135 3.918) 8.883 3.213 ( 4.172 -1.231 -1.327) 4.547 3.336 ( 0.214 -4.267 -1.319) 4.471 3.496 ( -3.126 2.617 3.140) 5.146 3.751 ( 4.389 -12.062 -6.978) 14.610 3.847 ( -0.351 -13.286 -3.338) 13.703 4.086 ( -7.316 -4.997 -4.421) 9.902 4.312 ( -0.283 5.087 -7.039) 8.689 4.452 ( -12.150 -0.240 -4.487) 12.954 4.507 ( -3.658 4.428 -0.564) 5.772 4.601 ( -3.733 9.941 0.694) 10.642 4.738 ( 0.213 13.346 -3.208) 13.728 4.937 ( -2.738 1.819 -3.785) 5.013 5.026 ( 0.302 7.044 -6.932) 9.888 5.107 ( 3.086 5.034 6.617) 8.868 5.163 ( -6.292 1.724 6.750) 9.388 5.263 ( -2.941 0.001 2.732) 4.014 5.367 ( -3.420 -10.120 1.247) 10.755 5.456 ( -0.357 -4.661 1.538) 4.922 5.739 ( 0.415 0.197 4.023) 4.050 5.973 ( 2.170 0.835 1.582) 2.812 6.053 ( -1.160 8.950 -2.688) 9.417 6.202 ( -4.320 -2.379 -3.238) 5.900 6.355 ( 4.975 -6.233 0.140) 7.976 6.467 ( -0.011 -0.990 -1.383) 1.701 6.608 ( 2.907 0.274 2.018) 3.550 6.687 ( 3.024 -1.215 -3.609) 4.862 6.753 ( 4.735 3.134 0.755) 5.728 6.854 ( 5.209 2.079 -1.355) 5.770 7.108 ( -0.068 9.971 -11.061) 14.892 7.125 ( 1.989 -4.441 -0.824) 4.935 7.198 ( -4.443 -0.668 -7.112) 8.412 7.386 ( 5.999 5.572 2.934) 8.697 7.571 ( -4.931 3.056 0.765) 5.852 7.764 ( -3.888 0.280 -1.455) 4.161 7.928 ( -0.588 -2.753 1.052) 3.005 8.034 ( 11.199 -15.870 7.332) 20.761 8.330 ( 6.187 -2.033 3.430) 7.361 8.827 ( -1.938 -0.852 -1.119) 2.394 9.045 ( -1.712 2.726 2.712) 4.209 9.103 ( -2.254 11.415 -16.719) 20.369 9.470 ( -1.911 -3.188 -1.526) 4.018 9.527 ( 0.025 1.089 1.801) 2.105 9.757 ( -2.024 3.197 6.703) 7.697 10.142 ( 1.677 0.404 4.284) 4.619 10.200 ( -0.559 3.899 9.143) 9.956 10.471 ( -12.760 -3.468 0.067) 13.223 10.570 ( -2.918 0.852 -2.409) 3.879 10.873 ( -5.687 1.335 -0.016) 5.842 11.221 ( 9.082 -0.982 -2.424) 9.451 11.664 ( 3.361 -7.067 -1.717) 8.012 11.794 ( 7.874 -21.606 -7.772) 24.274 11.899 ( -2.860 1.467 -1.705) 3.638 12.153 ( -4.986 3.364 -4.418) 7.463 12.597 ( -1.977 -6.038 7.920) 10.153 13.071 ( -0.818 0.001 -5.384) 5.446 13.096 ( 0.392 -4.338 -4.055) 5.951 13.537 ( -3.159 2.289 2.637) 4.709 13.572 ( -8.587 -0.929 -0.654) 8.662 13.783 ( -1.455 -1.949 6.619) 7.052 14.055 ( 14.452 5.087 5.839) 16.396 14.721 ( -7.293 11.693 -10.244) 17.171 14.904 ( -1.657 -5.767 2.444) 6.479 14.977 ( 5.395 -10.948 8.141) 14.671 15.199 ( 1.322 5.604 1.357) 5.916 15.437 ( -0.987 4.007 -0.011) 4.127 15.705 ( -0.138 3.860 1.614) 4.186 15.877 ( 1.732 -4.835 -0.713) 5.185 15.933 ( 4.124 2.398 -3.622) 5.990 16.076 ( 4.188 3.516 -2.476) 6.003 24.675 ( -0.801 0.053 1.804) 1.974 24.738 ( -1.194 1.719 3.450) 4.035 24.781 ( 0.490 0.654 1.367) 1.593 24.846 ( -1.987 -0.219 1.975) 2.810 24.892 ( 0.681 0.014 -0.588) 0.899 24.923 ( -10.011 0.497 8.178) 12.936 25.111 ( -2.218 -1.258 5.858) 6.389 25.206 ( 1.496 -0.013 1.361) 2.022 26.231 ( -1.915 6.961 -1.850) 7.453 26.511 ( -1.345 -1.453 4.827) 5.217 26.720 ( 3.754 -4.218 -3.374) 6.578 27.441 ( 5.188 -24.277 2.214) 24.923 28.624 ( -10.105 3.283 -4.025) 11.361 28.816 ( -2.441 -5.510 -0.719) 6.070 29.345 ( 3.114 14.361 -2.501) 14.906 29.755 ( 18.010 2.846 -15.250) 23.770 ======================= Grid point 57 (25/104) ======================= q-point: ( 0.33 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.027 ( 21.408 -7.888 15.129) 27.375 1.555 ( 22.072 -1.882 15.995) 27.323 1.964 ( -24.207 -15.546 -3.194) 28.946 2.295 ( -18.683 5.006 -5.905) 20.224 2.405 ( -7.754 -12.879 4.632) 15.730 2.624 ( -2.677 15.546 9.162) 18.243 2.708 ( 6.488 5.240 22.860) 24.333 2.850 ( -2.213 -1.150 3.403) 4.219 3.057 ( 3.428 -2.702 0.152) 4.367 3.135 ( -5.529 -11.723 -6.520) 14.510 3.224 ( 5.218 -2.453 3.867) 6.943 3.338 ( 0.358 -1.594 3.169) 3.566 3.359 ( 4.842 1.753 5.033) 7.201 3.461 ( -0.422 1.653 -1.454) 2.242 3.764 ( 3.281 -12.909 -9.209) 16.193 3.803 ( -0.897 -13.303 -9.219) 16.210 4.048 ( 1.752 -2.472 7.239) 7.848 4.108 ( -16.864 1.970 -5.446) 17.831 4.283 ( -3.497 -1.811 6.413) 7.525 4.456 ( 2.142 12.479 -9.782) 16.000 4.557 ( -2.240 9.918 0.525) 10.181 4.723 ( -0.520 13.338 -0.996) 13.385 4.890 ( -0.119 4.632 -5.799) 7.423 5.010 ( 1.627 12.682 -2.866) 13.103 5.109 ( -0.997 8.716 -0.849) 8.813 5.191 ( 0.120 -2.874 9.750) 10.165 5.211 ( -4.292 -2.901 4.026) 6.561 5.372 ( 0.902 -5.743 5.596) 8.069 5.466 ( 0.447 -4.695 2.252) 5.227 5.765 ( 0.209 1.274 3.786) 4.000 5.973 ( -0.134 1.156 -1.917) 2.243 6.042 ( -0.354 8.181 0.755) 8.224 6.112 ( -4.212 -1.098 -0.341) 4.367 6.413 ( -0.125 -2.277 -2.909) 3.697 6.464 ( 3.622 -6.564 -3.585) 8.310 6.644 ( 2.775 -0.932 -1.863) 3.469 6.758 ( 3.372 1.580 1.201) 3.913 6.867 ( 2.648 -1.211 -0.686) 2.991 7.003 ( 10.445 -5.564 5.879) 13.214 7.057 ( 1.687 8.838 -7.532) 11.734 7.093 ( -0.166 4.127 -5.759) 7.087 7.242 ( 8.157 -2.254 0.268) 8.467 7.467 ( 0.851 5.630 0.625) 5.729 7.511 ( -2.082 2.155 -0.392) 3.022 7.651 ( -5.757 3.429 -2.803) 7.264 7.890 ( -3.386 -6.723 0.482) 7.543 8.193 ( 3.805 -10.443 -9.551) 14.654 8.390 ( 2.608 -4.791 -0.616) 5.490 8.757 ( -3.784 0.902 0.766) 3.965 8.996 ( 0.991 8.175 -7.827) 11.361 9.121 ( 4.641 2.248 1.576) 5.392 9.404 ( -3.328 -2.443 -2.136) 4.649 9.548 ( -0.010 -0.020 5.820) 5.820 9.763 ( -3.118 2.240 8.908) 9.700 10.155 ( -0.856 1.947 0.484) 2.181 10.235 ( -5.635 -2.372 7.434) 9.625 10.255 ( -8.688 -0.715 2.821) 9.162 10.527 ( 0.103 4.575 -0.069) 4.577 10.764 ( -4.890 2.620 1.304) 5.698 11.374 ( 9.142 -2.551 -1.084) 9.553 11.682 ( -6.031 -5.460 -1.320) 8.242 11.736 ( 3.319 -5.947 -3.824) 7.811 11.951 ( -4.950 -1.026 2.437) 5.612 12.114 ( 10.783 -22.867 -11.920) 27.951 12.607 ( -2.426 1.923 6.043) 6.790 13.022 ( -1.343 0.277 -4.400) 4.609 13.070 ( -0.618 -1.656 -2.362) 2.950 13.396 ( -7.759 4.942 -4.006) 10.034 13.531 ( 1.337 1.903 -1.270) 2.649 13.804 ( -1.132 -0.979 8.694) 8.822 14.315 ( 8.665 11.178 4.045) 14.710 14.535 ( -4.525 3.957 -6.819) 9.090 14.909 ( 1.496 -8.535 -1.535) 8.800 15.107 ( 1.094 -11.299 5.214) 12.491 15.218 ( 1.647 4.448 -0.267) 4.751 15.398 ( -3.872 -1.624 1.087) 4.337 15.711 ( 0.292 3.594 0.533) 3.645 15.867 ( -0.688 5.717 -3.358) 6.666 15.994 ( 3.937 4.233 0.241) 5.786 16.133 ( 3.182 2.975 -1.766) 4.700 24.659 ( -0.927 0.700 0.114) 1.167 24.738 ( -2.964 1.093 5.392) 6.250 24.795 ( 0.292 0.381 0.003) 0.480 24.840 ( -1.106 0.807 7.438) 7.563 24.869 ( 1.462 2.729 -1.312) 3.362 24.894 ( -2.422 0.431 4.941) 5.520 25.127 ( -0.556 -1.441 6.310) 6.496 25.241 ( 1.390 -0.816 0.420) 1.666 26.221 ( 0.790 4.836 -0.090) 4.901 26.492 ( -3.390 -1.755 3.162) 4.957 26.776 ( 4.396 -5.912 -3.746) 8.265 27.422 ( -3.924 -13.177 -5.430) 14.782 28.512 ( -1.992 -1.697 0.181) 2.623 28.768 ( -2.419 -6.445 0.125) 6.885 29.388 ( 2.758 13.505 -3.256) 14.163 29.892 ( 8.028 0.792 -11.764) 14.264 ======================= Grid point 58 (26/104) ======================= q-point: (-0.50 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( -19.356 -18.766 -3.254) 27.156 1.613 ( 13.502 -12.980 7.749) 20.269 1.856 ( -24.043 7.689 -6.233) 26.000 2.038 ( 17.635 0.047 12.048) 21.358 2.314 ( -3.977 -6.282 1.633) 7.612 2.499 ( -13.549 16.861 9.370) 23.572 2.784 ( -6.438 -4.329 -5.497) 9.508 2.888 ( -2.139 3.682 13.789) 14.432 2.993 ( 2.441 -6.708 -6.068) 9.370 3.135 ( -0.265 2.019 -2.946) 3.581 3.275 ( -8.079 -3.220 1.504) 8.826 3.281 ( -1.762 -3.094 0.445) 3.588 3.398 ( -3.007 -2.259 2.933) 4.769 3.453 ( -0.167 -0.706 -2.238) 2.352 3.770 ( 4.584 -12.173 -8.710) 15.654 3.783 ( 3.556 -11.583 -5.906) 13.480 3.955 ( 3.870 1.772 2.374) 4.874 4.186 ( 7.338 -1.586 8.854) 11.609 4.265 ( -2.979 -3.225 8.261) 9.354 4.450 ( 1.140 8.149 -5.589) 9.947 4.531 ( 1.278 12.928 -4.411) 13.719 4.707 ( -0.573 6.374 -0.979) 6.474 4.870 ( 1.984 9.423 -4.189) 10.501 5.064 ( 2.969 15.597 3.475) 16.252 5.089 ( 1.520 0.142 -2.819) 3.206 5.182 ( -0.384 4.691 3.705) 5.991 5.271 ( -0.885 -1.052 13.957) 14.025 5.419 ( -0.164 -7.872 5.102) 9.382 5.485 ( -0.779 -6.152 3.711) 7.227 5.802 ( 0.361 2.958 5.703) 6.435 5.975 ( 1.197 0.179 -0.728) 1.412 6.028 ( -0.713 1.410 -1.542) 2.208 6.074 ( -0.192 7.866 1.974) 8.112 6.356 ( -1.211 0.214 -6.839) 6.949 6.523 ( 2.543 -10.153 -0.547) 10.481 6.668 ( 0.617 -2.079 -1.680) 2.743 6.801 ( 0.583 2.041 -1.322) 2.500 6.887 ( 0.886 -4.490 -0.163) 4.580 6.995 ( -5.945 -1.209 -1.274) 6.199 7.082 ( 4.537 8.129 -1.632) 9.451 7.202 ( 4.150 -0.872 2.327) 4.837 7.380 ( -7.450 -0.302 -5.170) 9.073 7.410 ( 6.249 4.283 3.743) 8.451 7.497 ( -0.703 1.128 -0.901) 1.606 7.619 ( 5.934 2.486 -0.158) 6.436 7.854 ( -0.275 -3.248 -0.116) 3.261 8.060 ( -6.141 -5.679 -16.596) 18.584 8.430 ( 0.646 -10.237 -2.744) 10.618 8.742 ( 0.380 1.370 3.820) 4.076 8.981 ( 1.485 7.017 -6.024) 9.366 9.165 ( -1.296 3.757 -2.163) 4.525 9.395 ( 3.504 -1.840 2.314) 4.584 9.590 ( 0.348 -4.052 3.563) 5.407 9.756 ( -2.113 4.105 8.722) 9.868 10.114 ( -4.441 0.648 1.665) 4.787 10.128 ( -5.526 -2.249 0.680) 6.005 10.228 ( 2.208 -0.175 3.583) 4.213 10.544 ( 1.473 3.404 -0.902) 3.817 10.769 ( 1.688 3.419 10.220) 10.908 11.504 ( 1.719 -4.345 2.671) 5.382 11.580 ( -1.051 -2.696 -5.077) 5.844 11.751 ( 0.157 -1.381 -5.366) 5.543 11.905 ( 1.600 -7.947 1.814) 8.307 12.193 ( 1.868 -21.262 -7.387) 22.586 12.551 ( -6.392 8.845 0.878) 10.948 12.990 ( 2.273 -2.610 -4.524) 5.696 13.039 ( -1.431 0.933 -4.193) 4.528 13.302 ( 1.632 3.736 -5.153) 6.571 13.567 ( 3.420 2.668 -1.379) 4.551 13.847 ( -1.098 -2.962 11.661) 12.081 14.311 ( -5.689 8.319 -3.829) 10.781 14.581 ( 7.151 3.686 3.540) 8.790 14.894 ( -1.772 -10.994 -5.663) 12.493 15.095 ( -3.179 -7.191 1.842) 8.075 15.247 ( 0.423 3.826 0.194) 3.854 15.339 ( -2.168 -1.507 0.422) 2.674 15.672 ( -3.899 2.545 -3.761) 5.985 15.858 ( 2.583 11.316 -3.956) 12.263 16.070 ( 2.351 3.504 3.862) 5.720 16.161 ( 0.617 2.025 -0.215) 2.127 24.657 ( 0.493 0.484 0.680) 0.969 24.705 ( -3.109 2.007 3.258) 4.931 24.802 ( 0.790 -0.152 -0.472) 0.933 24.853 ( -1.204 2.572 1.082) 3.039 24.878 ( -1.010 0.690 3.437) 3.648 24.948 ( 2.733 -0.902 11.417) 11.774 25.158 ( -1.206 -1.031 8.423) 8.571 25.254 ( -0.405 -1.243 0.879) 1.575 26.246 ( 1.389 4.622 1.428) 5.033 26.440 ( -2.976 -1.585 0.329) 3.388 26.810 ( 1.399 -6.480 -3.859) 7.671 27.294 ( -3.625 -7.703 -11.698) 14.468 28.512 ( 0.493 -3.771 1.794) 4.205 28.746 ( 0.138 -6.604 0.402) 6.617 29.389 ( 0.002 13.264 -4.673) 14.063 29.937 ( 4.760 0.106 -10.151) 11.212 ======================= Grid point 59 (27/104) ======================= q-point: (-0.33 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.831 ( -28.418 -15.983 9.624) 33.995 1.312 ( -27.586 13.271 -7.462) 31.508 2.044 ( -0.270 1.535 13.321) 13.412 2.095 ( -6.824 7.742 10.388) 14.643 2.351 ( 5.569 -6.062 3.661) 9.009 2.454 ( 10.545 5.459 2.427) 12.120 2.644 ( -2.923 -2.984 -6.291) 7.551 2.927 ( -2.281 -0.049 9.411) 9.683 2.972 ( -7.377 11.253 -8.797) 16.076 3.025 ( 1.740 -1.735 -4.889) 5.472 3.161 ( -2.210 -3.746 -3.119) 5.352 3.269 ( -0.532 -5.097 2.825) 5.852 3.342 ( -4.544 -3.017 1.267) 5.600 3.439 ( 0.604 -2.898 -2.467) 3.853 3.772 ( 2.101 -13.669 -9.817) 16.959 3.854 ( 4.414 -9.202 -1.957) 10.392 4.106 ( 8.503 1.743 3.805) 9.477 4.288 ( 2.956 -2.426 0.147) 3.827 4.394 ( 5.465 2.486 5.290) 8.002 4.464 ( 5.184 0.758 2.697) 5.892 4.553 ( 4.132 12.874 -5.644) 14.651 4.693 ( -0.563 1.978 0.792) 2.204 4.893 ( 2.391 9.452 -1.643) 9.887 5.087 ( -0.438 1.391 1.550) 2.129 5.165 ( 2.977 7.505 2.087) 8.339 5.231 ( 2.368 2.369 4.325) 5.471 5.315 ( -2.729 2.131 11.953) 12.444 5.418 ( -3.104 -10.216 5.682) 12.095 5.494 ( -0.525 -5.909 4.117) 7.221 5.836 ( -0.301 2.444 7.828) 8.206 5.932 ( -4.249 6.569 -4.987) 9.278 6.066 ( -0.676 7.298 -0.573) 7.352 6.112 ( 7.555 0.867 2.072) 7.882 6.330 ( 2.052 0.444 -2.133) 2.993 6.498 ( -3.870 -5.575 -2.573) 7.258 6.682 ( 1.950 -4.123 1.256) 4.731 6.762 ( -4.036 -0.418 -2.993) 5.042 6.864 ( -6.774 -1.165 1.979) 7.152 6.888 ( 0.133 -6.293 -0.539) 6.317 7.167 ( -1.801 0.062 2.332) 2.947 7.196 ( -3.126 -4.698 -8.272) 10.013 7.258 ( 2.146 6.236 -0.697) 6.631 7.432 ( -1.398 1.861 1.789) 2.936 7.549 ( 3.742 6.352 3.149) 8.017 7.733 ( 1.981 -4.303 -8.630) 9.844 7.834 ( -0.970 -2.042 0.611) 2.342 7.897 ( -2.082 0.276 -2.343) 3.147 8.345 ( -7.713 -8.269 -5.045) 12.382 8.802 ( 3.422 0.893 2.778) 4.497 8.963 ( 0.208 5.078 -3.558) 6.204 9.120 ( 1.133 7.246 -5.646) 9.256 9.489 ( 3.293 -3.092 2.904) 5.370 9.590 ( -0.363 -3.463 -0.479) 3.515 9.832 ( 4.481 1.275 5.448) 7.169 9.961 ( -7.893 2.994 0.151) 8.444 10.166 ( 4.399 -4.686 1.237) 6.546 10.328 ( 5.655 -0.277 3.829) 6.835 10.591 ( 4.252 0.876 -0.992) 4.453 10.912 ( 4.492 3.148 15.405) 16.353 11.433 ( -8.614 -1.436 -2.617) 9.117 11.550 ( 0.736 1.400 -6.022) 6.226 11.721 ( 0.149 -12.181 -5.632) 13.421 11.997 ( 3.787 -6.555 3.771) 8.458 12.110 ( -3.438 -1.301 -6.218) 7.223 12.413 ( -7.816 8.770 0.082) 11.747 13.008 ( 2.969 3.542 -3.074) 5.551 13.070 ( 8.329 -8.789 -4.681) 12.982 13.347 ( 6.582 1.740 -9.770) 11.908 13.630 ( 2.970 1.500 2.057) 3.912 13.895 ( -2.350 -7.377 11.334) 13.726 14.156 ( -9.607 -0.591 0.923) 9.669 14.710 ( 0.263 -4.474 -3.248) 5.535 14.813 ( 2.621 0.280 -0.206) 2.644 15.034 ( -4.664 -4.056 2.477) 6.659 15.224 ( -2.778 8.905 -0.012) 9.328 15.346 ( 2.618 2.000 -1.389) 3.575 15.575 ( -2.149 4.799 -5.452) 7.575 15.882 ( 2.292 5.580 -3.953) 7.212 16.065 ( -5.308 -0.933 0.083) 5.390 16.178 ( 0.295 4.466 2.786) 5.272 24.668 ( -1.691 1.201 2.365) 3.146 24.692 ( 1.459 0.475 1.711) 2.298 24.807 ( -1.453 1.481 1.580) 2.608 24.834 ( -0.454 -0.327 0.449) 0.718 24.885 ( 0.577 1.947 -0.779) 2.175 25.082 ( 2.539 -4.419 12.119) 13.147 25.180 ( -2.612 -0.632 8.920) 9.316 25.260 ( -1.150 -4.129 11.907) 12.655 26.286 ( 1.908 6.459 3.497) 7.589 26.413 ( 0.528 -0.427 -0.409) 0.793 26.774 ( -2.252 -4.895 -3.774) 6.579 27.140 ( -4.626 -8.024 -18.931) 21.075 28.549 ( 3.265 -0.556 1.408) 3.599 28.778 ( 2.749 -6.146 0.608) 6.760 29.340 ( -1.661 13.259 -5.035) 14.279 29.923 ( 0.662 -1.042 -13.815) 13.870 ======================= Grid point 60 (28/104) ======================= q-point: (-0.17 0.14 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.584 ( -15.702 -1.596 23.099) 27.976 0.878 ( -11.809 26.068 10.133) 30.359 1.639 ( -33.417 23.329 35.967) 54.356 2.398 ( 15.036 -10.463 -1.979) 18.425 2.496 ( 4.670 -0.415 2.513) 5.319 2.607 ( 5.124 1.807 -3.905) 6.691 2.658 ( 7.229 2.289 -0.880) 7.634 2.795 ( 0.587 8.318 -4.951) 9.698 2.950 ( -4.708 -3.963 8.663) 10.626 3.065 ( 2.305 -3.726 -3.518) 5.619 3.109 ( -0.936 0.054 -2.827) 2.978 3.242 ( -6.949 -4.859 1.182) 8.562 3.297 ( 1.793 -1.640 0.968) 2.615 3.455 ( 1.478 -0.893 1.803) 2.497 3.742 ( 2.088 -14.169 -10.529) 17.776 3.892 ( 0.662 -9.568 0.275) 9.595 4.259 ( 5.788 3.801 -2.850) 7.487 4.377 ( 6.805 1.144 -2.405) 7.308 4.431 ( 1.482 7.555 -3.288) 8.372 4.573 ( 5.094 3.536 -3.214) 6.984 4.622 ( 3.171 3.089 1.524) 4.682 4.731 ( 3.850 2.293 2.759) 5.263 4.920 ( -0.444 5.945 1.747) 6.212 5.073 ( -2.010 2.967 1.517) 3.892 5.173 ( -1.213 1.575 -0.702) 2.108 5.257 ( -2.737 -6.940 4.464) 8.694 5.341 ( -2.184 2.763 2.596) 4.376 5.424 ( 1.067 -3.860 8.175) 9.103 5.509 ( -1.986 -6.205 5.914) 8.799 5.771 ( -8.156 7.275 -4.829) 11.948 5.889 ( 0.246 0.094 4.149) 4.157 6.063 ( 0.904 3.300 1.552) 3.757 6.279 ( 8.450 2.268 -0.096) 8.750 6.370 ( 0.120 -0.226 2.685) 2.697 6.423 ( -1.463 2.631 -2.564) 3.955 6.618 ( -4.747 -2.377 -7.587) 9.260 6.725 ( 0.223 -1.139 -2.405) 2.670 6.829 ( -1.444 -4.041 1.822) 4.662 6.901 ( 0.036 -6.021 0.952) 6.096 7.034 ( -2.258 -11.484 -1.278) 11.774 7.157 ( 0.789 -1.032 -2.654) 2.955 7.277 ( -2.206 7.493 -3.303) 8.481 7.441 ( -0.759 3.718 3.882) 5.428 7.599 ( -4.375 -4.207 9.821) 11.545 7.661 ( 1.290 -4.473 -0.398) 4.672 7.841 ( -2.365 2.782 -2.214) 4.270 7.899 ( 1.802 4.421 5.297) 7.132 8.117 ( -12.305 -2.348 -1.089) 12.574 8.845 ( 0.015 -0.846 0.355) 0.918 9.012 ( 5.338 4.375 1.406) 7.044 9.150 ( 7.829 11.124 -10.936) 17.454 9.525 ( -0.519 -4.737 1.605) 5.028 9.580 ( -0.652 -3.183 -1.625) 3.633 9.852 ( -2.359 6.097 -5.503) 8.545 9.942 ( 3.483 -1.214 4.902) 6.135 10.302 ( 7.984 -3.958 -0.173) 8.913 10.440 ( 5.978 -5.132 -0.758) 7.915 10.653 ( 1.923 -0.158 0.768) 2.077 11.010 ( -8.124 -3.164 3.372) 9.348 11.192 ( -7.910 -0.698 -2.458) 8.313 11.601 ( 7.570 9.227 -7.943) 14.337 11.686 ( 0.075 -8.359 -3.029) 8.891 12.001 ( 2.149 1.720 2.352) 3.621 12.131 ( 2.927 -0.409 2.970) 4.190 12.320 ( -2.560 11.525 4.284) 12.559 13.140 ( 9.147 -5.628 -3.101) 11.178 13.181 ( 9.230 -1.952 -2.285) 9.707 13.366 ( 0.182 0.549 -11.362) 11.377 13.680 ( 0.085 -3.269 5.004) 5.978 13.835 ( -5.944 -1.666 -1.907) 6.461 14.048 ( -10.869 -18.579 19.270) 28.890 14.584 ( -2.824 -11.289 -4.306) 12.408 14.960 ( -4.584 2.101 0.295) 5.051 15.006 ( 9.551 5.889 4.713) 12.170 15.205 ( 2.029 12.653 3.123) 13.190 15.367 ( 3.024 10.372 -5.754) 12.240 15.568 ( 4.137 2.855 -4.956) 7.059 15.887 ( -5.977 0.510 1.144) 6.107 15.891 ( -4.979 -0.214 -8.256) 9.643 16.164 ( -4.577 0.905 3.856) 6.053 24.656 ( -1.157 1.169 2.863) 3.302 24.741 ( 1.744 -0.814 2.575) 3.215 24.780 ( -2.272 2.238 2.525) 4.068 24.835 ( 1.136 -0.985 -3.121) 3.464 24.890 ( 0.432 1.993 -0.835) 2.204 25.126 ( -1.689 -2.089 3.246) 4.213 25.166 ( -3.113 -0.591 5.190) 6.081 25.386 ( -4.868 -25.990 29.040) 39.275 26.414 ( 6.481 2.250 4.533) 8.222 26.480 ( 9.218 5.259 7.992) 13.285 26.710 ( -1.641 -2.873 -3.451) 4.781 26.844 ( -12.725 -0.961 -20.175) 23.872 28.684 ( 12.174 2.485 -1.747) 12.548 28.841 ( 4.496 -3.248 -0.589) 5.577 29.292 ( 0.520 14.364 -4.616) 15.097 29.731 ( -11.534 2.464 -21.167) 24.231 ======================= Grid point 61 (29/104) ======================= q-point: ( 0.00 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.784 ( 2.880 23.200 -9.078) 25.079 1.305 ( -13.160 23.675 12.820) 29.968 1.984 ( 1.268 15.291 34.838) 38.068 2.374 ( 14.343 -18.264 -4.877) 23.730 2.454 ( -5.118 -5.826 -5.982) 9.794 2.522 ( -14.592 -12.122 -3.644) 19.317 2.769 ( -1.402 -4.880 0.144) 5.080 2.826 ( 2.960 -7.923 1.829) 8.654 2.928 ( 3.100 8.017 1.065) 8.661 2.963 ( 2.617 0.972 1.091) 2.997 3.096 ( 2.091 4.454 0.756) 4.979 3.283 ( 0.727 6.592 5.323) 8.503 3.372 ( -1.601 5.957 6.725) 9.126 3.525 ( 5.677 -1.359 -3.283) 6.697 3.595 ( 0.584 7.774 -2.965) 8.341 3.703 ( -3.495 -7.584 1.744) 8.531 4.284 ( -8.489 0.715 -10.416) 13.456 4.378 ( -4.379 -4.135 -3.688) 7.062 4.486 ( 4.441 -3.883 -0.910) 5.969 4.609 ( 1.412 -1.245 2.163) 2.867 4.671 ( 1.089 -5.330 4.038) 6.776 4.876 ( 3.131 3.280 -3.319) 5.619 4.946 ( 3.249 -0.218 -5.379) 6.288 5.106 ( 1.306 -6.462 -1.900) 6.861 5.136 ( -3.275 3.765 5.062) 7.108 5.178 ( 0.673 1.689 -2.599) 3.172 5.358 ( -6.925 0.814 2.627) 7.451 5.365 ( -1.045 5.470 6.142) 8.291 5.456 ( -5.428 2.113 -0.486) 5.845 5.735 ( -2.979 1.145 2.958) 4.351 5.894 ( 3.159 0.323 5.232) 6.121 6.140 ( 2.658 1.071 -4.204) 5.088 6.246 ( -1.633 -1.929 -4.865) 5.482 6.296 ( -3.075 -2.186 -3.318) 5.025 6.446 ( -2.288 -4.030 -2.163) 5.114 6.538 ( 1.793 -1.720 0.016) 2.485 6.710 ( -0.175 -0.082 -1.645) 1.656 6.770 ( 0.254 3.557 2.917) 4.607 6.884 ( 1.147 2.884 0.075) 3.104 7.011 ( 4.613 -0.580 -2.381) 5.224 7.166 ( 4.944 -6.730 6.050) 10.312 7.340 ( 4.528 -3.486 9.881) 11.414 7.343 ( -0.836 -0.448 5.734) 5.812 7.471 ( -2.114 2.023 -3.282) 4.397 7.796 ( -4.616 6.905 -3.295) 8.936 7.852 ( -2.343 2.237 -3.023) 4.431 8.022 ( -2.119 5.831 -0.048) 6.205 8.182 ( 5.920 3.502 4.650) 8.303 8.852 ( 0.238 3.076 0.727) 3.169 9.120 ( -2.991 3.056 -1.273) 4.461 9.286 ( 3.928 -4.308 -3.342) 6.720 9.475 ( -1.592 -1.896 -3.927) 4.642 9.572 ( 3.569 7.867 -1.568) 8.780 9.876 ( -0.200 0.398 -6.759) 6.774 9.989 ( 3.550 -2.370 7.971) 9.042 10.329 ( -6.086 4.943 -3.550) 8.606 10.413 ( 9.679 -10.762 1.918) 14.601 10.646 ( -3.277 -0.553 -0.794) 3.417 10.750 ( -2.280 -4.332 1.854) 5.235 11.199 ( -0.533 0.775 -2.083) 2.285 11.430 ( -6.011 -9.320 -7.796) 13.556 11.746 ( -2.193 5.970 -9.425) 11.370 12.015 ( -5.355 -2.975 -1.547) 6.318 12.090 ( 4.937 -9.646 3.862) 11.504 12.647 ( 4.926 10.861 2.325) 12.151 12.991 ( -2.395 -5.528 -5.788) 8.354 13.203 ( -3.893 2.271 -4.522) 6.384 13.462 ( 12.723 -1.040 6.990) 14.554 13.605 ( -5.082 -4.629 7.489) 10.166 13.675 ( -2.068 -6.080 2.862) 7.031 13.930 ( 3.746 6.411 4.812) 8.848 14.469 ( 8.177 -10.793 8.617) 16.050 14.932 ( -4.648 3.660 -2.670) 6.491 15.134 ( -1.402 -0.251 1.895) 2.371 15.401 ( -6.796 9.812 -7.356) 14.021 15.577 ( -5.787 4.349 -5.139) 8.877 15.630 ( 10.027 0.998 -0.986) 10.125 15.817 ( 3.021 2.156 4.260) 5.650 15.883 ( 2.597 -1.263 -2.343) 3.718 16.028 ( -3.070 -3.450 4.103) 6.178 24.682 ( -0.503 1.387 2.391) 2.810 24.757 ( -0.248 0.328 2.217) 2.255 24.802 ( 1.136 0.020 -1.677) 2.026 24.835 ( -1.204 0.676 2.772) 3.097 24.908 ( -0.532 0.583 -1.501) 1.696 24.999 ( -7.673 -3.210 9.064) 12.302 25.085 ( -1.702 -1.638 5.074) 5.597 25.169 ( -0.130 -1.874 3.403) 3.887 26.461 ( -0.802 0.366 1.415) 1.668 26.528 ( -5.032 6.592 -5.834) 10.140 26.620 ( -0.005 -4.420 -2.316) 4.990 26.891 ( 9.804 -7.391 5.017) 13.263 28.690 ( -0.004 -4.581 -0.432) 4.601 28.802 ( -1.237 -7.237 -4.800) 8.772 29.576 ( 2.631 8.785 -3.304) 9.748 29.681 ( 5.443 7.984 -9.640) 13.649 ======================= Grid point 62 (30/104) ======================= q-point: ( 0.17 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.674 ( -13.123 10.817 17.064) 24.091 1.356 ( 12.261 21.502 7.425) 25.842 2.104 ( -23.315 -15.734 -1.516) 28.168 2.202 ( -2.048 -8.830 6.426) 11.111 2.466 ( 5.762 -1.723 9.952) 11.628 2.555 ( 7.620 -9.751 -6.406) 13.935 2.682 ( -3.970 -6.578 -0.773) 7.722 2.791 ( -5.243 -9.657 3.903) 11.661 2.975 ( -0.889 5.862 3.638) 6.956 3.090 ( 5.751 4.429 3.668) 8.133 3.193 ( 3.245 3.701 4.203) 6.472 3.279 ( -0.539 4.427 0.605) 4.500 3.357 ( -3.289 4.211 4.629) 7.070 3.540 ( 0.897 0.241 -7.294) 7.353 3.628 ( -3.839 -4.344 1.385) 5.961 3.697 ( 6.433 5.446 1.167) 8.509 4.025 ( -10.063 -3.837 -4.918) 11.840 4.287 ( -3.964 -4.082 -0.362) 5.701 4.463 ( -9.684 3.009 -3.198) 10.633 4.592 ( 2.797 1.543 -2.649) 4.150 4.696 ( -1.800 -3.053 4.335) 5.599 4.921 ( 2.342 5.578 -0.332) 6.059 4.995 ( 3.976 3.593 -6.214) 8.206 5.087 ( -1.516 -4.834 0.382) 5.081 5.136 ( -0.790 2.348 6.044) 6.532 5.193 ( 1.492 0.701 -1.120) 1.993 5.231 ( -4.597 2.710 1.333) 5.500 5.362 ( -2.989 0.607 4.924) 5.792 5.402 ( -0.360 5.275 -0.100) 5.289 5.779 ( 2.924 2.192 2.054) 4.193 5.994 ( 3.193 1.241 0.927) 3.549 6.138 ( -1.361 -3.145 -3.667) 5.019 6.166 ( -1.540 2.180 -3.140) 4.121 6.261 ( 1.556 -3.226 -4.205) 5.523 6.444 ( 2.117 -1.740 2.043) 3.418 6.573 ( 3.596 -5.585 1.042) 6.724 6.702 ( -1.649 4.668 -1.897) 5.301 6.812 ( 2.570 3.901 2.467) 5.283 6.936 ( 2.092 4.737 3.651) 6.336 7.015 ( 2.868 -4.935 -1.069) 5.807 7.206 ( 0.557 2.314 -2.022) 3.123 7.312 ( -1.778 8.301 -9.073) 12.425 7.479 ( 7.662 3.569 4.396) 9.528 7.620 ( 3.716 -8.394 4.263) 10.121 7.667 ( -3.334 -0.104 -1.039) 3.493 7.801 ( -0.646 -1.779 -0.378) 1.930 7.976 ( -3.008 2.608 0.724) 4.046 8.297 ( 2.163 -3.461 2.695) 4.891 8.849 ( -1.365 3.821 -0.735) 4.124 9.088 ( 0.861 2.747 3.090) 4.224 9.259 ( -2.316 2.766 -10.541) 11.142 9.423 ( -0.385 -0.061 -6.943) 6.954 9.570 ( -2.096 3.497 0.242) 4.085 9.819 ( -2.860 1.847 0.796) 3.496 10.117 ( 1.794 -1.711 10.189) 10.487 10.247 ( -1.639 0.783 2.001) 2.703 10.400 ( -10.111 -2.941 1.830) 10.688 10.592 ( 0.120 1.811 -1.774) 2.538 10.854 ( 4.131 -5.587 3.024) 7.578 11.202 ( 6.797 0.812 -6.585) 9.498 11.309 ( -2.799 -22.902 -2.622) 23.221 11.615 ( -3.315 -0.165 -6.917) 7.672 11.878 ( -5.731 -3.092 -5.155) 8.305 12.116 ( -5.126 -6.988 -3.220) 9.245 12.679 ( -0.396 10.279 7.052) 12.472 12.982 ( 1.510 -2.234 0.256) 2.709 13.166 ( 0.556 5.410 -3.309) 6.366 13.525 ( -3.041 -2.723 -0.386) 4.100 13.584 ( -1.137 0.444 1.048) 1.609 13.727 ( 1.787 -3.881 6.131) 7.473 14.148 ( 13.954 5.988 8.356) 17.331 14.702 ( 7.530 -10.918 11.448) 17.520 14.842 ( -2.120 1.664 -4.702) 5.419 14.967 ( -12.290 3.556 -6.087) 14.169 15.292 ( -1.151 4.253 -3.271) 5.487 15.465 ( -5.105 -0.212 -2.621) 5.742 15.760 ( 1.267 1.658 1.131) 2.374 15.800 ( 1.921 -2.800 1.375) 3.663 16.002 ( 7.428 4.250 0.133) 8.559 16.121 ( 8.301 1.242 -1.603) 8.545 24.688 ( -0.355 1.241 1.323) 1.848 24.760 ( -0.625 1.425 2.551) 2.988 24.810 ( -0.140 -0.430 -0.694) 0.828 24.828 ( -1.204 0.455 4.173) 4.367 24.902 ( 0.231 0.846 1.190) 1.478 24.945 ( -3.099 1.039 3.784) 5.000 25.086 ( -1.754 -0.832 5.919) 6.229 25.192 ( 0.926 -1.542 1.494) 2.338 26.382 ( -3.307 7.766 -2.980) 8.951 26.490 ( -1.404 0.156 1.954) 2.411 26.622 ( 1.681 -5.425 -2.431) 6.178 27.069 ( 6.678 -15.604 1.216) 17.016 28.618 ( -7.275 -1.945 -2.342) 7.887 28.702 ( -4.068 -5.758 -1.662) 7.244 29.599 ( 3.262 11.166 -2.819) 11.970 29.809 ( 10.510 2.303 -8.540) 13.737 ======================= Grid point 63 (31/104) ======================= q-point: ( 0.33 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.775 ( 10.655 -13.670 25.575) 30.894 1.507 ( -22.378 -14.748 -1.226) 26.829 1.794 ( 12.370 7.380 5.349) 15.365 2.152 ( -4.847 -10.905 1.749) 12.061 2.405 ( -12.703 5.691 -7.197) 15.670 2.632 ( 4.469 -7.936 4.970) 10.376 2.722 ( -1.263 -11.296 1.522) 11.467 2.778 ( 4.393 -17.078 -6.284) 18.720 2.953 ( -4.199 3.481 10.250) 11.611 3.125 ( -5.476 10.104 -0.561) 11.506 3.209 ( 3.142 1.657 9.245) 9.904 3.301 ( -2.629 -1.440 1.392) 3.305 3.393 ( 4.139 -1.045 0.463) 4.294 3.520 ( 1.502 4.544 -0.638) 4.828 3.598 ( -0.203 -4.118 -4.910) 6.411 3.683 ( -1.294 2.000 -8.148) 8.489 4.011 ( 1.053 -1.506 12.199) 12.336 4.189 ( -11.078 5.386 1.717) 12.437 4.263 ( -4.947 1.797 2.424) 5.795 4.617 ( 3.039 3.485 -7.894) 9.149 4.673 ( -2.390 0.602 2.138) 3.263 4.923 ( -2.353 6.513 -0.746) 6.965 5.005 ( 2.054 3.835 -6.325) 7.676 5.067 ( -0.132 -2.733 -0.992) 2.910 5.181 ( 1.326 3.157 8.265) 8.946 5.210 ( 2.401 -0.215 1.322) 2.749 5.257 ( 2.280 1.617 1.623) 3.232 5.341 ( -2.317 0.113 5.265) 5.753 5.403 ( -0.826 7.741 2.121) 8.068 5.821 ( 1.429 2.230 2.323) 3.523 5.984 ( -3.742 1.309 -0.895) 4.064 6.084 ( -1.196 -1.184 -2.039) 2.644 6.165 ( 1.978 2.931 -2.137) 4.132 6.285 ( 2.042 -6.074 -1.445) 6.569 6.475 ( 1.032 2.282 -2.873) 3.811 6.653 ( -0.041 1.134 -0.632) 1.298 6.705 ( 6.586 -5.700 0.045) 8.710 6.852 ( 0.947 -1.101 -0.409) 1.508 6.948 ( -1.753 2.923 4.335) 5.515 7.147 ( 5.012 -0.145 1.312) 5.183 7.226 ( 2.625 8.280 -5.461) 10.261 7.292 ( 9.595 8.148 -2.725) 12.879 7.528 ( -1.801 1.175 -4.691) 5.160 7.587 ( -3.409 2.657 -3.617) 5.636 7.683 ( 3.579 -0.992 4.689) 5.982 7.756 ( -6.006 -4.811 -3.119) 8.303 8.007 ( 2.333 -7.594 4.811) 9.288 8.255 ( -5.192 -9.315 -3.336) 11.174 8.813 ( -1.813 5.137 1.280) 5.596 9.141 ( -0.166 3.130 -10.434) 10.895 9.186 ( 4.139 6.773 4.636) 9.193 9.368 ( -0.808 0.288 -6.700) 6.755 9.542 ( -1.415 -0.657 0.619) 1.678 9.795 ( -1.915 -0.585 5.347) 5.709 10.140 ( -1.981 -2.906 0.831) 3.613 10.172 ( -8.356 -3.133 2.227) 9.198 10.296 ( -4.514 4.864 7.240) 9.821 10.616 ( 2.226 4.773 1.060) 5.372 10.829 ( -4.235 3.630 1.901) 5.893 11.229 ( -1.968 -17.027 2.020) 17.259 11.423 ( 13.106 -15.831 -4.936) 21.136 11.601 ( 3.764 -7.622 -0.950) 8.554 11.771 ( -2.734 -4.933 -6.130) 8.330 11.953 ( -6.528 -3.097 -2.005) 7.499 12.741 ( 1.229 8.433 4.072) 9.445 12.972 ( -2.446 -1.208 -0.094) 2.730 13.158 ( 0.226 6.630 -2.517) 7.096 13.438 ( -5.193 -0.430 -4.741) 7.045 13.587 ( 2.222 3.725 -0.462) 4.362 13.783 ( 0.167 -1.584 6.971) 7.151 14.438 ( 11.405 3.867 7.323) 14.095 14.635 ( -11.434 3.687 -7.206) 14.009 14.797 ( -0.150 -2.705 -5.509) 6.139 14.926 ( 2.856 -7.402 8.009) 11.274 15.260 ( -0.096 0.645 -3.621) 3.679 15.371 ( -3.406 -1.817 0.332) 3.875 15.754 ( -0.927 1.927 0.942) 2.337 15.877 ( 3.486 -1.694 0.507) 3.909 16.141 ( 7.487 6.960 -0.110) 10.223 16.209 ( 2.974 4.657 -3.988) 6.814 24.682 ( -0.538 1.689 -0.129) 1.777 24.767 ( -1.477 1.867 4.355) 4.963 24.792 ( -0.515 -0.832 -0.375) 1.048 24.859 ( 0.988 0.980 5.351) 5.529 24.909 ( -2.176 1.235 5.126) 5.705 24.925 ( 0.264 2.433 -1.898) 3.097 25.103 ( -1.003 -0.594 7.845) 7.932 25.214 ( 0.847 -2.058 0.154) 2.231 26.344 ( 0.274 7.588 -1.211) 7.689 26.458 ( -2.942 -1.167 1.074) 3.342 26.648 ( 2.378 -6.438 -1.539) 7.033 27.135 ( 1.646 -15.978 -3.727) 16.490 28.489 ( -4.377 -0.519 -0.798) 4.480 28.637 ( -2.735 -6.466 -0.248) 7.025 29.641 ( 2.906 11.772 -3.840) 12.719 29.906 ( 5.881 0.401 -7.775) 9.757 ======================= Grid point 64 (32/104) ======================= q-point: (-0.50 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.975 ( -29.780 -18.450 6.338) 35.601 1.243 ( 22.610 -22.516 15.531) 35.488 2.002 ( -15.632 3.832 -3.577) 16.488 2.156 ( 17.209 10.165 1.734) 20.062 2.180 ( -3.005 0.005 2.144) 3.692 2.628 ( -4.859 -10.528 -5.563) 12.861 2.744 ( 5.826 -15.549 -0.466) 16.611 2.782 ( -3.908 3.474 10.356) 11.601 3.001 ( 2.808 -3.382 -0.245) 4.403 3.046 ( -1.722 6.992 -1.602) 7.377 3.175 ( -5.787 -8.113 2.970) 10.399 3.321 ( -7.045 1.922 0.131) 7.304 3.396 ( 0.743 2.505 -0.603) 2.682 3.474 ( -4.017 -0.783 -4.409) 6.016 3.605 ( 4.510 -1.022 -5.035) 6.836 3.681 ( 1.627 1.107 0.431) 2.015 4.035 ( -0.907 5.309 8.631) 10.173 4.144 ( 3.022 1.364 4.864) 5.886 4.256 ( -1.003 0.618 9.558) 9.631 4.587 ( -1.767 4.365 -5.895) 7.545 4.656 ( 1.204 0.096 -4.994) 5.138 4.865 ( -1.927 8.093 -1.532) 8.459 4.986 ( 0.415 -1.272 -3.803) 4.031 5.104 ( 4.754 4.510 -3.607) 7.480 5.208 ( -1.197 -1.561 1.041) 2.225 5.267 ( -1.115 -5.071 4.777) 7.055 5.314 ( -1.071 3.629 9.266) 10.009 5.341 ( -0.231 0.492 5.161) 5.189 5.415 ( 1.165 10.894 3.691) 11.561 5.884 ( 0.987 4.686 4.798) 6.779 5.912 ( -0.660 -4.691 1.269) 4.904 6.060 ( 0.463 0.797 -4.761) 4.849 6.212 ( 3.435 4.245 2.098) 5.850 6.303 ( 1.488 -5.098 -1.750) 5.592 6.458 ( -0.975 3.228 -3.894) 5.151 6.646 ( -0.541 0.284 -0.501) 0.790 6.775 ( 1.427 -6.612 -3.904) 7.810 6.853 ( 0.141 -2.903 -2.362) 3.745 6.904 ( -6.045 1.024 3.815) 7.221 7.202 ( -1.165 1.759 1.735) 2.732 7.230 ( 2.635 4.455 -5.609) 7.632 7.411 ( -6.816 3.029 -6.536) 9.917 7.491 ( 0.689 1.939 -2.876) 3.536 7.542 ( 7.429 5.302 1.445) 9.241 7.669 ( 5.019 2.246 -1.705) 5.757 7.813 ( 4.076 -0.579 5.058) 6.521 7.925 ( -10.877 -7.497 -2.415) 13.429 8.209 ( 2.270 -12.551 -2.100) 12.926 8.809 ( -0.043 5.474 2.872) 6.182 9.101 ( 0.897 4.238 -6.860) 8.113 9.251 ( 0.334 5.024 -1.818) 5.353 9.361 ( 3.249 -0.050 0.690) 3.322 9.523 ( 0.159 -2.819 -2.296) 3.639 9.805 ( -0.719 -0.431 4.864) 4.935 10.057 ( -2.217 -3.145 -2.543) 4.613 10.096 ( -5.673 -4.879 0.920) 7.539 10.277 ( -0.008 7.277 6.273) 9.608 10.624 ( -0.884 4.743 -1.525) 5.060 10.840 ( 1.743 3.466 8.685) 9.513 11.261 ( 2.165 -19.921 7.969) 21.565 11.526 ( 2.078 -4.009 -5.256) 6.929 11.585 ( -5.895 -17.066 -11.106) 21.198 11.755 ( 7.024 0.653 3.590) 7.915 12.000 ( 7.085 -3.507 7.287) 10.752 12.718 ( -4.823 7.355 -2.086) 9.039 12.913 ( -2.285 -1.668 -3.332) 4.371 13.142 ( 0.391 6.273 -3.950) 7.423 13.335 ( -0.902 0.122 -6.726) 6.787 13.635 ( 2.888 4.283 -0.348) 5.177 13.813 ( -2.195 -1.342 8.115) 8.513 14.379 ( -10.336 0.912 -8.607) 13.482 14.615 ( 1.115 -4.273 -0.537) 4.448 14.780 ( 3.733 1.944 0.064) 4.210 14.987 ( -0.314 -4.147 5.341) 6.769 15.267 ( 3.274 0.339 -1.098) 3.470 15.357 ( 0.234 0.690 2.040) 2.166 15.725 ( -2.356 3.211 -1.868) 4.399 15.918 ( 0.935 -1.788 -0.267) 2.035 16.188 ( -2.862 5.103 -2.119) 6.223 16.247 ( 4.163 6.641 -1.387) 7.960 24.676 ( 0.107 1.559 -0.067) 1.565 24.748 ( -2.692 1.973 3.130) 4.576 24.798 ( 0.907 -0.192 -0.386) 1.005 24.889 ( -3.156 1.455 4.517) 5.699 24.923 ( 1.595 -1.366 3.642) 4.204 24.925 ( 0.582 3.291 2.660) 4.271 25.136 ( -1.654 -1.083 9.757) 9.955 25.219 ( -0.464 -2.422 -0.102) 2.468 26.366 ( 2.162 7.579 0.377) 7.890 26.414 ( -1.641 -0.711 -0.261) 1.808 26.675 ( 0.951 -6.735 -0.555) 6.825 27.092 ( -1.924 -12.887 -8.268) 15.432 28.461 ( 0.969 -1.357 0.866) 1.879 28.610 ( 0.192 -6.747 -0.102) 6.750 29.641 ( 0.176 11.936 -5.341) 13.078 29.937 ( 2.803 -0.391 -7.515) 8.030 ======================= Grid point 65 (33/104) ======================= q-point: (-0.33 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.643 ( -12.656 -0.761 23.355) 26.575 1.625 ( -9.833 15.886 -5.777) 19.556 1.751 ( 15.399 -18.155 5.422) 24.416 2.247 ( 1.278 -1.360 10.528) 10.693 2.330 ( -2.247 6.020 2.986) 7.086 2.543 ( 2.701 -3.880 -4.895) 6.805 2.741 ( -5.355 8.522 8.647) 13.269 2.872 ( 6.295 -7.660 -2.388) 10.198 2.921 ( -5.608 0.723 4.406) 7.168 3.069 ( 0.035 -1.371 -6.788) 6.926 3.122 ( -2.839 -4.429 -2.226) 5.712 3.214 ( 0.494 1.511 0.952) 1.853 3.297 ( -4.261 -0.908 -2.346) 4.948 3.466 ( 0.497 2.759 -0.020) 2.803 3.625 ( 1.315 2.754 -6.486) 7.168 3.726 ( 2.056 -2.381 0.656) 3.213 4.114 ( 5.130 -3.114 8.547) 10.443 4.259 ( 5.052 3.319 2.963) 6.732 4.375 ( 7.129 -1.942 9.109) 11.729 4.538 ( 0.406 2.589 -2.271) 3.468 4.606 ( -2.135 -3.918 -8.287) 9.412 4.853 ( 0.560 8.495 -0.849) 8.556 4.991 ( 2.789 -0.143 -4.821) 5.572 5.122 ( -2.973 -5.225 -1.360) 6.163 5.198 ( 2.456 2.973 -3.631) 5.297 5.266 ( -2.587 -4.627 8.387) 9.921 5.274 ( -4.750 3.564 3.767) 7.032 5.403 ( -0.159 1.986 9.006) 9.224 5.468 ( 1.077 7.861 4.162) 8.960 5.871 ( -1.619 0.241 5.526) 5.763 6.017 ( 1.185 1.652 -1.422) 2.481 6.040 ( 4.051 -2.870 -1.131) 5.092 6.285 ( -1.312 8.613 3.190) 9.278 6.332 ( 2.757 -0.113 -1.780) 3.284 6.402 ( 1.820 -2.858 0.088) 3.390 6.637 ( -0.760 -1.006 -1.728) 2.139 6.697 ( -6.024 -6.782 -3.797) 9.834 6.789 ( -4.654 -5.380 -1.457) 7.261 6.842 ( -2.504 2.270 -0.583) 3.430 7.091 ( -6.276 -3.277 -8.024) 10.701 7.155 ( -6.182 -1.193 -1.890) 6.573 7.359 ( 1.435 1.423 0.018) 2.021 7.496 ( 1.876 4.555 -2.531) 5.538 7.637 ( -9.545 -3.039 -1.161) 10.085 7.690 ( 4.678 6.223 0.119) 7.786 7.852 ( 7.541 4.338 5.782) 10.446 7.918 ( 1.673 0.759 3.758) 4.183 8.218 ( -0.594 -6.076 -4.091) 7.349 8.851 ( 2.265 4.461 2.665) 5.669 9.047 ( -2.293 4.222 -2.759) 5.540 9.251 ( 3.541 5.200 -7.344) 9.670 9.434 ( 2.856 -1.500 2.078) 3.837 9.523 ( 0.942 -2.954 -2.309) 3.865 9.836 ( 2.545 -1.519 0.175) 2.969 9.971 ( -4.489 -2.717 -1.588) 5.482 10.074 ( 3.702 -5.662 -2.040) 7.065 10.361 ( 3.331 6.106 6.192) 9.312 10.619 ( 1.734 2.077 -1.411) 3.051 10.948 ( 1.837 -0.133 11.525) 11.671 11.336 ( -6.701 -14.304 -5.677) 16.785 11.386 ( 1.285 -8.568 3.407) 9.310 11.578 ( 6.256 -2.380 -2.344) 7.092 11.939 ( 7.689 0.671 7.354) 10.661 12.125 ( 0.260 -0.419 2.062) 2.120 12.586 ( -5.882 8.464 -1.577) 10.426 12.888 ( 3.528 -6.265 -5.355) 8.965 13.131 ( 1.984 5.586 -4.649) 7.533 13.334 ( 5.415 -2.542 -9.390) 11.133 13.665 ( -0.559 2.091 0.990) 2.380 13.802 ( -4.646 -3.199 8.874) 10.515 14.137 ( -11.746 0.227 -5.482) 12.964 14.511 ( -5.991 -10.339 -7.333) 14.020 14.924 ( 6.567 4.550 5.758) 9.848 15.008 ( 0.588 0.453 3.908) 3.978 15.363 ( 4.967 4.714 1.692) 7.054 15.382 ( 3.149 2.457 1.000) 4.118 15.649 ( -3.314 4.049 -4.911) 7.176 15.914 ( -0.417 -1.973 -1.524) 2.527 16.084 ( -7.867 3.004 -0.757) 8.455 16.257 ( -2.518 2.532 -1.196) 3.766 24.684 ( 0.152 0.838 1.058) 1.358 24.723 ( -1.335 2.102 1.891) 3.127 24.810 ( 0.709 -0.857 -0.920) 1.443 24.856 ( -2.867 2.410 3.562) 5.169 24.926 ( 0.519 1.560 -1.737) 2.392 25.002 ( 0.516 -2.870 10.934) 11.316 25.150 ( -3.851 -2.273 10.044) 10.995 25.195 ( -2.277 -2.824 0.410) 3.651 26.395 ( 1.036 2.518 0.561) 2.780 26.445 ( 4.591 5.978 2.084) 7.820 26.669 ( -1.141 -5.499 -0.515) 5.640 26.976 ( -4.410 -9.054 -10.974) 14.895 28.526 ( 5.577 -1.414 0.450) 5.771 28.646 ( 3.761 -6.735 0.157) 7.716 29.592 ( -1.360 11.913 -5.729) 13.289 29.905 ( -1.013 -1.016 -9.274) 9.384 ======================= Grid point 66 (34/104) ======================= q-point: (-0.17 0.29 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.729 ( 4.730 15.723 5.828) 17.423 1.418 ( -6.352 28.910 4.450) 29.933 2.010 ( -22.380 10.530 24.230) 34.624 2.109 ( 14.912 -15.936 0.974) 21.846 2.482 ( 7.700 -1.618 -0.131) 7.870 2.641 ( 9.120 0.327 -3.295) 9.703 2.711 ( -3.201 -8.955 -1.029) 9.565 2.822 ( -2.981 0.203 4.766) 5.625 2.913 ( -5.447 2.042 -9.183) 10.870 2.983 ( 0.178 0.467 3.079) 3.120 3.126 ( -2.284 -3.174 -4.337) 5.840 3.187 ( 4.188 4.755 2.527) 6.822 3.339 ( 0.658 2.250 8.190) 8.519 3.477 ( 1.918 2.802 -2.207) 4.050 3.605 ( 1.804 4.855 -7.023) 8.727 3.734 ( -1.472 -5.845 2.052) 6.367 4.310 ( 7.809 -5.088 3.728) 10.038 4.386 ( 7.917 8.134 0.132) 11.351 4.478 ( -0.610 -4.417 -7.053) 8.344 4.520 ( 0.735 -6.369 2.638) 6.933 4.603 ( 3.434 -4.441 4.045) 6.919 4.851 ( 1.418 4.871 -3.655) 6.253 4.990 ( -1.301 -0.482 -6.162) 6.316 5.070 ( 1.928 -6.705 -2.804) 7.519 5.178 ( -3.211 -3.440 1.068) 4.825 5.207 ( -3.481 4.829 1.730) 6.199 5.315 ( 1.829 5.402 4.543) 7.292 5.428 ( -3.830 0.280 9.202) 9.971 5.501 ( 0.123 4.251 2.650) 5.011 5.872 ( -6.566 -2.234 3.154) 7.619 5.885 ( -7.195 4.470 0.391) 8.479 6.109 ( 3.134 0.731 -3.956) 5.100 6.284 ( 2.573 -1.014 -1.044) 2.956 6.352 ( -2.139 -1.472 -0.484) 2.641 6.473 ( -2.905 -0.192 -2.427) 3.790 6.562 ( 1.739 -3.037 -2.707) 4.424 6.692 ( 3.106 -0.823 -2.283) 3.942 6.752 ( 5.416 -6.074 11.234) 13.872 6.788 ( -3.149 -1.290 0.899) 3.520 6.949 ( -2.422 1.655 -8.731) 9.210 7.102 ( -0.148 -4.749 0.666) 4.798 7.356 ( -6.171 -7.801 4.343) 10.854 7.383 ( -6.153 3.958 0.724) 7.352 7.539 ( -2.125 3.277 -1.519) 4.191 7.804 ( 4.060 7.714 0.940) 8.768 7.915 ( -2.128 3.502 -1.036) 4.226 8.008 ( 4.408 6.698 5.980) 10.003 8.137 ( -3.402 2.581 -4.229) 6.010 8.860 ( -1.591 2.881 0.522) 3.332 9.093 ( 5.957 4.457 2.298) 7.787 9.256 ( 1.721 -0.777 -7.403) 7.640 9.494 ( 3.893 3.822 -0.092) 5.456 9.515 ( -0.308 -3.693 -2.382) 4.405 9.880 ( 3.460 -3.347 -5.217) 7.099 9.930 ( 0.138 -0.574 0.848) 1.033 10.195 ( 10.558 -8.837 0.085) 13.769 10.416 ( -0.764 5.328 0.663) 5.423 10.650 ( 1.329 -0.067 0.352) 1.376 10.913 ( -11.237 -5.699 1.514) 12.690 11.216 ( -0.944 -0.055 -1.062) 1.422 11.489 ( 4.463 -7.574 0.313) 8.797 11.721 ( 7.959 2.301 -1.316) 8.388 12.011 ( -2.904 -0.403 -0.651) 3.003 12.097 ( -0.218 -2.926 2.485) 3.845 12.545 ( 1.874 10.639 0.634) 10.822 12.980 ( 7.684 -8.374 -4.359) 12.172 13.199 ( 8.687 1.948 0.798) 8.938 13.353 ( -0.566 -1.697 -9.822) 9.984 13.612 ( -4.199 -2.871 2.794) 5.803 13.754 ( -7.097 -6.112 9.048) 13.022 13.940 ( -6.573 3.457 1.061) 7.502 14.391 ( -2.097 -9.400 -2.092) 9.855 14.997 ( -1.314 2.423 2.669) 3.837 15.083 ( 3.672 2.107 2.776) 5.063 15.442 ( 6.178 8.745 2.602) 11.019 15.494 ( 3.026 7.771 -2.511) 8.710 15.598 ( 4.383 -0.005 -4.331) 6.162 15.884 ( -7.151 0.068 -6.946) 9.969 15.899 ( -5.493 0.086 2.823) 6.176 16.148 ( -8.970 -2.696 1.964) 9.570 24.682 ( -1.117 1.433 2.239) 2.883 24.735 ( 0.950 0.371 1.829) 2.094 24.804 ( -0.120 -0.736 -1.846) 1.991 24.840 ( -1.285 2.401 2.815) 3.917 24.921 ( 0.085 0.779 -1.500) 1.693 25.061 ( -2.465 -5.457 11.748) 13.186 25.105 ( -6.854 -3.257 7.436) 10.625 25.162 ( -1.257 -2.136 1.731) 3.024 26.432 ( 2.008 1.122 1.155) 2.574 26.570 ( 5.500 3.527 2.134) 6.873 26.645 ( -0.551 -3.158 0.254) 3.215 26.814 ( -4.719 -2.321 -8.527) 10.018 28.641 ( 5.776 -3.414 -0.759) 6.752 28.743 ( 6.999 -6.302 -1.006) 9.472 29.548 ( 1.000 11.306 -4.995) 12.400 29.782 ( -5.097 2.085 -11.031) 12.329 ======================= Grid point 67 (35/104) ======================= q-point: ( 0.00 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( 7.198 28.234 -14.858) 32.707 1.688 ( -5.014 6.868 2.216) 8.788 1.940 ( 1.827 -14.844 -7.257) 16.624 2.143 ( -12.884 -12.645 5.836) 18.972 2.287 ( -1.688 9.601 14.367) 17.362 2.463 ( -1.168 -1.279 -7.539) 7.736 2.608 ( -3.661 -9.517 5.480) 11.576 2.628 ( -3.754 -9.231 -6.552) 11.926 2.997 ( 4.983 3.568 -1.073) 6.222 3.048 ( 6.379 -0.516 -0.826) 6.453 3.236 ( -0.159 8.202 9.674) 12.684 3.346 ( -2.070 -1.922 8.564) 9.017 3.451 ( 2.990 3.457 5.787) 7.374 3.535 ( 1.466 -4.192 2.302) 5.003 3.725 ( -6.288 18.493 -1.415) 19.584 3.906 ( 1.665 18.290 -3.805) 18.756 4.135 ( -8.927 -16.156 -4.281) 18.948 4.243 ( -1.787 -12.622 -6.978) 14.532 4.418 ( 5.013 1.379 5.869) 7.841 4.525 ( 1.823 -8.337 7.027) 11.054 4.663 ( 1.384 6.494 -0.011) 6.640 4.808 ( 0.618 -7.947 -2.527) 8.362 4.956 ( 6.682 2.471 -3.554) 7.961 5.017 ( 3.825 -3.710 -5.109) 7.383 5.182 ( -0.786 2.446 3.729) 4.528 5.214 ( -0.896 -0.048 1.695) 1.918 5.407 ( -6.302 3.470 1.282) 7.307 5.460 ( -4.170 -1.438 0.465) 4.435 5.554 ( -3.022 10.765 1.132) 11.238 5.702 ( -1.513 -4.610 1.401) 5.050 5.944 ( 1.104 5.281 4.300) 6.899 6.077 ( 0.157 -7.076 -1.350) 7.205 6.239 ( 1.462 0.908 -4.665) 4.973 6.268 ( 0.201 -1.475 -5.132) 5.343 6.391 ( -2.764 0.160 -1.460) 3.130 6.455 ( -1.698 -5.367 -1.614) 5.856 6.760 ( 2.059 4.358 0.755) 4.879 6.820 ( 3.700 -0.249 2.442) 4.441 6.898 ( 1.508 2.400 7.606) 8.117 7.004 ( 1.665 -7.371 8.637) 11.476 7.104 ( 7.453 5.470 0.978) 9.297 7.207 ( 2.873 -5.427 7.813) 9.937 7.433 ( -0.409 4.842 -1.402) 5.058 7.500 ( -0.301 -1.287 -5.435) 5.593 7.881 ( -4.487 1.679 -2.473) 5.392 7.884 ( -3.308 1.311 -3.867) 5.255 8.140 ( -2.439 5.940 -3.152) 7.153 8.212 ( 1.222 -1.048 -1.032) 1.912 8.955 ( 0.845 7.334 0.815) 7.427 9.104 ( -0.956 -7.045 -1.132) 7.199 9.262 ( 1.320 5.673 0.095) 5.826 9.401 ( -0.163 -6.649 -1.364) 6.789 9.748 ( 2.121 8.663 -4.901) 10.176 9.847 ( 2.196 -2.144 -6.783) 7.445 9.964 ( 5.064 2.096 8.946) 10.491 10.138 ( 6.321 -13.591 9.388) 17.686 10.533 ( -3.165 9.854 -6.613) 12.282 10.626 ( -1.594 -1.914 -3.023) 3.917 10.738 ( -5.364 5.253 0.119) 7.509 10.981 ( -3.974 -16.773 -4.261) 17.757 11.526 ( -6.583 12.886 -6.380) 15.814 11.790 ( -10.298 -11.536 -5.996) 16.585 11.884 ( 3.612 2.644 -2.115) 4.951 11.977 ( 0.993 -4.706 0.948) 4.902 12.823 ( 5.261 6.899 0.593) 8.697 12.913 ( 1.800 -3.418 -1.861) 4.288 13.285 ( -0.914 6.176 -0.167) 6.246 13.407 ( 6.895 -5.421 4.972) 10.082 13.545 ( -3.395 -0.986 4.395) 5.640 13.574 ( 0.472 -3.786 3.795) 5.382 14.085 ( 5.373 9.369 4.887) 11.854 14.271 ( 6.646 -10.139 6.664) 13.834 15.013 ( -4.205 4.545 -1.568) 6.387 15.093 ( -2.759 -3.589 0.152) 4.530 15.536 ( -4.704 4.793 -8.537) 10.862 15.596 ( -1.579 -1.649 -8.097) 8.413 15.711 ( -0.548 6.226 0.276) 6.256 15.816 ( -5.007 -4.062 0.650) 6.480 15.885 ( 8.611 3.162 4.113) 10.053 15.956 ( 2.487 -3.965 5.147) 6.957 24.713 ( -0.073 1.899 1.398) 2.359 24.751 ( 0.565 -1.720 1.415) 2.298 24.804 ( 0.213 1.705 -0.488) 1.786 24.841 ( -1.110 -1.313 1.296) 2.153 24.921 ( -1.681 1.568 3.272) 3.999 24.958 ( -3.534 -1.992 5.684) 6.983 25.088 ( -0.700 1.675 3.330) 3.793 25.129 ( 0.109 -2.301 2.372) 3.307 26.480 ( -0.381 1.991 0.211) 2.038 26.537 ( -0.303 -3.873 -1.171) 4.057 26.653 ( -1.925 6.324 -3.940) 7.695 26.770 ( 2.734 -6.073 -0.579) 6.685 28.644 ( -0.064 -0.144 -0.684) 0.702 28.686 ( -0.520 -4.445 -1.833) 4.836 29.709 ( 2.937 4.934 -3.871) 6.925 29.754 ( 3.324 0.412 -5.558) 6.489 ======================= Grid point 68 (36/104) ======================= q-point: ( 0.17 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( -21.479 27.378 -0.831) 34.808 1.622 ( -23.779 -29.400 -3.439) 37.969 1.785 ( 10.648 22.919 1.465) 25.314 2.195 ( 3.655 -12.753 -4.294) 13.944 2.235 ( 1.011 -0.857 -2.607) 2.925 2.421 ( -2.963 -9.699 -6.337) 11.958 2.541 ( 1.360 -1.491 2.066) 2.888 2.619 ( -2.066 -7.040 4.815) 8.776 3.050 ( -1.820 4.195 4.674) 6.539 3.121 ( 0.478 -2.336 2.327) 3.332 3.308 ( 2.084 3.825 4.677) 6.391 3.340 ( -3.334 0.346 5.172) 6.163 3.514 ( -0.239 1.989 -0.752) 2.139 3.543 ( 0.518 -2.636 -1.083) 2.896 3.595 ( -5.322 15.750 3.551) 17.000 3.881 ( -11.806 -11.218 -3.287) 16.614 3.955 ( 3.762 15.161 0.637) 15.634 4.191 ( -0.698 -7.962 -2.069) 8.256 4.540 ( 4.013 -0.291 4.666) 6.161 4.578 ( -0.227 -2.604 0.137) 2.617 4.620 ( -5.089 5.923 3.952) 8.752 4.843 ( 0.814 -12.208 1.632) 12.343 5.028 ( 1.722 1.387 -1.099) 2.469 5.038 ( 0.636 -0.080 -0.758) 0.993 5.190 ( 0.624 1.951 3.367) 3.941 5.201 ( -0.972 0.575 0.833) 1.404 5.318 ( -1.846 4.919 -0.762) 5.309 5.392 ( -1.025 -1.515 -0.280) 1.851 5.563 ( 1.657 12.119 -0.427) 12.239 5.756 ( 3.896 -6.033 -0.895) 7.237 6.009 ( 2.269 0.893 4.719) 5.312 6.055 ( -1.548 -4.054 1.145) 4.488 6.212 ( -0.313 2.175 -7.729) 8.036 6.232 ( 0.086 -0.384 -6.441) 6.453 6.415 ( 4.973 -0.331 1.776) 5.291 6.462 ( 3.191 -5.071 0.387) 6.004 6.796 ( -0.689 4.340 0.147) 4.396 6.853 ( -0.616 -1.210 -0.050) 1.359 6.974 ( 4.365 3.074 8.711) 10.217 7.016 ( -1.486 0.505 7.586) 7.747 7.260 ( 6.592 4.121 0.641) 7.801 7.392 ( 7.960 -9.310 5.070) 13.257 7.432 ( 1.414 4.412 -3.741) 5.955 7.504 ( 3.191 -1.973 -3.198) 4.930 7.758 ( -5.774 4.707 -4.296) 8.600 7.800 ( -3.009 0.068 -1.877) 3.548 8.048 ( -5.242 5.448 -2.860) 8.083 8.183 ( -3.580 -7.771 -1.478) 8.683 8.966 ( -0.518 7.715 -0.450) 7.745 9.099 ( 0.785 -4.422 -0.011) 4.492 9.287 ( 1.335 5.228 1.011) 5.489 9.409 ( 2.251 -4.513 -1.412) 5.238 9.669 ( -5.125 6.776 -8.092) 11.732 9.789 ( -3.417 -4.782 -6.603) 8.840 10.113 ( -0.007 2.428 12.063) 12.305 10.203 ( -5.211 -5.526 7.245) 10.496 10.460 ( -0.934 9.531 -1.718) 9.730 10.636 ( 7.339 -2.067 -4.401) 8.803 10.706 ( 0.905 -2.093 3.422) 4.112 10.900 ( -3.180 -17.095 -0.608) 17.399 11.354 ( -5.322 11.123 -7.375) 14.368 11.560 ( -8.249 -8.186 -6.414) 13.273 11.853 ( -2.731 2.557 -6.012) 7.081 11.960 ( -3.595 -7.784 -4.282) 9.584 12.864 ( -0.443 7.759 5.205) 9.354 12.956 ( 0.973 -2.166 3.020) 3.841 13.291 ( 1.072 7.530 -1.153) 7.693 13.432 ( -1.123 -6.762 -1.121) 6.946 13.599 ( 2.676 1.592 2.780) 4.174 13.650 ( 4.159 -3.717 4.367) 7.084 14.297 ( 11.264 9.453 10.123) 17.853 14.493 ( 9.301 -10.877 11.695) 18.482 14.903 ( -5.226 4.116 -4.803) 8.205 14.973 ( -8.379 -2.467 -5.653) 10.404 15.370 ( -5.696 3.931 -6.820) 9.717 15.436 ( -7.263 -2.776 -6.194) 9.941 15.773 ( 2.779 -0.285 2.238) 3.580 15.774 ( 0.449 -0.001 2.078) 2.126 16.077 ( 9.813 3.371 1.400) 10.470 16.122 ( 10.461 -1.181 0.014) 10.527 24.721 ( -0.032 2.160 1.028) 2.392 24.765 ( -0.257 -2.218 1.800) 2.868 24.805 ( -0.002 2.097 0.265) 2.114 24.838 ( 0.202 -0.725 0.811) 1.106 24.923 ( -0.671 1.172 4.218) 4.429 24.943 ( -1.671 -0.928 4.636) 5.014 25.100 ( -0.412 2.191 3.638) 4.267 25.150 ( 0.520 -2.691 1.901) 3.336 26.459 ( -1.683 1.914 -0.104) 2.551 26.511 ( -1.522 -3.124 -2.219) 4.123 26.613 ( 0.119 8.672 -2.401) 8.999 26.814 ( 2.758 -11.869 -1.647) 12.296 28.592 ( -4.893 -0.267 -1.086) 5.019 28.617 ( -4.495 -2.956 -1.135) 5.498 29.760 ( 4.689 5.817 -3.402) 8.210 29.824 ( 6.530 -1.105 -5.054) 8.331 ======================= Grid point 69 (37/104) ======================= q-point: ( 0.33 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.726 ( -15.498 11.275 16.072) 25.012 1.101 ( -30.092 -23.911 3.441) 38.589 2.037 ( 5.814 10.305 -2.302) 12.054 2.116 ( 7.628 10.919 1.540) 13.408 2.300 ( -2.899 -16.038 -5.326) 17.146 2.448 ( 13.646 -14.769 -3.629) 20.433 2.538 ( -5.997 0.234 -0.886) 6.067 2.589 ( -1.397 -3.747 -0.722) 4.064 3.000 ( -6.929 4.126 7.922) 11.305 3.104 ( -4.931 -5.843 5.169) 9.229 3.303 ( -1.170 1.984 -1.571) 2.788 3.343 ( 0.484 -1.809 -0.628) 1.975 3.418 ( -2.031 8.682 -4.939) 10.193 3.529 ( -1.616 -3.484 -9.061) 9.841 3.627 ( 0.360 6.268 9.676) 11.534 3.734 ( -3.531 -2.310 4.522) 6.185 4.047 ( 2.374 7.363 5.870) 9.711 4.187 ( 0.211 -4.372 1.588) 4.656 4.473 ( -7.459 16.297 0.982) 17.950 4.606 ( 1.202 -0.854 1.181) 1.890 4.624 ( -0.229 -4.183 4.534) 6.173 4.824 ( -3.160 -16.155 1.789) 16.558 5.020 ( -1.682 1.161 0.258) 2.060 5.039 ( -0.292 -0.235 1.875) 1.912 5.207 ( 0.980 2.601 -1.716) 3.266 5.257 ( 3.638 -0.887 -0.041) 3.745 5.318 ( 1.620 7.155 2.253) 7.674 5.403 ( 1.055 -0.009 1.510) 1.842 5.583 ( 1.272 11.535 -1.517) 11.703 5.781 ( 0.703 -7.112 -1.518) 7.306 6.020 ( -4.303 2.094 3.015) 5.657 6.062 ( -0.456 -1.709 1.289) 2.189 6.192 ( 2.693 0.783 -4.406) 5.223 6.208 ( 2.419 -1.811 -2.677) 4.037 6.512 ( 4.066 1.798 -0.900) 4.536 6.567 ( 6.959 -4.708 -1.003) 8.461 6.738 ( -3.807 4.435 -0.380) 5.857 6.813 ( -2.611 -3.119 -0.983) 4.184 7.052 ( -0.248 6.322 5.344) 8.282 7.137 ( 4.739 -1.725 6.422) 8.166 7.378 ( 4.383 7.345 -4.318) 9.582 7.436 ( 7.481 5.533 -0.901) 9.348 7.490 ( -0.783 -4.980 -6.336) 8.097 7.536 ( 4.105 -5.245 -1.892) 6.924 7.681 ( -1.215 2.987 1.235) 3.453 7.741 ( -1.759 -0.931 -1.392) 2.429 7.944 ( -4.721 1.667 0.600) 5.042 8.064 ( -8.444 -9.688 -2.035) 13.012 8.942 ( -1.448 7.914 0.577) 8.066 9.087 ( -1.294 -6.527 -1.419) 6.804 9.344 ( 2.912 7.938 1.920) 8.670 9.432 ( 2.517 1.637 -8.496) 9.011 9.541 ( -3.436 3.723 -3.375) 6.087 9.700 ( -1.730 -8.860 -1.784) 9.202 10.091 ( -4.546 -1.062 1.959) 5.063 10.113 ( -6.630 -2.882 1.466) 7.376 10.474 ( -2.265 13.917 9.347) 16.917 10.718 ( 3.336 5.302 0.113) 6.265 10.804 ( 1.084 -15.572 9.189) 18.113 10.855 ( -1.937 -8.263 2.062) 8.734 11.303 ( 5.260 2.562 -6.599) 8.819 11.443 ( -1.002 -9.384 -5.560) 10.954 11.775 ( -1.246 3.406 -3.557) 5.080 11.862 ( -2.532 -5.353 -1.516) 6.112 12.880 ( -1.006 5.757 1.784) 6.110 12.952 ( -2.321 -1.892 0.631) 3.061 13.289 ( -0.584 6.581 -1.561) 6.789 13.392 ( -2.480 -4.128 -2.820) 5.581 13.663 ( 3.279 4.160 1.070) 5.403 13.736 ( 2.431 -3.323 3.948) 5.704 14.524 ( 5.119 5.415 5.908) 9.510 14.623 ( -4.550 -4.093 1.074) 6.214 14.793 ( -2.065 1.162 -4.965) 5.501 14.830 ( 0.508 -3.020 1.254) 3.310 15.277 ( -1.084 1.677 -3.771) 4.267 15.324 ( -1.803 -2.901 -1.548) 3.750 15.793 ( 0.408 2.234 1.533) 2.740 15.838 ( 2.143 -2.333 1.436) 3.478 16.238 ( 6.946 3.520 -0.861) 7.835 16.267 ( 6.290 0.749 -3.192) 7.093 24.721 ( -0.254 2.280 -0.178) 2.301 24.762 ( -0.731 -1.880 0.525) 2.084 24.812 ( -0.171 2.357 2.186) 3.219 24.853 ( 0.438 -1.650 1.820) 2.496 24.937 ( -1.363 1.556 5.541) 5.915 24.952 ( -0.037 0.290 3.192) 3.206 25.116 ( -0.602 1.982 4.526) 4.977 25.166 ( 0.204 -2.874 0.960) 3.037 26.434 ( -0.892 1.666 0.136) 1.895 26.470 ( -0.889 -0.731 -2.032) 2.336 26.617 ( 1.097 7.103 -1.032) 7.261 26.842 ( 1.732 -14.430 -2.936) 14.827 28.495 ( -4.066 1.218 -0.582) 4.284 28.540 ( -3.273 -3.652 -0.321) 4.915 29.814 ( 3.489 6.486 -4.371) 8.564 29.893 ( 4.361 -2.096 -5.454) 7.291 ======================= Grid point 70 (38/104) ======================= q-point: (-0.50 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.715 ( -13.907 -5.158 17.976) 23.306 0.850 ( 13.156 -16.942 19.270) 28.835 2.043 ( 1.988 6.614 1.146) 7.000 2.262 ( 0.381 -7.715 -3.210) 8.365 2.368 ( -5.915 -0.547 -1.992) 6.266 2.398 ( 8.975 12.387 4.898) 16.061 2.532 ( 2.510 -6.687 -7.327) 10.232 2.688 ( 11.304 -12.319 1.433) 16.781 2.927 ( -5.289 1.429 4.896) 7.347 3.019 ( -6.113 -7.350 2.527) 9.888 3.257 ( -0.152 8.977 -6.253) 10.941 3.365 ( -4.623 1.374 0.529) 4.852 3.387 ( 3.423 -2.903 0.552) 4.522 3.404 ( -6.544 -2.878 -4.189) 8.286 3.691 ( 2.673 5.285 3.927) 7.106 3.743 ( 0.164 1.331 4.978) 5.156 4.085 ( -2.011 5.249 5.065) 7.567 4.217 ( 0.981 -4.910 4.224) 6.551 4.394 ( -1.635 19.169 2.757) 19.435 4.604 ( -1.850 -0.325 -2.366) 3.021 4.619 ( -2.462 -2.889 1.749) 4.179 4.787 ( -0.946 -17.237 0.251) 17.265 4.991 ( -1.351 2.073 -0.315) 2.494 5.040 ( -1.063 -3.137 1.832) 3.786 5.194 ( -1.015 3.340 -1.817) 3.936 5.274 ( 0.610 -2.059 -2.838) 3.559 5.394 ( 1.044 6.056 6.044) 8.620 5.445 ( 2.666 2.993 2.248) 4.595 5.595 ( 1.040 9.911 -1.304) 10.050 5.790 ( 1.206 -8.672 -0.510) 8.771 5.968 ( -2.225 3.738 3.191) 5.395 6.035 ( -1.271 -3.195 -0.319) 3.454 6.244 ( 4.489 1.686 -0.611) 4.834 6.271 ( 3.509 -0.265 2.290) 4.198 6.527 ( -1.273 3.748 -3.227) 5.107 6.628 ( -0.129 -7.208 -2.526) 7.639 6.683 ( -1.328 3.365 -2.382) 4.332 6.761 ( -2.081 -4.538 -2.909) 5.778 7.032 ( -4.286 8.646 1.428) 9.755 7.175 ( -3.707 -4.948 1.990) 6.495 7.332 ( -4.215 5.341 -8.422) 10.827 7.404 ( -3.861 -2.603 -6.710) 8.167 7.547 ( 2.655 3.735 -2.368) 5.158 7.607 ( 4.794 -0.903 -0.334) 4.890 7.743 ( 8.732 5.789 4.799) 11.523 7.805 ( 1.366 -1.922 6.360) 6.783 7.836 ( -6.170 1.081 -1.034) 6.348 7.976 ( 4.790 -11.327 -1.124) 12.349 8.937 ( 0.246 7.618 1.612) 7.791 9.075 ( 0.805 -5.977 -0.857) 6.091 9.354 ( -0.324 5.380 -3.728) 6.554 9.420 ( 1.574 0.737 -7.612) 7.808 9.514 ( 1.167 6.123 0.204) 6.237 9.705 ( 1.033 -9.687 1.381) 9.839 10.003 ( -4.427 -1.913 -2.744) 5.549 10.012 ( -4.102 -2.665 -2.254) 5.386 10.492 ( -0.801 14.408 8.604) 16.800 10.701 ( -2.568 0.223 -2.715) 3.743 10.862 ( -0.516 -2.843 7.471) 8.010 10.898 ( 2.168 -12.701 12.949) 18.267 11.374 ( 2.611 -2.996 -5.208) 6.551 11.429 ( 3.201 -5.994 -4.427) 8.110 11.816 ( 6.151 4.567 3.819) 8.561 11.912 ( 6.283 -5.349 6.174) 10.305 12.829 ( -4.005 4.597 -3.917) 7.247 12.892 ( -3.329 -1.851 -3.544) 5.203 13.252 ( -0.920 4.832 -4.356) 6.571 13.317 ( -2.052 -2.051 -6.104) 6.759 13.717 ( 1.209 3.997 1.722) 4.517 13.779 ( -1.054 -2.471 4.916) 5.602 14.412 ( -9.531 3.224 -9.069) 13.546 14.501 ( -6.392 -5.912 -6.904) 11.111 14.853 ( 5.790 3.888 5.759) 9.045 14.920 ( 3.383 -3.297 5.945) 7.593 15.293 ( 3.989 2.266 0.359) 4.602 15.340 ( 2.702 -2.197 1.801) 3.920 15.790 ( -1.390 3.618 -0.289) 3.886 15.861 ( -0.236 -3.671 0.410) 3.701 16.276 ( -1.429 4.098 -3.075) 5.319 16.318 ( 1.223 0.357 -3.261) 3.501 24.713 ( -0.237 2.158 -0.631) 2.261 24.750 ( -0.737 -1.482 0.023) 1.655 24.819 ( -0.602 2.254 2.205) 3.210 24.867 ( -0.514 -2.619 2.369) 3.568 24.946 ( -1.333 2.609 5.626) 6.343 24.971 ( -0.297 0.692 3.716) 3.791 25.128 ( -1.628 0.700 5.212) 5.505 25.166 ( -0.734 -2.860 0.462) 2.989 26.427 ( 0.072 2.149 0.171) 2.157 26.472 ( 1.780 -0.130 -0.257) 1.803 26.630 ( 0.703 5.869 -0.387) 5.924 26.836 ( 0.112 -13.294 -4.300) 13.972 28.460 ( 0.524 1.225 0.133) 1.339 28.508 ( 0.173 -3.895 -0.194) 3.904 29.821 ( 0.595 6.944 -5.669) 8.984 29.910 ( 1.436 -2.745 -6.132) 6.871 ======================= Grid point 71 (39/104) ======================= q-point: (-0.33 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.831 ( 10.747 18.809 15.622) 26.709 1.271 ( 20.082 -25.592 8.429) 33.605 2.033 ( -4.564 21.064 -3.044) 21.767 2.277 ( 6.906 4.032 3.471) 8.718 2.368 ( -4.117 -3.867 1.017) 5.739 2.412 ( 4.977 -14.110 1.853) 15.076 2.635 ( -1.223 1.760 -2.316) 3.155 2.796 ( -5.455 -10.942 3.690) 12.771 2.912 ( 5.259 4.199 7.443) 10.034 3.013 ( 5.205 -5.213 -0.034) 7.367 3.200 ( -2.608 1.755 -6.018) 6.790 3.240 ( -6.038 -1.418 -3.320) 7.035 3.308 ( -0.279 9.933 1.921) 10.121 3.450 ( 0.762 -4.199 2.554) 4.973 3.775 ( 2.974 7.699 4.117) 9.224 3.816 ( 6.029 6.846 0.868) 9.163 4.058 ( -1.573 1.431 3.291) 3.918 4.243 ( -1.697 -11.493 4.783) 12.564 4.430 ( 1.601 10.719 0.058) 10.838 4.546 ( -1.787 1.643 -3.381) 4.163 4.562 ( -1.571 0.156 0.559) 1.675 4.803 ( 2.851 -15.634 -2.297) 16.057 4.964 ( -1.260 0.984 -2.185) 2.708 5.006 ( -2.796 -3.831 -1.921) 5.117 5.171 ( -1.006 3.465 1.218) 3.809 5.258 ( -1.238 -3.566 -0.613) 3.824 5.428 ( 0.624 7.465 3.658) 8.336 5.491 ( -0.596 1.357 4.235) 4.487 5.608 ( 0.808 10.934 0.727) 10.988 5.813 ( 0.924 -7.616 0.892) 7.723 5.994 ( 1.446 -0.103 3.662) 3.938 6.020 ( -1.427 -1.602 3.145) 3.807 6.331 ( 3.709 1.394 -0.731) 4.029 6.359 ( 4.211 -0.364 3.344) 5.389 6.429 ( -4.660 4.231 -4.696) 7.853 6.535 ( -7.245 -7.072 -3.680) 10.773 6.660 ( 0.987 1.201 -3.060) 3.432 6.702 ( -1.643 -3.441 -4.211) 5.681 6.933 ( -6.569 6.035 -0.905) 8.966 7.033 ( -9.175 -4.204 -0.840) 10.127 7.181 ( -5.210 5.136 -6.837) 10.013 7.310 ( -3.675 -6.411 -4.294) 8.547 7.553 ( -3.063 2.847 -0.369) 4.198 7.603 ( -2.417 -1.577 -0.499) 2.929 7.813 ( 5.594 5.668 3.676) 8.772 7.894 ( 3.499 -2.766 6.381) 7.785 7.975 ( 9.347 7.073 2.281) 11.941 8.103 ( 7.173 -6.240 -1.091) 9.569 8.965 ( 1.196 6.976 0.996) 7.148 9.076 ( 0.015 -2.992 -2.096) 3.653 9.316 ( -2.039 4.120 -1.584) 4.863 9.409 ( 1.706 -4.078 -5.361) 6.948 9.558 ( 3.777 8.390 -0.211) 9.203 9.744 ( 3.850 -8.650 -1.371) 9.567 9.920 ( -2.025 -1.140 -3.535) 4.230 9.954 ( -0.084 -5.003 -3.830) 6.301 10.551 ( 2.157 11.334 3.761) 12.135 10.656 ( -0.283 0.665 -2.448) 2.552 10.904 ( -1.819 -1.869 10.247) 10.574 11.026 ( 2.172 -14.251 11.541) 18.467 11.375 ( 3.595 4.769 -2.231) 6.376 11.497 ( 6.894 -6.312 -1.651) 9.492 11.988 ( 6.316 3.874 7.776) 10.741 12.070 ( 2.972 -4.403 6.598) 8.471 12.718 ( -3.188 5.697 -5.225) 8.362 12.807 ( -1.089 -3.681 -6.697) 7.719 13.219 ( 1.167 3.651 -6.482) 7.531 13.278 ( 3.219 -2.903 -8.210) 9.284 13.706 ( -4.310 2.224 2.201) 5.325 13.751 ( -5.626 -2.470 5.596) 8.310 14.194 ( -8.519 5.648 -6.882) 12.322 14.333 ( -6.531 -8.558 -6.909) 12.792 14.983 ( 3.831 2.238 5.398) 6.987 15.012 ( 3.776 -0.634 4.379) 5.816 15.412 ( 7.597 1.501 2.229) 8.058 15.421 ( 4.840 0.683 2.496) 5.489 15.740 ( -3.011 5.354 -2.452) 6.614 15.842 ( -1.366 -5.052 -0.627) 5.271 16.168 ( -8.369 5.207 -2.503) 10.170 16.252 ( -6.545 -2.892 -2.822) 7.692 24.708 ( -0.041 1.623 -0.076) 1.626 24.737 ( -0.560 -0.988 -0.022) 1.136 24.817 ( -0.807 1.974 1.255) 2.475 24.864 ( -1.239 -2.209 2.118) 3.302 24.951 ( -1.865 2.563 4.701) 5.669 24.989 ( -1.075 -0.519 5.891) 6.011 25.117 ( -2.943 -0.264 4.834) 5.666 25.145 ( -1.613 -2.456 0.038) 2.938 26.443 ( 1.318 3.420 0.607) 3.715 26.515 ( 2.315 -2.590 0.475) 3.506 26.642 ( 1.058 5.961 0.204) 6.057 26.800 ( -0.824 -9.258 -4.792) 10.458 28.512 ( 4.757 0.294 0.034) 4.767 28.547 ( 4.073 -3.545 -0.059) 5.400 29.773 ( -1.443 7.193 -6.174) 9.588 29.870 ( -1.392 -3.170 -7.013) 7.821 ======================= Grid point 72 (40/104) ======================= q-point: (-0.17 0.43 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.119 ( 14.585 24.251 -3.032) 28.461 1.606 ( 14.834 -25.156 -3.794) 29.449 1.964 ( -2.109 24.182 0.877) 24.289 2.273 ( -11.322 10.552 16.192) 22.399 2.397 ( -8.788 -18.190 -2.463) 20.351 2.437 ( 4.989 -4.351 -0.068) 6.620 2.620 ( 5.555 -1.239 -0.879) 5.759 2.690 ( -6.877 -9.422 8.029) 14.161 2.985 ( -0.565 2.322 -9.011) 9.322 3.020 ( -1.695 -0.505 -4.991) 5.295 3.164 ( 3.196 6.467 5.878) 9.305 3.290 ( 3.178 -3.756 8.834) 10.112 3.353 ( 3.047 7.679 4.735) 9.522 3.477 ( 2.325 -4.016 0.952) 4.738 3.807 ( -3.120 16.257 2.951) 16.814 3.890 ( 4.070 18.653 -4.911) 19.713 4.171 ( 9.373 -12.284 3.529) 15.850 4.223 ( -1.297 -19.328 -0.423) 19.376 4.405 ( -3.157 0.293 0.589) 3.225 4.489 ( -2.246 -5.164 2.562) 6.187 4.617 ( 3.597 9.972 -1.181) 10.666 4.826 ( 1.750 -10.117 -4.353) 11.152 4.915 ( -0.944 1.111 -4.418) 4.653 4.974 ( 3.438 -4.846 -5.838) 8.330 5.169 ( -0.616 2.875 3.052) 4.238 5.228 ( -2.098 -1.988 1.849) 3.431 5.457 ( -0.610 4.153 2.932) 5.120 5.484 ( -2.021 1.732 3.146) 4.121 5.621 ( -1.970 10.942 2.890) 11.487 5.796 ( -5.400 -5.984 1.389) 8.179 5.961 ( -5.091 3.938 3.645) 7.396 6.059 ( 1.616 -5.566 1.449) 5.975 6.274 ( -1.974 0.450 -5.800) 6.143 6.307 ( -4.088 -2.812 -5.307) 7.266 6.452 ( -0.936 0.196 0.003) 0.956 6.494 ( 1.513 -3.632 -0.237) 3.941 6.689 ( 4.479 -0.216 2.747) 5.259 6.696 ( 4.881 -0.096 0.207) 4.887 6.834 ( -2.663 4.625 2.293) 5.809 6.934 ( -1.144 -5.039 -0.302) 5.176 7.091 ( -2.033 5.220 -1.942) 5.929 7.214 ( -4.839 -7.000 1.273) 8.605 7.480 ( -3.722 5.231 -0.301) 6.427 7.556 ( -2.304 -1.995 -3.043) 4.307 7.908 ( 2.023 3.379 0.998) 4.063 7.942 ( -1.016 -0.368 0.878) 1.392 8.131 ( 5.476 5.280 1.958) 7.855 8.178 ( 2.675 0.524 -2.950) 4.017 8.957 ( -1.414 7.021 -0.052) 7.163 9.098 ( 2.577 -6.319 -0.152) 6.826 9.265 ( -1.810 6.158 -1.422) 6.574 9.410 ( 0.654 -7.402 -2.048) 7.708 9.656 ( 7.329 11.092 -1.165) 13.345 9.815 ( 5.043 -3.561 -5.462) 8.243 9.898 ( 1.002 -1.313 -0.890) 1.876 9.982 ( 4.893 -11.175 1.940) 12.352 10.584 ( 0.306 8.255 -1.213) 8.349 10.649 ( 0.094 -0.391 -1.120) 1.190 10.866 ( -7.379 3.327 3.330) 8.752 11.060 ( -2.620 -13.536 1.355) 13.854 11.518 ( 9.018 8.172 1.812) 12.305 11.681 ( 11.963 -6.831 2.786) 14.055 12.008 ( -8.168 0.974 -1.932) 8.450 12.044 ( -5.607 -2.405 1.526) 6.289 12.713 ( 5.083 7.400 -2.158) 9.233 12.841 ( 7.432 -6.572 -3.284) 10.450 13.246 ( 5.768 3.028 -1.789) 6.756 13.307 ( 2.994 -3.052 -5.541) 6.999 13.596 ( -7.519 1.337 3.167) 8.268 13.654 ( -8.511 -4.342 5.767) 11.160 14.057 ( -3.042 7.866 -1.353) 8.541 14.218 ( -2.161 -8.883 -1.654) 9.291 15.048 ( 0.243 2.721 2.919) 3.998 15.089 ( 1.600 -1.266 2.760) 3.432 15.528 ( 6.656 3.047 -0.425) 7.332 15.575 ( 6.833 -1.902 -1.685) 7.290 15.683 ( 0.745 9.121 -1.201) 9.230 15.823 ( 0.444 -5.538 -1.737) 5.821 15.962 ( -12.527 5.253 -0.188) 13.585 16.068 ( -11.700 -5.366 0.275) 12.874 24.709 ( -0.193 1.443 0.892) 1.707 24.735 ( 0.359 -0.992 0.295) 1.095 24.808 ( -0.569 1.811 0.253) 1.915 24.853 ( -1.271 -1.971 1.885) 3.009 24.938 ( -2.254 2.303 3.546) 4.791 24.990 ( -3.570 -2.783 6.934) 8.281 25.090 ( -2.031 1.065 3.049) 3.816 25.124 ( -0.948 -2.086 1.455) 2.714 26.470 ( 1.085 2.987 0.450) 3.210 26.541 ( 0.487 -4.159 -0.359) 4.203 26.676 ( 1.854 4.282 -0.126) 4.668 26.755 ( -0.722 -3.789 -3.660) 5.317 28.603 ( 4.576 -0.200 -0.478) 4.606 28.640 ( 5.487 -4.000 -0.519) 6.810 29.714 ( -0.447 6.310 -5.443) 8.345 29.789 ( -1.988 -1.634 -6.911) 7.374 ======================= Grid point 91 (41/104) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( -14.647 0.000 31.321) 34.576 1.277 ( 5.123 0.000 30.911) 31.332 2.386 ( 0.226 0.000 54.897) 54.898 2.564 ( 9.142 0.000 -0.199) 9.144 2.618 ( -4.159 0.000 -1.134) 4.311 2.735 ( 3.729 0.000 2.097) 4.278 2.765 ( 2.888 0.000 6.071) 6.723 2.861 ( 13.511 0.000 -4.848) 14.354 2.904 ( 2.204 0.000 -6.311) 6.685 3.124 ( 3.881 0.000 1.995) 4.364 3.133 ( 2.868 0.000 -1.821) 3.398 3.201 ( -9.929 0.000 11.965) 15.548 3.284 ( -2.533 0.000 -2.711) 3.710 3.685 ( -4.623 0.000 7.925) 9.175 3.711 ( 5.758 0.000 -12.264) 13.549 3.978 ( -1.112 0.000 -4.464) 4.600 3.986 ( 1.459 0.000 -2.922) 3.266 4.215 ( 1.566 0.000 -2.067) 2.593 4.452 ( -0.409 0.000 -1.301) 1.363 4.482 ( 0.041 0.000 4.558) 4.558 4.630 ( -6.062 0.000 -0.577) 6.090 4.711 ( -4.312 0.000 1.755) 4.656 4.865 ( -0.874 0.000 -8.248) 8.294 4.904 ( -10.339 0.000 -13.343) 16.880 5.039 ( 1.789 0.000 -0.216) 1.802 5.351 ( -4.924 0.000 0.973) 5.020 5.413 ( 0.115 0.000 -3.665) 3.667 5.463 ( -5.264 0.000 13.724) 14.699 5.674 ( -6.504 0.000 -1.741) 6.733 5.838 ( 9.817 0.000 7.244) 12.200 5.871 ( -3.025 0.000 1.084) 3.213 6.035 ( -10.545 0.000 -3.993) 11.276 6.126 ( 5.556 0.000 -7.809) 9.583 6.354 ( 5.217 0.000 -3.122) 6.080 6.438 ( 5.280 0.000 4.275) 6.793 6.472 ( 3.485 0.000 -5.370) 6.402 6.595 ( -2.313 0.000 -5.610) 6.068 6.738 ( 1.032 0.000 -5.203) 5.305 6.764 ( -7.174 0.000 3.723) 8.082 6.862 ( -3.510 0.000 -6.056) 7.000 7.132 ( 1.787 0.000 -4.948) 5.260 7.165 ( 6.042 0.000 0.609) 6.073 7.308 ( -12.714 0.000 -6.518) 14.288 7.678 ( -3.703 0.000 2.027) 4.222 7.856 ( -3.081 0.000 4.664) 5.590 7.933 ( 3.566 0.000 2.712) 4.480 8.010 ( 6.734 0.000 -4.239) 7.957 8.245 ( 3.030 0.000 -5.604) 6.371 8.908 ( -1.213 0.000 -0.164) 1.224 8.971 ( -1.356 0.000 6.456) 6.596 9.059 ( 0.170 0.000 2.511) 2.517 9.431 ( 3.032 0.000 -6.166) 6.871 9.542 ( -2.937 0.000 -0.710) 3.022 9.830 ( 2.631 0.000 10.796) 11.112 10.100 ( 0.528 0.000 -4.045) 4.079 10.280 ( 5.266 0.000 10.604) 11.840 10.618 ( 1.657 0.000 -0.880) 1.876 10.620 ( -4.782 0.000 -1.180) 4.926 10.996 ( -8.162 0.000 2.679) 8.590 11.235 ( -8.800 0.000 2.035) 9.032 11.373 ( 23.598 0.000 -8.242) 24.995 11.679 ( 4.946 0.000 -7.252) 8.778 12.033 ( -2.715 0.000 -4.984) 5.675 12.149 ( -8.435 0.000 1.118) 8.508 12.571 ( 9.806 0.000 -1.557) 9.929 13.086 ( 6.469 0.000 0.708) 6.508 13.089 ( -8.059 0.000 -6.172) 10.151 13.475 ( 3.464 0.000 -5.695) 6.666 13.719 ( 14.452 0.000 2.402) 14.651 13.904 ( -2.875 0.000 6.154) 6.792 14.147 ( -22.885 0.000 -3.367) 23.131 14.523 ( -4.778 0.000 -7.610) 8.985 15.058 ( 1.448 0.000 5.344) 5.537 15.086 ( 0.656 0.000 1.944) 2.052 15.139 ( 6.911 0.000 3.984) 7.977 15.307 ( 3.092 0.000 3.793) 4.893 15.615 ( 10.920 0.000 1.139) 10.979 15.811 ( 3.352 0.000 -2.889) 4.425 15.828 ( -3.046 0.000 3.537) 4.668 16.128 ( -7.630 0.000 -0.465) 7.644 24.747 ( -2.704 0.000 0.775) 2.813 24.764 ( -0.566 0.000 -0.642) 0.856 24.764 ( 2.281 0.000 4.629) 5.160 24.841 ( -1.920 0.000 -0.946) 2.140 24.927 ( 2.774 0.000 6.665) 7.219 25.163 ( 1.870 0.000 1.686) 2.517 25.271 ( -5.442 0.000 5.989) 8.092 25.513 ( -29.929 0.000 -5.479) 30.427 26.173 ( -1.151 0.000 1.345) 1.770 26.626 ( 2.671 0.000 -6.600) 7.120 26.631 ( 0.794 0.000 9.115) 9.149 27.557 ( 24.321 0.000 -10.082) 26.327 28.550 ( -2.601 0.000 4.388) 5.101 28.917 ( -0.890 0.000 1.530) 1.771 29.076 ( 2.069 0.000 -3.790) 4.318 29.175 ( 9.695 0.000 -7.179) 12.064 ======================= Grid point 92 (42/104) ======================= q-point: ( 0.17 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( -8.451 0.000 29.589) 30.772 1.622 ( 12.465 0.000 26.030) 28.860 2.368 ( -14.598 0.000 -8.312) 16.799 2.485 ( -14.613 0.000 0.555) 14.624 2.743 ( 0.896 0.000 1.851) 2.057 2.758 ( -1.120 0.000 19.217) 19.249 2.811 ( -4.898 0.000 3.055) 5.773 3.026 ( 6.418 0.000 14.287) 15.663 3.060 ( 10.291 0.000 -9.658) 14.114 3.118 ( -7.350 0.000 22.284) 23.465 3.226 ( 6.479 0.000 0.473) 6.497 3.256 ( 8.331 0.000 7.475) 11.193 3.290 ( 5.437 0.000 -4.922) 7.334 3.620 ( -6.000 0.000 7.140) 9.327 3.723 ( 1.862 0.000 -7.236) 7.472 3.921 ( -2.611 0.000 -8.477) 8.870 3.995 ( 6.143 0.000 -6.345) 8.831 4.226 ( -4.298 0.000 -0.680) 4.352 4.375 ( -15.715 0.000 0.460) 15.722 4.391 ( -2.913 0.000 1.390) 3.228 4.510 ( -1.334 0.000 1.641) 2.115 4.611 ( -5.931 0.000 0.450) 5.948 4.804 ( 1.339 0.000 3.321) 3.580 4.805 ( 0.070 0.000 -9.912) 9.912 5.015 ( -2.737 0.000 -1.532) 3.137 5.291 ( -1.222 0.000 -7.593) 7.691 5.413 ( 2.650 0.000 -3.852) 4.675 5.421 ( -4.510 0.000 7.595) 8.833 5.557 ( -5.350 0.000 5.092) 7.386 5.867 ( 1.240 0.000 2.879) 3.134 5.883 ( -4.475 0.000 -2.009) 4.905 5.989 ( 1.616 0.000 5.283) 5.525 6.172 ( 2.145 0.000 -2.542) 3.326 6.346 ( -1.982 0.000 -8.090) 8.330 6.550 ( 5.930 0.000 -1.346) 6.081 6.566 ( 0.772 0.000 0.616) 0.988 6.617 ( 15.790 0.000 -7.770) 17.599 6.697 ( -1.641 0.000 3.664) 4.015 6.823 ( 1.532 0.000 -3.597) 3.910 6.864 ( 11.491 0.000 3.407) 11.986 7.039 ( -7.607 0.000 -7.339) 10.570 7.202 ( 7.028 0.000 0.291) 7.034 7.301 ( 6.186 0.000 0.241) 6.191 7.616 ( -4.605 0.000 2.547) 5.263 7.728 ( -9.690 0.000 -0.694) 9.715 7.950 ( -2.824 0.000 -19.837) 20.037 8.024 ( 1.211 0.000 3.054) 3.285 8.334 ( 7.260 0.000 0.813) 7.305 8.839 ( -4.540 0.000 0.639) 4.585 8.975 ( -1.836 0.000 4.834) 5.171 9.080 ( 0.883 0.000 2.623) 2.768 9.480 ( -3.640 0.000 -0.941) 3.760 9.503 ( 5.893 0.000 -3.332) 6.770 9.921 ( -0.950 0.000 12.349) 12.385 10.109 ( 2.521 0.000 -2.680) 3.680 10.441 ( 4.212 0.000 6.908) 8.091 10.487 ( -8.364 0.000 0.145) 8.365 10.530 ( -10.920 0.000 1.146) 10.980 10.878 ( -5.861 0.000 5.724) 8.192 11.195 ( 5.507 0.000 -2.045) 5.874 11.673 ( -0.582 0.000 -9.993) 10.010 11.781 ( 23.774 0.000 -12.024) 26.642 11.950 ( -11.081 0.000 1.737) 11.216 11.999 ( 1.619 0.000 -1.316) 2.087 12.701 ( 5.382 0.000 -1.944) 5.722 12.912 ( -5.950 0.000 -6.028) 8.469 13.142 ( -0.910 0.000 -2.084) 2.275 13.411 ( -5.354 0.000 -4.631) 7.079 13.695 ( -17.232 0.000 0.365) 17.236 13.969 ( -1.303 0.000 9.163) 9.256 14.017 ( 12.503 0.000 3.956) 13.113 14.425 ( -0.360 0.000 -6.272) 6.283 15.088 ( 0.217 0.000 1.480) 1.496 15.090 ( -0.609 0.000 2.610) 2.680 15.295 ( -2.901 0.000 -1.189) 3.135 15.327 ( 9.570 0.000 3.627) 10.235 15.687 ( -3.678 0.000 1.023) 3.817 15.842 ( -1.092 0.000 -2.845) 3.047 15.944 ( 10.604 0.000 2.060) 10.802 15.987 ( -4.028 0.000 -0.763) 4.100 24.700 ( -2.896 0.000 1.519) 3.270 24.766 ( 1.328 0.000 -1.146) 1.754 24.800 ( -0.631 0.000 -1.950) 2.049 24.858 ( 2.809 0.000 7.621) 8.122 25.004 ( -0.025 0.000 8.197) 8.197 25.077 ( -15.059 0.000 4.173) 15.627 25.231 ( -2.085 0.000 5.038) 5.452 25.237 ( 1.347 0.000 3.191) 3.464 26.175 ( 0.162 0.000 2.032) 2.038 26.655 ( 5.020 0.000 -7.509) 9.032 26.658 ( -3.866 0.000 7.952) 8.842 27.584 ( -5.361 0.000 -15.376) 16.284 28.553 ( 0.073 0.000 4.039) 4.040 28.895 ( -2.343 0.000 1.298) 2.679 29.122 ( 3.955 0.000 -3.838) 5.511 29.406 ( 18.396 0.000 -14.127) 23.194 ======================= Grid point 93 (43/104) ======================= q-point: ( 0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.382 ( 10.394 0.000 20.228) 22.743 1.987 ( -20.635 0.000 -9.526) 22.727 2.003 ( 13.619 0.000 18.717) 23.147 2.142 ( -22.614 0.000 0.545) 22.621 2.664 ( -11.451 0.000 3.037) 11.847 2.686 ( -3.958 0.000 -2.235) 4.545 2.786 ( -2.415 0.000 5.422) 5.935 3.032 ( -4.752 0.000 -13.715) 14.515 3.044 ( -5.621 0.000 0.183) 5.624 3.134 ( -4.981 0.000 8.677) 10.005 3.345 ( 2.309 0.000 -6.192) 6.608 3.441 ( 0.918 0.000 19.151) 19.173 3.443 ( 6.691 0.000 3.701) 7.646 3.601 ( -2.605 0.000 13.299) 13.552 3.699 ( 1.424 0.000 -8.863) 8.977 3.837 ( 0.214 0.000 -11.096) 11.098 4.001 ( -9.545 0.000 1.158) 9.615 4.033 ( 2.006 0.000 -7.699) 7.957 4.298 ( -1.743 0.000 14.002) 14.110 4.442 ( 4.225 0.000 5.543) 6.970 4.457 ( -2.893 0.000 -1.112) 3.100 4.587 ( 1.001 0.000 5.127) 5.223 4.732 ( -1.232 0.000 -8.357) 8.447 4.884 ( 2.325 0.000 9.691) 9.966 4.985 ( 2.354 0.000 -2.170) 3.202 5.211 ( -1.557 0.000 -6.356) 6.544 5.454 ( 1.563 0.000 9.239) 9.371 5.454 ( 4.177 0.000 -4.865) 6.412 5.555 ( 0.930 0.000 5.154) 5.237 5.833 ( 0.069 0.000 0.077) 0.103 5.920 ( 1.962 0.000 3.700) 4.188 5.999 ( -2.840 0.000 3.851) 4.785 6.153 ( -3.615 0.000 0.856) 3.715 6.266 ( -0.985 0.000 -8.984) 9.038 6.597 ( 2.517 0.000 -1.320) 2.842 6.669 ( 5.719 0.000 -0.469) 5.738 6.711 ( 2.196 0.000 3.253) 3.924 6.755 ( 5.229 0.000 -11.434) 12.573 6.896 ( 1.437 0.000 -2.149) 2.585 6.945 ( 9.925 0.000 1.798) 10.087 7.163 ( 10.124 0.000 4.567) 11.106 7.350 ( 6.453 0.000 5.125) 8.240 7.398 ( 4.022 0.000 -1.453) 4.277 7.544 ( -4.296 0.000 0.447) 4.319 7.552 ( -6.041 0.000 -0.248) 6.046 7.758 ( -2.598 0.000 -23.115) 23.260 7.988 ( -5.773 0.000 0.453) 5.791 8.428 ( 3.133 0.000 -5.044) 5.938 8.799 ( -1.325 0.000 4.921) 5.096 8.972 ( -1.694 0.000 4.230) 4.557 9.120 ( 1.429 0.000 0.540) 1.528 9.415 ( -2.203 0.000 1.196) 2.506 9.578 ( 5.212 0.000 -4.634) 6.974 9.924 ( -7.313 0.000 11.081) 13.276 10.149 ( 3.236 0.000 -1.955) 3.780 10.319 ( -7.770 0.000 -2.176) 8.069 10.336 ( -9.095 0.000 3.100) 9.608 10.483 ( -2.592 0.000 0.183) 2.598 10.911 ( 1.232 0.000 18.167) 18.209 11.371 ( 14.154 0.000 -3.000) 14.468 11.569 ( -2.995 0.000 -9.752) 10.201 11.699 ( -8.198 0.000 -9.672) 12.679 12.046 ( 2.461 0.000 2.023) 3.185 12.130 ( 13.343 0.000 -3.323) 13.750 12.688 ( -7.393 0.000 -0.066) 7.393 12.817 ( -0.154 0.000 -7.210) 7.212 13.058 ( -2.930 0.000 -7.273) 7.841 13.255 ( -8.332 0.000 -3.438) 9.013 13.503 ( -3.066 0.000 -0.880) 3.189 14.061 ( 3.268 0.000 13.900) 14.279 14.149 ( 1.355 0.000 -0.588) 1.477 14.465 ( 6.384 0.000 -0.815) 6.436 15.076 ( -1.329 0.000 -2.452) 2.790 15.107 ( 0.582 0.000 2.589) 2.654 15.214 ( -3.943 0.000 -4.396) 5.905 15.490 ( 5.310 0.000 0.100) 5.311 15.598 ( -5.872 0.000 0.207) 5.875 15.687 ( -7.842 0.000 -5.630) 9.654 16.043 ( 5.272 0.000 4.217) 6.751 16.107 ( 5.157 0.000 2.856) 5.895 24.671 ( -1.204 0.000 1.401) 1.847 24.778 ( -1.155 0.000 -1.226) 1.684 24.790 ( 1.558 0.000 -0.271) 1.581 24.868 ( -5.887 0.000 5.855) 8.303 25.010 ( -4.173 0.000 6.865) 8.034 25.026 ( 4.462 0.000 6.790) 8.124 25.266 ( 1.070 0.000 7.724) 7.798 25.304 ( 2.611 0.000 7.273) 7.727 26.204 ( 1.386 0.000 2.832) 3.153 26.591 ( -7.262 0.000 4.308) 8.443 26.700 ( 5.300 0.000 -9.665) 11.023 27.336 ( -10.044 0.000 -15.142) 18.170 28.596 ( 1.382 0.000 4.625) 4.827 28.857 ( -2.428 0.000 1.386) 2.796 29.151 ( 2.121 0.000 -5.094) 5.518 29.587 ( 11.952 0.000 -16.200) 20.131 ======================= Grid point 94 (44/104) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( -21.625 0.000 -5.016) 22.199 1.701 ( -26.228 0.000 3.589) 26.472 1.863 ( 16.413 0.000 14.005) 21.576 2.308 ( 7.852 0.000 6.708) 10.327 2.504 ( -4.859 0.000 4.971) 6.951 2.602 ( -5.158 0.000 2.198) 5.606 2.730 ( -10.166 0.000 9.310) 13.785 2.781 ( -11.572 0.000 -14.171) 18.296 2.955 ( -0.298 0.000 -5.472) 5.480 3.096 ( -0.751 0.000 0.607) 0.966 3.280 ( -3.166 0.000 -9.061) 9.598 3.357 ( -15.490 0.000 13.002) 20.224 3.514 ( 0.264 0.000 -1.378) 1.403 3.596 ( -6.290 0.000 13.174) 14.599 3.681 ( 4.167 0.000 -13.131) 13.777 3.828 ( 4.785 0.000 -8.994) 10.188 4.036 ( 4.423 0.000 10.555) 11.444 4.041 ( 3.860 0.000 -3.521) 5.224 4.374 ( -3.827 0.000 -0.425) 3.851 4.429 ( 6.011 0.000 11.208) 12.718 4.533 ( 1.038 0.000 0.669) 1.235 4.658 ( 2.057 0.000 4.506) 4.953 4.710 ( 3.309 0.000 -3.250) 4.638 5.008 ( 4.454 0.000 11.373) 12.214 5.062 ( 4.101 0.000 -2.693) 4.906 5.189 ( 2.945 0.000 1.219) 3.188 5.492 ( 3.758 0.000 -5.253) 6.459 5.538 ( 0.358 0.000 8.143) 8.151 5.633 ( 3.172 0.000 7.301) 7.960 5.898 ( 3.838 0.000 6.832) 7.836 5.916 ( -7.755 0.000 -1.009) 7.821 5.975 ( 1.158 0.000 2.072) 2.374 6.082 ( -3.311 0.000 1.337) 3.571 6.223 ( 2.150 0.000 -5.661) 6.056 6.590 ( -3.272 0.000 -3.218) 4.590 6.694 ( 1.413 0.000 -5.573) 5.750 6.735 ( 1.581 0.000 -4.133) 4.425 6.849 ( 8.141 0.000 -0.310) 8.147 7.037 ( -2.636 0.000 3.730) 4.568 7.043 ( 9.391 0.000 8.854) 12.907 7.225 ( -2.933 0.000 -2.034) 3.569 7.314 ( -6.716 0.000 -2.181) 7.062 7.457 ( -3.332 0.000 -7.565) 8.267 7.479 ( 3.414 0.000 6.295) 7.161 7.633 ( 3.492 0.000 -14.714) 15.123 7.675 ( 11.271 0.000 2.422) 11.529 7.880 ( -4.243 0.000 -0.542) 4.277 8.376 ( -2.835 0.000 -10.987) 11.347 8.835 ( 0.500 0.000 6.160) 6.181 8.957 ( -3.133 0.000 5.141) 6.021 9.100 ( -2.790 0.000 -1.011) 2.968 9.462 ( 5.036 0.000 3.831) 6.328 9.631 ( 5.100 0.000 -9.190) 10.510 9.802 ( -10.885 0.000 7.368) 13.144 10.171 ( 1.376 0.000 -6.518) 6.662 10.189 ( -7.758 0.000 5.634) 9.588 10.291 ( 0.861 0.000 4.803) 4.880 10.466 ( 4.012 0.000 -1.950) 4.460 11.084 ( 3.044 0.000 21.506) 21.720 11.467 ( -0.891 0.000 -9.251) 9.294 11.503 ( -6.604 0.000 -12.594) 14.221 11.612 ( 11.150 0.000 -0.535) 11.163 12.097 ( 1.256 0.000 3.580) 3.793 12.193 ( -4.593 0.000 -4.787) 6.634 12.491 ( -11.432 0.000 2.985) 11.815 12.815 ( 4.791 0.000 -6.619) 8.171 13.001 ( 3.245 0.000 -12.648) 13.058 13.116 ( -2.689 0.000 -5.026) 5.700 13.551 ( 6.376 0.000 2.795) 6.962 14.107 ( -4.158 0.000 -4.046) 5.802 14.247 ( 6.836 0.000 16.841) 18.175 14.580 ( 5.193 0.000 1.990) 5.562 15.011 ( -3.450 0.000 -4.460) 5.639 15.070 ( -5.315 0.000 -7.064) 8.840 15.162 ( 0.579 0.000 1.891) 1.978 15.394 ( -9.393 0.000 -5.411) 10.841 15.500 ( -4.368 0.000 0.179) 4.371 15.672 ( 4.936 0.000 -2.180) 5.396 16.158 ( -1.418 0.000 2.566) 2.932 16.165 ( 4.098 0.000 5.755) 7.065 24.678 ( 1.072 0.000 1.486) 1.833 24.735 ( -2.951 0.000 1.213) 3.190 24.812 ( 0.631 0.000 0.512) 0.813 24.847 ( -0.203 0.000 3.192) 3.198 24.956 ( -5.383 0.000 4.636) 7.105 25.129 ( 2.734 0.000 0.563) 2.791 25.334 ( -0.376 0.000 10.455) 10.462 25.480 ( 9.662 0.000 20.608) 22.761 26.254 ( 1.448 0.000 4.000) 4.254 26.475 ( -6.212 0.000 0.717) 6.253 26.708 ( 2.664 0.000 -12.692) 12.968 27.066 ( -9.024 0.000 -16.718) 18.998 28.636 ( -0.994 0.000 5.392) 5.483 28.841 ( -0.062 0.000 1.761) 1.762 29.136 ( 0.062 0.000 -5.769) 5.769 29.643 ( 5.618 0.000 -17.809) 18.674 ======================= Grid point 95 (45/104) ======================= q-point: (-0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.084 ( -14.161 0.000 17.207) 22.285 1.296 ( -22.439 0.000 13.069) 25.967 2.274 ( 17.651 0.000 10.132) 20.352 2.315 ( 2.181 0.000 -10.428) 10.653 2.486 ( -21.733 0.000 31.001) 37.860 2.536 ( -6.239 0.000 -4.118) 7.476 2.598 ( -3.531 0.000 -0.316) 3.546 2.635 ( 7.210 0.000 7.867) 10.671 2.942 ( 2.752 0.000 -5.985) 6.588 3.101 ( 0.131 0.000 -7.151) 7.152 3.171 ( -1.104 0.000 -10.966) 11.021 3.245 ( -3.380 0.000 15.613) 15.975 3.468 ( -3.235 0.000 -2.264) 3.949 3.580 ( -4.383 0.000 14.442) 15.092 3.677 ( 5.097 0.000 -15.602) 16.413 3.865 ( 5.421 0.000 -8.761) 10.302 4.102 ( 2.632 0.000 -2.088) 3.359 4.170 ( 3.894 0.000 5.587) 6.810 4.322 ( -1.356 0.000 1.703) 2.177 4.528 ( -0.561 0.000 -0.990) 1.138 4.575 ( 3.868 0.000 4.524) 5.952 4.714 ( 2.490 0.000 2.412) 3.467 4.793 ( 5.839 0.000 1.126) 5.946 5.048 ( -0.663 0.000 -5.976) 6.012 5.145 ( 3.572 0.000 4.352) 5.630 5.316 ( 5.659 0.000 5.327) 7.772 5.538 ( 4.205 0.000 -2.816) 5.061 5.545 ( -4.684 0.000 8.147) 9.397 5.707 ( -11.921 0.000 -3.008) 12.294 5.731 ( 1.122 0.000 8.569) 8.643 5.940 ( -4.150 0.000 1.273) 4.341 6.041 ( 5.627 0.000 7.091) 9.053 6.098 ( 3.112 0.000 -2.344) 3.896 6.278 ( 5.816 0.000 -1.168) 5.932 6.462 ( -6.462 0.000 -3.446) 7.324 6.696 ( 1.559 0.000 -3.696) 4.012 6.701 ( -5.252 0.000 -5.468) 7.582 6.908 ( -2.555 0.000 -3.924) 4.682 7.041 ( 3.847 0.000 8.863) 9.662 7.074 ( -8.702 0.000 -7.209) 11.300 7.127 ( -4.085 0.000 -4.211) 5.867 7.303 ( -6.982 0.000 -9.306) 11.634 7.346 ( 8.476 0.000 10.325) 13.359 7.582 ( 3.381 0.000 7.593) 8.312 7.699 ( 9.163 0.000 -4.767) 10.329 7.794 ( 0.902 0.000 -2.601) 2.754 7.887 ( 2.804 0.000 4.665) 5.443 8.227 ( -3.878 0.000 -13.305) 13.858 8.868 ( -0.430 0.000 4.177) 4.199 8.937 ( -2.523 0.000 6.593) 7.060 9.048 ( -2.230 0.000 0.539) 2.294 9.590 ( 5.404 0.000 4.997) 7.360 9.629 ( 2.033 0.000 -14.230) 14.374 9.674 ( -6.760 0.000 4.158) 7.936 10.103 ( -5.505 0.000 9.501) 10.980 10.173 ( 4.321 0.000 -9.606) 10.533 10.387 ( 6.151 0.000 3.319) 6.989 10.579 ( 6.982 0.000 0.063) 6.983 11.183 ( -6.186 0.000 -0.863) 6.246 11.323 ( -4.046 0.000 -1.367) 4.271 11.420 ( -0.071 0.000 -3.887) 3.887 11.707 ( 0.355 0.000 -3.435) 3.453 12.041 ( -4.961 0.000 5.798) 7.631 12.136 ( 0.413 0.000 2.230) 2.268 12.379 ( -5.293 0.000 7.398) 9.097 12.930 ( 11.764 0.000 -1.944) 11.924 12.992 ( 4.703 0.000 -15.417) 16.119 13.125 ( 7.040 0.000 -6.980) 9.913 13.717 ( 7.362 0.000 7.132) 10.250 13.943 ( -9.777 0.000 -7.998) 12.631 14.513 ( 11.690 0.000 16.200) 19.978 14.675 ( 3.713 0.000 1.600) 4.043 14.888 ( -8.884 0.000 -10.355) 13.644 14.913 ( -3.616 0.000 -3.271) 4.876 15.177 ( -1.149 0.000 3.417) 3.605 15.214 ( -7.569 0.000 -1.540) 7.724 15.467 ( 0.572 0.000 0.501) 0.761 15.737 ( 4.088 0.000 -3.929) 5.670 16.088 ( -7.662 0.000 1.949) 7.906 16.241 ( 0.259 0.000 5.106) 5.112 24.705 ( -1.397 0.000 2.180) 2.589 24.725 ( 2.977 0.000 1.338) 3.264 24.814 ( -0.881 0.000 0.625) 1.080 24.870 ( 0.463 0.000 2.178) 2.227 24.885 ( -4.934 0.000 3.864) 6.267 25.139 ( -0.189 0.000 -1.750) 1.760 25.364 ( -3.600 0.000 10.453) 11.056 25.946 ( 25.883 0.000 29.713) 39.405 26.260 ( -3.456 0.000 1.814) 3.903 26.441 ( 1.959 0.000 3.331) 3.864 26.614 ( -4.193 0.000 -20.140) 20.572 26.799 ( -9.078 0.000 -14.198) 16.852 28.624 ( -3.708 0.000 5.602) 6.718 28.871 ( 1.585 0.000 2.077) 2.613 29.096 ( -0.337 0.000 -4.967) 4.979 29.552 ( -3.295 0.000 -20.769) 21.029 ======================= Grid point 96 (46/104) ======================= q-point: (-0.17 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.123 ( -9.215 0.000 26.800) 28.340 1.172 ( 0.728 0.000 34.705) 34.713 2.272 ( -24.344 0.000 49.921) 55.540 2.365 ( 11.029 0.000 -9.443) 14.520 2.565 ( 9.229 0.000 3.005) 9.706 2.568 ( 8.405 0.000 4.997) 9.779 2.623 ( 5.659 0.000 0.299) 5.667 2.769 ( 3.003 0.000 4.588) 5.483 2.958 ( 0.951 0.000 -8.510) 8.563 3.054 ( 1.439 0.000 -1.841) 2.337 3.121 ( 2.494 0.000 -9.733) 10.047 3.286 ( -5.357 0.000 11.428) 12.621 3.380 ( -5.259 0.000 -1.444) 5.453 3.644 ( 0.751 0.000 14.605) 14.624 3.684 ( 6.304 0.000 -15.290) 16.539 3.921 ( 6.449 0.000 -7.138) 9.620 4.061 ( -3.891 0.000 -3.994) 5.576 4.224 ( 0.596 0.000 -1.085) 1.238 4.374 ( 4.175 0.000 3.329) 5.340 4.509 ( -1.379 0.000 -0.022) 1.379 4.637 ( 1.123 0.000 2.423) 2.670 4.760 ( 0.271 0.000 0.943) 0.982 4.897 ( 3.329 0.000 -0.482) 3.363 5.000 ( 0.598 0.000 -4.728) 4.766 5.131 ( -4.299 0.000 -8.738) 9.738 5.400 ( -1.346 0.000 7.832) 7.946 5.487 ( -6.736 0.000 -4.665) 8.194 5.494 ( -6.508 0.000 8.714) 10.876 5.644 ( 6.042 0.000 4.733) 7.675 5.748 ( -2.316 0.000 2.225) 3.211 5.906 ( -1.826 0.000 3.827) 4.241 6.108 ( 1.935 0.000 -7.974) 8.205 6.151 ( 2.420 0.000 1.370) 2.781 6.376 ( -0.758 0.000 -0.270) 0.804 6.389 ( 4.388 0.000 1.077) 4.519 6.461 ( -11.389 0.000 -8.884) 14.444 6.676 ( -1.788 0.000 -4.477) 4.821 6.856 ( -2.530 0.000 -2.693) 3.695 6.858 ( -7.623 0.000 -10.145) 12.689 7.029 ( -9.149 0.000 -3.166) 9.681 7.078 ( 2.570 0.000 -2.897) 3.873 7.175 ( -1.889 0.000 -3.793) 4.237 7.496 ( -2.064 0.000 4.067) 4.561 7.692 ( 1.915 0.000 4.881) 5.243 7.773 ( 1.550 0.000 1.128) 1.917 7.855 ( 9.166 0.000 -0.520) 9.181 7.935 ( -1.036 0.000 4.208) 4.334 8.179 ( 6.666 0.000 -5.437) 8.602 8.882 ( 0.724 0.000 2.215) 2.330 8.950 ( -1.241 0.000 7.424) 7.527 9.037 ( 0.284 0.000 1.629) 1.654 9.521 ( -3.585 0.000 -14.192) 14.638 9.600 ( -3.768 0.000 1.153) 3.941 9.712 ( 3.977 0.000 7.681) 8.650 10.110 ( -0.384 0.000 6.052) 6.064 10.186 ( 2.615 0.000 -6.296) 6.818 10.526 ( 7.262 0.000 0.468) 7.277 10.661 ( 0.974 0.000 0.231) 1.002 11.031 ( -0.585 0.000 -1.136) 1.278 11.246 ( -3.888 0.000 -4.530) 5.970 11.379 ( -6.027 0.000 2.675) 6.594 11.656 ( 0.738 0.000 -7.165) 7.203 12.113 ( -2.645 0.000 -2.592) 3.703 12.159 ( 6.262 0.000 7.048) 9.428 12.395 ( 2.256 0.000 11.883) 12.096 12.993 ( 5.300 0.000 -10.019) 11.334 13.165 ( 8.345 0.000 -6.425) 10.532 13.257 ( 13.541 0.000 2.184) 13.716 13.706 ( -7.608 0.000 -9.905) 12.490 13.861 ( 2.789 0.000 7.646) 8.139 14.572 ( -15.884 0.000 -11.888) 19.840 14.658 ( -4.371 0.000 -5.839) 7.294 14.900 ( 16.660 0.000 11.045) 19.989 14.931 ( 5.535 0.000 4.516) 7.144 15.112 ( -3.937 0.000 2.662) 4.752 15.185 ( 0.132 0.000 6.428) 6.429 15.504 ( 2.836 0.000 -0.310) 2.853 15.776 ( 3.232 0.000 -4.282) 5.365 15.933 ( -9.899 0.000 3.394) 10.464 16.230 ( -4.164 0.000 2.756) 4.993 24.713 ( 0.513 0.000 3.298) 3.337 24.774 ( 0.973 0.000 -2.416) 2.604 24.791 ( -2.201 0.000 2.364) 3.230 24.853 ( -0.358 0.000 5.748) 5.759 24.874 ( -1.102 0.000 0.286) 1.138 25.132 ( 0.592 0.000 -0.096) 0.600 25.334 ( -5.861 0.000 8.286) 10.150 26.163 ( -25.886 0.000 -25.653) 36.444 26.202 ( -2.822 0.000 0.626) 2.891 26.535 ( 3.564 0.000 7.444) 8.253 26.645 ( 0.888 0.000 -5.990) 6.055 26.808 ( 43.424 0.000 20.553) 48.042 28.584 ( -4.090 0.000 5.221) 6.632 28.907 ( 0.762 0.000 1.892) 2.040 29.077 ( 1.237 0.000 -3.390) 3.608 29.286 ( -10.838 0.000 -16.416) 19.671 ======================= Grid point 97 (47/104) ======================= q-point: ( 0.00 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.101 ( 2.196 -11.894 32.188) 34.385 1.382 ( -13.195 9.207 27.305) 31.693 2.392 ( 2.976 -7.891 9.341) 12.585 2.545 ( 0.050 -2.363 5.728) 6.196 2.616 ( 1.181 -0.343 18.406) 18.447 2.655 ( -1.368 -5.652 0.965) 5.895 2.812 ( 6.135 1.963 1.192) 6.551 2.861 ( 9.648 -0.504 0.524) 9.675 2.918 ( 2.005 4.550 2.532) 5.580 3.113 ( 0.523 -9.410 -2.715) 9.808 3.127 ( 3.677 -0.454 1.228) 3.903 3.144 ( -1.115 1.108 3.602) 3.930 3.252 ( -4.868 4.928 3.238) 7.647 3.570 ( 3.932 -7.505 -2.883) 8.950 3.724 ( -2.508 0.835 10.955) 11.269 3.858 ( -4.181 -9.043 -2.812) 10.352 4.074 ( 4.083 3.457 -8.553) 10.089 4.182 ( -5.753 1.694 -6.276) 8.681 4.527 ( 0.632 2.040 2.703) 3.445 4.589 ( 1.774 5.725 -3.218) 6.803 4.633 ( -4.387 0.914 -2.253) 5.016 4.721 ( -1.257 3.027 0.783) 3.370 4.928 ( -2.418 5.912 -7.960) 10.206 4.961 ( -2.780 4.711 -6.665) 8.623 5.103 ( 3.166 5.376 0.232) 6.243 5.286 ( -2.012 -6.200 -0.733) 6.560 5.432 ( -7.921 0.848 0.791) 8.005 5.439 ( -2.515 -2.037 11.762) 12.199 5.557 ( -5.325 -6.947 2.522) 9.109 5.817 ( 0.216 -0.717 6.818) 6.859 5.940 ( 1.483 2.117 0.559) 2.645 6.014 ( 0.794 1.076 -5.746) 5.900 6.143 ( -1.854 -0.106 -7.377) 7.608 6.323 ( -1.432 -4.344 -0.683) 4.625 6.442 ( 1.324 2.581 -2.421) 3.778 6.531 ( 6.272 3.208 -1.524) 7.207 6.612 ( -1.589 1.119 -3.110) 3.668 6.711 ( 4.460 4.133 -1.720) 6.319 6.789 ( -1.772 0.356 1.124) 2.129 6.975 ( -1.391 2.873 -7.859) 8.482 7.098 ( -2.019 4.664 -2.465) 5.649 7.259 ( -3.858 3.620 -1.986) 5.651 7.315 ( -2.363 2.057 -2.216) 3.837 7.675 ( -3.738 0.268 0.549) 3.787 7.824 ( -1.984 -3.673 2.108) 4.677 7.865 ( 6.681 -7.552 -0.952) 10.127 7.996 ( 0.750 0.581 3.039) 3.184 8.266 ( 4.543 1.552 -0.100) 4.802 8.851 ( -1.383 -2.284 2.080) 3.385 9.019 ( -0.548 2.921 -2.650) 3.981 9.112 ( -0.601 4.466 1.171) 4.656 9.448 ( 2.886 1.040 -4.099) 5.120 9.494 ( -2.004 -3.136 -1.323) 3.950 9.849 ( 1.451 1.539 8.556) 8.813 10.130 ( 0.402 2.382 -5.758) 6.244 10.261 ( 6.910 -2.176 10.275) 12.572 10.563 ( 2.285 -3.581 -0.061) 4.249 10.648 ( -4.507 0.501 -0.485) 4.560 10.992 ( 0.400 -7.015 7.271) 10.111 11.078 ( -1.741 -3.622 -5.285) 6.639 11.454 ( 0.697 5.109 -7.614) 9.195 11.582 ( 6.451 -11.462 -5.623) 14.305 11.974 ( -7.614 -1.410 -4.890) 9.158 12.219 ( -3.463 1.251 -1.693) 4.052 12.580 ( 7.915 2.117 2.088) 8.455 13.006 ( 5.004 -4.357 -0.607) 6.663 13.081 ( -6.108 -0.653 -4.857) 7.832 13.529 ( 5.714 3.038 -1.681) 6.686 13.726 ( 8.204 0.525 1.041) 8.287 13.856 ( -5.667 -5.388 5.670) 9.659 14.026 ( -7.052 -4.753 3.853) 9.336 14.685 ( -4.200 8.380 -8.405) 12.590 14.935 ( 7.765 -9.739 7.870) 14.733 15.062 ( -7.993 2.080 -0.658) 8.285 15.205 ( 1.317 4.293 2.202) 5.001 15.407 ( 2.014 5.585 -1.867) 6.224 15.624 ( 10.442 1.087 2.308) 10.749 15.812 ( 3.670 1.012 -0.744) 3.879 15.856 ( -1.703 1.905 1.552) 2.989 16.115 ( -7.155 -1.325 -0.054) 7.276 24.732 ( -1.490 -0.588 3.025) 3.423 24.757 ( -0.033 0.063 -1.083) 1.086 24.796 ( 0.640 1.486 2.175) 2.711 24.853 ( -1.520 1.256 -1.150) 2.283 24.929 ( 2.208 0.228 7.139) 7.476 25.156 ( 1.685 -0.724 2.165) 2.837 25.238 ( -7.734 -3.636 5.109) 9.956 25.397 ( -17.772 -8.540 2.444) 19.869 26.259 ( -3.877 7.273 -2.454) 8.600 26.594 ( 1.665 -2.994 4.069) 5.319 26.609 ( 1.486 -2.171 -2.251) 3.463 27.258 ( 15.925 -20.166 0.358) 25.698 28.709 ( -3.732 4.905 -6.258) 8.783 28.802 ( 1.594 -7.733 -0.650) 7.922 29.231 ( 4.511 15.358 -4.957) 16.757 29.310 ( 7.217 10.426 -5.457) 13.805 ======================= Grid point 98 (48/104) ======================= q-point: ( 0.17 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( -7.692 0.463 28.426) 29.452 1.514 ( 11.443 -6.017 25.756) 28.818 2.293 ( -17.565 -9.288 -5.344) 20.576 2.436 ( -5.833 -6.050 -1.188) 8.488 2.601 ( -7.168 -8.769 -1.570) 11.434 2.755 ( 3.070 -4.710 6.882) 8.886 2.861 ( -6.378 0.545 5.668) 8.550 2.973 ( 7.784 -4.785 -0.519) 9.152 3.053 ( -1.301 -9.838 -2.312) 10.189 3.129 ( 2.485 4.821 5.320) 7.597 3.197 ( 2.036 5.076 21.329) 22.019 3.249 ( 8.963 -0.102 -2.544) 9.318 3.295 ( 7.150 2.939 5.926) 9.741 3.588 ( -2.854 -4.995 5.086) 7.679 3.661 ( -5.035 -2.085 -0.799) 5.508 3.751 ( -5.707 -10.361 -5.690) 13.126 4.094 ( 2.339 2.088 -5.565) 6.387 4.154 ( 5.921 1.423 2.865) 6.730 4.349 ( -14.047 1.066 -4.493) 14.787 4.555 ( -6.408 4.557 3.482) 8.600 4.604 ( -1.230 8.786 -0.142) 8.873 4.721 ( -0.057 10.080 0.992) 10.129 4.836 ( -1.907 2.924 -8.204) 8.916 4.936 ( 2.749 11.703 0.105) 12.021 5.110 ( -2.021 7.495 -2.922) 8.294 5.239 ( -0.945 -4.894 -4.530) 6.735 5.341 ( -2.076 -2.116 2.195) 3.688 5.459 ( -2.057 -1.803 7.306) 7.801 5.507 ( -1.743 -2.786 5.057) 6.031 5.828 ( -1.162 -1.069 4.774) 5.029 5.911 ( 0.021 0.311 -5.664) 5.672 6.068 ( 2.690 5.695 3.216) 7.072 6.157 ( 1.179 -1.571 -0.841) 2.137 6.334 ( 4.323 -10.027 -2.333) 11.166 6.370 ( -3.126 2.469 -7.730) 8.696 6.592 ( 0.824 3.091 0.177) 3.204 6.646 ( 8.195 -2.193 -4.748) 9.721 6.795 ( 1.811 3.202 2.451) 4.421 6.880 ( 8.775 2.559 1.879) 9.331 6.923 ( 2.417 9.920 -4.130) 11.014 7.051 ( -6.335 1.986 -7.156) 9.761 7.129 ( 6.102 -3.839 1.220) 7.311 7.415 ( 5.234 8.080 0.364) 9.634 7.590 ( -5.914 -1.670 0.518) 6.167 7.737 ( -6.536 -0.182 -1.409) 6.688 7.911 ( -0.068 -4.494 -4.566) 6.407 8.030 ( 1.184 -0.149 -3.475) 3.674 8.319 ( 3.487 -1.162 -2.836) 4.643 8.824 ( -2.585 -0.759 1.371) 3.023 8.982 ( -2.048 1.286 1.351) 2.770 9.113 ( 0.544 3.336 3.577) 4.921 9.433 ( -2.500 -4.400 -0.910) 5.142 9.517 ( 4.039 1.472 -3.516) 5.554 9.916 ( -0.850 -0.543 10.300) 10.350 10.121 ( 1.949 0.535 -4.432) 4.871 10.437 ( -0.924 -0.741 5.659) 5.782 10.473 ( -7.613 -0.968 4.791) 9.047 10.537 ( -5.107 0.710 -1.217) 5.298 10.908 ( -6.220 2.903 5.151) 8.582 11.174 ( 8.316 -3.444 -2.727) 9.405 11.538 ( 10.006 -11.642 -9.820) 18.223 11.691 ( 8.530 -12.159 -5.982) 16.012 11.833 ( -3.110 -4.559 -2.389) 6.014 12.068 ( -7.753 2.158 -4.312) 9.130 12.706 ( 2.305 2.028 5.033) 5.896 12.957 ( -1.396 4.361 -6.817) 8.212 13.073 ( -0.548 -3.739 1.391) 4.027 13.469 ( -6.973 2.774 -6.669) 10.040 13.634 ( -10.255 -3.043 3.009) 11.112 13.908 ( 1.786 -2.729 6.354) 7.143 14.168 ( 13.131 8.063 6.617) 16.769 14.513 ( -5.742 8.235 -10.823) 14.763 14.943 ( -4.867 -6.570 1.961) 8.408 15.133 ( 6.198 -8.131 7.135) 12.468 15.199 ( -1.568 1.822 -1.220) 2.695 15.422 ( 1.240 2.491 -1.669) 3.245 15.723 ( -1.013 3.250 0.300) 3.418 15.860 ( -1.312 0.662 -2.618) 3.003 15.912 ( 6.394 0.395 2.962) 7.058 16.042 ( 2.418 3.335 -1.009) 4.241 24.702 ( -2.556 0.278 1.633) 3.046 24.760 ( 0.704 -0.082 -0.627) 0.946 24.824 ( 0.313 1.937 -2.051) 2.838 24.860 ( 2.157 -0.015 5.797) 6.185 24.999 ( -1.053 -0.887 8.136) 8.252 25.061 ( -10.821 -0.989 5.083) 11.996 25.212 ( 1.818 -1.124 5.239) 5.658 25.249 ( -2.775 0.240 3.226) 4.262 26.221 ( -0.479 4.596 0.783) 4.687 26.608 ( -1.204 -3.937 -1.153) 4.276 26.639 ( 1.851 -2.445 1.343) 3.348 27.368 ( 0.723 -18.021 -8.783) 20.060 28.575 ( -5.182 0.788 -0.591) 5.274 28.809 ( -1.284 -7.089 -0.196) 7.207 29.275 ( 3.742 13.213 -4.456) 14.437 29.499 ( 14.870 7.753 -11.647) 20.418 ======================= Grid point 99 (49/104) ======================= q-point: ( 0.33 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( 5.696 -1.907 19.362) 20.272 1.882 ( -7.176 -15.297 9.239) 19.258 1.902 ( -1.117 -3.253 4.885) 5.975 2.211 ( -16.518 6.378 -0.028) 17.707 2.465 ( -6.793 -15.421 -0.345) 16.854 2.732 ( -6.471 0.649 -1.136) 6.602 2.818 ( 0.292 -0.467 1.942) 2.019 2.951 ( -7.941 -4.990 -6.381) 11.344 3.057 ( -0.776 -0.937 -1.460) 1.900 3.095 ( 1.084 -5.863 0.512) 5.985 3.293 ( 0.247 -1.316 -3.676) 3.912 3.390 ( -0.976 -5.496 1.699) 5.835 3.469 ( 2.177 0.566 10.685) 10.919 3.574 ( -2.498 -2.547 12.418) 12.921 3.624 ( -0.622 -3.508 1.044) 3.713 3.658 ( 2.075 -8.744 -3.859) 9.780 4.051 ( -9.239 5.397 2.669) 11.027 4.134 ( 1.927 4.172 -6.536) 7.990 4.336 ( 4.867 4.786 7.083) 9.837 4.458 ( -4.256 1.179 7.617) 8.805 4.558 ( -3.675 8.441 -0.166) 9.208 4.712 ( -1.640 8.344 -1.353) 8.611 4.775 ( 1.408 6.440 -4.441) 7.949 5.002 ( 1.834 5.828 -2.039) 6.441 5.069 ( 1.911 8.970 1.508) 9.294 5.214 ( 0.869 1.739 -2.429) 3.111 5.382 ( 3.506 -1.683 4.236) 5.750 5.470 ( -0.474 -2.818 4.622) 5.435 5.547 ( 1.149 -1.501 6.292) 6.570 5.836 ( 1.089 1.056 1.640) 2.234 5.931 ( 2.291 0.222 0.983) 2.503 6.096 ( -2.444 8.003 3.703) 9.151 6.124 ( -2.923 -2.527 1.226) 4.054 6.273 ( -1.373 1.569 -8.821) 9.064 6.429 ( 6.008 -12.267 -0.893) 13.688 6.619 ( 1.546 2.097 -0.483) 2.650 6.728 ( 3.963 -2.016 -7.366) 8.603 6.832 ( 0.760 -2.156 -2.523) 3.405 6.948 ( 6.905 9.565 0.445) 11.806 7.014 ( 4.917 4.738 -2.408) 7.241 7.111 ( 8.267 -4.119 3.834) 10.001 7.302 ( 9.596 -1.829 4.993) 10.971 7.423 ( -3.749 2.212 -4.794) 6.475 7.488 ( -3.213 -2.279 -1.336) 4.160 7.623 ( -5.253 3.734 -0.513) 6.465 7.837 ( -1.953 3.633 -9.008) 9.907 7.983 ( -2.881 0.742 -3.757) 4.792 8.350 ( 1.915 -7.958 -4.819) 9.499 8.808 ( -0.772 1.302 4.625) 4.867 8.966 ( -1.434 0.117 2.353) 2.758 9.158 ( 1.298 3.921 0.993) 4.248 9.394 ( -0.785 -2.104 1.904) 2.944 9.555 ( 3.132 -2.536 -4.681) 6.177 9.925 ( -5.525 -0.178 9.237) 10.765 10.132 ( 0.339 -1.714 -3.476) 3.890 10.260 ( -5.836 -2.936 0.233) 6.537 10.366 ( -10.091 0.837 2.811) 10.509 10.523 ( -1.766 3.789 -2.325) 4.783 10.931 ( 1.324 1.835 16.750) 16.902 11.336 ( 11.428 -3.494 -4.268) 12.689 11.545 ( -0.513 -2.755 -6.600) 7.170 11.693 ( -2.677 -4.890 -13.890) 14.967 11.864 ( 3.892 -13.881 1.817) 14.530 12.058 ( 6.984 -6.206 2.788) 9.750 12.705 ( -5.328 3.911 4.244) 7.855 12.910 ( -0.686 5.392 -7.186) 9.010 13.009 ( -4.308 -1.353 -4.030) 6.053 13.289 ( -6.957 1.937 -6.680) 9.838 13.528 ( -1.701 2.661 0.141) 3.161 13.979 ( 1.015 -3.428 8.538) 9.256 14.336 ( -1.834 10.827 -2.822) 11.338 14.471 ( 9.275 2.092 2.412) 9.809 14.881 ( -3.128 -10.900 -1.934) 11.503 15.147 ( -1.863 -2.857 0.377) 3.431 15.244 ( 1.794 0.775 1.979) 2.781 15.404 ( -2.971 -3.025 -0.599) 4.282 15.686 ( -1.915 2.708 -3.020) 4.486 15.772 ( -2.510 8.405 -5.978) 10.615 16.046 ( 5.958 1.490 4.554) 7.646 16.133 ( 4.211 2.167 1.968) 5.129 24.675 ( -1.197 0.552 1.425) 1.941 24.769 ( 0.566 0.046 -0.352) 0.669 24.826 ( 0.228 2.593 -1.454) 2.982 24.866 ( -4.834 -0.217 5.215) 7.114 25.005 ( 0.135 -0.459 6.875) 6.892 25.021 ( -0.886 -0.283 6.295) 6.364 25.257 ( 0.413 -1.236 4.025) 4.230 25.299 ( 2.684 -0.287 10.508) 10.849 26.239 ( 1.407 3.657 2.215) 4.501 26.538 ( -5.651 -4.557 0.280) 7.265 26.684 ( 3.814 -1.909 -4.578) 6.257 27.238 ( -6.386 -9.592 -12.657) 17.117 28.538 ( -0.308 -4.025 2.660) 4.834 28.773 ( -2.154 -7.351 0.390) 7.670 29.300 ( 2.134 12.623 -5.393) 13.892 29.644 ( 9.780 4.872 -13.643) 17.479 ======================= Grid point 100 (50/104) ======================= q-point: (-0.50 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -17.873 -6.748 4.740) 19.684 1.749 ( -23.813 1.912 1.141) 23.917 1.849 ( 11.779 -3.343 13.128) 17.952 2.257 ( 7.912 -2.821 7.516) 11.271 2.375 ( -1.294 -9.899 3.215) 10.488 2.609 ( -3.632 -0.992 -7.155) 8.085 2.762 ( -9.796 9.262 8.243) 15.802 2.865 ( 3.337 -5.031 -5.214) 7.977 2.990 ( -4.832 5.512 -3.528) 8.135 3.078 ( -1.660 0.596 -2.813) 3.320 3.205 ( -6.281 -5.528 -5.733) 10.143 3.327 ( -5.036 -9.342 0.507) 10.625 3.435 ( -8.084 -0.576 6.661) 10.490 3.562 ( -3.677 -4.995 -0.751) 6.248 3.596 ( -1.635 -3.259 4.489) 5.783 3.726 ( 5.750 -5.764 -1.831) 8.345 4.070 ( 3.998 3.913 9.368) 10.911 4.158 ( 4.222 5.157 -7.510) 10.041 4.402 ( 2.252 2.246 5.409) 6.275 4.474 ( -1.811 3.535 2.145) 4.514 4.526 ( -0.263 1.642 5.561) 5.805 4.704 ( 1.960 4.818 0.584) 5.234 4.808 ( 2.844 8.784 -0.857) 9.272 5.017 ( 3.761 -2.533 -5.955) 7.485 5.161 ( 3.468 9.640 6.016) 11.881 5.229 ( 1.343 4.445 -0.074) 4.644 5.471 ( 1.284 -1.814 2.939) 3.685 5.494 ( 1.459 -4.427 3.897) 6.076 5.601 ( -0.920 -2.630 9.917) 10.301 5.920 ( 4.384 1.567 2.800) 5.433 5.952 ( -2.351 2.872 3.469) 5.080 6.020 ( -1.949 -0.932 -0.126) 2.164 6.105 ( -2.108 7.135 -1.033) 7.512 6.241 ( 3.149 2.472 -2.804) 4.887 6.516 ( 1.217 -9.686 -0.726) 9.789 6.625 ( 1.494 -0.636 -1.958) 2.544 6.723 ( 1.106 -1.585 -6.483) 6.765 6.840 ( 2.446 -2.784 -1.414) 3.967 7.029 ( -4.289 -1.794 2.206) 5.145 7.128 ( 8.963 6.675 5.258) 12.351 7.222 ( 0.205 -6.031 -3.912) 7.192 7.239 ( -6.529 0.354 -5.480) 8.532 7.444 ( -0.683 -1.296 -2.410) 2.820 7.488 ( 1.381 1.792 -1.268) 2.593 7.579 ( 5.169 1.718 0.813) 5.507 7.803 ( 3.553 5.683 -1.660) 6.905 7.921 ( -2.309 2.552 -0.960) 3.573 8.319 ( -0.893 -5.885 -8.309) 10.222 8.838 ( -0.089 0.708 5.935) 5.978 8.950 ( -1.722 0.165 1.811) 2.505 9.134 ( -3.005 3.242 -1.292) 4.606 9.452 ( 4.191 -0.662 2.962) 5.174 9.580 ( 2.851 -5.308 -4.094) 7.284 9.821 ( -8.495 1.706 2.877) 9.130 10.093 ( 0.515 -5.737 -4.094) 7.067 10.205 ( -9.378 0.596 4.875) 10.586 10.297 ( 4.184 -0.384 3.206) 5.285 10.481 ( 2.049 2.191 -4.424) 5.345 11.092 ( 2.761 0.782 19.596) 19.805 11.422 ( 2.770 -3.972 -10.551) 11.609 11.478 ( -6.468 -2.255 -11.283) 13.200 11.628 ( 6.314 -3.338 -0.840) 7.191 11.972 ( 5.101 -8.712 6.170) 11.832 12.148 ( -1.306 -2.092 2.322) 3.388 12.582 ( -9.095 6.955 2.513) 11.722 12.868 ( 3.076 0.145 -8.022) 8.593 12.920 ( -0.505 -0.662 -8.570) 8.611 13.161 ( -1.386 1.973 -8.610) 8.941 13.580 ( 5.409 2.989 2.693) 6.741 14.018 ( -2.005 -5.118 3.155) 6.338 14.285 ( -1.840 -0.176 3.262) 3.749 14.652 ( 5.946 4.448 2.847) 7.953 14.796 ( -2.683 -8.760 -3.172) 9.695 15.124 ( -2.432 -2.404 0.874) 3.529 15.249 ( -0.672 5.506 0.028) 5.547 15.338 ( -2.745 -0.534 -0.616) 2.864 15.584 ( -5.212 3.753 -4.743) 7.984 15.753 ( 2.918 7.307 -6.391) 10.136 16.151 ( -0.159 0.682 4.090) 4.149 16.194 ( 2.633 1.973 3.623) 4.894 24.681 ( 0.821 0.342 1.634) 1.860 24.756 ( -2.626 2.151 1.053) 3.554 24.804 ( -0.218 -0.723 0.932) 1.200 24.866 ( 0.640 1.669 1.653) 2.435 24.961 ( -5.294 0.676 4.897) 7.243 25.113 ( 2.967 -1.572 2.298) 4.069 25.299 ( 0.145 -3.327 8.097) 8.755 25.447 ( 4.632 -3.265 17.691) 18.576 26.294 ( 2.428 3.933 3.693) 5.916 26.439 ( -4.042 -2.791 -0.714) 4.963 26.702 ( 1.857 -1.000 -7.422) 7.716 27.021 ( -7.647 -4.680 -15.228) 17.672 28.563 ( 0.134 -5.304 3.631) 6.429 28.756 ( 0.340 -7.621 0.652) 7.657 29.284 ( -0.023 12.453 -5.754) 13.718 29.686 ( 4.477 3.663 -15.233) 16.294 ======================= Grid point 101 (51/104) ======================= q-point: (-0.33 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.169 ( -9.162 0.958 23.904) 25.617 1.304 ( -23.305 8.133 7.980) 25.941 2.164 ( 11.198 -10.534 4.807) 16.108 2.350 ( 8.057 0.327 1.312) 8.170 2.447 ( 2.358 -1.923 -2.619) 4.015 2.548 ( -5.884 0.859 8.991) 10.779 2.687 ( -2.282 10.610 11.484) 15.801 2.782 ( -13.343 8.640 3.834) 16.352 2.927 ( 2.600 -0.287 -4.704) 5.382 3.047 ( 0.674 -3.316 -6.978) 7.755 3.092 ( 0.004 -4.183 -2.965) 5.127 3.258 ( -2.547 -6.499 4.174) 8.134 3.361 ( -3.945 -1.087 2.384) 4.735 3.529 ( 2.671 -11.067 -11.189) 15.963 3.586 ( -3.382 -0.657 11.900) 12.388 3.812 ( 5.362 -5.290 -4.090) 8.571 4.173 ( 1.879 5.024 -0.367) 5.377 4.215 ( 6.019 4.119 -0.722) 7.329 4.405 ( -1.088 5.733 -0.399) 5.849 4.497 ( 1.273 -2.351 -0.141) 2.678 4.599 ( 3.761 1.494 6.194) 7.399 4.757 ( 1.137 5.618 4.071) 7.031 4.871 ( 4.981 5.553 -0.034) 7.460 5.036 ( 2.465 -1.552 -8.349) 8.843 5.204 ( -2.151 4.238 1.037) 4.864 5.284 ( 4.106 -2.957 0.951) 5.148 5.454 ( -3.654 -3.876 5.950) 7.986 5.566 ( 0.709 -2.822 3.071) 4.231 5.608 ( -3.740 -4.295 8.922) 10.585 5.855 ( -4.683 9.734 -0.942) 10.843 5.973 ( -3.487 1.916 5.595) 6.865 6.028 ( 0.533 -0.045 -3.383) 3.425 6.140 ( 7.394 1.833 0.465) 7.632 6.331 ( 6.298 5.651 1.592) 8.610 6.432 ( -5.067 -3.178 -3.308) 6.835 6.638 ( -2.562 -4.196 -6.597) 8.227 6.703 ( -0.516 -1.405 -1.507) 2.124 6.866 ( -2.131 -3.380 -2.593) 4.763 6.963 ( -7.019 -2.927 -0.116) 7.606 7.028 ( 0.149 -10.122 0.461) 10.133 7.141 ( -4.869 -0.171 -5.426) 7.292 7.282 ( 1.255 5.525 0.067) 5.667 7.457 ( 1.937 4.203 2.016) 5.048 7.553 ( 7.234 -2.838 0.843) 7.817 7.670 ( 3.458 1.579 1.855) 4.230 7.851 ( -1.890 4.453 -2.970) 5.677 7.927 ( 3.660 2.783 5.753) 7.365 8.220 ( -3.928 -1.726 -8.491) 9.514 8.870 ( -0.066 0.503 4.124) 4.155 8.938 ( 0.011 0.975 1.732) 1.987 9.078 ( -2.024 3.050 -0.129) 3.663 9.518 ( 2.600 -3.867 -4.204) 6.276 9.602 ( -2.059 -5.008 4.462) 7.016 9.727 ( 0.466 4.304 -4.838) 6.492 10.083 ( -2.879 -3.982 4.118) 6.411 10.137 ( 2.729 -2.034 -2.388) 4.157 10.378 ( 2.939 0.182 2.012) 3.567 10.563 ( 7.277 -1.225 -1.907) 7.621 11.172 ( -7.700 -2.022 -3.472) 8.685 11.272 ( -3.988 -2.833 1.351) 5.075 11.442 ( 4.378 -0.332 -5.255) 6.848 11.692 ( -0.747 -1.657 0.854) 2.008 12.064 ( -3.889 1.759 5.241) 6.759 12.112 ( 3.020 -1.013 3.576) 4.789 12.466 ( -5.959 7.514 5.109) 10.865 12.908 ( 6.533 -7.212 -10.224) 14.115 12.958 ( 9.916 2.689 -3.867) 10.978 13.145 ( 5.950 0.949 -9.621) 11.352 13.710 ( 4.801 -0.495 5.849) 7.584 13.916 ( -7.663 -2.021 -5.301) 9.534 14.325 ( -0.101 -12.234 11.608) 16.865 14.592 ( -5.696 -10.765 -6.102) 13.622 14.898 ( 8.832 9.471 6.192) 14.354 15.049 ( -5.174 1.822 -1.565) 5.704 15.241 ( -0.725 7.899 2.063) 8.197 15.305 ( -1.010 5.805 -3.042) 6.631 15.497 ( -0.992 2.634 -1.910) 3.402 15.762 ( 2.525 2.368 -7.044) 7.849 16.086 ( -7.841 0.176 2.552) 8.247 16.255 ( 0.030 1.182 4.008) 4.178 24.722 ( -0.850 1.129 2.556) 2.920 24.723 ( 1.556 0.388 1.225) 2.018 24.807 ( -0.374 -0.661 0.007) 0.759 24.885 ( 0.353 1.119 0.980) 1.528 24.896 ( -4.662 1.495 4.674) 6.769 25.135 ( -0.118 -0.349 -0.935) 1.005 25.338 ( -2.713 -2.719 9.851) 10.574 25.667 ( 4.937 -19.377 17.605) 26.641 26.365 ( 4.399 4.543 4.148) 7.563 26.449 ( 4.309 1.638 5.291) 7.018 26.656 ( -0.811 2.417 -9.855) 10.180 26.784 ( -8.147 -1.474 -14.703) 16.874 28.584 ( 0.766 -3.112 2.533) 4.085 28.791 ( 2.507 -7.227 0.709) 7.682 29.240 ( -0.877 12.316 -4.919) 13.291 29.606 ( -2.654 4.636 -17.315) 18.120 ======================= Grid point 102 (52/104) ======================= q-point: (-0.17 0.14 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.004 ( -13.743 -7.072 25.389) 29.723 1.343 ( -0.349 13.715 29.459) 32.497 2.316 ( 4.007 -3.725 -1.194) 5.599 2.394 ( -3.982 0.968 20.640) 21.043 2.539 ( -0.618 4.960 12.736) 13.682 2.582 ( 4.599 -1.505 4.282) 6.461 2.685 ( 7.641 4.724 1.881) 9.178 2.766 ( 2.322 -0.191 2.796) 3.640 2.910 ( -0.724 -2.621 -6.479) 7.026 3.059 ( 4.114 1.182 -3.936) 5.815 3.095 ( 1.666 -1.494 -2.985) 3.731 3.234 ( -4.614 -9.495 0.640) 10.576 3.315 ( -4.669 3.227 7.353) 9.289 3.519 ( 4.926 -11.928 -10.483) 16.626 3.651 ( 0.580 -0.033 14.270) 14.282 3.875 ( 3.684 -5.985 -2.440) 7.440 4.121 ( -1.850 5.394 -11.253) 12.616 4.284 ( 0.125 5.623 -2.391) 6.111 4.446 ( 3.452 4.306 4.467) 7.100 4.529 ( 4.151 0.494 -2.546) 4.895 4.668 ( 0.815 1.708 1.982) 2.741 4.770 ( -2.093 1.841 0.701) 2.874 4.969 ( 4.149 3.116 2.071) 5.587 5.004 ( 0.875 1.892 -10.660) 10.862 5.122 ( -4.408 1.830 -4.345) 6.455 5.315 ( -1.559 -9.233 1.296) 9.453 5.436 ( -4.098 -1.488 9.156) 10.141 5.545 ( -3.682 0.359 4.516) 5.838 5.615 ( -1.735 -4.445 1.682) 5.060 5.767 ( -3.607 6.224 4.338) 8.401 5.953 ( -2.094 3.467 3.731) 5.507 6.017 ( 1.309 -3.036 -5.438) 6.364 6.255 ( 3.157 2.081 -3.364) 5.061 6.365 ( -0.279 -1.457 -1.381) 2.027 6.422 ( -5.077 1.262 -0.574) 5.262 6.468 ( 0.502 2.903 -5.340) 6.099 6.665 ( -2.009 -1.054 -2.477) 3.359 6.764 ( -5.944 -3.103 -6.924) 9.639 6.825 ( -1.457 -1.608 -2.701) 3.465 7.042 ( -1.209 -3.337 -6.432) 7.346 7.164 ( 2.060 1.749 2.844) 3.923 7.219 ( -3.275 7.814 -0.691) 8.501 7.475 ( -4.052 -1.673 0.433) 4.405 7.685 ( 3.524 -0.495 2.761) 4.504 7.742 ( 5.019 -7.474 -0.278) 9.007 7.806 ( -0.131 3.025 1.023) 3.196 7.997 ( -1.140 3.761 3.771) 5.446 8.156 ( 2.887 -1.049 2.305) 3.840 8.865 ( -1.787 -0.654 2.087) 2.824 9.003 ( 5.029 4.672 -1.786) 7.093 9.069 ( 1.084 3.127 2.111) 3.926 9.486 ( -1.263 -1.907 -8.642) 8.939 9.552 ( -3.669 -4.625 0.713) 5.947 9.771 ( 3.022 4.181 3.205) 6.074 10.107 ( 1.100 -2.317 10.104) 10.425 10.176 ( 3.494 0.285 -10.445) 11.018 10.455 ( 5.617 -5.358 1.941) 8.001 10.658 ( 3.207 -0.970 -0.402) 3.374 10.972 ( -5.220 -5.027 -2.445) 7.648 11.211 ( -6.807 0.531 0.759) 6.869 11.486 ( 3.311 2.660 -5.104) 6.640 11.610 ( -5.760 -1.145 -4.896) 7.646 12.098 ( -1.499 -0.505 2.650) 3.086 12.164 ( 4.405 -1.436 2.541) 5.284 12.454 ( 1.502 5.471 6.926) 8.953 12.945 ( 4.664 -4.392 -9.649) 11.582 13.154 ( 6.918 -0.737 -6.877) 9.783 13.271 ( 13.896 1.170 3.159) 14.299 13.707 ( -4.410 -0.522 -5.122) 6.779 13.843 ( 1.025 -0.792 5.872) 6.013 14.255 ( -13.577 -17.005 2.062) 21.857 14.609 ( 8.248 -9.154 5.793) 13.616 14.929 ( -5.671 4.563 -3.576) 8.110 15.095 ( 7.377 5.756 4.226) 10.268 15.219 ( -4.732 8.737 -3.693) 10.601 15.303 ( 5.862 11.454 3.322) 13.289 15.511 ( 2.276 0.629 -1.256) 2.675 15.768 ( 2.629 -0.714 -4.485) 5.247 15.940 ( -8.878 0.817 3.433) 9.554 16.228 ( -5.123 -0.570 2.219) 5.612 24.719 ( -0.347 0.692 3.113) 3.208 24.771 ( 1.035 -0.337 -1.655) 1.981 24.791 ( -0.881 -0.357 1.853) 2.083 24.868 ( -1.336 1.994 5.663) 6.150 24.885 ( -0.732 0.811 -0.135) 1.101 25.129 ( 0.260 -0.274 0.278) 0.469 25.315 ( -5.617 -1.919 7.702) 9.725 25.690 ( -11.208 -26.256 3.633) 28.778 26.419 ( -8.810 7.317 -10.808) 15.747 26.500 ( 4.729 -2.183 6.122) 8.038 26.632 ( -1.207 -1.639 -6.458) 6.772 26.821 ( 22.811 -0.189 11.930) 25.743 28.649 ( 6.345 1.369 -1.056) 6.577 28.827 ( 0.497 -6.109 -0.812) 6.183 29.206 ( 0.535 12.524 -3.849) 13.113 29.399 ( -7.647 9.468 -13.189) 17.946 ======================= Grid point 103 (53/104) ======================= q-point: ( 0.00 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.960 ( 0.578 0.640 22.057) 22.074 1.613 ( -11.965 14.180 18.408) 26.136 2.233 ( -0.774 -7.169 -5.403) 9.010 2.283 ( 6.431 -24.439 -4.196) 25.617 2.425 ( -7.205 -10.567 -4.903) 13.697 2.571 ( -0.689 -5.288 10.399) 11.687 2.737 ( -5.656 -12.455 -2.036) 13.830 2.841 ( 7.764 -2.619 1.220) 8.284 2.933 ( 3.561 -1.787 -3.210) 5.117 3.068 ( 3.852 1.626 6.409) 7.653 3.259 ( -1.334 16.282 19.975) 25.804 3.326 ( 1.682 8.839 -7.907) 11.978 3.406 ( 0.169 13.969 0.879) 13.998 3.490 ( -0.086 1.237 10.274) 10.348 3.684 ( -3.102 -6.027 1.149) 6.875 3.772 ( -1.418 1.780 9.436) 9.707 4.104 ( -3.361 0.216 -7.492) 8.214 4.194 ( -2.972 -2.949 -11.621) 12.352 4.501 ( 0.849 -1.475 -2.083) 2.690 4.618 ( -2.598 0.411 3.060) 4.035 4.720 ( 5.262 4.134 1.642) 6.891 4.819 ( 4.723 5.440 -2.155) 7.520 4.966 ( -1.964 -3.215 2.697) 4.633 5.052 ( 2.632 0.843 -7.176) 7.690 5.123 ( 0.598 -4.996 -0.688) 5.079 5.179 ( 1.950 1.703 0.088) 2.590 5.415 ( -5.541 1.679 4.008) 7.042 5.482 ( -5.887 2.049 5.928) 8.603 5.503 ( -7.045 1.048 4.589) 8.473 5.796 ( -1.626 -2.600 2.908) 4.226 5.960 ( 1.340 3.016 0.244) 3.309 6.057 ( 2.944 0.843 -2.769) 4.129 6.124 ( -1.382 -1.027 -6.950) 7.160 6.246 ( -3.043 -3.566 -0.921) 4.778 6.443 ( -0.075 -2.663 0.476) 2.706 6.537 ( 1.707 -2.434 -1.152) 3.188 6.673 ( 2.007 4.958 -1.527) 5.563 6.809 ( 2.668 3.690 0.880) 4.637 6.889 ( 2.636 8.515 0.308) 8.919 6.942 ( 2.353 0.605 -4.087) 4.755 7.247 ( -1.154 1.198 2.208) 2.764 7.268 ( -8.151 2.981 -7.958) 11.775 7.389 ( 5.983 4.076 3.883) 8.215 7.622 ( 4.409 -12.890 5.529) 14.703 7.716 ( -4.440 3.652 -4.040) 7.027 7.818 ( -2.629 0.595 -1.119) 2.919 8.022 ( -1.824 1.647 -0.097) 2.459 8.267 ( 4.441 -2.130 1.970) 5.305 8.860 ( -1.090 3.276 0.335) 3.469 9.085 ( -0.190 3.266 -5.177) 6.124 9.190 ( 0.935 3.779 -1.311) 4.107 9.380 ( -1.922 -4.103 -3.459) 5.700 9.555 ( 2.441 5.978 -2.228) 6.831 9.843 ( 0.681 -3.346 4.549) 5.688 10.176 ( 6.990 -1.616 -4.081) 8.254 10.222 ( 0.759 4.106 6.893) 8.060 10.472 ( 7.921 -6.432 3.380) 10.749 10.633 ( -5.970 -2.073 -0.593) 6.347 10.793 ( 1.450 -7.697 2.054) 8.097 11.139 ( -4.694 0.351 -3.688) 5.980 11.282 ( -2.594 -10.334 -6.770) 12.624 11.599 ( -4.773 7.484 -5.841) 10.626 11.926 ( -8.510 -5.819 -6.815) 12.358 12.124 ( -0.022 -9.311 -2.482) 9.636 12.693 ( 7.133 8.894 2.717) 11.720 12.956 ( 5.164 -1.313 3.741) 6.510 13.124 ( -2.982 5.708 -3.960) 7.560 13.543 ( 7.503 -1.690 0.486) 7.706 13.699 ( -7.087 -4.248 1.395) 8.380 13.737 ( 0.235 -5.496 5.000) 7.434 14.045 ( 7.141 6.063 7.379) 11.925 14.672 ( 11.944 -10.185 11.376) 19.385 14.860 ( -6.999 3.994 -5.645) 9.839 15.109 ( -9.451 0.502 -4.108) 10.318 15.292 ( -3.228 5.037 -3.321) 6.843 15.460 ( -1.263 0.291 -6.066) 6.203 15.664 ( 8.443 3.189 3.963) 9.857 15.841 ( 6.095 0.654 -1.577) 6.330 15.892 ( -1.993 2.555 3.066) 4.461 16.080 ( -4.500 -2.296 1.081) 5.166 24.731 ( -1.174 0.431 2.449) 2.750 24.768 ( 0.012 1.061 -0.288) 1.100 24.808 ( 1.186 -0.082 1.919) 2.258 24.876 ( -0.946 0.577 -1.257) 1.675 24.942 ( 0.091 1.457 6.526) 6.687 25.122 ( -3.291 -3.923 3.647) 6.286 25.165 ( -4.228 -1.480 4.469) 6.328 25.278 ( -4.415 -4.295 6.076) 8.652 26.406 ( -4.403 7.745 -4.628) 10.039 26.534 ( 1.267 -2.632 4.008) 4.960 26.557 ( 0.466 -2.993 -3.743) 4.815 26.948 ( 6.977 -12.834 0.406) 14.613 28.678 ( -0.761 -4.454 -0.894) 4.606 28.705 ( -0.637 -3.219 -4.406) 5.494 29.497 ( 3.253 8.860 -4.734) 10.559 29.508 ( 6.619 10.821 -7.641) 14.808 ======================= Grid point 104 (54/104) ======================= q-point: ( 0.17 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.115 ( -2.008 -6.790 25.996) 26.943 1.607 ( 2.079 13.012 16.927) 21.452 2.037 ( -20.335 -18.421 -4.441) 27.795 2.203 ( -1.161 -13.996 -1.988) 14.184 2.436 ( 2.037 -12.324 -5.914) 13.821 2.634 ( -1.545 -2.448 3.554) 4.584 2.645 ( 1.969 -19.124 -1.762) 19.306 2.840 ( -5.724 -6.236 2.292) 8.770 3.027 ( 4.662 1.716 -1.680) 5.244 3.196 ( 6.821 0.125 0.840) 6.873 3.273 ( -5.390 5.742 2.486) 8.259 3.352 ( -5.156 2.870 3.378) 6.799 3.388 ( 4.893 5.695 -0.296) 7.514 3.503 ( -3.365 0.185 8.953) 9.566 3.651 ( -10.790 0.399 -3.674) 11.406 3.680 ( 0.128 4.426 8.791) 9.843 4.116 ( 2.225 1.516 8.265) 8.692 4.179 ( 7.202 -1.900 -6.046) 9.593 4.412 ( -7.898 6.207 -0.514) 10.058 4.604 ( -3.283 1.957 3.525) 5.199 4.760 ( -2.053 4.889 1.236) 5.444 4.882 ( 2.783 4.762 -4.850) 7.345 4.935 ( -0.930 7.986 -0.263) 8.045 5.066 ( 1.579 -1.340 -4.290) 4.763 5.129 ( 2.067 -1.120 -2.003) 3.088 5.232 ( 3.065 0.348 0.556) 3.135 5.314 ( -5.135 0.762 6.612) 8.407 5.450 ( -2.013 0.121 3.567) 4.098 5.471 ( -1.228 1.151 7.269) 7.461 5.818 ( 1.277 -1.067 1.783) 2.439 5.940 ( 0.054 3.952 -5.057) 6.418 6.092 ( 0.626 -1.734 0.236) 1.859 6.137 ( 3.207 -2.026 -1.335) 4.021 6.228 ( 1.679 -1.461 1.129) 2.495 6.425 ( -1.797 1.799 -4.760) 5.396 6.546 ( 3.819 -6.476 -2.945) 8.074 6.695 ( -0.517 5.833 0.766) 5.905 6.840 ( 0.388 1.251 0.042) 1.311 6.983 ( 4.328 8.315 1.244) 9.456 7.020 ( 7.978 1.842 -1.112) 8.263 7.110 ( -0.283 5.017 -4.352) 6.647 7.196 ( -1.928 8.907 -1.702) 9.271 7.503 ( -0.117 -0.936 -2.096) 2.298 7.595 ( -3.107 0.562 -2.435) 3.987 7.699 ( 0.766 -2.145 3.621) 4.277 7.806 ( -1.056 -4.961 -0.291) 5.081 7.990 ( 0.784 -3.061 -0.552) 3.208 8.282 ( -2.540 -3.937 -5.995) 7.609 8.847 ( -0.466 3.852 1.023) 4.012 9.041 ( -1.175 4.383 -5.115) 6.838 9.203 ( 1.399 6.306 5.228) 8.310 9.339 ( -1.084 -4.629 -2.051) 5.178 9.547 ( -0.896 1.140 -4.584) 4.808 9.876 ( -0.865 -4.706 6.503) 8.074 10.134 ( 0.032 1.787 -5.892) 6.158 10.394 ( -8.515 -4.122 4.876) 10.643 10.467 ( -0.771 0.769 8.632) 8.701 10.560 ( 2.202 1.855 -1.877) 3.437 10.947 ( 1.638 -4.585 6.067) 7.779 11.050 ( 8.573 -3.449 -7.941) 12.185 11.251 ( 1.269 -15.377 -3.812) 15.894 11.553 ( 2.128 -1.942 0.863) 3.007 11.745 ( -6.308 -4.766 -8.342) 11.493 12.024 ( -5.320 -6.631 -5.550) 10.152 12.809 ( 0.945 8.395 6.131) 10.438 13.005 ( -1.127 0.512 -0.188) 1.252 13.115 ( 2.123 7.333 0.174) 7.636 13.459 ( -7.437 -3.177 -6.536) 10.398 13.622 ( -2.983 0.813 2.364) 3.892 13.840 ( 3.404 -4.740 5.430) 7.971 14.310 ( 13.578 8.062 8.947) 18.149 14.669 ( -6.865 7.146 -11.804) 15.412 14.853 ( -9.181 -4.236 0.329) 10.117 14.963 ( 5.592 -8.292 8.395) 13.058 15.223 ( -1.776 0.848 -3.839) 4.314 15.411 ( -1.853 -2.993 -3.038) 4.650 15.779 ( 0.619 2.235 0.615) 2.400 15.842 ( 0.093 -1.179 1.820) 2.170 15.990 ( 7.741 5.563 -0.433) 9.543 16.093 ( 4.799 1.879 -1.087) 5.267 24.714 ( -1.906 1.081 1.651) 2.744 24.770 ( 0.398 1.002 -0.357) 1.135 24.850 ( 1.642 -0.490 2.561) 3.082 24.861 ( 0.051 1.004 -0.178) 1.021 24.978 ( -1.822 -0.437 6.782) 7.036 25.051 ( -4.350 -0.421 5.110) 6.724 25.193 ( 1.616 -0.783 4.977) 5.291 25.242 ( -2.543 -0.965 4.466) 5.229 26.336 ( -1.298 7.202 -1.425) 7.455 26.526 ( -2.464 -4.061 -1.227) 4.907 26.580 ( 2.276 -3.129 1.074) 4.015 27.031 ( 3.520 -16.302 -4.800) 17.354 28.573 ( -6.200 -0.555 -1.796) 6.479 28.681 ( -2.020 -5.713 -0.665) 6.096 29.517 ( 3.536 10.847 -5.377) 12.612 29.637 ( 9.961 5.882 -8.852) 14.566 ======================= Grid point 105 (55/104) ======================= q-point: ( 0.33 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( 2.114 -10.556 23.592) 25.933 1.561 ( -21.878 -16.263 6.620) 28.053 1.919 ( 11.869 5.497 6.946) 14.810 2.164 ( -3.274 -13.471 -1.497) 13.944 2.313 ( -8.804 2.620 -1.689) 9.339 2.642 ( 1.315 -11.243 -2.336) 11.558 2.656 ( -2.838 -12.700 -4.011) 13.617 2.809 ( 3.968 -8.602 5.447) 10.927 3.035 ( -2.991 -1.081 -1.486) 3.510 3.088 ( -7.099 7.077 -3.648) 10.667 3.219 ( -4.408 -9.180 -6.768) 12.227 3.388 ( 3.865 6.264 -0.569) 7.382 3.456 ( -1.226 -3.106 -2.827) 4.376 3.492 ( -2.360 -4.421 5.977) 7.800 3.547 ( 2.362 2.976 9.555) 10.282 3.726 ( -2.301 6.746 8.344) 10.974 4.164 ( 1.255 2.219 0.834) 2.682 4.230 ( -9.254 9.885 2.636) 13.795 4.351 ( 4.507 -2.379 8.552) 9.955 4.538 ( -4.399 6.104 1.378) 7.649 4.698 ( -4.425 4.679 -0.091) 6.440 4.851 ( -0.352 6.394 -7.052) 9.526 4.941 ( 0.592 8.961 0.590) 9.000 5.018 ( -1.385 -0.765 -6.178) 6.378 5.178 ( 3.035 -1.112 -1.399) 3.522 5.294 ( 2.468 2.317 2.222) 4.050 5.348 ( 3.146 -1.610 5.757) 6.756 5.450 ( 0.025 1.231 3.213) 3.441 5.516 ( -1.094 0.724 10.657) 10.737 5.851 ( 2.696 -0.829 -0.580) 2.879 5.942 ( 1.005 1.848 0.502) 2.162 6.078 ( -1.910 -1.244 1.563) 2.764 6.169 ( 1.033 -2.575 -0.578) 2.834 6.268 ( 0.366 0.179 1.341) 1.401 6.381 ( 2.459 5.331 -5.022) 7.726 6.623 ( 4.860 -5.191 -4.557) 8.446 6.683 ( -0.294 1.045 -1.383) 1.758 6.819 ( -0.990 -0.456 -3.204) 3.384 7.031 ( -1.103 1.642 2.398) 3.108 7.076 ( 5.185 5.078 -2.990) 7.850 7.183 ( 3.928 8.701 -2.776) 9.942 7.319 ( 11.018 3.092 4.348) 12.242 7.456 ( -0.556 0.348 -1.867) 1.979 7.473 ( -4.455 0.654 -5.696) 7.260 7.669 ( -6.736 0.142 -3.113) 7.422 7.821 ( 3.018 -2.439 5.997) 7.143 8.013 ( -1.623 -0.276 -4.222) 4.531 8.154 ( -2.556 -11.215 -5.714) 12.844 8.860 ( 0.045 4.285 3.398) 5.469 9.003 ( -0.291 3.659 -2.912) 4.686 9.245 ( -0.951 3.176 -1.491) 3.636 9.358 ( 3.444 0.249 6.915) 7.730 9.487 ( -1.270 -3.872 -6.659) 7.807 9.890 ( -2.339 -4.264 6.542) 8.152 10.095 ( -3.584 -1.914 -4.214) 5.853 10.204 ( -6.604 -3.806 0.964) 7.683 10.415 ( -7.570 5.816 2.293) 9.818 10.605 ( -0.346 4.490 -4.404) 6.299 10.969 ( 1.340 1.779 13.575) 13.756 11.244 ( 8.404 -5.785 -3.873) 10.913 11.315 ( 8.640 -19.264 -3.580) 21.414 11.568 ( -6.191 -9.946 -6.248) 13.277 11.675 ( 6.767 -0.505 3.382) 7.582 11.983 ( 3.481 -4.310 3.459) 6.532 12.793 ( -4.531 5.114 1.027) 6.909 12.940 ( -4.715 0.179 -3.762) 6.035 13.106 ( -2.885 7.986 -2.536) 8.862 13.308 ( -5.097 0.093 -8.272) 9.717 13.599 ( 0.731 4.741 1.501) 5.026 13.921 ( 1.191 -3.484 6.877) 7.801 14.411 ( -6.162 0.909 -9.846) 11.651 14.621 ( 4.407 7.825 6.229) 10.929 14.712 ( -1.231 -4.896 -3.115) 5.932 15.063 ( -0.208 -5.423 5.881) 8.003 15.219 ( 2.035 -1.308 0.024) 2.419 15.370 ( -0.505 -2.216 -0.516) 2.331 15.741 ( -2.557 3.112 -2.645) 4.819 15.863 ( 1.291 1.015 -3.576) 3.935 16.124 ( 6.735 5.704 0.378) 8.835 16.177 ( 3.642 2.356 0.573) 4.375 24.693 ( -1.185 1.370 1.291) 2.224 24.776 ( 0.545 0.235 -0.303) 0.667 24.857 ( -3.313 -0.141 3.203) 4.611 24.876 ( 1.547 1.714 -1.014) 2.522 24.997 ( 1.408 0.026 6.198) 6.355 25.028 ( -3.467 1.093 6.268) 7.246 25.221 ( -0.103 -2.145 0.998) 2.368 25.288 ( 1.214 -1.361 11.197) 11.345 26.336 ( 1.373 6.234 0.592) 6.411 26.459 ( -3.554 -2.953 -1.362) 4.817 26.629 ( 2.629 -3.461 -0.077) 4.346 27.010 ( -1.245 -13.421 -8.553) 15.964 28.487 ( -2.493 -1.234 0.604) 2.846 28.633 ( -2.559 -6.614 -0.182) 7.094 29.537 ( 2.333 11.069 -6.429) 13.012 29.729 ( 6.602 3.408 -10.226) 12.640 ======================= Grid point 106 (56/104) ======================= q-point: (-0.50 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( -16.214 -6.768 17.230) 24.609 1.551 ( 9.044 -17.285 16.127) 25.311 1.913 ( -14.931 7.062 -2.814) 16.755 2.148 ( 5.317 -5.787 2.588) 8.273 2.337 ( 8.002 3.375 1.585) 8.828 2.567 ( -3.725 -3.361 4.065) 6.457 2.683 ( 5.176 -12.013 -4.231) 13.748 2.909 ( -4.231 0.481 -7.887) 8.963 2.953 ( 6.342 -10.101 -1.888) 12.075 3.030 ( -0.967 2.209 2.276) 3.316 3.119 ( -1.174 -5.965 -3.239) 6.888 3.308 ( -6.859 3.650 -2.477) 8.155 3.449 ( 2.499 3.993 -7.399) 8.771 3.511 ( -12.659 3.536 14.285) 19.412 3.572 ( -1.865 -0.383 10.548) 10.718 3.718 ( -0.300 4.193 0.799) 4.278 4.165 ( 0.387 -2.017 -2.241) 3.039 4.194 ( 2.542 9.462 7.263) 12.196 4.445 ( 2.347 -5.357 5.317) 7.905 4.481 ( -2.908 5.248 1.089) 6.098 4.617 ( -4.055 4.547 -0.582) 6.120 4.836 ( 2.320 6.380 -2.812) 7.348 4.935 ( -0.833 2.114 -0.272) 2.288 5.010 ( 4.148 4.394 -7.114) 9.334 5.186 ( -1.329 -6.402 -1.792) 6.780 5.318 ( -0.943 0.325 1.106) 1.489 5.439 ( 1.415 -0.603 4.310) 4.576 5.477 ( 0.783 2.895 3.787) 4.830 5.558 ( -1.626 0.197 12.181) 12.291 5.930 ( 3.931 -5.051 0.678) 6.436 5.943 ( 0.935 1.073 0.176) 1.434 6.053 ( -2.616 5.605 5.691) 8.405 6.193 ( 3.025 -1.525 -6.431) 7.268 6.323 ( 5.459 3.283 5.474) 8.399 6.397 ( -1.163 1.242 -1.919) 2.564 6.620 ( -1.937 -0.148 -1.853) 2.685 6.655 ( 0.672 -5.742 -8.022) 9.888 6.799 ( 0.846 -2.165 -2.283) 3.258 6.960 ( -6.737 -2.310 -0.183) 7.124 7.123 ( -3.121 0.715 -4.226) 5.302 7.225 ( -2.259 0.624 -0.905) 2.512 7.331 ( 2.727 5.775 -0.436) 6.401 7.401 ( -1.060 -1.285 -5.337) 5.591 7.564 ( 5.271 4.832 -1.746) 7.361 7.655 ( 5.422 5.066 2.753) 7.915 7.871 ( -0.680 1.128 2.570) 2.888 7.930 ( 0.702 -0.605 1.412) 1.689 8.162 ( 2.184 -10.149 -2.627) 10.709 8.877 ( -0.513 3.576 3.864) 5.290 8.990 ( 0.861 3.749 -3.716) 5.348 9.195 ( -2.210 2.307 -2.674) 4.166 9.442 ( 1.111 -5.922 -6.557) 8.904 9.476 ( 2.710 1.719 8.920) 9.480 9.841 ( -5.747 -0.411 1.235) 5.892 9.995 ( -1.585 -4.350 -3.211) 5.634 10.126 ( -6.557 -7.954 2.445) 10.594 10.366 ( 2.337 7.461 1.452) 7.952 10.542 ( -0.294 3.672 -6.939) 7.856 11.107 ( 2.012 0.353 16.213) 16.341 11.329 ( 4.265 -7.062 -5.061) 9.678 11.334 ( -4.471 -11.113 -12.644) 17.417 11.508 ( 3.940 -6.539 6.982) 10.346 11.874 ( 10.214 -0.460 8.295) 13.166 12.138 ( 5.946 -1.714 6.852) 9.232 12.678 ( -6.232 3.053 -1.771) 7.162 12.815 ( -5.073 -0.743 -6.987) 8.666 13.023 ( -0.507 6.189 -8.594) 10.603 13.173 ( -2.706 -0.299 -9.559) 9.940 13.662 ( 3.373 5.461 3.050) 7.106 13.949 ( -2.427 -2.751 4.636) 5.912 14.245 ( -6.331 -2.415 -4.130) 7.935 14.534 ( -6.092 -9.751 -5.597) 12.788 14.869 ( 8.315 7.808 7.020) 13.394 15.075 ( -1.405 -2.397 4.112) 4.963 15.275 ( 4.352 0.835 1.937) 4.836 15.381 ( 0.771 1.572 0.407) 1.797 15.656 ( -4.163 4.400 -5.236) 8.007 15.844 ( 0.571 1.221 -7.729) 7.845 16.186 ( -1.982 2.630 1.988) 3.847 16.241 ( 3.305 2.712 1.213) 4.444 24.693 ( 0.195 0.955 1.605) 1.877 24.784 ( -0.329 -1.333 0.540) 1.476 24.807 ( -2.447 2.834 1.071) 3.894 24.894 ( 0.717 0.796 -0.449) 1.162 24.990 ( -4.185 2.562 5.310) 7.230 25.083 ( 2.614 -1.089 6.133) 6.755 25.228 ( -0.432 -3.654 3.252) 4.911 25.366 ( -1.217 -5.123 11.949) 13.058 26.387 ( 2.349 4.809 1.505) 5.560 26.410 ( 0.144 0.892 0.774) 1.190 26.662 ( 1.126 -3.031 -1.014) 3.388 26.896 ( -4.056 -8.192 -11.349) 14.573 28.485 ( 0.975 -2.613 1.664) 3.248 28.607 ( 0.332 -7.121 -0.266) 7.133 29.519 ( 0.232 11.107 -6.823) 13.037 29.748 ( 2.778 2.269 -11.564) 12.108 ======================= Grid point 107 (57/104) ======================= q-point: (-0.33 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.088 ( -14.560 -3.924 21.427) 26.202 1.629 ( -6.276 21.099 8.468) 23.585 1.864 ( 9.279 -20.379 6.615) 23.349 2.304 ( 9.901 -3.748 1.790) 10.737 2.432 ( 5.469 -3.033 -6.626) 9.111 2.586 ( -2.305 4.295 13.397) 14.256 2.671 ( -3.563 -7.121 -12.068) 14.458 2.849 ( 3.105 -6.102 -8.248) 10.720 2.983 ( -1.493 -1.521 -0.502) 2.190 3.031 ( -2.025 2.327 2.281) 3.837 3.127 ( 1.140 -2.632 3.423) 4.466 3.206 ( -5.607 13.876 11.672) 18.979 3.384 ( -3.014 0.851 7.033) 7.698 3.433 ( 2.187 7.844 -11.938) 14.451 3.591 ( -3.799 0.985 12.720) 13.311 3.734 ( 1.926 -0.833 -1.656) 2.673 4.218 ( 6.365 -4.270 1.485) 7.807 4.302 ( 3.612 8.301 3.208) 9.604 4.383 ( -3.065 -4.664 -8.644) 10.289 4.557 ( -0.301 5.267 0.645) 5.315 4.598 ( 4.401 -2.910 10.637) 11.874 4.870 ( -0.066 3.223 1.098) 3.405 4.900 ( -0.637 -2.672 -4.911) 5.627 5.052 ( 5.525 4.092 -8.761) 11.137 5.118 ( -4.471 -11.213 -0.381) 12.077 5.279 ( -3.104 1.607 -1.315) 3.735 5.443 ( -3.074 0.443 6.342) 7.062 5.522 ( 1.321 2.577 4.263) 5.154 5.600 ( -1.783 1.169 9.251) 9.494 5.929 ( 0.247 -3.752 0.006) 3.761 6.005 ( -0.822 4.280 1.022) 4.476 6.085 ( -0.799 3.013 4.790) 5.714 6.178 ( 1.960 3.454 -8.931) 9.774 6.326 ( -1.202 -5.345 -1.392) 5.652 6.477 ( 5.815 5.281 3.897) 8.768 6.537 ( -4.583 -5.804 -7.368) 10.439 6.659 ( 0.630 -2.196 1.206) 2.583 6.815 ( 1.015 -9.636 3.104) 10.175 6.834 ( -3.755 0.634 -2.334) 4.466 6.963 ( -8.217 2.819 -1.854) 8.883 7.107 ( -4.169 -3.398 -5.058) 7.383 7.400 ( 2.972 -4.632 2.396) 6.002 7.416 ( 1.314 6.711 -3.469) 7.668 7.610 ( -4.346 1.017 -0.955) 4.565 7.712 ( 6.925 4.557 1.079) 8.359 7.938 ( -0.441 4.733 0.324) 4.765 7.998 ( 5.606 4.331 6.268) 9.459 8.146 ( -1.868 -5.428 -3.211) 6.577 8.901 ( -0.124 2.919 2.404) 3.783 8.987 ( 3.102 3.613 -3.168) 5.719 9.155 ( -0.254 4.690 -2.347) 5.251 9.442 ( 2.238 -6.034 -5.118) 8.223 9.530 ( -1.998 0.700 5.755) 6.132 9.778 ( 0.277 0.543 -1.873) 1.970 9.968 ( -0.994 -6.461 0.057) 6.537 10.077 ( 1.747 -5.472 2.393) 6.222 10.429 ( 1.278 5.384 1.004) 5.624 10.555 ( 5.862 0.557 -5.367) 7.967 11.080 ( -9.692 -6.622 -6.679) 13.505 11.244 ( -0.615 -2.292 1.897) 3.039 11.385 ( 4.503 -3.173 0.776) 5.563 11.655 ( 5.630 -2.776 7.405) 9.708 12.084 ( 4.528 1.400 7.689) 9.033 12.130 ( -6.771 1.788 -0.969) 7.070 12.598 ( -5.105 5.145 1.042) 7.322 12.764 ( 7.018 -6.921 -6.545) 11.831 13.020 ( 6.449 3.416 -6.528) 9.792 13.143 ( 6.393 -1.071 -8.925) 11.031 13.714 ( -1.088 1.307 3.804) 4.167 13.897 ( -3.872 -0.088 0.299) 3.884 14.133 ( -6.930 -7.036 5.029) 11.083 14.405 ( -3.711 -9.188 -3.800) 10.613 15.041 ( 5.547 4.631 6.283) 9.576 15.072 ( -1.245 1.616 2.719) 3.399 15.387 ( 5.195 4.211 -0.009) 6.688 15.398 ( 2.230 6.162 0.987) 6.627 15.547 ( -3.421 3.196 -4.878) 6.761 15.795 ( 0.071 0.198 -9.713) 9.715 16.104 ( -8.133 1.827 2.528) 8.710 16.267 ( -1.913 -0.446 1.817) 2.676 24.720 ( 1.384 -0.037 2.161) 2.566 24.755 ( -2.199 0.756 1.418) 2.724 24.800 ( -0.269 0.683 -0.053) 0.736 24.896 ( -0.074 0.030 -0.201) 0.216 24.951 ( -3.330 3.866 4.364) 6.714 25.132 ( -0.065 0.266 1.769) 1.790 25.258 ( -0.406 -5.992 8.502) 10.409 25.369 ( -5.713 -10.768 9.363) 15.371 26.411 ( 1.991 1.813 1.592) 3.128 26.507 ( 5.240 3.427 3.773) 7.310 26.657 ( -0.685 -2.006 -0.526) 2.184 26.751 ( -3.227 -2.062 -11.551) 12.169 28.531 ( 3.619 -2.200 0.268) 4.243 28.646 ( 3.799 -7.077 -0.206) 8.035 29.473 ( -0.513 10.994 -6.093) 12.580 29.686 ( -1.400 3.079 -12.422) 12.875 ======================= Grid point 108 (58/104) ======================= q-point: (-0.17 0.29 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.932 ( -11.889 1.844 17.523) 21.255 1.662 ( -3.837 18.270 17.887) 25.854 2.077 ( 11.881 -19.975 0.125) 23.242 2.356 ( -5.012 -2.593 -4.720) 7.357 2.493 ( 0.357 -7.241 0.678) 7.281 2.579 ( 3.049 -8.701 -6.062) 11.034 2.648 ( 3.219 4.084 8.909) 10.316 2.826 ( -1.244 -2.582 0.066) 2.867 2.940 ( -2.590 -6.824 -6.384) 9.697 2.984 ( 0.599 0.186 5.956) 5.989 3.188 ( -3.620 16.952 17.560) 24.675 3.319 ( 7.839 6.805 7.801) 12.985 3.373 ( 0.602 6.577 -11.546) 13.301 3.413 ( 0.615 7.102 3.616) 7.993 3.654 ( 0.856 0.707 13.256) 13.303 3.748 ( 0.237 -5.977 -0.408) 5.996 4.213 ( -2.046 2.063 -14.391) 14.681 4.345 ( -2.051 -3.495 -4.455) 6.022 4.407 ( 7.173 -1.534 3.228) 8.014 4.585 ( 3.131 3.835 3.891) 6.297 4.687 ( -0.835 -1.293 0.402) 1.590 4.795 ( -1.545 1.232 -2.901) 3.510 4.941 ( 3.090 -4.691 1.148) 5.733 5.059 ( -0.873 -9.774 -1.352) 9.906 5.090 ( 3.278 -0.236 -3.777) 5.006 5.205 ( -3.072 3.778 -2.619) 5.529 5.432 ( -2.440 2.620 6.528) 7.445 5.571 ( -0.675 3.568 4.208) 5.558 5.580 ( -6.051 -0.094 6.592) 8.949 5.875 ( -8.685 0.113 -0.637) 8.709 5.940 ( -0.998 1.270 1.623) 2.290 6.046 ( 0.294 2.779 -1.787) 3.317 6.221 ( -0.446 -4.200 -5.518) 6.949 6.306 ( -2.154 -4.388 -2.566) 5.521 6.428 ( 0.718 0.397 -1.977) 2.140 6.518 ( -1.363 -0.450 -0.635) 1.569 6.667 ( 1.062 2.051 -0.636) 2.395 6.781 ( -0.947 2.759 -1.275) 3.184 6.860 ( 1.322 5.969 -1.196) 6.230 6.926 ( 1.984 -7.060 1.144) 7.422 7.120 ( 6.869 -4.405 3.798) 9.001 7.374 ( -2.683 6.393 -1.597) 7.114 7.443 ( -3.748 -1.283 1.500) 4.236 7.523 ( -0.724 -10.445 1.396) 10.563 7.790 ( 0.529 6.267 -2.113) 6.635 7.889 ( -3.568 4.875 -1.766) 6.294 8.049 ( -1.927 1.975 -0.400) 2.788 8.159 ( 4.287 0.897 4.532) 6.302 8.880 ( -1.916 2.492 1.418) 3.449 9.091 ( 7.696 2.888 -6.932) 10.753 9.143 ( 0.248 4.799 0.698) 4.856 9.433 ( -0.479 -5.349 -4.148) 6.785 9.521 ( 0.630 4.421 0.037) 4.466 9.803 ( 1.594 -1.840 1.545) 2.883 10.010 ( 4.583 -5.914 4.935) 8.963 10.189 ( 8.364 -1.726 -1.651) 8.698 10.407 ( -3.125 2.574 -0.018) 4.049 10.632 ( 4.128 -1.248 -2.228) 4.854 10.876 ( -7.867 -4.774 -2.436) 9.519 11.212 ( -2.314 -5.784 -2.191) 6.604 11.406 ( -3.028 -0.702 -5.317) 6.158 11.720 ( -3.116 7.837 -1.771) 8.618 12.046 ( 2.712 -7.769 3.610) 8.986 12.108 ( -6.134 -2.226 -1.319) 6.657 12.572 ( 3.545 6.453 1.309) 7.478 12.858 ( 6.134 -4.276 -5.549) 9.312 13.158 ( 6.525 1.682 -5.412) 8.643 13.288 ( 12.971 0.377 3.014) 13.322 13.677 ( -2.165 -1.846 2.595) 3.850 13.854 ( -3.695 -0.217 3.389) 5.018 14.021 ( -7.815 -6.042 4.567) 10.883 14.428 ( 6.611 -9.737 5.956) 13.190 15.006 ( -5.833 4.059 -1.520) 7.267 15.157 ( 2.326 1.260 3.916) 4.726 15.390 ( -2.335 7.675 -6.914) 10.590 15.489 ( 7.061 7.295 2.955) 10.574 15.524 ( 0.825 1.211 -4.908) 5.122 15.755 ( 2.513 -0.518 -4.726) 5.377 15.963 ( -7.962 1.689 3.518) 8.867 16.193 ( -7.083 -3.266 2.056) 8.066 24.735 ( -1.228 0.583 2.380) 2.741 24.761 ( 1.585 -0.714 0.707) 1.877 24.788 ( -0.704 0.745 1.003) 1.435 24.894 ( -0.215 -0.049 -0.211) 0.305 24.926 ( -2.026 3.708 4.022) 5.833 25.127 ( -0.861 0.179 1.379) 1.636 25.263 ( -6.552 -4.125 5.966) 9.774 25.309 ( -4.677 -12.941 9.099) 16.497 26.474 ( 2.705 -0.530 3.366) 4.350 26.529 ( -3.341 4.782 -5.739) 8.183 26.587 ( -2.200 -2.638 -5.488) 6.474 26.788 ( 8.058 -3.027 4.200) 9.577 28.618 ( 5.877 -2.647 -1.488) 6.615 28.712 ( 3.201 -5.730 -1.892) 6.831 29.445 ( 1.932 10.821 -5.192) 12.157 29.567 ( -2.906 7.010 -10.120) 12.649 ======================= Grid point 109 (59/104) ======================= q-point: ( 0.00 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.182 ( 1.946 21.546 4.525) 22.102 1.670 ( 3.717 -24.364 -1.593) 24.697 1.971 ( -10.543 9.718 7.902) 16.372 2.180 ( -4.063 -2.744 -5.992) 7.742 2.222 ( -6.655 -5.683 -7.970) 11.837 2.378 ( -4.010 -13.583 -5.453) 15.176 2.642 ( -3.088 2.650 8.233) 9.184 2.739 ( -1.208 -6.359 5.533) 8.516 2.971 ( 7.788 3.558 -1.237) 8.652 3.040 ( 6.865 -3.289 0.468) 7.627 3.403 ( -0.309 4.801 -5.316) 7.169 3.463 ( -3.641 2.612 5.770) 7.306 3.546 ( -2.869 0.639 5.940) 6.627 3.597 ( -5.645 -1.892 6.768) 9.014 3.785 ( -1.985 19.420 8.126) 21.145 3.873 ( 1.086 8.926 -1.691) 9.149 4.046 ( -7.802 -7.278 -1.193) 10.736 4.076 ( 3.641 -8.874 -7.766) 12.342 4.536 ( 3.970 5.088 3.572) 7.376 4.615 ( -0.816 -1.156 4.653) 4.864 4.742 ( 0.311 -1.157 7.817) 7.908 4.799 ( 4.412 -6.962 0.716) 8.274 4.931 ( 6.820 1.642 1.054) 7.094 4.964 ( 6.478 -3.310 -1.564) 7.441 5.161 ( 0.839 3.237 -4.506) 5.611 5.200 ( -0.209 -0.349 -2.909) 2.937 5.473 ( -9.124 3.142 5.152) 10.939 5.514 ( -8.579 -0.888 3.793) 9.422 5.559 ( -1.277 7.106 0.247) 7.224 5.706 ( -0.122 -6.848 -0.278) 6.855 6.030 ( 1.937 2.237 3.328) 4.453 6.047 ( 1.649 -0.720 -0.822) 1.978 6.128 ( -0.933 1.994 -5.300) 5.739 6.184 ( -1.981 -3.101 -2.468) 4.430 6.401 ( -0.930 -0.132 1.233) 1.551 6.455 ( -1.122 -5.053 0.241) 5.182 6.764 ( 3.417 4.378 -0.332) 5.563 6.825 ( 2.651 -1.754 -0.810) 3.280 6.997 ( 4.365 7.546 2.455) 9.057 7.111 ( 1.022 8.668 2.146) 8.988 7.154 ( 6.543 -4.950 3.351) 8.863 7.316 ( 0.428 -5.999 -5.128) 7.903 7.415 ( 0.813 -1.495 5.500) 5.758 7.439 ( 0.803 -0.878 1.882) 2.227 7.808 ( -5.198 4.158 -3.775) 7.652 7.838 ( -4.062 0.560 -1.920) 4.528 8.071 ( -2.335 4.309 -4.194) 6.450 8.183 ( 0.668 -6.267 -2.402) 6.745 8.958 ( 0.230 6.395 -0.450) 6.415 9.075 ( 0.581 -4.804 -2.406) 5.404 9.276 ( 1.873 5.725 1.159) 6.134 9.352 ( 0.650 -0.850 -4.879) 4.995 9.646 ( -1.159 3.416 -3.515) 5.037 9.736 ( 0.198 -6.344 -1.229) 6.465 10.170 ( 12.227 4.314 7.745) 15.102 10.317 ( 10.666 -9.298 7.019) 15.795 10.395 ( -6.630 11.114 -5.207) 13.950 10.566 ( -8.644 -5.727 -2.579) 10.685 10.736 ( -0.200 1.857 0.121) 1.872 10.890 ( 0.925 -14.336 -4.266) 14.986 11.412 ( -9.160 13.189 -4.786) 16.756 11.662 ( -12.036 -8.979 -6.299) 16.283 11.812 ( -1.278 3.145 -5.790) 6.712 11.951 ( -2.207 -8.486 -4.390) 9.806 12.854 ( 8.824 6.826 3.337) 11.644 12.934 ( 7.035 -1.907 4.504) 8.569 13.275 ( -1.462 9.406 -1.435) 9.626 13.451 ( 1.671 -8.060 -0.795) 8.269 13.629 ( -3.749 -1.138 4.145) 5.704 13.655 ( 1.414 -3.301 4.237) 5.554 14.216 ( 10.519 11.145 8.781) 17.663 14.446 ( 11.848 -12.559 10.858) 20.396 14.966 ( -7.739 6.057 -3.748) 10.518 15.068 ( -8.057 -4.247 -2.932) 9.568 15.380 ( -5.293 3.886 -7.564) 10.017 15.438 ( -3.396 -2.251 -8.003) 8.980 15.737 ( 4.683 4.239 2.595) 6.829 15.811 ( 2.664 -3.201 0.003) 4.165 15.961 ( 1.680 3.996 2.974) 5.257 16.029 ( -0.356 -3.137 2.252) 3.878 24.746 ( -0.253 1.185 1.949) 2.296 24.772 ( 0.622 -1.133 1.101) 1.698 24.822 ( -0.053 2.099 1.705) 2.705 24.864 ( -0.784 -1.746 0.507) 1.980 24.986 ( -1.332 2.899 3.777) 4.944 25.047 ( -2.916 -3.525 3.406) 5.704 25.171 ( -1.154 1.426 5.044) 5.367 25.212 ( -1.722 -2.856 5.404) 6.350 26.488 ( -1.054 0.039 0.123) 1.062 26.503 ( -0.735 -1.766 -1.733) 2.581 26.577 ( -0.707 7.636 -3.528) 8.441 26.742 ( 1.785 -9.530 -2.368) 9.980 28.629 ( -0.122 -0.713 -0.782) 1.066 28.647 ( -0.634 -2.370 -1.949) 3.133 29.619 ( 4.318 3.878 -5.150) 7.760 29.634 ( 4.346 2.624 -6.413) 8.180 ======================= Grid point 110 (60/104) ======================= q-point: ( 0.17 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.174 ( -8.843 14.206 11.761) 20.453 1.584 ( -15.797 -26.036 0.502) 30.457 1.902 ( 2.708 16.724 9.293) 19.323 2.077 ( -1.995 1.325 -7.593) 7.962 2.181 ( 5.426 -12.876 -5.421) 14.987 2.284 ( -1.727 -17.699 -2.143) 17.912 2.648 ( -2.961 2.812 6.384) 7.578 2.727 ( -4.514 -5.329 6.412) 9.481 3.072 ( 2.851 3.206 -2.325) 4.880 3.146 ( 3.720 -4.211 -1.928) 5.940 3.349 ( -1.062 2.687 -3.006) 4.169 3.401 ( -3.365 -2.123 -2.815) 4.874 3.430 ( -9.484 6.058 2.349) 11.496 3.529 ( -7.238 -2.637 5.404) 9.410 3.726 ( -4.192 8.007 -6.323) 11.031 3.809 ( -1.480 3.085 4.326) 5.515 4.104 ( 5.373 -1.542 8.793) 10.419 4.132 ( 2.954 -2.023 2.346) 4.280 4.580 ( -1.207 9.600 2.513) 9.997 4.639 ( 0.005 1.747 5.096) 5.387 4.765 ( -3.625 -1.171 7.407) 8.329 4.870 ( 1.475 -7.701 0.230) 7.845 5.027 ( 1.677 0.629 -1.939) 2.639 5.041 ( 3.228 1.243 2.316) 4.163 5.138 ( 0.412 2.392 -6.241) 6.696 5.193 ( 1.301 -2.433 -1.755) 3.270 5.382 ( -2.709 4.464 5.328) 7.461 5.441 ( -0.553 -1.422 4.701) 4.942 5.561 ( -0.725 8.179 0.575) 8.232 5.735 ( 1.570 -8.035 -0.299) 8.192 6.038 ( -0.655 4.679 -3.116) 5.660 6.082 ( 0.105 0.040 1.585) 1.588 6.108 ( 2.456 0.544 -2.611) 3.626 6.176 ( 1.845 -4.563 2.659) 5.594 6.428 ( 3.104 -0.372 -0.821) 3.233 6.450 ( 2.025 -2.837 -1.789) 3.918 6.789 ( -1.535 3.709 -0.513) 4.046 6.835 ( -1.104 -1.386 -1.142) 2.108 7.103 ( 4.435 6.297 2.854) 8.214 7.151 ( 1.431 5.407 2.426) 6.096 7.225 ( 6.344 7.091 -1.988) 9.720 7.320 ( 2.577 2.703 -2.346) 4.411 7.439 ( -1.670 -4.002 -2.705) 5.111 7.468 ( 0.703 -9.506 2.206) 9.784 7.714 ( -2.526 2.198 -0.914) 3.471 7.767 ( -3.876 -1.750 -2.416) 4.891 7.994 ( -2.394 5.290 -2.849) 6.467 8.151 ( -3.398 -9.124 -3.225) 10.256 8.960 ( 0.157 7.021 -0.092) 7.023 9.071 ( 0.170 -3.140 -2.628) 4.098 9.308 ( -0.095 2.838 -5.210) 5.934 9.330 ( 1.997 3.739 -0.206) 4.244 9.569 ( -4.038 3.572 -2.671) 6.016 9.727 ( -1.094 -10.225 3.767) 10.952 10.197 ( -6.174 4.386 -4.187) 8.654 10.293 ( -9.838 -5.672 1.214) 11.421 10.518 ( 9.220 4.557 6.382) 12.104 10.592 ( 10.203 -0.492 -0.435) 10.224 10.794 ( 6.221 -2.779 4.463) 8.145 10.913 ( 1.107 -11.860 0.626) 11.928 11.232 ( -6.336 10.227 -2.897) 12.375 11.448 ( -7.360 -10.519 -3.653) 13.348 11.740 ( -1.365 4.895 -5.883) 7.774 11.872 ( -2.349 -8.178 -4.776) 9.757 12.963 ( -1.704 6.146 4.856) 8.016 13.016 ( -1.474 -0.056 2.924) 3.275 13.255 ( 1.441 6.822 -2.153) 7.297 13.373 ( -2.813 -5.571 -5.078) 8.046 13.653 ( 1.100 2.922 2.862) 4.236 13.737 ( 3.771 -5.548 4.448) 8.049 14.489 ( 10.011 10.660 9.200) 17.277 14.697 ( 3.844 -10.304 5.939) 12.498 14.789 ( -6.827 4.527 -5.571) 9.907 14.865 ( -6.401 -3.400 -2.870) 7.795 15.256 ( -3.097 2.994 -4.786) 6.439 15.333 ( -3.058 -4.656 -4.448) 7.129 15.809 ( 0.595 1.102 1.454) 1.919 15.825 ( 0.765 -0.756 2.275) 2.516 16.078 ( 8.285 3.220 -0.835) 8.928 16.109 ( 6.912 -0.230 -0.901) 6.974 24.743 ( -1.253 1.845 1.351) 2.607 24.776 ( -0.550 -1.072 0.202) 1.221 24.845 ( 0.684 0.712 2.643) 2.821 24.864 ( 0.545 -0.730 0.921) 1.295 24.997 ( -0.374 2.001 4.069) 4.550 25.034 ( -1.178 -1.533 4.033) 4.473 25.190 ( -0.268 0.618 4.730) 4.778 25.215 ( -1.298 -1.683 5.268) 5.681 26.453 ( -1.287 2.649 -1.551) 3.328 26.473 ( -2.015 -1.435 -0.232) 2.484 26.574 ( 1.608 5.295 -1.578) 5.754 26.759 ( 2.167 -12.427 -3.853) 13.190 28.570 ( -4.722 0.526 -1.000) 4.856 28.600 ( -3.346 -2.833 -0.569) 4.421 29.667 ( 4.622 4.880 -5.907) 8.948 29.704 ( 6.538 0.914 -6.976) 9.604 ======================= Grid point 111 (61/104) ======================= q-point: ( 0.33 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.110 ( -6.553 -0.531 22.350) 23.297 1.265 ( -19.700 -14.440 13.079) 27.707 2.025 ( 0.755 3.273 -0.586) 3.410 2.109 ( 9.146 8.433 -3.893) 13.035 2.212 ( 7.089 -10.419 -2.050) 12.768 2.358 ( 5.940 -12.826 -3.123) 14.475 2.590 ( -6.199 2.435 6.319) 9.181 2.677 ( -4.396 -5.912 7.342) 10.401 3.031 ( -4.378 0.999 -2.952) 5.374 3.084 ( -4.833 -4.839 -6.386) 9.357 3.231 ( -6.306 7.104 -6.203) 11.345 3.352 ( -3.100 -5.684 -4.598) 7.941 3.444 ( 2.116 0.217 7.131) 7.441 3.455 ( 2.496 -0.740 6.279) 6.798 3.707 ( 1.485 9.922 0.222) 10.035 3.809 ( -1.518 0.366 3.202) 3.563 4.178 ( -0.176 0.298 2.750) 2.772 4.220 ( 1.558 -4.837 7.188) 8.803 4.545 ( -5.745 16.405 5.130) 18.123 4.639 ( -2.259 4.394 1.708) 5.227 4.716 ( -4.422 -1.777 3.650) 6.003 4.848 ( -3.017 -9.733 -0.379) 10.197 5.014 ( -1.548 2.230 -2.471) 3.671 5.082 ( -0.065 0.004 2.848) 2.849 5.117 ( 1.399 1.971 -6.665) 7.090 5.219 ( 2.124 -4.887 -1.187) 5.459 5.426 ( 2.798 5.241 5.459) 8.068 5.488 ( 0.507 0.353 4.510) 4.552 5.560 ( 0.925 6.241 2.230) 6.692 5.748 ( 1.096 -9.711 -1.146) 9.839 6.005 ( -0.957 3.524 -1.784) 4.064 6.053 ( -0.765 -1.691 -2.530) 3.138 6.186 ( 3.586 4.075 3.462) 6.438 6.253 ( 3.228 -2.386 5.528) 6.832 6.463 ( 2.511 2.803 -3.388) 5.063 6.518 ( 5.228 -4.149 -4.253) 7.914 6.721 ( -4.585 2.489 -1.542) 5.440 6.776 ( -3.502 -3.194 -2.809) 5.510 7.131 ( -2.724 6.561 1.277) 7.217 7.174 ( 1.894 3.461 -2.801) 4.839 7.334 ( -0.535 5.573 -0.036) 5.598 7.371 ( 2.359 1.062 -4.073) 4.825 7.442 ( 1.659 -2.136 -2.977) 4.022 7.465 ( 6.672 -0.537 -1.697) 6.906 7.661 ( -0.727 2.375 -0.162) 2.489 7.772 ( 6.200 -5.747 3.951) 9.332 7.953 ( -1.714 -1.450 0.031) 2.245 8.005 ( -9.291 -4.901 -4.186) 11.308 8.964 ( -0.177 6.092 1.393) 6.252 9.049 ( -0.348 -1.162 -2.350) 2.645 9.257 ( -0.566 2.137 -6.188) 6.571 9.344 ( 0.094 -4.997 -5.869) 7.709 9.541 ( 0.594 10.519 5.884) 12.068 9.753 ( -0.256 -10.061 7.059) 12.293 10.074 ( -6.263 0.195 -2.806) 6.866 10.117 ( -8.349 -4.276 -0.800) 9.415 10.579 ( -2.925 9.663 -1.751) 10.247 10.672 ( 0.142 1.200 -6.619) 6.728 10.960 ( 4.865 -2.913 9.293) 10.886 11.008 ( 7.006 -10.692 7.514) 14.828 11.202 ( 3.983 3.800 -0.929) 5.583 11.356 ( -1.973 -10.743 -0.922) 10.962 11.747 ( 5.129 5.842 0.961) 7.833 11.870 ( 4.511 -6.796 2.150) 8.435 12.886 ( -6.332 4.054 -1.321) 7.634 12.935 ( -6.132 -1.167 -2.550) 6.743 13.233 ( -3.152 4.892 -4.361) 7.272 13.293 ( -3.678 -1.744 -7.056) 8.146 13.708 ( 2.999 6.542 3.583) 8.039 13.831 ( 2.820 -5.960 5.519) 8.599 14.455 ( -8.875 4.038 -9.700) 13.754 14.556 ( -9.572 -6.193 -7.088) 13.425 14.823 ( 7.370 7.778 7.797) 13.252 14.952 ( 3.422 -6.192 8.280) 10.891 15.232 ( 2.298 2.728 -0.737) 3.642 15.305 ( 1.964 -4.279 -0.409) 4.726 15.799 ( -1.111 2.850 -1.735) 3.517 15.847 ( 0.434 -2.075 -1.700) 2.717 16.207 ( 6.219 2.364 -1.815) 6.896 16.215 ( 4.651 1.207 -1.006) 4.909 24.726 ( -1.112 2.013 0.865) 2.457 24.763 ( -0.774 -1.592 0.244) 1.788 24.864 ( -0.467 0.964 2.168) 2.418 24.884 ( 0.729 -0.769 0.388) 1.129 25.020 ( 0.273 2.095 4.282) 4.774 25.047 ( -0.790 0.028 5.453) 5.510 25.199 ( -1.039 0.588 2.564) 2.829 25.243 ( -0.572 -3.077 7.622) 8.240 26.437 ( -0.258 1.545 -0.782) 1.751 26.445 ( -0.139 1.923 0.950) 2.149 26.599 ( 1.784 3.034 -0.740) 3.597 26.762 ( 0.965 -11.969 -5.004) 13.009 28.488 ( -3.266 1.272 -0.092) 3.506 28.535 ( -3.120 -3.723 -0.194) 4.861 29.698 ( 3.044 5.782 -7.242) 9.754 29.758 ( 4.379 -0.634 -8.238) 9.352 ======================= Grid point 112 (62/104) ======================= q-point: (-0.50 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.118 ( -8.979 -0.826 22.518) 24.256 1.241 ( 4.677 -13.222 20.895) 25.165 2.054 ( 1.530 8.316 -1.231) 8.545 2.144 ( 3.249 2.232 -5.032) 6.393 2.332 ( -1.402 -3.435 -4.594) 5.905 2.417 ( 7.101 -11.785 -1.266) 13.817 2.595 ( 3.014 6.134 12.852) 14.556 2.762 ( 8.821 -10.103 5.153) 14.368 2.908 ( -4.882 1.399 -7.940) 9.425 2.966 ( -3.925 -4.405 -4.785) 7.597 3.158 ( 0.998 4.837 -2.806) 5.681 3.255 ( -3.435 -5.083 -4.420) 7.562 3.539 ( -0.567 2.121 8.889) 9.156 3.550 ( 1.830 0.434 11.135) 11.293 3.721 ( -1.945 10.672 4.017) 11.567 3.796 ( 0.025 2.116 0.680) 2.223 4.142 ( -3.994 1.773 -0.920) 4.466 4.273 ( 1.213 -9.552 1.942) 9.822 4.473 ( -4.272 16.875 4.963) 18.101 4.585 ( -3.726 5.370 0.965) 6.607 4.652 ( -4.267 -1.392 1.266) 4.663 4.795 ( -2.130 -12.501 0.314) 12.685 4.950 ( -2.604 2.258 -5.180) 6.222 5.044 ( -3.709 -6.999 -3.582) 8.693 5.128 ( 2.353 6.724 -2.271) 7.478 5.246 ( 1.127 -5.135 -0.290) 5.265 5.499 ( 0.648 4.803 3.384) 5.911 5.526 ( 2.275 1.677 3.801) 4.737 5.608 ( 0.669 5.269 6.316) 8.252 5.778 ( 2.534 -10.188 -0.108) 10.499 5.998 ( 1.577 3.574 0.278) 3.916 6.066 ( 2.436 -3.582 1.690) 4.650 6.249 ( 1.475 7.718 1.031) 7.925 6.353 ( 4.079 -1.258 5.772) 7.179 6.434 ( -4.220 2.309 -5.999) 7.689 6.530 ( -0.656 -6.670 -6.649) 9.441 6.638 ( -1.659 2.058 -1.851) 3.227 6.707 ( -1.976 -5.377 -2.079) 6.094 7.038 ( -6.391 7.527 -2.077) 10.091 7.157 ( -2.704 -2.737 -4.050) 5.586 7.228 ( -9.708 3.938 -2.492) 10.768 7.319 ( -3.116 -3.518 -2.155) 5.170 7.480 ( 6.008 5.688 -4.072) 9.221 7.582 ( 5.903 -4.039 -2.667) 7.634 7.775 ( 2.429 8.252 -0.541) 8.619 7.884 ( 3.669 1.726 6.449) 7.618 7.924 ( 3.602 -1.266 6.047) 7.152 7.963 ( 4.875 -9.768 -0.051) 10.917 8.966 ( -0.175 5.302 1.157) 5.430 9.038 ( 0.453 -0.662 -2.795) 2.907 9.228 ( 1.623 2.652 -5.687) 6.481 9.313 ( 1.554 -5.922 -6.168) 8.690 9.601 ( -0.272 9.443 8.565) 12.752 9.776 ( -2.513 -7.107 6.025) 9.650 9.940 ( -4.805 -0.985 -2.930) 5.713 9.979 ( -6.448 -5.622 -0.945) 8.607 10.528 ( 0.738 7.855 -4.231) 8.953 10.596 ( -0.839 0.862 -8.408) 8.493 11.070 ( -0.822 -2.751 7.590) 8.115 11.123 ( 1.521 -8.364 3.784) 9.305 11.284 ( 4.353 2.741 1.706) 5.420 11.384 ( 4.980 -6.520 4.784) 9.497 11.933 ( 10.812 5.500 7.903) 14.477 12.052 ( 9.680 -6.359 7.877) 14.006 12.740 ( -6.989 3.723 -5.168) 9.456 12.800 ( -6.156 -2.015 -5.941) 8.789 13.116 ( -2.740 3.490 -9.625) 10.598 13.159 ( -3.976 -1.256 -9.805) 10.654 13.776 ( 0.951 6.256 4.257) 7.627 13.883 ( -1.143 -4.631 5.455) 7.247 14.249 ( -7.352 3.445 -7.398) 10.984 14.363 ( -6.804 -8.001 -6.900) 12.567 14.981 ( 4.950 3.890 7.312) 9.649 15.034 ( 1.572 -2.183 6.097) 6.664 15.317 ( 6.131 3.237 2.168) 7.264 15.373 ( 4.023 -2.095 1.661) 4.830 15.743 ( -2.747 4.447 -5.220) 7.387 15.818 ( -0.919 -3.201 -5.787) 6.677 16.239 ( -1.467 2.633 -0.184) 3.020 16.270 ( 1.065 -0.141 -0.989) 1.460 24.718 ( -0.445 1.658 1.126) 2.053 24.753 ( -0.751 -1.877 0.659) 2.126 24.856 ( -1.161 2.198 0.768) 2.602 24.889 ( -0.151 -1.196 -0.204) 1.223 25.044 ( -1.282 2.629 4.451) 5.326 25.079 ( 0.283 -0.401 7.173) 7.190 25.190 ( -1.658 0.890 2.215) 2.907 25.262 ( -2.672 -5.424 7.162) 9.374 26.438 ( 0.434 3.186 1.283) 3.462 26.478 ( 2.504 1.298 1.235) 3.079 26.624 ( 1.158 1.306 -0.207) 1.758 26.733 ( -0.142 -8.268 -6.102) 10.277 28.465 ( 0.632 0.480 0.402) 0.889 28.504 ( 0.196 -3.673 -0.246) 3.686 29.685 ( 0.717 6.274 -7.943) 10.147 29.757 ( 1.543 -1.494 -9.273) 9.519 ======================= Grid point 113 (63/104) ======================= q-point: (-0.33 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.130 ( -4.939 9.774 15.571) 19.036 1.443 ( 5.655 -21.432 9.885) 24.270 2.035 ( -0.794 19.479 3.511) 19.809 2.244 ( 8.106 -3.006 -4.541) 9.766 2.339 ( 3.908 -3.109 -3.475) 6.084 2.471 ( 0.584 -13.522 2.673) 13.796 2.717 ( -2.558 8.267 9.507) 12.856 2.817 ( 2.724 3.001 -13.016) 13.632 2.882 ( -2.728 -7.769 1.955) 8.463 2.919 ( 2.288 -7.495 -7.155) 10.611 3.170 ( 3.888 5.583 4.561) 8.191 3.288 ( 8.178 -5.491 4.656) 10.895 3.523 ( -8.186 8.449 16.594) 20.341 3.599 ( -4.138 -0.931 11.782) 12.522 3.726 ( 2.941 17.144 -6.278) 18.493 3.837 ( 3.194 9.038 -0.027) 9.586 4.093 ( 0.431 -5.681 0.716) 5.743 4.232 ( -3.471 -12.884 -5.682) 14.502 4.481 ( 0.558 9.962 3.717) 10.648 4.562 ( -1.620 1.980 7.314) 7.748 4.614 ( -0.285 0.579 3.599) 3.657 4.769 ( -1.078 -12.184 -1.312) 12.302 4.864 ( -1.756 0.327 -7.754) 7.957 4.937 ( -4.722 -7.103 -4.400) 9.598 5.150 ( 2.095 5.716 -3.192) 6.874 5.248 ( -0.252 -3.979 -1.523) 4.268 5.516 ( -1.017 5.548 4.570) 7.260 5.585 ( 0.104 -0.984 5.561) 5.648 5.652 ( 0.886 7.727 4.396) 8.934 5.819 ( 1.457 -8.048 0.031) 8.179 6.065 ( 3.308 3.617 2.267) 5.400 6.123 ( -0.600 -0.688 5.567) 5.641 6.232 ( -4.907 1.304 -10.830) 11.961 6.246 ( -3.937 -1.974 -6.208) 7.612 6.459 ( 0.298 -1.001 -0.295) 1.085 6.487 ( 2.363 -2.796 2.313) 4.331 6.651 ( 1.844 0.515 2.491) 3.142 6.685 ( 0.475 -3.835 2.666) 4.694 6.900 ( -5.495 4.953 -3.470) 8.171 6.988 ( -8.229 -3.605 -4.267) 9.946 7.113 ( -2.596 7.588 -0.684) 8.049 7.283 ( -1.073 -8.288 0.971) 8.414 7.518 ( 0.073 3.688 -3.298) 4.948 7.570 ( -3.657 -2.569 -3.026) 5.397 7.846 ( 5.339 7.748 0.862) 9.449 7.973 ( -0.143 -3.996 2.395) 4.661 8.058 ( 7.006 1.680 4.803) 8.659 8.072 ( 4.991 -0.267 -1.601) 5.249 8.977 ( -0.109 4.522 0.229) 4.530 9.031 ( 1.912 -0.109 -2.438) 3.100 9.240 ( 2.503 4.028 -4.596) 6.603 9.321 ( 2.665 -5.406 -4.577) 7.569 9.619 ( -1.687 7.164 5.352) 9.100 9.740 ( -2.704 -4.493 1.720) 5.519 9.886 ( -0.175 -1.165 0.529) 1.292 9.945 ( 2.452 -6.877 3.201) 7.972 10.543 ( 2.235 4.752 -3.317) 6.211 10.573 ( 3.581 0.775 -6.412) 7.385 11.000 ( -6.815 0.358 -3.801) 7.811 11.110 ( -2.796 -9.284 -3.707) 10.380 11.427 ( 6.613 6.184 9.437) 13.078 11.562 ( 8.762 -6.850 9.185) 14.424 12.125 ( 1.880 2.305 5.642) 6.378 12.150 ( -5.586 -0.057 1.019) 5.678 12.649 ( -1.143 0.949 -2.253) 2.699 12.675 ( 2.199 -2.428 -6.278) 7.081 13.076 ( 5.284 2.406 -7.488) 9.475 13.114 ( 6.420 -1.770 -7.378) 9.939 13.768 ( -5.037 4.290 3.968) 7.714 13.859 ( -4.950 -4.487 5.267) 8.507 14.106 ( -4.881 4.268 -2.398) 6.913 14.237 ( -3.215 -8.381 -3.247) 9.546 15.087 ( 1.406 1.444 5.281) 5.653 15.100 ( 2.496 0.400 5.207) 5.788 15.442 ( 4.295 2.002 0.899) 4.824 15.460 ( 5.872 0.394 1.705) 6.128 15.648 ( -2.708 6.650 -6.972) 10.008 15.757 ( -0.543 -4.167 -8.199) 9.213 16.158 ( -7.601 3.741 1.406) 8.587 16.230 ( -5.219 -3.284 0.699) 6.205 24.725 ( 0.256 0.647 1.689) 1.827 24.743 ( -0.813 -1.159 0.972) 1.718 24.839 ( -1.037 2.610 0.438) 2.842 24.881 ( -0.377 -1.602 -0.272) 1.668 25.032 ( -2.753 4.509 3.961) 6.603 25.125 ( -0.891 -4.973 7.335) 8.906 25.166 ( -2.340 1.631 2.519) 3.806 25.236 ( -4.176 -4.932 6.029) 8.838 26.460 ( 0.921 3.398 1.195) 3.718 26.526 ( 1.125 -2.476 0.771) 2.826 26.642 ( 1.262 1.995 -0.560) 2.427 26.700 ( 0.685 -3.225 -4.844) 5.860 28.509 ( 3.991 0.140 -0.208) 3.999 28.543 ( 4.098 -3.591 -0.256) 5.455 29.637 ( -0.405 6.165 -7.442) 9.672 29.706 ( -0.616 -1.178 -9.274) 9.368 ======================= Grid point 114 (64/104) ======================= q-point: (-0.17 0.43 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.130 ( -1.148 18.604 6.334) 19.687 1.573 ( 5.955 -25.608 1.247) 26.321 2.058 ( -3.242 16.900 7.647) 18.831 2.311 ( 1.291 -9.895 -6.333) 11.818 2.328 ( -2.358 1.135 -9.755) 10.100 2.451 ( -2.356 -8.782 0.654) 9.116 2.702 ( -6.601 2.877 7.927) 10.709 2.761 ( -3.615 -1.676 -3.044) 5.014 2.863 ( 4.513 -1.210 -5.926) 7.546 2.910 ( 4.587 -5.294 4.121) 8.127 3.362 ( 8.202 5.512 3.529) 10.494 3.442 ( 0.129 2.289 7.769) 8.100 3.530 ( 0.981 1.447 11.226) 11.362 3.579 ( -4.917 0.051 12.990) 13.890 3.750 ( 4.981 16.524 -6.051) 18.289 3.865 ( -1.926 20.080 3.031) 20.399 4.081 ( 1.188 -14.880 -9.691) 17.797 4.199 ( -0.748 -10.779 -3.043) 11.226 4.479 ( -1.925 4.798 4.055) 6.571 4.583 ( -0.707 -5.006 7.248) 8.837 4.671 ( 2.118 2.602 5.252) 6.233 4.766 ( 1.361 -6.236 -0.757) 6.427 4.832 ( 2.774 -1.815 -2.805) 4.343 4.874 ( 2.744 -5.425 -3.895) 7.220 5.164 ( 1.599 4.385 -3.571) 5.877 5.226 ( -0.666 -1.545 -2.401) 2.932 5.524 ( -1.263 4.902 4.627) 6.858 5.576 ( -4.640 -0.872 6.297) 7.870 5.673 ( -3.422 6.334 1.689) 7.395 5.787 ( -5.266 -5.649 -2.400) 8.087 6.018 ( -4.994 3.285 0.796) 6.030 6.064 ( -2.765 -1.355 -2.377) 3.890 6.160 ( 1.099 -0.028 -3.812) 3.967 6.217 ( 0.216 -4.629 -1.735) 4.948 6.440 ( -2.544 1.328 -0.254) 2.881 6.483 ( -2.366 -2.639 0.168) 3.548 6.712 ( 3.305 2.467 0.075) 4.124 6.766 ( 2.966 -3.364 2.239) 5.012 6.892 ( 5.090 3.047 1.691) 6.169 6.958 ( 7.427 -1.542 3.563) 8.381 7.093 ( -0.395 6.968 1.953) 7.248 7.288 ( -0.033 -11.190 5.178) 12.330 7.463 ( -2.920 2.040 -1.963) 4.067 7.468 ( -4.623 0.953 -4.373) 6.435 7.888 ( -0.802 3.835 -2.046) 4.420 7.936 ( -4.140 -0.706 -1.504) 4.461 8.107 ( 0.902 4.135 -3.458) 5.465 8.163 ( 2.985 -1.150 0.093) 3.200 8.961 ( -0.752 5.801 0.188) 5.853 9.072 ( 2.430 -4.636 -2.687) 5.883 9.247 ( 0.752 5.901 -0.547) 5.974 9.348 ( 2.837 -4.153 -4.380) 6.669 9.642 ( 2.278 6.106 -0.613) 6.546 9.727 ( 0.837 -4.270 -0.854) 4.435 9.956 ( 5.753 1.736 5.965) 8.467 10.076 ( 8.739 -8.507 6.133) 13.651 10.538 ( -1.933 7.815 -3.616) 8.826 10.613 ( 2.714 -1.159 -2.564) 3.909 10.828 ( -7.656 1.752 -4.553) 9.078 10.989 ( -5.844 -13.202 -7.886) 16.451 11.538 ( -0.646 11.237 0.486) 11.267 11.759 ( 6.743 -9.001 3.163) 11.683 11.942 ( -12.108 3.326 -4.890) 13.475 12.044 ( -7.820 -4.945 -1.506) 9.374 12.687 ( 7.247 5.514 -0.589) 9.126 12.780 ( 8.197 -4.315 -1.706) 9.419 13.217 ( 9.670 3.866 -1.133) 10.476 13.276 ( 11.890 -1.898 1.661) 12.154 13.672 ( -6.356 2.036 4.146) 7.858 13.759 ( -9.639 -6.598 4.736) 12.605 14.070 ( 1.664 7.686 2.576) 8.275 14.241 ( 4.377 -9.764 4.058) 11.444 15.085 ( -3.912 4.029 0.867) 5.682 15.147 ( -1.112 -2.181 2.825) 3.738 15.482 ( -0.235 2.557 -5.556) 6.121 15.511 ( 0.193 -0.768 -3.980) 4.058 15.641 ( 5.343 6.710 -2.356) 8.895 15.733 ( 3.903 -2.670 -4.574) 6.579 16.015 ( -8.545 4.061 3.838) 10.210 16.109 ( -8.380 -5.266 2.864) 10.303 24.739 ( -0.392 0.158 1.685) 1.738 24.747 ( 0.911 -0.681 1.586) 1.952 24.825 ( -0.905 2.724 0.922) 3.014 24.874 ( -0.458 -2.048 0.109) 2.102 25.002 ( -2.717 4.310 3.362) 6.104 25.096 ( -4.547 -5.527 3.455) 7.947 25.165 ( -1.485 0.873 5.527) 5.789 25.211 ( -2.364 -3.115 5.940) 7.111 26.482 ( 0.739 1.396 0.890) 1.813 26.524 ( -0.446 -2.809 -1.508) 3.219 26.629 ( -1.325 4.753 -4.215) 6.490 26.716 ( 2.195 -4.351 -0.700) 4.924 28.590 ( 4.476 -0.017 -0.867) 4.559 28.622 ( 4.147 -3.422 -1.103) 5.488 29.598 ( 1.288 5.275 -6.107) 8.172 29.642 ( -0.027 0.757 -7.635) 7.673 ======================= Grid point 133 (65/104) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( 4.439 0.000 25.497) 25.880 1.819 ( -14.540 0.000 26.918) 30.594 2.499 ( -9.515 0.000 -9.412) 13.383 2.523 ( 17.230 0.000 -5.874) 18.204 2.722 ( -3.102 0.000 -2.819) 4.191 2.732 ( 6.626 0.000 -6.016) 8.949 2.809 ( 6.226 0.000 0.139) 6.227 2.854 ( -0.633 0.000 0.509) 0.812 3.060 ( 5.201 0.000 -1.944) 5.553 3.116 ( 4.772 0.000 -0.638) 4.815 3.266 ( -2.178 0.000 13.386) 13.562 3.308 ( -0.649 0.000 1.178) 1.345 3.557 ( -0.349 0.000 38.790) 38.792 3.627 ( 10.568 0.000 5.673) 11.994 3.730 ( -2.819 0.000 0.953) 2.976 3.887 ( -2.689 0.000 -4.953) 5.636 4.057 ( -13.181 0.000 4.948) 14.079 4.200 ( 4.361 0.000 -1.271) 4.542 4.431 ( -0.771 0.000 -1.642) 1.813 4.577 ( -0.718 0.000 3.427) 3.501 4.592 ( -7.732 0.000 -0.752) 7.769 4.660 ( 0.867 0.000 -3.430) 3.537 4.672 ( -1.504 0.000 -10.510) 10.618 4.825 ( -0.581 0.000 3.593) 3.639 4.953 ( 4.910 0.000 -10.048) 11.184 5.194 ( -9.884 0.000 -16.925) 19.600 5.356 ( -1.764 0.000 -1.773) 2.501 5.506 ( -3.014 0.000 -6.524) 7.187 5.748 ( -2.871 0.000 7.865) 8.373 5.896 ( 1.792 0.000 -2.509) 3.083 5.918 ( -5.647 0.000 3.377) 6.579 6.011 ( 1.587 0.000 1.864) 2.448 6.050 ( 6.843 0.000 0.773) 6.887 6.271 ( 5.745 0.000 -5.560) 7.995 6.355 ( -6.910 0.000 -4.402) 8.193 6.423 ( 4.418 0.000 -3.546) 5.665 6.651 ( -0.957 0.000 8.272) 8.328 6.709 ( 6.898 0.000 1.893) 7.153 6.778 ( -0.574 0.000 -2.095) 2.172 6.839 ( -6.890 0.000 1.755) 7.109 7.064 ( 5.348 0.000 -1.934) 5.687 7.174 ( -10.206 0.000 -5.761) 11.720 7.201 ( 1.943 0.000 2.662) 3.296 7.589 ( -0.576 0.000 -12.125) 12.139 7.925 ( -8.422 0.000 2.821) 8.882 7.938 ( -5.519 0.000 0.103) 5.520 7.994 ( 5.096 0.000 3.680) 6.286 8.177 ( 8.660 0.000 -4.027) 9.551 8.926 ( -2.902 0.000 2.522) 3.845 9.042 ( 0.764 0.000 -0.155) 0.780 9.126 ( -2.531 0.000 4.991) 5.596 9.321 ( 6.752 0.000 -5.391) 8.640 9.584 ( -5.719 0.000 5.669) 8.052 9.952 ( 5.172 0.000 -10.344) 11.565 10.069 ( 3.416 0.000 13.755) 14.173 10.418 ( 2.475 0.000 0.872) 2.624 10.607 ( 2.006 0.000 -0.184) 2.014 10.621 ( -4.346 0.000 1.109) 4.485 11.050 ( -3.416 0.000 3.566) 4.938 11.243 ( -11.558 0.000 -1.989) 11.728 11.288 ( 17.524 0.000 0.747) 17.540 11.538 ( 2.744 0.000 -7.528) 8.013 11.940 ( 0.359 0.000 -3.424) 3.442 12.092 ( -8.440 0.000 -7.090) 11.022 12.588 ( 8.182 0.000 5.608) 9.920 12.954 ( -8.518 0.000 -8.769) 12.225 13.160 ( 1.437 0.000 5.061) 5.261 13.337 ( 5.392 0.000 -6.563) 8.494 13.806 ( 16.866 0.000 5.446) 17.723 13.971 ( -10.526 0.000 -0.590) 10.542 14.122 ( -8.238 0.000 2.665) 8.659 14.376 ( -4.237 0.000 -7.840) 8.912 15.118 ( 1.413 0.000 1.431) 2.011 15.128 ( -1.397 0.000 1.891) 2.351 15.216 ( 8.023 0.000 4.164) 9.039 15.338 ( -3.415 0.000 -0.839) 3.517 15.682 ( 8.509 0.000 5.297) 10.024 15.782 ( 4.032 0.000 -0.604) 4.077 15.891 ( -1.878 0.000 3.430) 3.910 16.080 ( -8.690 0.000 -4.476) 9.775 24.739 ( 0.652 0.000 0.084) 0.658 24.786 ( -0.108 0.000 -1.440) 1.444 24.796 ( -4.555 0.000 2.349) 5.125 24.849 ( 3.024 0.000 0.704) 3.104 25.072 ( 4.432 0.000 8.153) 9.280 25.224 ( 2.021 0.000 4.225) 4.684 25.346 ( -5.590 0.000 1.634) 5.824 25.394 ( -15.648 0.000 -6.710) 17.026 26.223 ( -1.109 0.000 4.146) 4.292 26.482 ( 2.652 0.000 -8.173) 8.592 26.834 ( -0.804 0.000 12.139) 12.166 27.335 ( 11.009 0.000 -12.968) 17.011 28.656 ( -4.353 0.000 6.773) 8.052 28.952 ( -1.606 0.000 2.164) 2.695 28.967 ( 5.550 0.000 -8.036) 9.766 29.060 ( 5.087 0.000 -4.204) 6.599 ======================= Grid point 134 (66/104) ======================= q-point: ( 0.17 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( -11.698 0.000 23.666) 26.399 2.074 ( 7.687 0.000 21.405) 22.744 2.221 ( -15.130 0.000 -6.927) 16.641 2.504 ( -14.407 0.000 0.267) 14.409 2.607 ( -3.926 0.000 -9.863) 10.616 2.744 ( 1.271 0.000 -12.899) 12.961 2.854 ( -0.932 0.000 -1.163) 1.490 2.929 ( 2.902 0.000 -0.913) 3.042 3.117 ( 6.121 0.000 -8.837) 10.750 3.170 ( 1.527 0.000 -2.187) 2.667 3.235 ( -6.204 0.000 3.555) 7.151 3.356 ( 3.832 0.000 0.629) 3.883 3.683 ( -3.704 0.000 -2.379) 4.402 3.743 ( -4.860 0.000 3.473) 5.973 3.801 ( -7.642 0.000 10.657) 13.114 3.868 ( 1.167 0.000 26.101) 26.127 3.923 ( 7.579 0.000 3.388) 8.302 4.186 ( -4.701 0.000 5.164) 6.983 4.407 ( 1.359 0.000 -3.672) 3.915 4.517 ( -3.869 0.000 7.612) 8.539 4.520 ( -5.063 0.000 -0.057) 5.063 4.625 ( 1.719 0.000 -7.891) 8.076 4.676 ( -0.382 0.000 6.972) 6.983 4.932 ( -4.792 0.000 -12.836) 13.701 4.942 ( 6.814 0.000 10.325) 12.371 4.990 ( 6.621 0.000 -14.487) 15.928 5.329 ( 0.534 0.000 -3.722) 3.760 5.481 ( 2.411 0.000 -0.635) 2.493 5.671 ( -7.045 0.000 5.165) 8.736 5.820 ( -2.014 0.000 -2.320) 3.072 5.938 ( 2.896 0.000 4.381) 5.251 6.112 ( 0.539 0.000 4.253) 4.287 6.148 ( 3.340 0.000 0.518) 3.380 6.189 ( -5.200 0.000 -6.720) 8.497 6.424 ( 14.044 0.000 -9.583) 17.002 6.537 ( 7.575 0.000 -1.351) 7.695 6.634 ( -2.920 0.000 5.103) 5.879 6.734 ( -2.914 0.000 -1.515) 3.284 6.801 ( 4.359 0.000 0.309) 4.369 6.922 ( -5.347 0.000 0.329) 5.357 6.983 ( 14.533 0.000 4.489) 15.211 7.251 ( 11.446 0.000 4.430) 12.274 7.319 ( 3.588 0.000 2.151) 4.183 7.457 ( -3.665 0.000 -17.093) 17.482 7.756 ( -11.641 0.000 4.420) 12.452 7.806 ( -8.838 0.000 2.652) 9.227 8.056 ( -0.593 0.000 0.027) 0.593 8.284 ( 5.584 0.000 -5.841) 8.081 8.894 ( -2.152 0.000 4.639) 5.114 9.037 ( -1.442 0.000 1.180) 1.863 9.117 ( -0.066 0.000 1.380) 1.381 9.406 ( 5.613 0.000 -6.478) 8.571 9.524 ( -4.969 0.000 6.194) 7.940 9.996 ( 5.984 0.000 -8.527) 10.417 10.171 ( -1.777 0.000 13.146) 13.266 10.351 ( -5.405 0.000 -8.012) 9.665 10.552 ( -9.010 0.000 1.265) 9.098 10.567 ( -3.515 0.000 0.801) 3.606 11.102 ( 2.193 0.000 15.380) 15.535 11.132 ( 3.691 0.000 -4.732) 6.001 11.482 ( -1.211 0.000 -9.936) 10.010 11.541 ( 7.790 0.000 -10.334) 12.942 11.971 ( 2.375 0.000 -0.600) 2.449 12.002 ( 5.165 0.000 2.563) 5.766 12.757 ( 4.419 0.000 7.822) 8.984 12.762 ( -5.610 0.000 -9.617) 11.133 13.108 ( -7.457 0.000 -1.644) 7.637 13.319 ( -3.839 0.000 -5.386) 6.614 13.660 ( -15.861 0.000 -3.458) 16.234 14.080 ( 8.033 0.000 2.160) 8.318 14.160 ( 3.121 0.000 10.688) 11.134 14.326 ( 4.665 0.000 -3.593) 5.889 15.094 ( -2.708 0.000 -0.537) 2.760 15.138 ( 0.075 0.000 2.174) 2.175 15.239 ( -5.104 0.000 -4.383) 6.727 15.382 ( 7.369 0.000 2.076) 7.656 15.698 ( -4.685 0.000 0.124) 4.687 15.755 ( -7.389 0.000 -6.615) 9.917 15.991 ( 3.557 0.000 1.090) 3.721 16.037 ( 9.043 0.000 6.721) 11.267 24.733 ( -3.442 0.000 1.449) 3.734 24.764 ( -0.325 0.000 -1.705) 1.735 24.766 ( 1.698 0.000 1.438) 2.225 24.941 ( 4.934 0.000 0.803) 4.999 25.107 ( -10.054 0.000 -0.735) 10.081 25.164 ( -2.036 0.000 7.045) 7.333 25.319 ( 2.418 0.000 5.410) 5.926 25.339 ( 4.186 0.000 7.134) 8.271 26.239 ( -0.044 0.000 4.834) 4.834 26.490 ( 3.767 0.000 -9.438) 10.162 26.817 ( -8.297 0.000 8.424) 11.824 27.275 ( -4.807 0.000 -16.544) 17.229 28.654 ( -0.311 0.000 6.746) 6.753 28.925 ( -2.580 0.000 1.841) 3.170 29.035 ( 4.376 0.000 -5.745) 7.222 29.167 ( 11.502 0.000 -10.798) 15.776 ======================= Grid point 135 (67/104) ======================= q-point: ( 0.33 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -8.056 0.000 8.418) 11.652 1.959 ( -6.945 0.000 7.735) 10.395 2.175 ( -20.848 0.000 2.552) 21.003 2.318 ( 5.065 0.000 12.903) 13.862 2.491 ( -0.898 0.000 -12.006) 12.039 2.599 ( -6.485 0.000 -12.616) 14.185 2.824 ( 0.151 0.000 -2.150) 2.155 2.852 ( -8.735 0.000 -1.460) 8.856 3.062 ( -9.732 0.000 -5.609) 11.233 3.147 ( 2.758 0.000 -13.614) 13.890 3.150 ( -3.992 0.000 4.212) 5.803 3.393 ( 1.713 0.000 -5.560) 5.818 3.615 ( 2.667 0.000 -8.374) 8.789 3.645 ( -5.649 0.000 -0.641) 5.686 3.786 ( -2.830 0.000 11.620) 11.960 3.959 ( -11.073 0.000 20.979) 23.722 4.007 ( 0.778 0.000 4.340) 4.409 4.195 ( -1.147 0.000 15.821) 15.863 4.401 ( -0.174 0.000 -4.600) 4.603 4.503 ( 2.684 0.000 -0.827) 2.808 4.515 ( -1.009 0.000 8.525) 8.584 4.597 ( 0.379 0.000 -5.882) 5.894 4.729 ( -0.389 0.000 7.101) 7.112 4.878 ( 6.126 0.000 -13.353) 14.692 5.068 ( 8.002 0.000 -1.958) 8.238 5.115 ( 3.113 0.000 13.410) 13.767 5.337 ( 3.444 0.000 -3.359) 4.811 5.562 ( 5.307 0.000 1.907) 5.639 5.630 ( 0.153 0.000 2.503) 2.507 5.844 ( 4.835 0.000 1.379) 5.028 6.007 ( 0.914 0.000 5.276) 5.354 6.068 ( -5.331 0.000 -4.194) 6.783 6.127 ( 0.377 0.000 0.407) 0.555 6.173 ( -1.942 0.000 1.993) 2.783 6.565 ( 7.673 0.000 -7.810) 10.949 6.593 ( 2.228 0.000 -5.698) 6.118 6.616 ( -1.465 0.000 2.954) 3.297 6.740 ( 4.586 0.000 -0.685) 4.637 6.957 ( 11.071 0.000 -0.318) 11.076 6.990 ( 8.524 0.000 8.992) 12.390 7.272 ( 5.190 0.000 7.258) 8.923 7.285 ( -2.048 0.000 -17.457) 17.577 7.338 ( 2.459 0.000 -3.930) 4.636 7.466 ( 7.509 0.000 6.543) 9.960 7.607 ( -5.741 0.000 5.608) 8.026 7.662 ( -8.908 0.000 2.761) 9.326 7.968 ( -6.934 0.000 -2.836) 7.492 8.283 ( -0.822 0.000 -9.320) 9.357 8.914 ( 0.269 0.000 6.240) 6.246 9.039 ( 0.430 0.000 2.550) 2.586 9.120 ( -0.643 0.000 0.011) 0.643 9.437 ( 3.376 0.000 -9.241) 9.839 9.499 ( -1.721 0.000 7.835) 8.021 10.039 ( 2.823 0.000 -8.835) 9.275 10.144 ( -10.491 0.000 11.574) 15.621 10.232 ( 0.122 0.000 -6.699) 6.700 10.388 ( -6.690 0.000 1.979) 6.976 10.481 ( -5.547 0.000 -0.314) 5.556 11.238 ( 8.099 0.000 -9.904) 12.793 11.257 ( 2.682 0.000 12.820) 13.097 11.453 ( -4.651 0.000 -8.404) 9.605 11.461 ( 6.088 0.000 -2.343) 6.523 12.109 ( 3.389 0.000 5.079) 6.106 12.135 ( 9.606 0.000 1.236) 9.685 12.653 ( 0.576 0.000 -9.478) 9.496 12.761 ( -10.029 0.000 6.780) 12.106 12.924 ( -8.861 0.000 -6.034) 10.721 13.157 ( -8.466 0.000 -7.171) 11.096 13.497 ( 0.928 0.000 1.021) 1.379 14.109 ( -1.804 0.000 -3.754) 4.165 14.319 ( 6.058 0.000 12.786) 14.149 14.478 ( 9.071 0.000 2.050) 9.299 15.023 ( -3.886 0.000 -3.137) 4.994 15.088 ( -5.971 0.000 -6.156) 8.576 15.178 ( 0.765 0.000 2.292) 2.416 15.448 ( -2.751 0.000 -4.592) 5.353 15.593 ( -1.317 0.000 -3.777) 4.000 15.601 ( -5.594 0.000 0.289) 5.601 16.121 ( 7.177 0.000 3.416) 7.948 16.192 ( 3.523 0.000 5.319) 6.380 24.698 ( -1.278 0.000 1.271) 1.802 24.754 ( -0.185 0.000 -1.122) 1.137 24.810 ( 1.590 0.000 2.244) 2.750 24.934 ( -4.314 0.000 0.948) 4.417 25.065 ( 3.502 0.000 -0.797) 3.591 25.113 ( -5.355 0.000 3.391) 6.339 25.450 ( 3.791 0.000 12.093) 12.673 25.512 ( 9.229 0.000 11.468) 14.720 26.284 ( 1.551 0.000 5.719) 5.926 26.489 ( 2.875 0.000 -11.666) 12.015 26.657 ( -11.871 0.000 2.126) 12.060 27.039 ( -9.218 0.000 -15.334) 17.892 28.717 ( 1.467 0.000 8.258) 8.388 28.890 ( -2.283 0.000 2.162) 3.144 29.049 ( 1.427 0.000 -5.524) 5.705 29.286 ( 9.434 0.000 -15.182) 17.874 ======================= Grid point 136 (68/104) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( -11.166 0.000 12.488) 16.752 1.823 ( -20.316 0.000 8.593) 22.058 2.131 ( 13.393 0.000 9.096) 16.189 2.232 ( -8.939 0.000 -15.021) 17.479 2.450 ( 2.567 0.000 -4.427) 5.118 2.570 ( 0.958 0.000 1.800) 2.039 2.695 ( -4.823 0.000 5.315) 7.177 2.837 ( 1.906 0.000 -4.208) 4.620 2.912 ( -1.351 0.000 -3.698) 3.937 3.046 ( -2.714 0.000 -14.458) 14.710 3.127 ( -2.418 0.000 7.652) 8.025 3.382 ( 2.873 0.000 -9.507) 9.932 3.547 ( -4.238 0.000 -2.230) 4.789 3.642 ( 4.556 0.000 -6.246) 7.731 3.750 ( -16.462 0.000 23.287) 28.518 3.855 ( -6.090 0.000 12.621) 14.013 4.059 ( 2.077 0.000 2.521) 3.266 4.275 ( -0.458 0.000 12.357) 12.365 4.378 ( -1.088 0.000 0.995) 1.475 4.518 ( -0.252 0.000 -1.429) 1.451 4.579 ( 1.735 0.000 5.611) 5.873 4.632 ( 8.428 0.000 -6.895) 10.889 4.711 ( -1.733 0.000 -1.776) 2.482 4.892 ( 3.894 0.000 -13.387) 13.942 5.209 ( -0.649 0.000 8.423) 8.448 5.233 ( 8.310 0.000 3.392) 8.976 5.412 ( 4.941 0.000 0.304) 4.950 5.659 ( 1.864 0.000 6.508) 6.770 5.690 ( 5.712 0.000 -4.305) 7.152 5.874 ( -8.504 0.000 -3.772) 9.303 5.996 ( 5.218 0.000 2.531) 5.800 6.028 ( -1.588 0.000 2.880) 3.289 6.122 ( -4.211 0.000 3.193) 5.284 6.175 ( 4.209 0.000 0.559) 4.245 6.563 ( -4.521 0.000 -1.057) 4.643 6.622 ( 1.189 0.000 0.539) 1.305 6.628 ( 3.804 0.000 -5.264) 6.495 6.847 ( 4.373 0.000 -3.266) 5.458 7.089 ( 3.674 0.000 2.023) 4.195 7.168 ( -6.843 0.000 -1.481) 7.001 7.188 ( -1.428 0.000 2.140) 2.572 7.237 ( 4.349 0.000 -7.694) 8.838 7.352 ( 0.190 0.000 6.155) 6.158 7.538 ( -1.684 0.000 -2.223) 2.789 7.608 ( 3.371 0.000 6.601) 7.412 7.703 ( 7.509 0.000 1.493) 7.656 7.871 ( 0.548 0.000 -0.287) 0.619 8.145 ( -6.226 0.000 -12.823) 14.255 8.955 ( -0.480 0.000 6.014) 6.034 9.062 ( -0.783 0.000 4.508) 4.575 9.092 ( -2.423 0.000 1.108) 2.664 9.421 ( 2.045 0.000 -11.749) 11.925 9.572 ( 3.994 0.000 8.011) 8.952 9.969 ( -14.077 0.000 10.223) 17.398 9.983 ( 0.398 0.000 -11.779) 11.786 10.267 ( 0.840 0.000 1.588) 1.796 10.367 ( 1.381 0.000 2.737) 3.066 10.423 ( 3.281 0.000 -3.312) 4.662 11.196 ( -6.704 0.000 -9.820) 11.890 11.266 ( 4.285 0.000 -10.119) 10.989 11.460 ( -0.611 0.000 11.682) 11.698 11.631 ( 8.340 0.000 0.831) 8.381 12.171 ( 0.281 0.000 4.265) 4.275 12.213 ( -3.165 0.000 3.394) 4.641 12.600 ( -8.513 0.000 8.162) 11.794 12.686 ( 8.627 0.000 -6.187) 10.617 12.766 ( -1.647 0.000 -10.556) 10.684 12.988 ( -2.988 0.000 -8.429) 8.943 13.648 ( 9.910 0.000 7.311) 12.315 13.992 ( -7.384 0.000 -8.080) 10.946 14.518 ( 7.323 0.000 11.206) 13.387 14.624 ( 5.339 0.000 2.485) 5.889 14.925 ( -3.731 0.000 -4.487) 5.835 14.926 ( -7.099 0.000 -6.679) 9.747 15.215 ( 1.100 0.000 2.857) 3.062 15.309 ( -6.192 0.000 -3.347) 7.039 15.518 ( -3.761 0.000 1.663) 4.112 15.621 ( 3.609 0.000 -3.110) 4.764 16.223 ( -3.042 0.000 3.605) 4.716 16.251 ( 4.477 0.000 2.974) 5.375 24.703 ( 0.997 0.000 1.121) 1.500 24.736 ( -1.057 0.000 -0.573) 1.202 24.842 ( 0.206 0.000 2.456) 2.465 24.900 ( -0.671 0.000 1.474) 1.619 25.034 ( -5.424 0.000 3.333) 6.366 25.105 ( 1.709 0.000 -1.704) 2.413 25.558 ( -1.133 0.000 13.023) 13.072 25.822 ( 17.080 0.000 11.446) 20.560 26.344 ( -1.053 0.000 4.417) 4.541 26.436 ( -0.490 0.000 -12.777) 12.787 26.483 ( -4.539 0.000 0.950) 4.637 26.789 ( -8.410 0.000 -12.519) 15.082 28.774 ( -1.944 0.000 9.232) 9.434 28.885 ( 0.340 0.000 3.057) 3.076 29.029 ( 0.334 0.000 -5.288) 5.299 29.303 ( 3.269 0.000 -17.294) 17.600 ======================= Grid point 137 (69/104) ======================= q-point: (-0.33 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 1.954 0.000 28.496) 28.563 1.607 ( -11.744 0.000 18.448) 21.868 2.064 ( 2.878 0.000 -14.013) 14.306 2.411 ( 13.741 0.000 -2.523) 13.971 2.526 ( -0.721 0.000 0.782) 1.064 2.546 ( 5.626 0.000 9.586) 11.115 2.776 ( 4.278 0.000 6.220) 7.549 2.820 ( 0.875 0.000 -6.990) 7.044 2.937 ( 0.782 0.000 -11.943) 11.968 2.952 ( 5.051 0.000 -2.222) 5.518 3.132 ( -6.516 0.000 17.542) 18.713 3.395 ( 5.048 0.000 -8.830) 10.171 3.459 ( -4.138 0.000 -2.560) 4.866 3.582 ( -15.058 0.000 23.474) 27.889 3.710 ( 7.022 0.000 -5.504) 8.922 3.863 ( -2.781 0.000 13.698) 13.978 4.068 ( -1.592 0.000 -3.073) 3.461 4.306 ( -3.464 0.000 8.212) 8.913 4.388 ( 0.683 0.000 3.905) 3.965 4.516 ( 0.671 0.000 0.871) 1.099 4.620 ( 1.800 0.000 0.839) 1.986 4.705 ( 2.612 0.000 -4.926) 5.576 4.756 ( 8.185 0.000 -8.145) 11.546 4.870 ( 2.660 0.000 -9.931) 10.281 5.160 ( -7.374 0.000 -1.591) 7.544 5.384 ( 6.316 0.000 1.343) 6.457 5.482 ( 1.651 0.000 -0.896) 1.879 5.699 ( 0.218 0.000 -1.796) 1.809 5.701 ( -6.326 0.000 0.478) 6.344 5.719 ( -1.538 0.000 1.985) 2.511 5.982 ( -3.386 0.000 -3.019) 4.537 6.090 ( -1.939 0.000 4.752) 5.132 6.099 ( 4.039 0.000 0.155) 4.042 6.273 ( 6.008 0.000 0.045) 6.009 6.443 ( -6.739 0.000 1.033) 6.818 6.583 ( -7.171 0.000 -6.147) 9.445 6.648 ( 0.366 0.000 -0.528) 0.643 6.807 ( -1.118 0.000 -6.166) 6.267 6.948 ( -11.910 0.000 -4.099) 12.595 7.066 ( -5.795 0.000 -2.254) 6.218 7.168 ( -6.571 0.000 0.206) 6.574 7.204 ( 0.189 0.000 2.454) 2.461 7.524 ( 6.623 0.000 7.063) 9.683 7.592 ( 7.614 0.000 -6.327) 9.900 7.739 ( 7.201 0.000 6.922) 9.989 7.743 ( 0.556 0.000 -2.828) 2.883 7.974 ( 4.417 0.000 5.248) 6.859 7.982 ( 0.569 0.000 -12.187) 12.201 8.958 ( -2.785 0.000 4.863) 5.604 9.049 ( -1.473 0.000 -0.356) 1.516 9.084 ( -1.428 0.000 8.167) 8.291 9.365 ( 0.128 0.000 -12.690) 12.691 9.706 ( 3.572 0.000 6.977) 7.838 9.813 ( -8.406 0.000 10.823) 13.704 9.946 ( 3.718 0.000 -13.232) 13.744 10.260 ( -1.903 0.000 6.805) 7.066 10.438 ( 4.416 0.000 2.026) 4.858 10.542 ( 9.840 0.000 -4.974) 11.026 11.028 ( -5.654 0.000 -3.929) 6.885 11.312 ( 6.528 0.000 -5.878) 8.784 11.407 ( -10.362 0.000 2.658) 10.698 11.672 ( -3.407 0.000 -1.952) 3.926 12.155 ( -4.344 0.000 -0.001) 4.344 12.193 ( 0.420 0.000 7.164) 7.176 12.519 ( -5.562 0.000 0.367) 5.574 12.798 ( 8.226 0.000 1.385) 8.342 12.875 ( 14.314 0.000 -3.069) 14.639 13.010 ( 10.538 0.000 -5.195) 11.749 13.755 ( -11.367 0.000 -11.026) 15.836 13.865 ( 7.561 0.000 8.085) 11.070 14.631 ( -3.937 0.000 -4.129) 5.705 14.659 ( -2.557 0.000 -3.989) 4.738 14.837 ( 4.057 0.000 6.068) 7.299 14.893 ( 3.150 0.000 1.792) 3.624 15.211 ( -3.998 0.000 0.646) 4.050 15.250 ( 0.763 0.000 4.258) 4.326 15.494 ( -0.470 0.000 2.075) 2.128 15.665 ( 3.612 0.000 -3.406) 4.965 16.137 ( -8.079 0.000 2.403) 8.429 16.301 ( -0.610 0.000 1.042) 1.208 24.725 ( 0.253 0.000 0.111) 0.276 24.735 ( 1.469 0.000 0.044) 1.470 24.851 ( -0.604 0.000 3.077) 3.135 24.897 ( -0.841 0.000 -0.162) 0.856 24.969 ( -4.170 0.000 4.246) 5.951 25.122 ( 1.153 0.000 0.303) 1.192 25.554 ( -6.568 0.000 8.741) 10.933 26.080 ( 0.596 0.000 -18.070) 18.079 26.272 ( -4.235 0.000 0.037) 4.236 26.460 ( 14.627 0.000 8.490) 16.912 26.560 ( 5.319 0.000 9.092) 10.534 26.616 ( -1.992 0.000 -6.520) 6.818 28.761 ( -5.061 0.000 8.854) 10.198 28.924 ( 0.959 0.000 3.733) 3.854 29.009 ( 0.881 0.000 -4.189) 4.280 29.193 ( -3.415 0.000 -16.887) 17.229 ======================= Grid point 138 (70/104) ======================= q-point: (-0.17 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -1.807 0.000 25.466) 25.530 1.793 ( -0.375 0.000 30.205) 30.207 2.196 ( 18.361 0.000 -7.901) 19.989 2.600 ( 8.324 0.000 -2.002) 8.561 2.610 ( 8.046 0.000 -0.067) 8.046 2.660 ( 1.522 0.000 0.096) 1.525 2.780 ( 0.464 0.000 -5.951) 5.969 2.856 ( 1.367 0.000 1.632) 2.129 2.958 ( 5.850 0.000 -1.691) 6.089 3.029 ( 3.891 0.000 0.947) 4.005 3.151 ( -5.367 0.000 31.435) 31.890 3.365 ( -4.130 0.000 -2.679) 4.923 3.462 ( 7.279 0.000 -4.503) 8.559 3.500 ( -8.455 0.000 17.143) 19.115 3.767 ( 0.331 0.000 -2.329) 2.352 3.979 ( 6.732 0.000 13.454) 15.044 3.983 ( -4.218 0.000 -4.544) 6.200 4.256 ( -6.690 0.000 4.740) 8.199 4.428 ( 1.434 0.000 0.660) 1.579 4.548 ( 0.813 0.000 3.770) 3.856 4.654 ( 0.928 0.000 -0.881) 1.280 4.701 ( 1.115 0.000 -8.751) 8.822 4.757 ( 0.265 0.000 -11.510) 11.513 4.911 ( 5.679 0.000 -6.742) 8.815 4.962 ( -10.797 0.000 -5.310) 12.032 5.409 ( -3.906 0.000 -6.605) 7.673 5.423 ( -4.665 0.000 -1.774) 4.991 5.627 ( -2.137 0.000 -11.332) 11.531 5.728 ( -2.994 0.000 11.855) 12.228 5.732 ( 7.289 0.000 3.188) 7.956 5.922 ( 2.607 0.000 -4.574) 5.265 6.056 ( -6.579 0.000 4.822) 8.157 6.124 ( -2.027 0.000 -3.220) 3.805 6.301 ( -5.176 0.000 -7.359) 8.997 6.395 ( 1.046 0.000 -0.239) 1.073 6.413 ( -1.057 0.000 1.476) 1.815 6.600 ( -2.456 0.000 -1.059) 2.674 6.757 ( -7.196 0.000 0.002) 7.196 6.790 ( 1.686 0.000 -3.695) 4.062 6.978 ( -10.457 0.000 -1.664) 10.588 7.059 ( 4.864 0.000 1.324) 5.041 7.133 ( -7.500 0.000 -1.862) 7.727 7.477 ( -11.437 0.000 -4.633) 12.340 7.631 ( 2.892 0.000 -9.676) 10.099 7.836 ( 8.171 0.000 3.540) 8.905 7.916 ( 6.047 0.000 5.835) 8.404 8.019 ( -3.297 0.000 5.257) 6.205 8.057 ( 9.540 0.000 -7.682) 12.248 8.939 ( -1.421 0.000 3.622) 3.891 9.033 ( 0.141 0.000 -0.606) 0.622 9.117 ( -0.956 0.000 7.885) 7.943 9.293 ( 0.732 0.000 -9.395) 9.424 9.664 ( -7.120 0.000 5.979) 9.298 9.907 ( 5.022 0.000 12.457) 13.431 9.938 ( 4.226 0.000 -12.681) 13.367 10.318 ( 3.183 0.000 7.566) 8.208 10.535 ( 5.001 0.000 0.547) 5.031 10.653 ( 2.969 0.000 -1.728) 3.435 11.011 ( 6.974 0.000 -1.042) 7.051 11.204 ( -10.880 0.000 1.729) 11.017 11.401 ( 2.030 0.000 -0.661) 2.135 11.538 ( -5.335 0.000 -5.261) 7.492 12.033 ( -6.000 0.000 -5.224) 7.956 12.242 ( -2.209 0.000 -0.843) 2.364 12.452 ( 2.124 0.000 -0.265) 2.140 13.008 ( 9.139 0.000 9.148) 12.931 13.060 ( 5.295 0.000 -3.919) 6.588 13.237 ( 12.568 0.000 -6.791) 14.286 13.559 ( 1.413 0.000 -2.823) 3.157 13.989 ( 1.513 0.000 5.800) 5.994 14.403 ( -14.334 0.000 -6.597) 15.779 14.527 ( -6.260 0.000 -7.927) 10.100 15.025 ( 7.430 0.000 5.320) 9.138 15.028 ( 8.137 0.000 3.782) 8.973 15.165 ( -2.282 0.000 2.126) 3.119 15.320 ( 3.085 0.000 6.921) 7.578 15.518 ( 2.763 0.000 2.122) 3.484 15.714 ( 3.894 0.000 -2.014) 4.384 15.991 ( -8.700 0.000 2.198) 8.974 16.239 ( -5.899 0.000 -1.866) 6.187 24.740 ( -0.207 0.000 -0.856) 0.880 24.751 ( 2.302 0.000 0.713) 2.410 24.852 ( -2.865 0.000 3.510) 4.531 24.863 ( -1.960 0.000 -1.757) 2.632 24.965 ( 1.558 0.000 5.723) 5.931 25.161 ( 2.029 0.000 2.862) 3.508 25.455 ( -7.758 0.000 3.768) 8.624 25.773 ( -16.241 0.000 -16.978) 23.496 26.228 ( -1.940 0.000 2.705) 3.329 26.505 ( 0.193 0.000 -8.039) 8.041 26.720 ( 4.464 0.000 11.845) 12.658 27.001 ( 27.487 0.000 2.195) 27.574 28.710 ( -6.106 0.000 8.087) 10.133 28.953 ( -0.213 0.000 2.974) 2.981 29.015 ( 0.890 0.000 -3.876) 3.977 29.019 ( -2.460 0.000 -11.540) 11.799 ======================= Grid point 139 (71/104) ======================= q-point: ( 0.00 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 2.226 -12.263 27.016) 29.753 1.873 ( -12.502 3.621 24.020) 27.320 2.373 ( 1.684 -12.697 -8.010) 15.107 2.491 ( 1.766 -4.495 -3.711) 6.090 2.571 ( 4.787 -11.207 -5.008) 13.176 2.733 ( 4.299 -6.409 0.516) 7.735 2.822 ( 2.664 0.696 -9.846) 10.224 2.854 ( -1.989 0.004 2.129) 2.914 2.985 ( 1.013 -11.225 -1.359) 11.352 3.038 ( 4.443 1.202 -5.450) 7.134 3.242 ( 2.950 -3.696 5.531) 7.277 3.325 ( -1.470 3.851 6.078) 7.343 3.588 ( -1.159 1.927 28.993) 29.081 3.648 ( 4.098 1.678 5.257) 6.873 3.744 ( -2.538 1.370 1.465) 3.235 3.820 ( -0.940 -2.646 3.626) 4.586 4.070 ( -12.855 0.455 -0.374) 12.869 4.166 ( 4.861 -1.421 7.145) 8.757 4.452 ( -2.530 -1.801 -4.131) 5.168 4.559 ( 2.717 4.628 -3.511) 6.413 4.669 ( -1.563 4.885 3.141) 6.014 4.704 ( 0.702 2.853 -3.253) 4.383 4.764 ( 0.126 7.128 -7.162) 10.105 4.898 ( 0.201 6.475 1.043) 6.561 5.027 ( 4.749 6.026 -8.631) 11.548 5.174 ( -7.099 -1.409 -11.033) 13.195 5.419 ( -5.927 5.602 -0.235) 8.159 5.529 ( -1.772 -0.088 -2.061) 2.720 5.704 ( -4.770 -3.222 10.162) 11.679 5.875 ( -1.114 -1.183 -3.523) 3.880 5.909 ( -4.505 -1.984 0.738) 4.978 5.978 ( 8.336 1.912 1.742) 8.728 6.042 ( 2.490 -2.716 -2.862) 4.665 6.271 ( -0.600 -0.769 -6.162) 6.239 6.383 ( -2.708 3.841 -1.179) 4.846 6.490 ( 3.495 3.786 -2.732) 5.832 6.635 ( -2.459 -0.504 4.600) 5.241 6.735 ( 7.267 3.825 2.997) 8.742 6.776 ( 1.537 1.041 -0.369) 1.892 6.896 ( 1.175 0.993 -1.430) 2.100 7.070 ( -1.875 5.001 -0.900) 5.416 7.171 ( -14.047 -0.405 -5.972) 15.269 7.323 ( 5.770 9.919 2.902) 11.837 7.609 ( -0.063 1.685 -8.436) 8.603 7.842 ( -2.677 -6.197 2.723) 7.279 7.911 ( -1.187 -4.491 4.809) 6.686 8.009 ( -0.916 0.749 -1.507) 1.916 8.173 ( 5.117 -0.152 -7.468) 9.054 8.905 ( -2.763 -1.552 3.624) 4.814 9.028 ( 0.277 -1.205 0.745) 1.444 9.149 ( -0.355 2.267 2.989) 3.769 9.353 ( 5.733 2.815 -5.672) 8.542 9.536 ( -5.709 -4.002 6.338) 9.422 9.941 ( 4.532 -0.389 -10.852) 11.767 10.071 ( 1.992 -0.746 12.116) 12.301 10.397 ( 5.385 -1.690 0.699) 5.687 10.608 ( 1.588 0.160 3.797) 4.119 10.637 ( -4.467 0.744 -0.362) 4.543 10.986 ( 4.538 -9.709 -1.571) 10.832 11.144 ( -5.392 -2.914 7.145) 9.414 11.303 ( -1.685 -2.218 -7.438) 7.943 11.495 ( 6.177 -3.690 -4.425) 8.447 11.885 ( -4.905 -3.325 -2.774) 6.544 12.098 ( -5.791 -1.632 -9.824) 11.521 12.651 ( 9.088 5.382 6.476) 12.389 12.947 ( -5.979 1.519 -6.556) 9.002 13.116 ( 3.079 -2.401 7.182) 8.175 13.422 ( 1.738 5.346 -7.781) 9.599 13.792 ( 11.351 -1.610 4.366) 12.267 13.906 ( -9.559 -5.809 -0.385) 11.192 14.125 ( 2.093 2.080 7.468) 8.029 14.495 ( -7.946 9.501 -10.669) 16.347 15.055 ( 7.199 -5.945 3.515) 9.976 15.085 ( -4.100 -3.240 2.610) 5.841 15.231 ( -0.305 0.940 1.511) 1.805 15.362 ( 0.235 1.277 -3.123) 3.383 15.706 ( 7.261 2.248 5.206) 9.212 15.795 ( 4.504 1.346 -0.521) 4.729 15.904 ( -1.599 1.343 3.096) 3.735 16.077 ( -7.897 -0.327 -3.875) 8.803 24.745 ( 0.579 0.605 0.374) 0.917 24.785 ( -1.957 -0.092 1.520) 2.480 24.804 ( -1.792 0.875 -0.478) 2.051 24.850 ( 2.217 0.130 0.136) 2.225 25.069 ( 3.896 -0.378 7.179) 8.177 25.227 ( 1.879 0.372 4.616) 4.997 25.281 ( -7.511 -5.169 -0.483) 9.130 25.397 ( -10.422 -0.959 -1.545) 10.580 26.258 ( -1.445 3.627 2.367) 4.566 26.475 ( 2.046 -0.655 -7.338) 7.646 26.774 ( -0.043 -5.806 10.495) 11.994 27.173 ( 7.706 -13.949 -8.232) 17.936 28.667 ( -3.894 -0.086 1.018) 4.026 28.776 ( 2.515 -7.953 -2.301) 8.653 29.166 ( 1.997 12.735 -2.000) 13.045 29.214 ( 4.683 11.605 -4.229) 13.209 ======================= Grid point 140 (72/104) ======================= q-point: ( 0.17 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( -11.003 -0.234 22.393) 24.951 1.958 ( 5.677 -9.002 19.986) 22.643 2.169 ( -12.818 -8.122 -6.707) 16.591 2.436 ( -6.602 -7.776 -0.183) 10.202 2.533 ( -9.029 -6.141 -4.760) 11.912 2.724 ( 0.368 -4.775 -15.809) 16.518 2.793 ( 1.522 -6.602 1.144) 6.871 2.927 ( 3.954 -1.686 -1.345) 4.504 3.018 ( 2.573 -8.580 -2.929) 9.424 3.085 ( 2.586 0.827 -4.090) 4.909 3.218 ( -4.658 -0.811 -0.132) 4.730 3.395 ( 1.489 -0.688 1.947) 2.546 3.559 ( -4.677 -7.870 -2.838) 9.584 3.678 ( -3.640 -9.099 3.674) 10.467 3.761 ( -1.866 -0.218 7.080) 7.325 3.845 ( -3.567 1.671 17.508) 17.945 4.041 ( 3.759 6.708 11.467) 13.807 4.236 ( -2.627 4.688 4.306) 6.886 4.413 ( 0.516 0.506 8.009) 8.041 4.517 ( -3.335 5.376 -7.166) 9.559 4.652 ( 0.203 3.313 -4.387) 5.501 4.667 ( -2.703 6.739 0.180) 7.263 4.763 ( 1.339 6.760 1.485) 7.050 4.941 ( -3.759 1.286 -11.510) 12.176 5.038 ( 5.730 6.934 3.693) 9.724 5.064 ( 5.584 7.315 -8.315) 12.403 5.354 ( -1.305 3.636 1.657) 4.204 5.532 ( 1.873 1.631 1.237) 2.775 5.644 ( -5.211 -1.233 6.888) 8.724 5.804 ( -1.155 -1.583 -2.551) 3.217 5.944 ( 3.782 0.836 4.555) 5.979 6.107 ( 3.662 2.383 1.072) 4.498 6.132 ( 0.670 -2.712 -4.287) 5.116 6.240 ( 3.949 -1.460 -3.080) 5.217 6.310 ( -0.273 -1.920 -0.790) 2.094 6.530 ( 3.471 -1.252 -5.079) 6.278 6.639 ( -0.890 1.634 3.520) 3.982 6.786 ( 2.203 -0.561 -2.099) 3.094 6.862 ( 0.026 8.052 -3.323) 8.711 6.953 ( -2.739 2.004 -1.359) 3.656 6.978 ( 10.552 1.148 3.962) 11.329 7.203 ( 10.487 -1.440 6.445) 12.394 7.410 ( 0.905 6.312 -0.031) 6.376 7.535 ( -1.548 4.648 -8.525) 9.832 7.711 ( -9.209 -1.356 2.226) 9.571 7.846 ( -7.150 2.461 -0.203) 7.565 8.012 ( -0.198 -4.378 0.531) 4.414 8.228 ( 4.327 -5.679 -6.542) 9.683 8.887 ( -1.548 -0.303 4.777) 5.031 9.027 ( -1.053 -0.901 1.376) 1.953 9.158 ( 0.102 3.962 1.335) 4.182 9.405 ( 4.006 -0.404 -7.514) 8.525 9.488 ( -4.007 -3.042 7.097) 8.699 9.977 ( 5.869 -1.237 -8.647) 10.524 10.140 ( -2.068 -3.313 10.318) 11.032 10.390 ( -5.948 3.569 -5.640) 8.940 10.512 ( -7.259 -3.736 -0.987) 8.224 10.579 ( -5.432 0.952 1.610) 5.745 11.096 ( 1.755 -1.557 6.160) 6.592 11.116 ( 6.784 -2.114 3.365) 7.863 11.369 ( 6.894 -11.199 -6.632) 14.728 11.520 ( 1.329 -0.484 -10.186) 10.284 11.877 ( 2.265 -9.080 6.223) 11.238 11.990 ( 1.314 -0.589 -3.391) 3.684 12.779 ( -3.487 2.477 -3.929) 5.808 12.849 ( 3.957 6.963 1.968) 8.247 13.110 ( -7.419 1.671 1.602) 7.771 13.330 ( -5.744 0.258 -7.112) 9.145 13.650 ( -11.727 -0.528 -1.189) 11.798 14.008 ( 5.691 -4.108 3.874) 8.016 14.314 ( 3.609 10.711 2.638) 11.606 14.340 ( 4.720 2.220 -1.019) 5.315 14.965 ( -7.098 -8.021 -0.161) 10.712 15.174 ( 0.350 0.326 -0.468) 0.670 15.234 ( 1.278 -2.626 2.805) 4.049 15.379 ( 2.917 -0.224 -2.249) 3.690 15.713 ( -4.617 1.952 -1.427) 5.212 15.784 ( -5.097 2.434 -5.188) 7.670 15.990 ( 4.972 0.484 3.090) 5.874 16.060 ( 7.742 1.889 4.025) 8.928 24.735 ( -3.064 0.347 1.346) 3.364 24.760 ( 0.148 0.278 0.728) 0.793 24.792 ( 1.219 1.817 -0.895) 2.364 24.927 ( 4.144 -1.291 0.803) 4.414 25.094 ( -7.900 -1.213 0.333) 7.999 25.157 ( -1.426 -0.705 6.381) 6.576 25.291 ( -0.209 -2.049 2.381) 3.149 25.362 ( 5.042 1.150 8.882) 10.277 26.265 ( 0.003 2.711 3.968) 4.806 26.473 ( 2.518 -1.511 -8.185) 8.696 26.763 ( -6.643 -5.046 6.731) 10.719 27.158 ( -1.616 -11.134 -12.134) 16.547 28.601 ( -2.931 -3.419 2.917) 5.365 28.801 ( 0.117 -8.071 -0.875) 8.119 29.194 ( 2.601 12.407 -3.596) 13.177 29.309 ( 8.955 10.555 -8.320) 16.150 ======================= Grid point 141 (73/104) ======================= q-point: ( 0.33 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -10.609 -2.430 9.064) 14.164 1.947 ( -3.139 -1.990 7.288) 8.181 2.130 ( -9.120 -10.424 8.549) 16.277 2.289 ( -3.359 1.715 4.627) 5.969 2.384 ( -2.439 -9.676 -4.339) 10.881 2.606 ( -3.824 -0.300 -10.795) 11.456 2.778 ( -1.149 -5.171 -1.729) 5.573 2.891 ( -7.862 3.561 -3.644) 9.368 2.984 ( 0.242 -9.057 -10.355) 13.759 3.090 ( -0.328 -3.134 5.871) 6.663 3.142 ( -2.264 2.111 -9.722) 10.203 3.334 ( -3.518 -9.416 -3.515) 10.649 3.509 ( -1.843 -2.717 -2.138) 3.918 3.626 ( -0.911 -3.364 -2.746) 4.437 3.776 ( -2.240 -1.163 10.581) 10.877 3.948 ( -2.768 -0.941 18.377) 18.608 4.062 ( -4.678 4.290 4.707) 7.902 4.220 ( -2.117 3.378 12.201) 12.836 4.426 ( -1.247 3.715 -2.398) 4.595 4.510 ( 2.194 3.319 -0.745) 4.048 4.613 ( -0.429 1.390 -5.150) 5.351 4.630 ( -1.474 5.855 5.107) 7.908 4.800 ( 1.118 3.594 -4.668) 5.996 4.864 ( 3.343 2.132 -2.352) 4.610 5.108 ( 4.933 3.663 -5.625) 8.330 5.194 ( 3.969 6.381 6.388) 9.863 5.396 ( 4.062 4.353 2.507) 6.460 5.574 ( -0.253 -0.605 5.925) 5.961 5.654 ( 2.963 3.213 2.741) 5.159 5.840 ( 5.646 -0.640 1.519) 5.882 6.013 ( 0.093 -0.343 -1.363) 1.409 6.060 ( -2.752 0.642 -0.969) 2.987 6.157 ( 0.125 2.693 2.791) 3.880 6.217 ( -2.965 5.651 1.681) 6.600 6.414 ( 7.617 -11.818 -1.067) 14.100 6.565 ( 4.110 -2.305 -7.057) 8.485 6.630 ( -0.978 0.976 1.582) 2.100 6.796 ( 1.060 0.127 -1.310) 1.690 6.938 ( 12.193 3.491 -3.377) 13.125 7.032 ( 3.875 0.404 -2.261) 4.504 7.108 ( 4.142 -4.853 0.857) 6.437 7.331 ( -5.295 2.949 1.518) 6.248 7.432 ( 2.046 -1.682 1.463) 3.026 7.497 ( 3.195 2.434 4.624) 6.125 7.633 ( -1.968 2.833 3.030) 4.591 7.697 ( -4.309 6.399 -4.429) 8.896 7.970 ( -4.116 -0.346 -0.663) 4.183 8.226 ( 0.115 -5.740 -7.238) 9.239 8.910 ( 0.315 0.029 5.404) 5.413 9.020 ( -0.919 -1.877 2.221) 3.049 9.157 ( -1.044 3.410 -0.167) 3.571 9.401 ( 1.268 -3.187 -8.617) 9.275 9.503 ( 1.346 0.205 7.462) 7.585 10.016 ( 1.970 -1.885 -7.066) 7.574 10.123 ( -9.405 -2.304 9.782) 13.764 10.224 ( -1.817 -0.637 -5.086) 5.439 10.383 ( -5.147 -0.597 -1.113) 5.299 10.470 ( -6.209 -0.579 -1.622) 6.443 11.180 ( 4.966 -4.139 -5.643) 8.581 11.291 ( 5.215 1.357 13.053) 14.121 11.394 ( -2.477 -6.210 -12.658) 14.315 11.485 ( 7.428 1.565 -0.755) 7.628 11.989 ( 3.931 -9.669 8.828) 13.670 12.113 ( 9.135 -1.858 2.888) 9.759 12.689 ( -0.733 3.093 -7.981) 8.591 12.836 ( -8.555 2.795 1.100) 9.067 12.922 ( -10.529 3.442 -4.223) 11.855 13.159 ( -7.863 0.169 -6.948) 10.494 13.539 ( 1.227 4.186 1.665) 4.669 14.062 ( -1.249 -3.155 -0.773) 3.481 14.310 ( 2.912 -2.440 1.770) 4.190 14.573 ( 9.100 9.154 6.757) 14.569 14.831 ( -5.779 -10.933 -2.823) 12.685 15.161 ( -1.392 -0.244 0.655) 1.557 15.251 ( 0.141 5.983 -1.204) 6.105 15.384 ( -2.199 -4.303 -1.123) 4.961 15.605 ( -3.692 1.722 -4.970) 6.426 15.674 ( -2.756 5.196 -3.845) 7.027 16.128 ( 7.126 0.968 3.329) 7.925 16.200 ( 3.469 0.755 4.636) 5.839 24.704 ( -1.175 0.673 1.361) 1.920 24.764 ( 0.233 0.843 -0.526) 1.020 24.820 ( 1.038 1.052 1.207) 1.908 24.925 ( -3.428 -0.955 0.651) 3.618 25.064 ( 3.148 0.071 0.058) 3.150 25.116 ( -5.072 0.370 3.584) 6.221 25.370 ( 3.973 -5.712 8.267) 10.805 25.535 ( 6.395 -0.283 11.747) 13.378 26.309 ( 1.748 2.505 4.965) 5.830 26.450 ( 0.058 -2.933 -7.401) 7.961 26.654 ( -6.359 -0.618 -0.498) 6.408 26.994 ( -7.542 -4.977 -12.048) 15.060 28.609 ( 0.727 -7.223 4.563) 8.574 28.779 ( -1.680 -8.642 0.029) 8.804 29.207 ( 1.311 12.186 -3.770) 12.823 29.397 ( 7.003 8.626 -11.836) 16.234 ======================= Grid point 142 (74/104) ======================= q-point: (-0.50 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -5.724 3.375 15.884) 17.218 1.831 ( -21.650 -0.073 7.287) 22.843 2.097 ( 9.291 -5.617 7.344) 13.107 2.243 ( -3.575 1.374 -11.378) 12.005 2.378 ( 2.469 -7.182 3.933) 8.552 2.563 ( 1.259 0.572 0.389) 1.436 2.747 ( -4.488 3.871 0.957) 6.004 2.774 ( 3.084 -5.979 -6.468) 9.333 2.909 ( -0.296 -4.763 -10.064) 11.139 3.004 ( -3.156 3.366 -9.413) 10.483 3.147 ( 0.930 0.820 6.211) 6.333 3.283 ( 0.210 -9.286 -2.756) 9.689 3.443 ( -4.046 -6.614 -2.060) 8.022 3.624 ( 4.338 -2.412 -8.665) 9.986 3.782 ( -12.354 2.632 21.011) 24.516 3.849 ( -9.447 0.677 16.178) 18.746 4.099 ( 2.320 3.145 0.470) 3.936 4.273 ( -0.598 1.265 10.029) 10.127 4.417 ( 0.395 2.318 0.735) 2.464 4.493 ( -1.094 -1.013 -2.057) 2.541 4.610 ( 2.572 2.272 -1.587) 3.781 4.709 ( 6.622 6.485 1.388) 9.371 4.767 ( 1.532 2.396 -9.319) 9.743 4.912 ( 0.623 3.234 -1.757) 3.733 5.174 ( 4.755 -2.181 -2.113) 5.642 5.248 ( -0.129 2.424 1.759) 2.997 5.500 ( 4.550 4.504 3.826) 7.458 5.603 ( -0.838 -2.936 6.662) 7.328 5.739 ( 2.927 1.487 2.642) 4.214 5.891 ( -5.465 4.335 -7.099) 9.953 5.986 ( 4.220 -2.348 1.589) 5.084 6.044 ( 0.617 -1.468 1.370) 2.101 6.130 ( -4.924 3.453 5.203) 7.952 6.243 ( 4.691 7.545 1.182) 8.963 6.497 ( -1.216 -7.083 -0.738) 7.225 6.563 ( 0.972 -3.695 -4.778) 6.118 6.650 ( 2.417 0.360 0.192) 2.451 6.842 ( 1.892 -0.799 -2.001) 2.868 6.999 ( 2.612 -9.503 -3.790) 10.559 7.101 ( -2.365 -3.631 -2.243) 4.879 7.178 ( -0.988 -0.526 -1.206) 1.645 7.203 ( -2.056 2.311 -1.713) 3.536 7.464 ( 1.653 1.592 4.669) 5.203 7.503 ( 1.345 0.157 6.223) 6.369 7.626 ( 1.027 3.754 0.214) 3.898 7.808 ( 5.380 7.122 -0.756) 8.957 7.902 ( 1.732 2.547 0.452) 3.114 8.142 ( -3.565 -0.258 -9.439) 10.093 8.945 ( -0.439 -0.602 4.929) 4.985 9.016 ( -1.603 -3.968 3.722) 5.672 9.121 ( -2.649 2.409 0.591) 3.629 9.372 ( 2.043 -3.798 -9.471) 10.407 9.614 ( 5.387 2.940 7.305) 9.541 9.895 ( -11.452 -3.871 0.417) 12.096 10.001 ( -3.169 -0.700 -0.703) 3.321 10.276 ( -0.840 0.716 0.903) 1.427 10.340 ( 4.499 -4.380 0.629) 6.310 10.387 ( 0.658 -1.327 -4.359) 4.604 11.173 ( -3.017 -2.309 -8.580) 9.383 11.251 ( 0.340 -2.721 -10.017) 10.386 11.450 ( 1.157 0.055 12.921) 12.973 11.654 ( 7.002 1.048 0.830) 7.128 12.112 ( 3.943 -4.613 7.718) 9.817 12.222 ( -1.998 1.208 4.033) 4.659 12.641 ( -4.348 3.011 1.547) 5.510 12.714 ( -0.745 -3.962 -6.354) 7.525 12.747 ( 1.197 4.920 -6.714) 8.410 12.995 ( -3.143 0.486 -8.913) 9.464 13.670 ( 7.939 2.445 6.661) 10.648 13.967 ( -6.430 -1.926 -6.416) 9.285 14.404 ( 3.745 -7.831 6.929) 11.107 14.622 ( -4.827 -8.310 -4.718) 10.706 14.844 ( 6.513 6.899 6.659) 11.591 15.098 ( -4.583 4.933 -4.153) 7.911 15.260 ( 0.963 5.176 1.363) 5.438 15.319 ( -3.111 1.042 -1.202) 3.494 15.526 ( -2.992 0.727 -0.778) 3.176 15.639 ( 1.465 1.807 -5.366) 5.848 16.226 ( -2.828 0.405 3.624) 4.615 16.259 ( 4.164 0.696 2.443) 4.877 24.710 ( 0.852 0.683 1.361) 1.745 24.753 ( -0.845 1.692 -0.846) 2.072 24.834 ( -0.399 -0.778 2.306) 2.466 24.899 ( -0.351 -0.181 0.732) 0.831 25.043 ( -5.096 1.035 3.486) 6.260 25.110 ( 1.827 0.565 -0.995) 2.155 25.491 ( 1.340 -6.379 11.157) 12.922 25.715 ( 6.285 -9.649 7.380) 13.678 26.357 ( 0.812 1.860 0.996) 2.261 26.450 ( 3.977 1.095 4.847) 6.364 26.544 ( -3.344 4.621 -8.361) 10.122 26.775 ( -8.131 -1.735 -10.505) 13.396 28.648 ( -0.706 -8.303 5.090) 9.764 28.764 ( 0.758 -9.544 -0.111) 9.575 29.198 ( -0.098 12.280 -2.569) 12.546 29.405 ( 2.302 7.899 -13.328) 15.663 ======================= Grid point 143 (75/104) ======================= q-point: (-0.33 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( -15.769 -3.802 16.739) 23.309 1.673 ( 3.807 9.178 26.699) 28.488 2.081 ( 1.738 0.822 -12.040) 12.192 2.379 ( 13.492 -5.031 0.120) 14.400 2.511 ( -2.960 -1.508 -0.871) 3.434 2.513 ( 6.120 -5.902 6.860) 10.925 2.765 ( 1.548 -2.096 -0.811) 2.729 2.797 ( 3.781 1.640 -2.783) 4.973 2.870 ( 3.514 -4.501 -9.727) 11.279 2.972 ( 3.456 1.632 -4.911) 6.223 3.198 ( -1.976 6.757 13.714) 15.416 3.316 ( 4.872 -6.414 -2.312) 8.379 3.340 ( -5.636 -9.000 -1.434) 10.715 3.620 ( -13.947 2.949 23.876) 27.808 3.681 ( 5.194 -1.786 -6.855) 8.784 3.869 ( -2.096 0.559 14.785) 14.944 4.080 ( -3.213 1.808 -5.336) 6.486 4.314 ( -0.088 1.736 6.231) 6.469 4.457 ( 1.863 5.482 1.829) 6.072 4.480 ( 0.509 -4.620 1.580) 4.909 4.655 ( 2.138 1.212 -0.987) 2.648 4.759 ( 4.896 3.997 -11.065) 12.742 4.797 ( 0.769 4.083 -6.374) 7.609 4.903 ( 2.959 3.472 -1.097) 4.692 5.148 ( -5.433 0.635 -4.130) 6.854 5.291 ( 3.606 -5.986 -0.005) 6.988 5.590 ( 2.259 2.441 3.503) 4.830 5.623 ( -0.709 -4.775 6.449) 8.056 5.686 ( -7.248 1.050 0.117) 7.325 5.826 ( -0.111 9.246 -3.556) 9.907 5.956 ( -3.067 -2.042 -3.717) 5.234 6.086 ( -3.391 1.761 6.269) 7.342 6.136 ( 5.162 -0.518 -0.877) 5.262 6.349 ( 5.029 7.139 -1.212) 8.817 6.402 ( -4.928 -3.629 0.365) 6.131 6.528 ( -4.831 -4.785 -4.051) 7.915 6.678 ( 0.003 2.056 -0.376) 2.090 6.778 ( -1.855 -2.942 -5.896) 6.846 6.875 ( -11.738 -3.829 -2.030) 12.513 7.011 ( -6.612 -1.762 -7.072) 9.841 7.159 ( 5.672 -5.253 5.584) 9.537 7.284 ( 1.203 4.361 1.519) 4.772 7.513 ( 0.789 2.458 3.390) 4.261 7.621 ( 2.641 -4.352 -0.219) 5.096 7.650 ( 3.059 0.913 -1.412) 3.491 7.810 ( 3.050 4.037 0.784) 5.120 8.018 ( 0.022 3.365 -8.977) 9.587 8.040 ( 4.479 4.446 2.091) 6.648 8.945 ( -2.381 -0.933 3.719) 4.513 9.015 ( -1.060 -3.933 3.921) 5.654 9.092 ( -1.032 1.749 2.581) 3.284 9.350 ( 1.595 -0.988 -9.769) 9.948 9.714 ( -8.294 -3.583 3.287) 9.614 9.773 ( 4.982 1.557 10.119) 11.386 9.966 ( 1.981 0.755 -8.368) 8.632 10.234 ( -2.793 -3.063 6.075) 7.354 10.414 ( 3.289 -1.818 1.105) 3.917 10.494 ( 10.436 -3.694 -5.217) 12.238 11.027 ( -6.009 -1.206 -3.143) 6.888 11.270 ( 4.504 -4.086 -5.024) 7.888 11.435 ( -7.730 2.477 2.382) 8.460 11.687 ( -3.459 1.820 -2.488) 4.633 12.169 ( -1.271 -0.410 2.720) 3.030 12.183 ( -2.666 0.124 4.383) 5.132 12.523 ( -4.886 0.442 -2.682) 5.591 12.775 ( 6.099 -2.092 1.086) 6.539 12.877 ( 13.022 0.515 -3.926) 13.610 13.032 ( 12.211 1.832 -2.405) 12.580 13.758 ( -8.538 0.340 -6.856) 10.956 13.859 ( 5.188 0.020 5.756) 7.749 14.445 ( -8.270 -12.625 -1.971) 15.221 14.554 ( 5.504 -8.258 4.904) 11.070 14.966 ( -5.866 7.465 -6.734) 11.640 15.019 ( 7.570 9.071 6.306) 13.392 15.256 ( -3.249 3.884 -1.539) 5.292 15.300 ( 1.999 5.349 3.612) 6.757 15.497 ( -0.708 0.238 1.152) 1.373 15.655 ( 3.507 -1.002 -3.861) 5.312 16.139 ( -8.085 0.371 2.418) 8.447 16.303 ( -0.862 0.063 0.741) 1.139 24.732 ( 0.327 0.615 -0.108) 0.705 24.748 ( 0.980 1.363 0.342) 1.713 24.839 ( -0.690 -1.157 3.023) 3.309 24.895 ( -0.523 -0.250 -0.506) 0.769 24.983 ( -3.945 1.534 4.040) 5.851 25.129 ( 0.938 0.827 0.637) 1.404 25.511 ( -5.412 -4.150 7.216) 9.929 25.791 ( -0.923 -19.417 -2.965) 19.664 26.410 ( -4.956 6.467 -8.712) 11.928 26.455 ( 7.999 -0.047 5.764) 9.860 26.589 ( -2.329 0.237 -4.440) 5.019 26.653 ( 9.653 4.167 6.502) 12.362 28.645 ( -1.688 -7.420 3.546) 8.395 28.797 ( 2.079 -9.242 -0.451) 9.484 29.177 ( -0.834 12.181 -1.067) 12.256 29.323 ( -2.388 9.565 -11.686) 15.289 ======================= Grid point 144 (76/104) ======================= q-point: (-0.17 0.14 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( -4.094 -9.807 25.796) 27.899 1.876 ( -2.329 6.220 25.838) 26.677 2.180 ( 14.823 -2.098 -7.395) 16.697 2.469 ( 1.832 -9.617 -0.978) 9.839 2.582 ( 5.178 -8.641 -6.302) 11.882 2.643 ( 4.714 -5.761 1.942) 7.693 2.768 ( 4.730 0.745 -7.401) 8.815 2.854 ( 0.730 0.233 3.855) 3.930 2.927 ( 6.137 -1.036 -2.192) 6.598 3.024 ( 2.919 0.929 -0.048) 3.063 3.220 ( -4.446 -10.690 -2.154) 11.777 3.264 ( -0.977 8.632 18.309) 20.265 3.437 ( 4.845 1.380 9.248) 10.531 3.559 ( -6.601 4.426 18.856) 20.462 3.744 ( 4.234 -2.088 -5.175) 7.005 3.909 ( -4.444 -3.515 -0.545) 5.692 4.011 ( 2.282 0.836 8.527) 8.867 4.290 ( -8.411 2.812 2.968) 9.352 4.468 ( 3.113 -0.475 -4.405) 5.415 4.537 ( 1.649 0.839 -0.062) 1.851 4.658 ( 0.331 -0.937 -2.060) 2.287 4.727 ( -0.854 -0.593 -5.715) 5.809 4.781 ( 2.888 7.540 -7.565) 11.064 4.966 ( 1.311 3.978 -2.380) 4.817 5.012 ( -3.057 5.780 -6.538) 9.246 5.299 ( -2.157 -6.330 -2.648) 7.193 5.556 ( -7.370 3.498 -1.777) 8.349 5.591 ( -1.581 -2.001 -3.124) 4.032 5.683 ( -0.798 -0.766 10.699) 10.756 5.820 ( 2.956 5.941 1.143) 6.734 5.892 ( 1.414 -0.172 -5.256) 5.446 6.034 ( -7.643 -2.010 3.724) 8.737 6.161 ( -3.634 0.260 -5.477) 6.578 6.309 ( -3.166 -0.070 -5.828) 6.633 6.379 ( 1.081 -0.079 -0.434) 1.167 6.450 ( 1.325 3.404 0.073) 3.654 6.651 ( -1.041 5.088 1.761) 5.484 6.698 ( -5.044 -2.825 -0.694) 5.823 6.783 ( 0.233 -0.730 -0.045) 0.767 6.901 ( -0.886 -2.780 -6.579) 7.197 7.183 ( -4.163 3.648 -1.433) 5.717 7.249 ( -2.793 11.640 3.776) 12.551 7.448 ( -10.331 -2.611 -3.611) 11.251 7.636 ( 2.618 0.493 -8.560) 8.965 7.734 ( 7.423 -7.360 2.543) 10.758 7.886 ( 1.812 -3.297 5.665) 6.800 8.023 ( 1.446 1.552 -1.952) 2.883 8.127 ( 5.276 4.017 -3.451) 7.475 8.924 ( -2.060 -1.087 3.686) 4.360 9.019 ( -0.036 -1.688 1.002) 1.964 9.120 ( 1.106 0.950 4.106) 4.357 9.317 ( 1.795 2.645 -7.503) 8.156 9.610 ( -6.531 -4.925 5.736) 9.991 9.927 ( 3.489 2.292 8.458) 9.432 9.954 ( 4.294 0.855 -9.348) 10.323 10.279 ( 3.360 -3.823 6.646) 8.371 10.507 ( 5.268 -2.589 3.559) 6.864 10.625 ( 6.321 -3.032 -3.382) 7.784 10.958 ( -0.925 -4.162 0.771) 4.332 11.229 ( -9.066 2.389 2.522) 9.708 11.386 ( 6.296 -6.637 -5.237) 10.541 11.516 ( -10.872 2.653 -5.424) 12.436 12.043 ( -8.206 0.707 -5.259) 9.772 12.218 ( -0.340 -3.943 -2.964) 4.945 12.488 ( 3.526 3.693 1.490) 5.319 12.932 ( 7.639 -3.983 6.822) 10.989 13.045 ( 5.009 -0.739 -4.209) 6.585 13.310 ( 15.207 3.805 -0.723) 15.693 13.604 ( 0.314 4.441 -3.330) 5.560 13.963 ( 1.270 -2.123 5.854) 6.356 14.236 ( -11.917 -10.215 -2.017) 15.825 14.664 ( -1.321 5.037 -3.295) 6.162 14.877 ( 3.977 -5.233 0.765) 6.617 15.159 ( 0.724 4.436 2.754) 5.271 15.190 ( -0.259 3.815 0.329) 3.838 15.368 ( 1.721 3.636 1.717) 4.373 15.527 ( 4.700 1.284 3.740) 6.142 15.714 ( 4.602 0.004 -1.292) 4.780 15.996 ( -8.360 0.644 2.137) 8.653 16.234 ( -6.299 -0.682 -1.751) 6.573 24.740 ( 0.393 0.134 -0.404) 0.579 24.763 ( 1.114 1.143 0.632) 1.717 24.843 ( -2.018 -0.774 2.915) 3.629 24.868 ( -1.687 0.329 -1.519) 2.293 24.975 ( 1.015 1.112 5.247) 5.459 25.163 ( 1.712 0.359 3.111) 3.569 25.414 ( -7.402 -4.061 1.756) 8.624 25.642 ( -11.302 -11.228 -5.960) 17.009 26.296 ( -3.360 5.818 -1.949) 6.995 26.502 ( -0.327 -0.283 -7.200) 7.213 26.651 ( 6.170 -5.493 9.426) 12.534 26.964 ( 16.346 -4.213 2.864) 17.121 28.657 ( 1.593 -3.992 1.463) 4.540 28.802 ( -1.260 -7.724 -1.986) 8.074 29.160 ( -0.302 11.884 -0.664) 11.907 29.217 ( -1.716 12.174 -6.221) 13.779 ======================= Grid point 145 (77/104) ======================= q-point: ( 0.00 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.424 ( 0.749 -10.296 24.295) 26.397 1.955 ( -9.681 2.260 15.279) 18.229 2.107 ( -0.489 -11.235 -6.858) 13.172 2.226 ( -1.018 -21.686 -1.748) 21.780 2.319 ( 2.782 -14.268 -4.524) 15.224 2.584 ( 1.937 -10.048 -8.226) 13.130 2.734 ( -4.703 -3.451 2.017) 6.172 2.838 ( 4.334 -1.885 -3.214) 5.715 2.921 ( 2.945 3.172 4.584) 6.305 3.145 ( 3.906 7.375 -6.330) 10.475 3.186 ( 2.073 -3.581 5.539) 6.914 3.394 ( -0.012 4.757 1.017) 4.865 3.545 ( -8.661 -5.599 -2.249) 10.555 3.675 ( -1.432 1.952 -6.482) 6.919 3.759 ( -3.260 -0.034 4.452) 5.518 3.911 ( -2.460 7.652 24.506) 25.791 4.052 ( -3.212 -0.884 -2.258) 4.025 4.191 ( 3.772 3.120 14.110) 14.935 4.444 ( 1.612 2.656 -1.535) 3.466 4.639 ( 3.213 2.930 -4.450) 6.222 4.758 ( 2.445 4.327 -2.976) 5.793 4.783 ( 2.426 5.155 1.397) 5.866 4.884 ( 1.239 3.508 -7.275) 8.171 4.998 ( 0.127 3.696 2.111) 4.259 5.085 ( 0.848 -2.231 -4.447) 5.047 5.154 ( 0.263 0.913 -2.808) 2.964 5.475 ( -2.011 -2.019 1.519) 3.229 5.519 ( -5.887 2.003 0.151) 6.220 5.669 ( -7.388 -0.931 9.852) 12.350 5.847 ( -1.763 -1.849 3.103) 4.019 5.928 ( 1.121 4.641 -1.887) 5.134 5.988 ( -0.998 -0.841 -4.614) 4.795 6.066 ( 6.336 4.679 0.163) 7.878 6.246 ( -2.545 -2.749 -0.967) 3.869 6.421 ( -2.307 -0.212 -2.333) 3.288 6.491 ( -0.544 -3.080 -3.316) 4.558 6.676 ( 5.312 4.738 2.431) 7.521 6.820 ( 0.730 2.126 -1.452) 2.676 6.868 ( 3.069 6.160 -0.046) 6.883 6.906 ( 5.087 6.175 1.025) 8.066 7.143 ( -6.924 1.750 -4.688) 8.543 7.241 ( -5.105 5.081 -4.082) 8.279 7.482 ( 2.482 5.373 5.681) 8.204 7.650 ( -1.981 1.678 -2.451) 3.571 7.711 ( 3.996 -5.546 5.893) 9.025 7.815 ( -0.321 -3.973 1.749) 4.353 7.988 ( -2.961 -2.711 -3.829) 5.548 8.171 ( 1.252 -1.114 -11.723) 11.842 8.893 ( -1.982 1.006 3.618) 4.246 9.020 ( 0.764 0.614 -0.763) 1.242 9.204 ( 2.301 3.139 0.557) 3.932 9.349 ( 0.491 -4.210 -2.393) 4.867 9.528 ( -3.067 4.458 3.492) 6.441 9.958 ( 4.177 2.654 -13.191) 14.089 10.017 ( -1.194 -5.299 12.031) 13.200 10.368 ( 9.341 -1.318 -0.038) 9.433 10.561 ( 2.738 -6.515 5.959) 9.244 10.646 ( -1.566 0.749 3.360) 3.782 10.784 ( -1.233 -7.880 -2.219) 8.279 11.047 ( -1.190 -12.013 -7.515) 14.220 11.243 ( -3.977 2.806 4.400) 6.561 11.515 ( -0.337 5.014 -4.240) 6.575 11.803 ( -8.578 -6.727 -4.344) 11.734 11.993 ( -2.545 -8.676 -9.666) 13.236 12.784 ( 9.361 8.789 6.680) 14.474 13.034 ( -5.098 5.792 -4.700) 9.034 13.103 ( 6.733 1.644 9.180) 11.502 13.469 ( -1.057 -1.007 -7.360) 7.503 13.744 ( -0.294 -3.240 2.790) 4.286 13.794 ( -1.168 -5.295 1.089) 5.531 14.218 ( 10.411 7.668 10.835) 16.870 14.678 ( -10.658 9.289 -11.315) 18.108 14.884 ( 13.164 -10.867 8.736) 19.175 15.052 ( -10.837 -1.484 -1.661) 11.064 15.244 ( -3.800 0.669 -1.574) 4.167 15.355 ( 1.117 -1.978 -5.274) 5.742 15.755 ( 5.793 2.661 4.772) 7.963 15.823 ( 5.038 1.117 -0.320) 5.170 15.941 ( -1.396 2.473 2.404) 3.721 16.066 ( -5.321 -0.888 -2.487) 5.940 24.761 ( 0.590 1.064 1.207) 1.714 24.790 ( -2.570 0.765 2.065) 3.385 24.824 ( 0.449 0.989 -0.679) 1.281 24.853 ( 1.064 0.239 -0.868) 1.394 25.058 ( 2.150 -0.615 5.336) 5.785 25.180 ( -5.554 -4.971 0.873) 7.505 25.237 ( 1.261 0.637 4.624) 4.835 25.354 ( -5.260 -3.202 1.466) 6.330 26.352 ( -1.927 6.009 -0.631) 6.342 26.466 ( 0.813 0.066 -4.909) 4.976 26.646 ( 0.561 -6.871 6.883) 9.742 26.904 ( 2.943 -13.235 -4.785) 14.378 28.646 ( -3.213 -1.719 -1.261) 3.856 28.664 ( 2.391 -3.932 -1.104) 4.732 29.401 ( 2.722 10.390 -3.536) 11.307 29.415 ( 3.659 8.833 -3.607) 10.219 ======================= Grid point 146 (78/104) ======================= q-point: ( 0.17 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( -1.071 -12.196 22.018) 25.193 1.923 ( -0.665 0.015 7.510) 7.540 1.940 ( -13.658 -8.904 0.541) 16.313 2.176 ( -2.611 -17.311 0.616) 17.517 2.327 ( 0.325 -16.394 -5.107) 17.174 2.543 ( 1.165 -11.053 -8.952) 14.271 2.702 ( -1.791 -1.097 3.866) 4.400 2.879 ( -0.476 -1.242 1.168) 1.770 2.985 ( 2.937 1.536 -3.290) 4.670 3.187 ( -2.127 6.599 -1.550) 7.104 3.190 ( -0.018 -3.243 -3.770) 4.973 3.316 ( -8.147 -2.301 -1.518) 8.601 3.488 ( 5.148 -1.562 3.748) 6.556 3.543 ( -6.564 -4.393 -3.489) 8.635 3.741 ( -3.795 -1.320 10.949) 11.663 3.870 ( -3.100 0.041 3.959) 5.029 4.166 ( 1.003 6.175 12.841) 14.283 4.329 ( 2.860 3.375 7.097) 8.362 4.460 ( -0.627 5.344 5.741) 7.869 4.617 ( -1.401 3.387 -5.912) 6.956 4.731 ( 0.086 6.552 -10.062) 12.007 4.787 ( -4.212 5.718 3.529) 7.931 4.864 ( 2.257 2.056 -10.089) 10.541 5.010 ( -2.973 6.385 0.571) 7.066 5.102 ( 3.930 -0.712 -0.965) 4.109 5.178 ( 6.305 2.614 -5.235) 8.602 5.420 ( -3.368 2.327 4.199) 5.865 5.505 ( 0.482 -2.759 3.656) 4.606 5.649 ( -0.294 -0.085 10.485) 10.489 5.806 ( -1.641 2.514 -0.397) 3.028 5.964 ( 2.716 1.409 4.528) 5.465 6.071 ( 6.845 -1.947 -2.959) 7.708 6.124 ( -2.754 -3.365 -0.979) 4.457 6.227 ( 5.310 5.324 -2.779) 8.016 6.367 ( -2.594 2.445 1.586) 3.901 6.469 ( 1.342 -4.954 -3.933) 6.466 6.709 ( -1.980 4.841 -0.636) 5.268 6.789 ( -1.368 0.978 -4.416) 4.725 6.976 ( 5.965 4.763 1.092) 7.711 6.989 ( 3.671 3.419 -2.896) 5.793 7.068 ( 0.169 7.005 -2.457) 7.425 7.235 ( 8.026 4.355 4.995) 10.408 7.502 ( -3.738 -0.175 2.571) 4.541 7.541 ( -7.753 0.532 -2.017) 8.029 7.746 ( -3.459 2.186 0.809) 4.172 7.854 ( 1.060 -4.337 4.105) 6.065 7.934 ( 1.092 -1.710 -4.037) 4.518 8.101 ( -0.432 -5.709 -9.774) 11.327 8.897 ( -0.150 1.704 3.929) 4.285 9.021 ( -0.763 0.642 0.449) 1.094 9.233 ( 0.363 2.238 -0.784) 2.399 9.354 ( 2.019 -4.693 -4.448) 6.774 9.481 ( -3.531 3.865 5.806) 7.817 9.977 ( 5.246 1.881 -9.684) 11.173 10.050 ( -2.422 -6.288 10.005) 12.063 10.400 ( -11.093 -7.126 -2.321) 13.387 10.475 ( 0.263 3.826 -7.431) 8.362 10.604 ( -6.587 1.510 2.787) 7.310 10.960 ( 13.740 -12.255 -0.200) 18.412 11.032 ( 5.224 -6.301 -1.044) 8.251 11.238 ( -0.187 -0.034 6.357) 6.359 11.542 ( 2.256 3.073 -6.669) 7.682 11.690 ( -1.729 -10.238 7.269) 12.675 11.934 ( 2.260 -5.754 -3.206) 6.964 12.865 ( -5.001 6.500 -3.371) 8.867 12.967 ( 0.960 5.585 0.748) 5.716 13.186 ( -3.961 4.892 3.695) 7.299 13.309 ( -6.701 -2.413 -7.410) 10.278 13.654 ( -4.599 1.186 0.971) 4.848 13.921 ( 6.495 -5.393 3.056) 8.978 14.394 ( -6.717 4.655 -8.640) 11.892 14.540 ( 11.326 11.402 7.524) 17.745 14.823 ( -12.146 -6.757 -3.136) 14.248 15.131 ( 6.418 -7.335 7.919) 12.558 15.176 ( -0.971 0.436 -0.440) 1.152 15.348 ( 0.682 -3.273 -3.431) 4.791 15.762 ( -3.934 2.655 -2.384) 5.311 15.825 ( -2.452 1.389 -3.612) 4.581 16.021 ( 6.445 2.697 2.567) 7.443 16.093 ( 7.021 1.313 1.820) 7.371 24.749 ( -2.657 1.044 1.594) 3.270 24.774 ( -0.071 1.002 0.778) 1.270 24.829 ( 1.462 1.886 -1.289) 2.712 24.899 ( 2.330 -1.465 0.597) 2.816 25.072 ( -3.856 -0.751 2.190) 4.498 25.137 ( 0.185 -1.500 4.931) 5.157 25.254 ( -2.288 -1.389 1.384) 3.013 25.362 ( 3.880 -1.411 6.930) 8.067 26.339 ( -0.023 4.915 1.852) 5.252 26.451 ( 0.290 -0.170 -4.529) 4.541 26.653 ( -2.787 -6.005 4.112) 7.793 26.913 ( 1.515 -13.334 -6.577) 14.945 28.559 ( -4.681 -0.978 0.282) 4.790 28.671 ( -1.276 -5.392 -0.445) 5.559 29.418 ( 2.356 10.112 -4.410) 11.281 29.489 ( 6.430 7.566 -6.587) 11.915 ======================= Grid point 147 (79/104) ======================= q-point: ( 0.33 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( -8.621 -2.883 13.338) 16.141 1.765 ( -4.407 -15.464 13.016) 20.687 1.989 ( 0.764 -3.478 -1.999) 4.083 2.158 ( -0.626 -8.781 5.749) 10.514 2.308 ( -1.193 -4.886 0.208) 5.034 2.489 ( 2.074 -9.630 -9.880) 13.952 2.733 ( 1.255 -4.398 4.505) 6.420 2.817 ( -5.246 0.961 -5.471) 7.641 2.934 ( -5.811 -0.968 -4.975) 7.711 3.072 ( -1.792 0.826 1.503) 2.481 3.133 ( -3.500 -8.122 -1.317) 8.942 3.280 ( 0.686 9.887 -4.883) 11.048 3.433 ( -5.426 -6.436 0.886) 8.465 3.586 ( 3.667 -1.179 -1.963) 4.323 3.770 ( -0.918 1.084 10.077) 10.176 3.922 ( 2.342 -1.720 13.013) 13.334 4.148 ( -8.002 4.802 4.203) 10.235 4.342 ( -2.611 8.975 5.709) 10.952 4.497 ( -2.126 -0.697 4.435) 4.968 4.549 ( -2.231 2.941 -3.626) 5.174 4.694 ( -2.487 6.592 -3.505) 7.869 4.710 ( 1.987 3.540 -3.865) 5.605 4.815 ( 0.517 2.026 -12.219) 12.396 5.001 ( 0.429 7.461 4.910) 8.942 5.139 ( 1.670 -1.445 -4.487) 5.001 5.257 ( 4.214 -1.071 -4.182) 6.032 5.453 ( 2.106 2.871 6.273) 7.213 5.545 ( 0.505 -3.467 6.923) 7.759 5.726 ( -0.079 3.776 9.950) 10.642 5.827 ( 4.054 0.176 1.045) 4.190 5.991 ( -2.818 -2.014 -3.113) 4.657 6.098 ( -1.699 -3.517 -3.456) 5.215 6.122 ( 5.881 -1.146 4.336) 7.396 6.331 ( -1.525 5.398 1.905) 5.924 6.345 ( 5.059 5.089 1.652) 7.363 6.500 ( 4.351 -3.988 -5.615) 8.147 6.654 ( -2.777 1.554 -2.103) 3.815 6.757 ( 0.738 -2.491 -1.410) 2.955 7.007 ( -2.257 0.577 -5.299) 5.789 7.045 ( 3.400 4.488 -5.012) 7.538 7.130 ( 8.312 5.860 1.602) 10.295 7.381 ( -3.997 -1.096 -3.432) 5.381 7.387 ( -3.731 0.435 3.287) 4.991 7.498 ( 3.455 -1.575 2.610) 4.608 7.681 ( -1.883 3.137 6.092) 7.106 7.853 ( 0.836 6.841 -5.249) 8.663 7.937 ( -0.605 -3.117 -0.205) 3.182 8.089 ( 2.614 -7.683 -0.442) 8.128 8.927 ( 0.717 1.955 3.343) 3.938 8.995 ( -2.355 -0.055 0.671) 2.449 9.205 ( -2.133 0.445 -1.433) 2.608 9.323 ( 0.217 -5.158 -9.178) 10.530 9.540 ( 3.195 5.354 10.631) 12.325 9.986 ( -0.306 -1.154 -4.168) 4.336 10.057 ( -5.838 -4.367 7.228) 10.267 10.199 ( -4.672 -3.151 -1.894) 5.945 10.379 ( -4.751 1.214 -6.841) 8.417 10.476 ( -5.379 1.152 -5.693) 7.916 11.083 ( 5.909 -6.034 -6.171) 10.460 11.201 ( 5.702 -10.975 -4.849) 13.284 11.325 ( 3.002 1.438 12.946) 13.367 11.519 ( 2.604 0.898 1.601) 3.186 11.824 ( 7.433 -5.894 10.712) 14.308 12.061 ( 10.165 -4.627 4.564) 12.065 12.751 ( -3.326 3.431 -6.599) 8.147 12.848 ( -10.840 0.698 -4.324) 11.691 13.041 ( -9.946 6.020 -5.428) 12.831 13.165 ( -7.082 0.371 -5.569) 9.017 13.645 ( 2.611 6.769 3.420) 8.021 14.011 ( 0.255 -2.805 1.655) 3.266 14.250 ( -1.587 -2.379 -5.574) 6.265 14.599 ( -9.224 -9.719 -5.310) 14.413 14.806 ( 10.163 10.329 9.140) 17.132 15.149 ( -1.209 -1.106 3.708) 4.053 15.264 ( 2.349 -2.521 4.024) 5.297 15.351 ( 1.704 -0.639 -1.537) 2.382 15.657 ( -4.209 3.406 -5.764) 7.908 15.750 ( -2.028 2.245 -6.985) 7.612 16.161 ( 6.880 2.363 2.082) 7.567 16.215 ( 3.528 0.707 3.227) 4.833 24.723 ( -1.149 1.297 1.572) 2.340 24.780 ( 0.539 0.676 0.473) 0.986 24.842 ( -0.169 1.039 -0.800) 1.322 24.902 ( -1.269 -1.290 -0.024) 1.810 25.074 ( 1.990 0.950 2.010) 2.984 25.135 ( -3.260 1.794 4.195) 5.608 25.267 ( 1.905 -4.689 4.220) 6.589 25.478 ( 2.809 -5.424 7.343) 9.551 26.374 ( 2.022 4.173 3.322) 5.704 26.422 ( -0.614 0.716 -1.329) 1.630 26.628 ( -0.679 -2.155 -1.312) 2.613 26.854 ( -3.725 -9.171 -6.670) 11.937 28.510 ( -1.169 -2.939 1.705) 3.593 28.629 ( -2.663 -6.604 -0.254) 7.125 29.426 ( 1.411 9.937 -4.620) 11.049 29.542 ( 4.436 5.855 -8.958) 11.584 ======================= Grid point 148 (80/104) ======================= q-point: (-0.50 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( -7.220 -2.231 19.094) 20.535 1.819 ( -3.072 -4.000 11.854) 12.882 1.926 ( -1.774 -5.712 2.416) 6.450 2.198 ( 3.525 -7.570 -1.046) 8.416 2.288 ( 0.833 -1.113 1.170) 1.818 2.567 ( 3.094 -2.292 -6.099) 7.213 2.635 ( -0.435 -6.620 -13.653) 15.180 2.775 ( -0.609 3.311 9.074) 9.678 2.833 ( -0.676 -3.214 -9.083) 9.659 3.106 ( 0.487 -7.532 3.775) 8.439 3.151 ( 5.864 -0.654 4.925) 7.686 3.214 ( -3.108 14.287 -7.266) 16.328 3.342 ( -3.899 -3.266 -1.765) 5.384 3.606 ( 3.154 1.123 -9.098) 9.694 3.826 ( -2.009 2.465 15.014) 15.347 3.911 ( -15.654 5.318 21.047) 26.764 4.119 ( 4.154 -1.781 0.733) 4.579 4.354 ( -1.468 6.636 5.882) 8.988 4.409 ( -5.522 -1.188 -0.459) 5.667 4.521 ( 1.583 2.055 -3.806) 4.606 4.668 ( 2.110 1.688 -0.529) 2.754 4.740 ( 1.950 -1.320 -11.850) 12.082 4.809 ( 5.440 3.836 0.519) 6.677 5.019 ( -2.780 5.576 2.493) 6.711 5.125 ( 0.495 -4.833 -3.721) 6.119 5.264 ( 0.056 -1.656 -5.763) 5.996 5.524 ( 1.131 1.995 6.142) 6.557 5.590 ( -0.719 -1.977 6.768) 7.088 5.761 ( -2.377 2.503 8.449) 9.126 5.923 ( 1.427 -1.144 -4.696) 5.039 5.937 ( 3.924 -6.609 0.502) 7.702 6.037 ( -0.817 4.552 -4.935) 6.764 6.207 ( -1.742 1.746 6.527) 6.977 6.357 ( 1.725 -2.010 -0.752) 2.753 6.422 ( 3.028 6.593 2.036) 7.535 6.492 ( -1.510 -3.450 -6.877) 7.840 6.641 ( 2.784 -1.046 2.530) 3.904 6.800 ( 3.760 -5.310 3.868) 7.569 6.864 ( -5.808 -0.918 -8.123) 10.028 7.074 ( -2.136 0.195 -3.596) 4.187 7.167 ( -10.063 -0.706 -2.825) 10.476 7.268 ( 4.539 3.811 -6.072) 8.485 7.407 ( 2.432 -2.142 5.359) 6.262 7.588 ( 7.244 1.166 1.903) 7.580 7.676 ( -3.989 3.680 1.217) 5.562 7.921 ( 1.650 4.476 -3.380) 5.847 7.961 ( 7.230 3.685 6.361) 10.311 8.114 ( -0.372 -3.623 -2.241) 4.276 8.943 ( -1.547 0.460 2.901) 3.319 8.967 ( -0.512 0.015 0.625) 0.808 9.154 ( -2.143 0.637 -1.354) 2.614 9.296 ( 2.906 -4.449 -7.869) 9.495 9.673 ( 3.253 4.341 11.055) 12.314 9.864 ( -10.716 0.396 0.473) 10.734 9.965 ( -2.506 -2.571 1.044) 3.739 10.193 ( -4.473 -8.645 4.040) 10.539 10.315 ( 6.441 2.071 -8.268) 10.683 10.392 ( 0.855 1.189 -6.138) 6.311 11.099 ( -2.600 -5.466 -7.281) 9.469 11.160 ( 1.128 -6.009 -8.093) 10.143 11.469 ( 1.835 1.624 14.295) 14.504 11.647 ( 5.651 -1.798 5.206) 7.891 12.051 ( 9.459 -0.891 9.931) 13.744 12.239 ( 1.467 -0.688 3.097) 3.495 12.639 ( -4.462 -2.336 -4.675) 6.872 12.685 ( -2.118 1.214 -4.316) 4.959 12.852 ( -2.573 5.071 -6.873) 8.920 12.998 ( -3.998 -0.332 -8.594) 9.484 13.744 ( 3.901 5.378 5.416) 8.572 13.949 ( -4.611 0.468 -3.668) 5.911 14.252 ( 0.393 -7.757 3.722) 8.613 14.431 ( -5.839 -10.252 -5.185) 12.887 15.012 ( 7.189 8.364 7.630) 13.411 15.142 ( -2.164 1.073 2.504) 3.479 15.329 ( 2.705 1.586 3.094) 4.405 15.371 ( 1.446 3.410 -1.288) 3.921 15.553 ( -3.374 2.377 -4.583) 6.167 15.670 ( -1.112 0.824 -9.173) 9.277 16.239 ( -2.722 0.959 2.919) 4.105 16.273 ( 3.443 0.601 1.445) 3.782 24.727 ( 0.343 1.045 1.838) 2.142 24.792 ( 0.230 1.952 -1.004) 2.207 24.814 ( -1.732 -1.078 1.562) 2.569 24.891 ( -0.072 -0.719 -0.730) 1.028 25.075 ( -3.833 2.283 3.625) 5.748 25.136 ( 1.554 2.598 0.703) 3.108 25.350 ( 2.483 -7.684 8.076) 11.421 25.519 ( -2.139 -10.030 3.043) 10.698 26.406 ( 1.024 3.155 1.876) 3.811 26.484 ( 4.447 2.442 5.824) 7.723 26.608 ( 1.076 1.736 -5.496) 5.863 26.716 ( -6.275 -4.389 -6.355) 9.951 28.524 ( 0.306 -4.518 2.375) 5.113 28.597 ( 0.412 -7.292 -0.909) 7.360 29.413 ( 0.050 9.679 -3.555) 10.312 29.536 ( 1.427 5.253 -9.786) 11.198 ======================= Grid point 149 (81/104) ======================= q-point: (-0.33 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -16.180 -5.703 16.334) 23.688 1.911 ( 2.632 13.627 18.013) 22.739 1.980 ( 2.560 -13.350 3.907) 14.144 2.266 ( 6.281 -8.503 -8.236) 13.401 2.378 ( 3.804 -1.017 -4.951) 6.326 2.391 ( -2.328 -9.532 -3.729) 10.496 2.700 ( 4.677 -4.100 -10.199) 11.946 2.831 ( -0.981 3.805 10.238) 10.967 2.841 ( 6.618 -3.879 -4.501) 8.894 3.086 ( -4.692 3.942 -0.414) 6.143 3.164 ( 3.614 -2.667 -6.647) 8.022 3.280 ( 2.118 5.966 3.615) 7.290 3.360 ( 8.598 5.279 4.622) 11.098 3.618 ( 4.610 -0.014 -8.897) 10.020 3.768 ( -14.163 9.897 27.455) 32.439 3.878 ( -3.287 0.289 14.647) 15.014 4.130 ( -3.771 2.779 -6.946) 8.379 4.308 ( 1.408 -8.608 0.423) 8.733 4.411 ( -1.230 4.160 5.316) 6.861 4.556 ( 3.546 4.270 -1.073) 5.653 4.682 ( -0.210 -0.594 -10.573) 10.592 4.735 ( 4.739 0.140 -4.562) 6.580 4.896 ( -0.427 -1.207 1.177) 1.739 4.966 ( 1.613 4.038 -0.441) 4.370 5.120 ( -0.611 -8.636 1.544) 8.794 5.202 ( -2.388 0.603 -5.916) 6.408 5.568 ( -1.663 -0.411 6.775) 6.988 5.607 ( 0.422 2.355 4.048) 4.702 5.737 ( -4.158 2.473 4.519) 6.620 5.896 ( -0.645 -4.227 -2.524) 4.965 5.992 ( -0.777 5.558 -7.005) 8.976 6.045 ( 3.008 -4.255 0.734) 5.263 6.177 ( -3.194 3.905 3.150) 5.948 6.318 ( -2.534 -4.280 1.070) 5.088 6.418 ( -2.237 -2.706 -5.188) 6.264 6.502 ( 2.106 3.808 -0.714) 4.410 6.699 ( -1.340 0.405 1.235) 1.866 6.756 ( 1.892 1.736 -2.907) 3.879 6.869 ( -3.408 1.162 2.682) 4.490 6.951 ( -7.281 -4.826 -6.691) 11.003 7.056 ( 5.104 -2.684 5.796) 8.176 7.341 ( 4.223 2.651 -2.340) 5.508 7.478 ( 1.665 -4.906 3.286) 6.135 7.562 ( -4.672 -3.084 -4.500) 7.183 7.739 ( 3.267 7.064 2.124) 8.067 7.915 ( -0.222 6.697 -1.734) 6.922 8.045 ( -1.617 -1.227 -6.563) 6.870 8.111 ( 4.173 2.485 2.607) 5.513 8.940 ( -1.166 0.823 1.833) 2.323 8.966 ( 0.797 -0.189 1.288) 1.526 9.130 ( 0.355 2.081 -0.638) 2.206 9.322 ( 4.232 -3.021 -6.360) 8.215 9.652 ( -9.640 0.338 6.344) 11.545 9.841 ( 3.797 3.470 8.027) 9.534 9.953 ( 1.378 -2.233 -1.879) 3.227 10.142 ( -1.671 -6.001 3.735) 7.263 10.384 ( 4.843 -0.872 -7.066) 8.610 10.460 ( 8.070 0.194 -1.990) 8.314 10.962 ( -6.253 -4.903 -2.602) 8.361 11.155 ( 1.276 -7.981 -6.179) 10.173 11.497 ( -5.952 4.284 4.528) 8.618 11.735 ( 0.916 2.210 -0.651) 2.479 12.122 ( -7.038 -2.914 0.129) 7.618 12.194 ( -2.659 -0.384 1.788) 3.227 12.537 ( -1.514 1.224 -4.284) 4.706 12.723 ( 4.953 -3.388 1.462) 6.176 12.911 ( 11.077 3.147 -3.341) 11.990 13.060 ( 13.356 0.649 -0.185) 13.374 13.773 ( -5.157 1.722 0.444) 5.455 13.891 ( 1.716 3.355 1.707) 4.137 14.221 ( -7.820 -10.540 1.893) 13.260 14.387 ( 4.221 -9.176 2.875) 10.502 15.082 ( -5.079 5.109 -2.222) 7.539 15.160 ( 4.452 5.076 5.644) 8.800 15.341 ( -1.463 4.862 -4.333) 6.675 15.416 ( 3.761 5.715 0.666) 6.874 15.501 ( -1.267 0.191 -0.544) 1.392 15.631 ( 3.235 -1.367 -5.048) 6.149 16.155 ( -7.786 1.400 2.317) 8.243 16.294 ( -2.086 -1.296 0.449) 2.497 24.744 ( 0.143 0.669 0.609) 0.916 24.783 ( 0.285 2.051 0.214) 2.082 24.812 ( -0.620 -1.418 2.494) 2.935 24.885 ( 0.061 -0.836 -1.123) 1.401 25.027 ( -3.607 3.105 3.462) 5.886 25.158 ( 0.298 2.339 1.436) 2.760 25.414 ( -2.764 -5.679 5.123) 8.132 25.461 ( -3.274 -14.571 2.046) 15.074 26.463 ( 3.065 0.904 3.817) 4.978 26.508 ( -2.164 4.428 -5.143) 7.123 26.573 ( -4.232 -1.571 -5.138) 6.839 26.699 ( 7.879 -0.005 4.003) 8.838 28.539 ( 1.300 -3.593 0.529) 3.857 28.637 ( 3.569 -7.033 -0.716) 7.919 29.389 ( -0.605 9.447 -2.170) 9.712 29.482 ( -0.916 6.515 -8.176) 10.494 ======================= Grid point 150 (82/104) ======================= q-point: (-0.17 0.29 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( -7.566 -6.397 22.140) 24.255 2.003 ( -4.551 1.155 15.638) 16.327 2.073 ( 6.477 -5.780 -1.912) 8.889 2.225 ( -2.272 -13.647 -3.930) 14.382 2.345 ( 3.103 -13.566 -10.137) 17.217 2.522 ( 7.246 -4.307 -2.265) 8.729 2.734 ( 6.514 -3.164 -9.015) 11.563 2.846 ( -2.047 -3.302 4.840) 6.206 2.883 ( -3.665 -2.368 6.444) 7.782 3.092 ( 3.406 0.033 4.226) 5.428 3.142 ( 2.444 6.608 -11.066) 13.119 3.367 ( 3.106 5.615 2.768) 6.988 3.580 ( 8.553 3.374 6.650) 11.347 3.640 ( 0.889 2.973 -1.842) 3.609 3.760 ( -4.176 11.485 25.929) 28.665 3.855 ( -5.971 -2.770 -0.426) 6.596 4.051 ( 0.150 3.263 6.521) 7.293 4.267 ( -9.048 -7.890 -3.814) 12.596 4.422 ( 2.182 1.991 -1.227) 3.198 4.589 ( 3.786 2.385 -6.492) 7.885 4.681 ( 3.577 3.151 3.479) 5.901 4.753 ( 1.231 2.943 -2.646) 4.144 4.892 ( 2.556 2.247 -6.296) 7.157 5.009 ( 0.170 -0.916 0.346) 0.994 5.116 ( -1.442 0.281 -3.180) 3.503 5.145 ( 0.285 -5.046 1.456) 5.259 5.532 ( -4.072 -0.020 0.759) 4.142 5.615 ( -3.958 3.060 1.303) 5.170 5.719 ( -2.677 1.564 9.151) 9.662 5.853 ( -2.244 -5.549 -0.250) 5.991 5.931 ( -0.152 5.096 -2.420) 5.644 6.018 ( -2.702 0.495 -2.708) 3.857 6.133 ( -5.745 -1.318 -2.895) 6.567 6.277 ( -1.485 -2.685 -0.857) 3.186 6.420 ( 4.011 3.016 1.123) 5.142 6.497 ( -0.033 0.247 -2.156) 2.170 6.632 ( -2.081 -0.423 -3.053) 3.719 6.792 ( -0.983 4.234 2.473) 5.000 6.849 ( 0.520 1.194 -1.831) 2.247 6.872 ( 1.898 7.894 -0.916) 8.170 7.200 ( 5.248 -2.817 1.086) 6.055 7.333 ( -4.136 -1.770 -1.576) 4.767 7.471 ( -4.326 3.282 2.884) 6.148 7.566 ( 6.558 -7.945 3.566) 10.902 7.704 ( -2.755 6.015 -6.511) 9.283 7.865 ( -3.731 1.110 -0.898) 3.995 8.028 ( 1.156 -0.852 -2.892) 3.229 8.173 ( 3.448 0.166 -4.020) 5.299 8.916 ( -2.539 0.834 2.895) 3.940 9.003 ( 2.143 0.582 -1.375) 2.612 9.156 ( 2.344 2.754 0.419) 3.641 9.349 ( 2.339 -1.957 -4.837) 5.718 9.557 ( -4.586 2.502 5.505) 7.589 9.945 ( 1.122 -1.787 10.133) 10.350 9.972 ( 3.042 0.613 -7.821) 8.414 10.202 ( 6.029 -2.637 3.359) 7.388 10.440 ( 4.107 -3.381 2.007) 5.685 10.584 ( 6.335 -0.624 -1.563) 6.555 10.876 ( -4.185 -4.657 2.065) 6.593 11.113 ( -1.539 -15.111 -6.397) 16.481 11.354 ( -8.977 6.684 -0.334) 11.197 11.632 ( -6.861 7.732 -7.092) 12.536 12.007 ( -9.194 -7.040 -5.444) 12.796 12.085 ( -2.157 -7.683 -5.619) 9.760 12.589 ( 6.871 6.645 3.598) 10.213 12.886 ( 9.545 -1.966 7.393) 12.232 13.082 ( 5.227 5.262 -2.718) 7.899 13.338 ( 14.873 -0.442 1.267) 14.934 13.686 ( -1.324 3.097 -1.057) 3.530 13.928 ( -4.069 -2.622 3.638) 6.056 14.085 ( -3.770 -3.480 3.663) 6.304 14.579 ( 12.047 -10.475 8.790) 18.224 14.925 ( -8.841 7.142 -7.414) 13.570 15.206 ( -4.229 0.811 0.957) 4.412 15.282 ( 0.194 4.661 -3.540) 5.855 15.405 ( -2.279 -0.060 -6.246) 6.649 15.579 ( 7.628 3.917 5.845) 10.378 15.714 ( 6.180 -0.148 -0.089) 6.183 16.020 ( -7.672 1.994 2.183) 8.222 16.206 ( -7.030 -2.382 -0.953) 7.484 24.747 ( 0.290 0.666 0.365) 0.814 24.792 ( 0.396 1.894 0.619) 2.031 24.823 ( -0.682 -1.329 2.973) 3.327 24.872 ( -0.734 -0.012 -1.797) 1.942 25.006 ( -0.476 2.175 3.888) 4.481 25.177 ( 0.418 1.042 3.588) 3.760 25.311 ( -6.585 -6.400 -1.008) 9.238 25.436 ( -4.550 -9.105 4.282) 11.042 26.416 ( -3.330 6.523 -4.402) 8.545 26.496 ( -1.089 -0.224 -4.786) 4.913 26.560 ( 3.817 -3.689 5.544) 7.675 26.847 ( 5.431 -7.594 1.157) 9.408 28.593 ( 4.606 -2.324 -1.055) 5.266 28.681 ( 1.158 -5.169 -1.327) 5.461 29.374 ( 0.755 9.619 -1.891) 9.832 29.424 ( -0.630 8.737 -4.832) 10.004 ======================= Grid point 151 (83/104) ======================= q-point: ( 0.00 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( -0.722 7.780 14.415) 16.396 1.691 ( -0.393 -21.731 3.140) 21.960 1.952 ( -1.159 -3.097 -10.045) 10.575 2.039 ( -0.397 -10.702 -11.298) 15.567 2.185 ( -7.915 8.944 10.008) 15.582 2.382 ( -4.962 -10.869 2.205) 12.150 2.738 ( 0.844 2.441 1.636) 3.057 2.793 ( 3.557 -2.815 -0.854) 4.616 2.995 ( 2.246 4.396 4.956) 6.995 3.091 ( 0.877 -5.612 4.993) 7.563 3.284 ( 1.163 7.233 -4.061) 8.376 3.418 ( -2.779 -6.562 -4.397) 8.373 3.531 ( -0.205 7.598 -7.308) 10.544 3.658 ( -0.608 -4.722 -14.067) 14.851 3.799 ( -9.250 4.927 6.821) 12.505 3.905 ( -9.209 -5.324 1.638) 10.763 4.138 ( 3.575 6.461 15.437) 17.112 4.217 ( 3.360 -1.411 13.639) 14.117 4.573 ( 2.157 9.465 1.112) 9.771 4.678 ( 1.544 0.243 -2.949) 3.338 4.806 ( 4.236 0.804 -0.620) 4.356 4.863 ( 1.446 -4.252 0.497) 4.519 4.876 ( 4.606 4.013 -3.100) 6.850 4.957 ( 4.089 -4.818 0.821) 6.372 5.111 ( -0.083 3.507 0.727) 3.583 5.157 ( 1.378 -1.168 -0.167) 1.814 5.478 ( -3.800 2.272 -3.459) 5.619 5.522 ( -6.878 -1.604 -2.485) 7.487 5.681 ( -4.159 3.488 9.961) 11.344 5.785 ( -1.111 -5.482 9.453) 10.984 5.995 ( 4.686 4.283 -3.571) 7.284 6.062 ( -2.695 2.858 -2.141) 4.474 6.098 ( 3.941 0.253 2.319) 4.579 6.171 ( -3.466 -4.370 0.140) 5.579 6.403 ( -1.738 0.283 -1.382) 2.239 6.438 ( -2.017 -2.550 -2.305) 3.986 6.763 ( 4.870 3.761 0.991) 6.232 6.812 ( 2.837 -1.521 -0.093) 3.221 7.022 ( 3.581 9.641 -0.187) 10.286 7.070 ( 0.479 7.730 -4.239) 8.829 7.170 ( -2.223 -0.841 -3.115) 3.918 7.217 ( 5.350 -6.581 -1.486) 8.610 7.538 ( -1.557 0.618 8.207) 8.376 7.560 ( 0.626 -4.034 7.410) 8.461 7.747 ( -3.346 3.791 -2.298) 5.554 7.808 ( -2.705 -0.099 -0.912) 2.857 7.962 ( -2.130 3.132 -7.274) 8.201 8.091 ( 1.012 -7.131 -7.857) 10.659 8.954 ( -0.291 4.758 0.482) 4.792 9.026 ( 1.296 -1.502 -1.973) 2.798 9.242 ( 1.389 1.135 -3.478) 3.913 9.280 ( 1.146 -2.365 -3.336) 4.247 9.652 ( -3.592 8.657 6.065) 11.163 9.851 ( -2.023 -11.059 10.685) 15.510 10.080 ( 4.517 9.871 -11.832) 16.057 10.287 ( 6.420 -9.614 -8.542) 14.374 10.488 ( 1.339 2.729 8.743) 9.256 10.601 ( -4.333 -6.716 5.515) 9.711 10.731 ( 1.919 2.461 -1.294) 3.379 10.831 ( 4.645 -8.339 -2.888) 9.973 11.380 ( -8.261 10.284 2.264) 13.384 11.588 ( -9.720 -7.378 -0.704) 12.224 11.669 ( -1.567 3.260 -8.760) 9.477 11.819 ( -1.773 -9.053 -8.731) 12.701 12.954 ( 9.731 8.076 6.753) 14.336 13.060 ( 6.524 -2.574 7.525) 10.286 13.223 ( -2.701 9.015 -3.579) 10.068 13.386 ( -3.271 -7.223 -5.602) 9.709 13.695 ( -2.486 -0.985 2.688) 3.791 13.716 ( 1.465 -2.878 1.935) 3.765 14.406 ( 12.991 11.658 10.823) 20.538 14.641 ( 11.573 -12.552 8.058) 18.879 14.863 ( -9.324 8.239 -5.983) 13.806 14.995 ( -11.951 -5.049 -4.636) 13.777 15.264 ( -3.729 1.540 -4.219) 5.837 15.305 ( -1.100 -2.714 -5.751) 6.453 15.800 ( 4.603 1.982 3.468) 6.095 15.827 ( 4.341 -0.710 1.370) 4.607 15.994 ( -0.898 2.849 0.824) 3.099 16.040 ( -2.244 -1.906 -0.915) 3.083 24.783 ( 0.094 1.207 1.939) 2.286 24.800 ( -1.300 -0.262 1.774) 2.215 24.841 ( 1.050 1.055 -0.012) 1.489 24.856 ( 0.380 -0.226 -1.068) 1.156 25.059 ( -0.244 1.052 3.611) 3.769 25.101 ( -2.751 -3.310 2.174) 4.822 25.254 ( -0.026 1.285 3.399) 3.634 25.293 ( -1.673 -2.874 2.462) 4.137 26.457 ( -1.423 3.623 -1.057) 4.033 26.506 ( -0.988 3.573 -1.572) 4.027 26.540 ( 0.685 -1.894 1.588) 2.565 26.682 ( 0.485 -10.245 -3.845) 10.953 28.617 ( -0.773 -0.849 -0.496) 1.250 28.620 ( 0.257 -1.119 -0.785) 1.391 29.532 ( 3.674 3.398 -3.668) 6.205 29.533 ( 2.381 3.338 -3.750) 5.556 ======================= Grid point 152 (84/104) ======================= q-point: ( 0.17 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( -2.316 1.599 16.278) 16.519 1.643 ( -7.302 -15.768 4.682) 17.997 1.914 ( 2.403 -2.883 -7.360) 8.262 2.022 ( 4.820 -12.673 -8.323) 15.909 2.120 ( -4.108 9.987 10.730) 15.223 2.331 ( -2.230 -11.305 3.291) 11.983 2.742 ( -1.935 4.017 1.816) 4.814 2.827 ( -0.323 -4.240 2.344) 4.855 3.029 ( -0.928 2.709 -1.023) 3.041 3.093 ( -2.628 -4.466 1.084) 5.294 3.293 ( -5.052 3.728 -3.816) 7.347 3.328 ( -1.178 0.320 -0.074) 1.223 3.479 ( -1.667 0.699 -7.086) 7.313 3.497 ( -2.591 -1.270 -4.161) 5.064 3.748 ( -2.114 2.787 9.939) 10.537 3.828 ( -0.915 -4.256 2.539) 5.040 4.268 ( -0.484 4.579 12.152) 12.995 4.334 ( 1.092 -2.126 10.963) 11.220 4.600 ( 1.174 7.026 -2.683) 7.612 4.658 ( -0.118 0.688 -6.729) 6.765 4.830 ( -1.135 2.649 -2.932) 4.111 4.854 ( -2.355 0.295 -1.035) 2.589 4.909 ( 2.458 4.493 -6.325) 8.138 5.011 ( 2.549 -5.654 -3.287) 7.019 5.128 ( 0.112 3.600 3.553) 5.059 5.181 ( 1.522 -1.814 -1.026) 2.581 5.445 ( 0.606 2.254 1.667) 2.868 5.493 ( 2.197 -0.800 1.426) 2.739 5.656 ( -2.894 3.864 9.080) 10.283 5.787 ( -3.255 -6.215 5.969) 9.211 6.006 ( -0.936 2.998 -2.154) 3.808 6.055 ( -2.016 -2.041 -1.666) 3.318 6.130 ( 4.467 4.931 1.622) 6.848 6.233 ( 5.941 -4.851 1.681) 7.852 6.401 ( 2.108 0.925 -0.459) 2.347 6.411 ( 1.196 -0.132 -1.165) 1.675 6.777 ( -3.215 2.214 -1.374) 4.138 6.800 ( -3.296 -0.251 -3.391) 4.736 7.066 ( 4.480 5.077 -2.220) 7.126 7.101 ( 3.962 3.981 -3.876) 6.825 7.193 ( 3.806 6.606 -4.406) 8.806 7.295 ( 6.760 -0.810 -1.793) 7.041 7.477 ( -7.946 1.150 4.573) 9.240 7.532 ( -7.260 -2.843 3.378) 8.497 7.725 ( -3.948 -2.868 0.650) 4.923 7.746 ( 2.433 -5.093 3.860) 6.838 7.945 ( 1.847 4.148 -1.582) 4.809 8.034 ( -2.261 -3.683 -8.007) 9.099 8.963 ( 0.812 4.973 0.587) 5.073 9.034 ( 0.314 -0.901 -1.299) 1.612 9.221 ( -1.061 -0.835 -2.673) 2.995 9.266 ( -0.179 -4.412 -5.684) 7.198 9.645 ( -1.445 12.349 9.542) 15.673 9.885 ( -1.512 -11.378 10.796) 15.758 10.060 ( 1.334 6.760 -9.340) 11.607 10.225 ( -4.968 -10.113 -7.080) 13.307 10.548 ( 0.243 3.486 -4.261) 5.511 10.606 ( -2.885 -2.145 0.404) 3.618 10.821 ( 10.073 -0.203 -0.545) 10.089 10.900 ( 6.028 -6.709 -1.871) 9.211 11.310 ( -3.025 6.979 9.971) 12.541 11.483 ( -5.177 -10.463 6.654) 13.437 11.645 ( 4.878 6.769 -3.033) 8.877 11.793 ( 3.722 -8.300 -2.995) 9.577 12.995 ( -8.652 6.153 -3.835) 11.288 13.050 ( -6.019 1.552 0.946) 6.287 13.245 ( -0.591 0.969 0.078) 1.137 13.258 ( -1.720 -1.884 -4.419) 5.103 13.704 ( 1.778 4.231 2.407) 5.182 13.807 ( 5.766 -6.211 2.726) 8.903 14.509 ( -11.036 7.149 -9.032) 15.952 14.641 ( -6.231 -5.063 -4.317) 9.116 14.798 ( 3.717 8.180 5.954) 10.779 14.974 ( 8.374 -9.066 9.584) 15.626 15.203 ( -0.617 2.498 -0.598) 2.642 15.270 ( 0.176 -4.313 -1.995) 4.756 15.805 ( -2.951 1.827 -2.115) 4.064 15.830 ( -2.119 -0.694 -2.289) 3.196 16.075 ( 7.201 2.488 0.804) 7.661 16.103 ( 7.090 -0.400 0.675) 7.133 24.772 ( -2.028 1.257 1.557) 2.849 24.787 ( -0.971 -0.018 0.937) 1.349 24.857 ( 1.182 1.107 -0.982) 1.894 24.875 ( 1.138 -0.979 -0.045) 1.502 25.073 ( -0.577 0.884 3.253) 3.420 25.102 ( 0.897 -1.954 3.625) 4.214 25.256 ( -1.507 1.785 1.982) 3.063 25.311 ( 1.399 -3.459 3.802) 5.327 26.435 ( -0.499 4.485 0.526) 4.543 26.483 ( -1.303 2.175 0.341) 2.558 26.561 ( 1.129 -1.462 0.447) 1.901 26.682 ( 1.740 -10.551 -3.705) 11.317 28.559 ( -4.227 0.923 -0.112) 4.328 28.594 ( -2.950 -2.845 -0.102) 4.100 29.557 ( 2.915 4.328 -5.066) 7.272 29.580 ( 4.292 1.893 -5.608) 7.312 ======================= Grid point 153 (85/104) ======================= q-point: ( 0.33 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( -2.181 -4.159 19.993) 20.537 1.551 ( -8.250 -6.366 15.436) 18.624 1.930 ( 4.282 0.897 -7.458) 8.646 2.047 ( 2.283 -8.339 -4.008) 9.529 2.218 ( 7.965 2.099 3.680) 9.021 2.329 ( 0.580 -7.459 -1.290) 7.592 2.710 ( -1.567 2.921 1.868) 3.805 2.809 ( -3.554 -6.083 3.923) 8.064 2.941 ( -7.222 4.641 -2.333) 8.897 3.028 ( -5.314 -4.231 1.392) 6.933 3.138 ( -3.694 6.173 -1.731) 7.399 3.283 ( -3.576 -8.363 -0.357) 9.103 3.462 ( 4.451 7.523 -3.790) 9.528 3.555 ( 4.834 -2.634 -0.680) 5.547 3.814 ( 1.633 3.306 9.041) 9.764 3.879 ( 2.772 -3.013 8.219) 9.182 4.251 ( -7.608 6.117 6.037) 11.478 4.373 ( -3.466 -6.051 6.983) 9.868 4.564 ( -1.025 7.653 -5.220) 9.320 4.619 ( -0.785 2.061 -5.281) 5.723 4.735 ( -6.185 3.128 -1.681) 7.132 4.806 ( -1.008 0.598 -3.790) 3.967 4.897 ( 0.456 5.619 -6.028) 8.253 5.015 ( 0.153 -5.917 -3.005) 6.638 5.131 ( -1.301 2.028 0.540) 2.469 5.193 ( 1.470 -4.236 -3.881) 5.930 5.500 ( 2.361 3.097 3.904) 5.514 5.538 ( 1.565 2.402 5.043) 5.801 5.722 ( 1.231 -2.528 10.017) 10.404 5.780 ( -0.923 -6.076 5.145) 8.016 5.977 ( -1.472 0.979 -3.853) 4.239 5.997 ( 0.919 -1.627 -4.032) 4.444 6.232 ( 4.629 6.657 1.763) 8.298 6.337 ( 4.950 -4.068 1.520) 6.585 6.430 ( -0.381 3.071 0.398) 3.120 6.463 ( 2.542 -0.368 1.054) 2.777 6.675 ( -5.107 0.938 -3.564) 6.298 6.709 ( -2.725 -2.562 -3.353) 5.023 7.078 ( -3.454 5.306 -6.226) 8.879 7.113 ( 0.526 2.222 -3.345) 4.050 7.274 ( 8.641 7.842 -3.304) 12.127 7.350 ( -2.155 -0.820 -3.084) 3.851 7.381 ( -8.111 -1.977 -0.494) 8.363 7.426 ( 3.894 -5.635 -2.209) 7.197 7.752 ( 2.729 4.277 7.174) 8.786 7.848 ( 5.212 -5.290 3.760) 8.324 7.943 ( -1.382 2.286 -1.151) 2.909 7.981 ( 0.795 -2.929 4.002) 5.023 8.983 ( 0.762 3.429 0.423) 3.539 9.014 ( -1.467 0.858 -1.245) 2.107 9.181 ( -1.496 -1.344 -2.184) 2.968 9.217 ( -0.368 -4.965 -5.828) 7.665 9.715 ( 1.535 11.773 10.693) 15.978 9.919 ( -1.660 -7.996 8.543) 11.819 10.013 ( -3.479 1.485 -2.503) 4.536 10.092 ( -5.982 -6.481 -1.679) 8.979 10.441 ( -3.621 4.187 -11.381) 12.656 10.491 ( -3.966 -0.508 -10.041) 10.808 10.986 ( 7.421 -2.381 -4.256) 8.879 11.028 ( 6.678 -6.330 -3.434) 9.821 11.377 ( 1.325 4.100 14.696) 15.315 11.473 ( -0.544 -5.177 10.591) 11.802 11.816 ( 11.777 4.505 6.321) 14.105 11.939 ( 11.388 -7.370 4.931) 14.433 12.815 ( -6.999 3.028 -6.696) 10.148 12.853 ( -10.424 -0.759 -5.784) 11.945 13.128 ( -9.129 3.233 -6.533) 11.682 13.165 ( -7.618 -0.720 -5.317) 9.318 13.785 ( 4.100 7.714 4.084) 9.643 13.924 ( 3.791 -6.453 3.870) 8.426 14.270 ( -7.377 4.820 -8.819) 12.467 14.411 ( -9.301 -9.291 -7.521) 15.146 14.991 ( 6.431 8.119 9.076) 13.771 15.103 ( 0.885 -4.000 7.581) 8.617 15.251 ( 4.416 1.677 2.692) 5.437 15.309 ( 4.548 -3.446 0.656) 5.744 15.719 ( -3.482 2.834 -6.198) 7.653 15.758 ( -2.573 -1.117 -6.871) 7.421 16.204 ( 5.792 1.781 0.864) 6.121 16.222 ( 4.342 -0.158 1.566) 4.619 24.751 ( -1.164 1.615 1.599) 2.554 24.778 ( -0.592 -0.976 1.305) 1.734 24.860 ( -0.228 1.020 -1.704) 1.999 24.881 ( 0.064 -1.054 -1.069) 1.502 25.102 ( 1.056 2.113 3.835) 4.504 25.149 ( 1.091 -2.083 5.395) 5.885 25.241 ( -1.160 3.751 1.181) 4.100 25.354 ( 0.276 -6.980 3.206) 7.686 26.453 ( 1.252 3.778 2.631) 4.771 26.473 ( -0.045 3.055 1.690) 3.492 26.587 ( 1.846 -0.768 -1.053) 2.260 26.676 ( -0.487 -8.668 -3.254) 9.272 28.492 ( -2.748 0.750 0.443) 2.883 28.533 ( -3.225 -3.556 -0.006) 4.800 29.567 ( 1.797 4.802 -5.881) 7.802 29.606 ( 2.717 0.742 -7.162) 7.696 ======================= Grid point 154 (86/104) ======================= q-point: (-0.50 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.514 ( -9.114 -0.528 18.087) 20.260 1.612 ( -1.695 -10.567 17.384) 20.414 1.986 ( 6.410 4.530 -4.684) 9.141 2.072 ( 3.437 -5.386 -4.403) 7.759 2.294 ( 0.965 4.370 2.288) 5.026 2.436 ( 9.177 -8.506 2.744) 12.810 2.648 ( -5.372 4.111 -13.157) 14.794 2.738 ( -0.853 -5.112 -9.283) 10.632 2.878 ( -1.280 5.455 12.112) 13.345 2.985 ( -0.515 -5.720 7.459) 9.414 3.161 ( 3.882 2.340 2.404) 5.130 3.230 ( -1.613 -4.392 0.288) 4.687 3.514 ( 4.120 10.909 -5.787) 13.019 3.623 ( 4.696 -1.125 -6.282) 7.924 3.895 ( -0.197 4.821 11.577) 12.542 3.984 ( -2.009 -2.074 16.735) 16.982 4.106 ( -6.960 6.079 0.607) 9.261 4.290 ( -7.892 -9.572 0.450) 12.414 4.554 ( 3.083 4.231 -5.586) 7.655 4.571 ( -1.689 8.812 3.003) 9.462 4.628 ( -2.152 -0.555 -6.105) 6.497 4.778 ( -0.147 -2.596 -2.832) 3.844 4.854 ( -3.373 3.478 0.493) 4.870 4.986 ( -2.503 -8.314 0.711) 8.712 5.095 ( -1.116 3.553 -3.616) 5.191 5.188 ( 1.289 -5.387 -6.061) 8.211 5.564 ( 1.630 2.880 4.689) 5.739 5.607 ( 2.242 2.220 4.702) 5.662 5.765 ( -2.284 -2.256 7.291) 7.966 5.802 ( 0.249 -5.050 2.385) 5.590 5.955 ( 3.016 3.633 -5.267) 7.074 6.031 ( 5.055 -3.853 -5.201) 8.213 6.277 ( -2.515 6.159 2.613) 7.148 6.359 ( -6.347 -0.767 -1.064) 6.481 6.442 ( 2.240 -1.254 -0.761) 2.678 6.459 ( 0.643 -1.950 1.891) 2.791 6.643 ( 2.950 1.627 3.268) 4.693 6.697 ( 1.975 -4.222 2.632) 5.353 6.936 ( -6.343 6.056 -8.122) 11.953 7.042 ( -5.788 -4.394 -8.800) 11.413 7.207 ( -7.290 5.444 0.862) 9.139 7.300 ( -0.583 -2.230 -0.933) 2.487 7.412 ( 5.673 3.407 -2.024) 6.920 7.512 ( 4.337 -6.140 -4.398) 8.709 7.809 ( 1.567 8.442 4.275) 9.592 7.953 ( 4.384 -4.115 -1.007) 6.097 8.015 ( 4.952 1.536 5.683) 7.693 8.029 ( 1.131 -1.857 4.564) 5.055 8.977 ( -0.832 2.605 0.055) 2.735 8.995 ( 0.013 1.387 -1.352) 1.937 9.153 ( 0.388 0.237 -2.532) 2.572 9.203 ( 2.440 -4.718 -4.939) 7.253 9.805 ( -0.613 8.960 12.104) 15.072 9.883 ( -8.487 1.051 3.117) 9.102 9.919 ( -2.137 -1.798 1.065) 2.989 10.013 ( -4.184 -9.965 5.968) 12.346 10.368 ( 4.076 3.129 -12.426) 13.447 10.407 ( 2.556 -0.397 -10.302) 10.622 11.012 ( -1.732 -1.967 -5.664) 6.241 11.048 ( 1.058 -5.011 -6.614) 8.365 11.514 ( 2.949 3.317 14.306) 14.979 11.588 ( 4.300 -4.023 11.069) 12.537 12.086 ( 10.773 4.057 7.488) 13.733 12.179 ( 7.534 -4.945 4.524) 10.084 12.642 ( -7.236 2.020 -4.854) 8.945 12.681 ( -4.703 -1.466 -5.895) 7.683 12.931 ( -3.609 3.262 -8.159) 9.499 12.978 ( -4.513 -1.780 -8.428) 9.724 13.863 ( 0.795 6.616 4.514) 8.048 13.958 ( -1.634 -1.766 1.687) 2.938 14.153 ( -2.681 -0.380 -2.159) 3.464 14.249 ( -4.420 -8.498 -5.147) 10.874 15.124 ( 3.263 3.319 7.539) 8.860 15.152 ( 0.253 -0.118 6.250) 6.256 15.366 ( 5.772 2.309 2.636) 6.753 15.398 ( 4.174 -0.469 0.751) 4.267 15.610 ( -3.642 3.146 -7.663) 9.049 15.659 ( -2.452 -1.849 -9.531) 10.014 16.260 ( -1.408 1.111 1.677) 2.455 16.276 ( 1.170 -0.407 0.893) 1.528 24.750 ( -0.313 1.386 2.099) 2.535 24.779 ( -0.630 -1.648 2.100) 2.743 24.838 ( -0.441 1.993 -2.059) 2.899 24.871 ( -0.085 -1.412 -1.774) 2.269 25.129 ( -1.452 3.548 4.440) 5.866 25.205 ( 1.217 0.214 4.769) 4.926 25.230 ( -0.961 -0.324 2.458) 2.660 25.348 ( -2.342 -7.938 1.341) 8.384 26.477 ( -0.067 4.150 2.595) 4.895 26.524 ( 2.560 0.691 3.483) 4.377 26.613 ( 2.412 -0.726 -2.632) 3.643 26.627 ( -2.040 -3.744 -3.237) 5.354 28.476 ( 0.376 -0.636 0.711) 1.026 28.499 ( 0.082 -3.094 -0.333) 3.113 29.551 ( 0.374 4.749 -5.340) 7.156 29.592 ( 0.838 0.459 -7.329) 7.391 ======================= Grid point 155 (87/104) ======================= q-point: (-0.33 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.419 ( -11.320 5.247 14.616) 19.217 1.645 ( -3.477 -17.275 10.914) 20.727 2.094 ( 5.342 0.939 -0.378) 5.437 2.117 ( 5.634 -4.563 -8.422) 11.112 2.337 ( -4.468 8.054 2.116) 9.450 2.437 ( -0.895 2.318 -6.435) 6.898 2.627 ( 7.255 -2.985 -6.542) 10.215 2.689 ( 2.928 -9.443 -5.318) 11.226 2.922 ( -2.579 4.987 10.160) 11.609 3.019 ( -2.777 -5.146 5.916) 8.318 3.225 ( 5.889 5.861 -0.583) 8.329 3.342 ( 9.420 -5.209 0.991) 10.810 3.534 ( 3.187 13.366 -8.297) 16.051 3.658 ( 4.929 0.752 -8.303) 9.685 3.882 ( -7.716 3.886 13.426) 15.965 3.996 ( -5.581 6.522 19.273) 21.098 4.101 ( -2.788 -7.712 0.892) 8.249 4.157 ( -1.867 -1.235 0.095) 2.240 4.549 ( -2.093 8.062 0.994) 8.389 4.608 ( 4.187 2.550 -2.656) 5.575 4.641 ( 7.292 -2.558 -6.757) 10.265 4.753 ( -1.908 -8.257 -0.598) 8.495 4.797 ( -3.551 3.715 7.438) 9.041 4.933 ( -4.731 -9.563 4.087) 11.425 5.072 ( 1.687 5.440 -4.388) 7.190 5.170 ( 0.947 -4.163 -5.912) 7.293 5.605 ( -0.272 4.209 4.730) 6.337 5.675 ( 2.412 1.133 3.193) 4.159 5.741 ( -3.943 -0.367 4.202) 5.774 5.806 ( -0.417 -4.677 -2.070) 5.132 5.995 ( 3.481 2.178 -6.394) 7.599 6.051 ( -0.702 -1.333 -6.606) 6.775 6.221 ( -5.487 0.733 4.020) 6.841 6.239 ( -3.719 -2.512 3.815) 5.890 6.441 ( 1.180 3.914 -0.345) 4.103 6.508 ( 0.266 -2.233 -0.514) 2.307 6.728 ( -2.182 2.139 1.502) 3.405 6.793 ( 0.169 -3.196 3.476) 4.725 6.814 ( 3.028 1.021 -0.552) 3.243 6.879 ( 0.464 -3.680 -3.195) 4.895 7.140 ( -2.230 9.556 2.885) 10.228 7.322 ( 1.381 -7.651 2.417) 8.142 7.433 ( -0.565 2.521 -5.323) 5.917 7.496 ( -1.480 -3.464 -4.406) 5.797 7.869 ( 1.366 6.374 1.312) 6.650 7.979 ( -1.207 -5.083 -2.166) 5.655 8.039 ( 0.510 5.810 -2.039) 6.178 8.117 ( 2.653 -2.025 0.675) 3.405 8.977 ( -0.412 2.498 0.041) 2.532 8.992 ( 1.701 1.414 -1.243) 2.537 9.169 ( 2.984 2.175 -2.774) 4.618 9.234 ( 3.780 -4.974 -4.232) 7.546 9.730 ( -7.706 6.228 6.788) 12.010 9.843 ( -4.834 -4.816 8.462) 10.870 9.935 ( 3.119 3.291 3.820) 5.929 10.032 ( 2.646 -5.679 4.571) 7.755 10.403 ( 6.861 2.900 -10.212) 12.639 10.458 ( 7.580 -1.613 -6.025) 9.816 10.901 ( -6.283 0.354 -3.336) 7.122 10.992 ( -3.599 -8.054 -5.530) 10.411 11.601 ( -1.377 6.439 5.607) 8.648 11.716 ( 3.764 -4.570 4.121) 7.214 12.107 ( -11.779 1.754 -5.073) 12.944 12.160 ( -6.944 -2.892 -2.916) 8.068 12.579 ( 2.789 3.199 -0.888) 4.336 12.651 ( 4.784 -4.077 1.430) 6.446 12.985 ( 12.022 4.099 -1.198) 12.758 13.047 ( 13.334 -2.097 0.070) 13.498 13.838 ( -5.940 5.106 2.690) 8.282 13.934 ( -2.945 -2.232 2.654) 4.549 14.096 ( -2.643 0.708 0.957) 2.899 14.214 ( 2.547 -8.755 1.123) 9.187 15.165 ( -2.550 3.461 2.278) 4.865 15.203 ( 0.523 -0.242 4.862) 4.896 15.423 ( -0.328 3.442 -4.841) 5.949 15.466 ( 0.878 -0.890 -3.149) 3.388 15.536 ( 2.134 3.852 -1.508) 4.655 15.599 ( 3.230 -2.389 -4.843) 6.292 16.195 ( -6.553 2.785 1.845) 7.356 16.252 ( -4.321 -2.903 0.931) 5.288 24.759 ( -0.263 0.933 1.735) 1.988 24.781 ( -0.564 -1.354 2.736) 3.105 24.828 ( 0.353 2.090 -1.276) 2.474 24.863 ( 0.415 -1.545 -1.485) 2.183 25.104 ( -3.586 5.194 3.480) 7.208 25.212 ( -2.472 0.578 2.475) 3.545 25.246 ( -1.131 -5.463 3.683) 6.685 25.311 ( -1.764 -5.153 2.300) 5.912 26.490 ( 0.088 1.923 2.086) 2.838 26.532 ( -2.360 -2.289 -0.671) 3.355 26.591 ( 0.061 4.076 -3.578) 5.424 26.663 ( 3.372 -3.269 -0.221) 4.702 28.506 ( 3.001 -0.009 -0.158) 3.005 28.538 ( 3.825 -3.429 -0.278) 5.144 29.523 ( -0.159 4.488 -3.924) 5.963 29.555 ( -0.099 1.077 -5.784) 5.885 ======================= Grid point 156 (88/104) ======================= q-point: (-0.17 0.43 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( -5.722 9.265 14.558) 18.180 1.659 ( -0.609 -21.685 6.947) 22.779 2.070 ( -2.959 -2.550 -11.881) 12.506 2.127 ( 0.358 -8.164 -11.822) 14.372 2.241 ( -4.110 11.640 5.821) 13.648 2.436 ( 0.033 -7.437 -2.616) 7.884 2.694 ( 4.392 0.096 -2.201) 4.913 2.738 ( 1.809 -4.198 0.974) 4.674 2.936 ( -1.141 4.641 8.780) 9.996 3.033 ( 0.625 -5.070 6.780) 8.489 3.291 ( 2.917 8.610 -6.602) 11.235 3.459 ( 2.834 -7.861 -3.987) 9.259 3.544 ( 3.079 9.118 -7.193) 12.015 3.696 ( 4.637 -4.408 -12.442) 13.991 3.864 ( -2.993 7.572 11.542) 14.124 4.007 ( -6.124 4.626 16.687) 18.367 4.078 ( 0.096 -3.175 9.621) 10.132 4.116 ( -4.189 -1.145 -2.119) 4.832 4.537 ( -0.638 9.803 3.443) 10.410 4.645 ( 3.224 3.366 -2.846) 5.462 4.725 ( 3.674 -0.327 0.700) 3.755 4.784 ( 6.972 -5.436 -3.886) 9.657 4.826 ( 0.495 -1.331 6.347) 6.504 4.900 ( -0.849 -7.431 4.592) 8.776 5.095 ( 2.200 3.254 -1.170) 4.098 5.152 ( 0.540 -1.531 -4.034) 4.348 5.593 ( -3.690 5.733 -2.264) 7.184 5.684 ( -5.056 3.241 4.099) 7.272 5.712 ( -7.855 -3.968 -0.823) 8.839 5.731 ( 0.713 -4.197 6.241) 7.555 5.985 ( -0.710 0.650 -4.719) 4.816 6.004 ( 2.880 -1.586 -1.668) 3.686 6.157 ( -4.243 3.521 1.426) 5.696 6.224 ( -2.105 -3.070 1.376) 3.969 6.451 ( -2.097 1.230 1.030) 2.641 6.483 ( -1.611 -1.415 -0.681) 2.250 6.677 ( 2.400 4.086 -2.909) 5.561 6.763 ( 1.579 -4.507 -1.917) 5.146 6.927 ( 5.218 7.216 3.866) 9.708 7.054 ( 8.634 -0.979 5.113) 10.082 7.123 ( -1.211 4.608 0.536) 4.795 7.286 ( -5.084 -6.286 -5.458) 9.754 7.445 ( 4.677 -0.446 3.651) 5.950 7.483 ( 1.698 -2.478 3.075) 4.298 7.843 ( -3.673 5.845 -2.448) 7.325 7.891 ( -5.169 0.371 -3.245) 6.115 8.029 ( 0.249 2.577 -5.273) 5.874 8.122 ( -0.090 -5.125 -4.785) 7.012 8.964 ( -0.973 3.699 0.509) 3.858 9.016 ( 1.586 -0.657 -2.385) 2.939 9.213 ( 3.407 2.883 -2.832) 5.286 9.271 ( 2.488 -3.939 -3.456) 5.801 9.675 ( -3.289 7.572 5.720) 10.043 9.830 ( -2.886 -8.672 9.944) 13.506 10.022 ( 5.540 5.960 -1.798) 8.334 10.153 ( 8.153 -5.450 0.989) 9.857 10.457 ( 2.592 6.044 -3.403) 7.404 10.570 ( 6.421 -2.719 -1.393) 7.111 10.792 ( -3.440 -2.926 0.858) 4.597 10.847 ( -8.011 -9.997 -4.613) 13.616 11.529 ( -7.128 11.296 -1.155) 13.407 11.743 ( -0.469 -4.980 -5.310) 7.295 11.829 ( -13.381 -0.084 -6.264) 14.775 11.955 ( -7.895 -7.363 -8.339) 13.641 12.721 ( 10.220 6.820 5.210) 13.345 12.830 ( 11.012 -4.332 6.528) 13.515 13.210 ( 8.576 6.800 -0.176) 10.946 13.305 ( 12.190 -3.112 0.679) 12.599 13.731 ( -5.669 2.865 1.730) 6.583 13.823 ( -9.823 -6.541 1.973) 11.965 14.157 ( 7.103 8.792 6.657) 13.118 14.360 ( 10.572 -11.835 7.851) 17.705 15.067 ( -7.832 7.163 -3.303) 11.115 15.177 ( -5.830 -3.969 0.004) 7.053 15.352 ( -1.821 2.585 -7.214) 7.877 15.387 ( -3.058 -1.381 -8.018) 8.692 15.653 ( 7.507 3.463 3.416) 8.945 15.701 ( 7.217 -1.490 1.050) 7.444 16.073 ( -7.355 3.530 1.990) 8.397 16.145 ( -7.348 -3.804 0.641) 8.299 24.766 ( 0.216 1.283 1.532) 2.010 24.794 ( 0.062 -1.620 2.538) 3.011 24.831 ( 0.342 2.039 -0.097) 2.069 24.862 ( 0.182 -1.102 -1.140) 1.596 25.063 ( -2.577 3.971 2.914) 5.559 25.155 ( -4.598 -5.031 2.560) 7.280 25.242 ( -0.655 1.518 2.087) 2.663 25.307 ( -1.655 -4.883 3.770) 6.388 26.489 ( -1.305 0.609 -1.741) 2.259 26.510 ( 0.653 -1.776 2.015) 2.764 26.553 ( -1.509 6.983 -3.621) 8.010 26.696 ( 0.678 -7.948 -1.739) 8.164 28.574 ( 4.160 0.305 -0.712) 4.231 28.604 ( 3.087 -2.855 -0.719) 4.266 29.508 ( 1.140 4.233 -2.964) 5.292 29.528 ( 0.615 2.182 -3.853) 4.470 ======================= Grid point 175 (89/104) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 56 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -5.199 0.000 -17.768) 18.513 2.231 ( 5.199 0.000 17.768) 18.513 2.268 ( 15.820 0.000 -19.252) 24.918 2.268 ( -15.820 0.000 19.252) 24.918 2.693 ( -9.216 0.000 -0.548) 9.232 2.693 ( 9.216 0.000 0.548) 9.232 2.824 ( -3.693 0.000 -1.643) 4.042 2.824 ( 3.693 0.000 1.643) 4.042 3.080 ( 2.586 0.000 -2.383) 3.517 3.080 ( -2.586 0.000 2.383) 3.517 3.314 ( -2.423 0.000 -0.539) 2.482 3.314 ( 2.423 0.000 0.539) 2.482 3.780 ( 3.758 0.000 -2.633) 4.589 3.780 ( -3.758 0.000 2.633) 4.589 3.885 ( -9.516 0.000 -14.539) 17.377 3.885 ( 9.516 0.000 14.539) 17.377 4.266 ( -2.540 0.000 -22.470) 22.613 4.266 ( 2.540 0.000 22.470) 22.613 4.387 ( 5.818 0.000 -18.507) 19.400 4.387 ( -5.818 0.000 18.507) 19.400 4.623 ( -3.422 0.000 -3.064) 4.593 4.623 ( 3.422 0.000 3.064) 4.593 4.692 ( -0.960 0.000 -6.763) 6.831 4.692 ( 0.960 0.000 6.763) 6.831 4.933 ( -6.181 0.000 -8.624) 10.610 4.933 ( 6.181 0.000 8.624) 10.610 5.381 ( 3.197 0.000 -4.928) 5.874 5.381 ( -3.197 0.000 4.928) 5.874 5.836 ( -0.579 0.000 -3.144) 3.196 5.836 ( 0.579 0.000 3.144) 3.196 5.995 ( 8.562 0.000 -3.415) 9.218 5.995 ( -8.562 0.000 3.415) 9.218 6.137 ( -1.561 0.000 -7.173) 7.340 6.137 ( 1.561 0.000 7.173) 7.340 6.362 ( 8.134 0.000 -3.053) 8.688 6.362 ( -8.134 0.000 3.053) 8.688 6.734 ( 0.851 0.000 -2.606) 2.741 6.734 ( -0.851 0.000 2.606) 2.741 6.816 ( -8.873 0.000 -4.952) 10.161 6.816 ( 8.873 0.000 4.952) 10.161 7.077 ( -12.367 0.000 -3.327) 12.807 7.077 ( 12.367 0.000 3.327) 12.807 7.338 ( -3.931 0.000 -11.544) 12.195 7.338 ( 3.931 0.000 11.544) 12.195 7.956 ( -2.063 0.000 0.063) 2.064 7.956 ( 2.063 0.000 -0.063) 2.064 8.079 ( 6.334 0.000 -5.445) 8.352 8.079 ( -6.334 0.000 5.445) 8.352 8.994 ( 2.585 0.000 -3.933) 4.706 8.994 ( -2.585 0.000 3.933) 4.706 9.223 ( 5.777 0.000 -5.061) 7.680 9.223 ( -5.777 0.000 5.061) 7.680 9.745 ( 6.850 0.000 -10.569) 12.594 9.745 ( -6.850 0.000 10.569) 12.594 10.313 ( -2.974 0.000 -10.657) 11.064 10.313 ( 2.974 0.000 10.657) 11.064 10.616 ( -2.138 0.000 -1.106) 2.407 10.616 ( 2.138 0.000 1.106) 2.407 11.155 ( -9.526 0.000 -6.458) 11.509 11.155 ( 9.526 0.000 6.458) 11.509 11.387 ( -3.904 0.000 -8.025) 8.924 11.387 ( 3.904 0.000 8.025) 8.924 11.955 ( -4.819 0.000 -5.238) 7.117 11.955 ( 4.819 0.000 5.238) 7.117 12.759 ( -8.192 0.000 -10.915) 13.647 12.759 ( 8.192 0.000 10.915) 13.647 13.245 ( 4.529 0.000 -3.994) 6.038 13.245 ( -4.529 0.000 3.994) 6.038 13.906 ( -16.003 0.000 -4.888) 16.733 13.906 ( 16.003 0.000 4.888) 16.733 14.230 ( -1.370 0.000 -7.337) 7.464 14.230 ( 1.370 0.000 7.337) 7.464 15.138 ( -2.056 0.000 -0.504) 2.116 15.138 ( 2.056 0.000 0.504) 2.116 15.292 ( -6.570 0.000 -3.588) 7.486 15.292 ( 6.570 0.000 3.588) 7.486 15.762 ( 0.383 0.000 -2.281) 2.313 15.762 ( -0.383 0.000 2.281) 2.313 15.976 ( -5.706 0.000 -5.635) 8.019 15.976 ( 5.706 0.000 5.635) 8.019 24.755 ( -0.983 0.000 -1.471) 1.769 24.755 ( 0.983 0.000 1.471) 1.769 24.837 ( 4.965 0.000 -1.682) 5.242 24.837 ( -4.965 0.000 1.682) 5.242 25.221 ( -6.676 0.000 -6.775) 9.511 25.221 ( 6.676 0.000 6.775) 9.511 25.335 ( -2.324 0.000 -1.937) 3.025 25.335 ( 2.324 0.000 1.937) 3.025 26.332 ( 1.778 0.000 -7.223) 7.439 26.332 ( -1.778 0.000 7.223) 7.439 27.080 ( 4.264 0.000 -13.533) 14.189 27.080 ( -4.264 0.000 13.533) 14.189 28.803 ( 5.926 0.000 -8.561) 10.412 28.803 ( -5.926 0.000 8.561) 10.412 28.998 ( 2.659 0.000 -2.739) 3.817 28.998 ( -2.659 0.000 2.739) 3.817 ======================= Grid point 177 (90/104) ======================= q-point: ( 0.17 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( -11.004 0.000 -4.659) 11.950 2.059 ( -10.613 0.000 -0.631) 10.632 2.293 ( 0.427 0.000 -20.298) 20.303 2.445 ( 5.576 0.000 14.536) 15.569 2.500 ( -9.257 0.000 2.932) 9.710 2.606 ( -12.748 0.000 0.235) 12.750 2.833 ( -2.488 0.000 -0.023) 2.488 2.857 ( 4.925 0.000 -7.264) 8.776 3.032 ( -4.231 0.000 -0.451) 4.255 3.082 ( -2.463 0.000 -7.973) 8.345 3.274 ( -2.544 0.000 3.601) 4.409 3.348 ( 0.351 0.000 -1.227) 1.277 3.535 ( -7.442 0.000 -8.595) 11.369 3.743 ( -3.734 0.000 -0.303) 3.746 3.886 ( 2.461 0.000 5.509) 6.034 4.043 ( -1.104 0.000 -13.216) 13.262 4.155 ( 5.823 0.000 -11.009) 12.454 4.363 ( -3.407 0.000 12.009) 12.483 4.400 ( -3.169 0.000 15.044) 15.374 4.409 ( 9.910 0.000 -13.758) 16.956 4.541 ( -4.778 0.000 2.234) 5.274 4.656 ( 1.239 0.000 -2.585) 2.867 4.685 ( -4.182 0.000 9.138) 10.050 4.738 ( 3.498 0.000 0.869) 3.605 4.925 ( 6.826 0.000 -0.085) 6.826 5.184 ( 9.280 0.000 14.444) 17.169 5.385 ( -1.230 0.000 10.748) 10.818 5.433 ( 5.167 0.000 -2.724) 5.841 5.742 ( -7.695 0.000 2.024) 7.957 5.807 ( 0.858 0.000 0.455) 0.971 6.002 ( -4.270 0.000 -9.362) 10.290 6.039 ( 4.255 0.000 5.665) 7.085 6.157 ( 5.676 0.000 -4.500) 7.243 6.192 ( 2.511 0.000 3.971) 4.698 6.343 ( 4.761 0.000 2.297) 5.286 6.470 ( 3.743 0.000 -4.393) 5.772 6.660 ( -1.547 0.000 -5.141) 5.368 6.721 ( -3.503 0.000 3.834) 5.193 6.795 ( 5.611 0.000 -1.773) 5.885 6.951 ( 4.635 0.000 1.898) 5.009 7.080 ( 13.016 0.000 3.979) 13.611 7.164 ( -4.839 0.000 -10.672) 11.718 7.367 ( 12.644 0.000 6.186) 14.076 7.426 ( -1.784 0.000 9.712) 9.874 7.857 ( -8.299 0.000 1.380) 8.413 7.890 ( -10.560 0.000 8.810) 13.752 8.019 ( -3.289 0.000 -3.904) 5.105 8.146 ( 4.211 0.000 -7.770) 8.837 8.983 ( -0.948 0.000 4.137) 4.244 9.010 ( 1.695 0.000 -3.370) 3.772 9.166 ( -2.600 0.000 4.320) 5.042 9.269 ( 3.249 0.000 -7.769) 8.421 9.701 ( -5.533 0.000 11.688) 12.932 9.817 ( 7.759 0.000 -9.506) 12.270 10.154 ( -5.330 0.000 -12.584) 13.667 10.360 ( -2.394 0.000 4.548) 5.139 10.552 ( -3.860 0.000 -1.312) 4.077 10.590 ( -8.209 0.000 3.419) 8.893 11.037 ( 1.340 0.000 -4.167) 4.377 11.307 ( 3.050 0.000 -8.104) 8.659 11.348 ( 1.925 0.000 7.459) 7.704 11.447 ( 1.789 0.000 1.694) 2.464 11.963 ( 7.676 0.000 1.173) 7.765 12.111 ( 6.041 0.000 8.482) 10.413 12.569 ( -5.122 0.000 -9.865) 11.115 12.953 ( 3.293 0.000 10.354) 10.865 13.100 ( -12.280 0.000 2.417) 12.515 13.190 ( -5.852 0.000 -8.528) 10.342 13.586 ( -12.635 0.000 -3.715) 13.170 14.075 ( 1.075 0.000 -2.851) 3.047 14.315 ( 12.000 0.000 2.467) 12.251 14.358 ( 5.755 0.000 9.888) 11.441 15.074 ( -4.685 0.000 -1.541) 4.932 15.127 ( -6.133 0.000 -4.861) 7.826 15.181 ( 0.540 0.000 -0.079) 0.546 15.397 ( 2.970 0.000 -0.961) 3.121 15.612 ( -7.929 0.000 -7.503) 10.916 15.697 ( -4.849 0.000 0.092) 4.850 16.008 ( 7.376 0.000 0.272) 7.381 16.163 ( 7.565 0.000 5.853) 9.565 24.740 ( 0.095 0.000 -0.748) 0.754 24.750 ( -2.776 0.000 0.539) 2.828 24.814 ( 1.402 0.000 2.989) 3.301 24.915 ( 4.159 0.000 -2.803) 5.015 25.059 ( -5.135 0.000 -4.013) 6.517 25.210 ( -3.810 0.000 -1.369) 4.049 25.455 ( 7.606 0.000 3.748) 8.479 25.494 ( 9.666 0.000 12.572) 15.858 26.323 ( 1.962 0.000 -7.381) 7.637 26.356 ( -0.295 0.000 7.311) 7.316 26.957 ( -15.651 0.000 5.704) 16.658 26.975 ( -4.854 0.000 -14.874) 15.646 28.810 ( 0.539 0.000 9.659) 9.674 28.883 ( 7.751 0.000 -9.623) 12.356 28.965 ( -2.606 0.000 2.388) 3.534 29.023 ( 2.769 0.000 -4.833) 5.570 ======================= Grid point 178 (91/104) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( -9.820 0.000 8.147) 12.759 1.953 ( 3.802 0.000 -12.523) 13.087 2.061 ( -8.785 0.000 -21.602) 23.320 2.336 ( -16.825 0.000 1.565) 16.897 2.452 ( 0.141 0.000 8.172) 8.174 2.606 ( 2.594 0.000 9.107) 9.469 2.792 ( -1.307 0.000 0.328) 1.347 2.814 ( -3.450 0.000 -8.050) 8.758 2.915 ( -6.760 0.000 -7.315) 9.960 2.935 ( -4.628 0.000 -3.663) 5.902 3.253 ( -3.256 0.000 5.906) 6.744 3.302 ( -2.441 0.000 -4.190) 4.849 3.485 ( 3.454 0.000 -4.485) 5.661 3.642 ( -6.804 0.000 0.941) 6.868 3.966 ( 1.628 0.000 7.548) 7.721 4.024 ( 5.051 0.000 -8.154) 9.591 4.152 ( 8.900 0.000 -22.846) 24.518 4.339 ( -7.919 0.000 13.631) 15.764 4.431 ( -2.617 0.000 11.601) 11.892 4.451 ( 1.981 0.000 -5.375) 5.729 4.546 ( -0.691 0.000 4.986) 5.033 4.660 ( -1.743 0.000 0.142) 1.748 4.670 ( 3.050 0.000 -4.293) 5.266 4.727 ( -4.716 0.000 2.150) 5.183 5.113 ( 10.570 0.000 3.515) 11.139 5.331 ( -0.927 0.000 7.682) 7.737 5.464 ( 0.527 0.000 13.851) 13.861 5.517 ( 4.933 0.000 -3.996) 6.348 5.685 ( 0.788 0.000 2.403) 2.529 5.880 ( 1.308 0.000 -0.203) 1.323 5.912 ( 3.524 0.000 -5.727) 6.724 6.083 ( -1.409 0.000 1.972) 2.423 6.164 ( -0.622 0.000 -0.873) 1.072 6.240 ( -2.776 0.000 4.032) 4.895 6.471 ( 7.383 0.000 -2.295) 7.732 6.519 ( 5.078 0.000 -0.733) 5.130 6.688 ( 5.824 0.000 -3.880) 6.998 6.695 ( -1.358 0.000 5.250) 5.422 6.937 ( 10.333 0.000 -1.704) 10.473 7.070 ( 2.204 0.000 -4.433) 4.951 7.127 ( 9.118 0.000 4.211) 10.044 7.270 ( 1.678 0.000 -3.132) 3.553 7.437 ( -0.945 0.000 9.374) 9.421 7.568 ( 3.873 0.000 2.896) 4.836 7.701 ( -7.795 0.000 1.426) 7.924 7.750 ( -8.564 0.000 8.692) 12.202 7.886 ( -5.500 0.000 -4.973) 7.415 8.106 ( -3.541 0.000 -8.651) 9.348 9.011 ( 1.001 0.000 3.662) 3.796 9.036 ( 2.935 0.000 -2.886) 4.116 9.177 ( -0.525 0.000 6.755) 6.775 9.254 ( 1.516 0.000 -9.537) 9.656 9.697 ( -2.814 0.000 12.448) 12.762 9.859 ( 0.252 0.000 -9.217) 9.220 10.049 ( 5.734 0.000 -12.413) 13.673 10.320 ( -5.042 0.000 3.575) 6.181 10.421 ( -9.791 0.000 4.195) 10.652 10.467 ( -4.565 0.000 -1.094) 4.694 11.068 ( 4.509 0.000 -6.806) 8.164 11.254 ( -7.881 0.000 -0.923) 7.935 11.434 ( 12.190 0.000 -0.968) 12.228 11.576 ( 3.721 0.000 8.920) 9.664 12.148 ( 9.417 0.000 0.434) 9.427 12.226 ( 0.918 0.000 5.210) 5.291 12.496 ( 3.687 0.000 -4.926) 6.153 12.852 ( -12.854 0.000 -1.223) 12.912 12.901 ( -13.824 0.000 6.857) 15.431 12.979 ( -9.032 0.000 -11.396) 14.541 13.571 ( 8.454 0.000 7.224) 11.120 14.009 ( -4.944 0.000 -6.701) 8.327 14.530 ( 6.168 0.000 9.247) 11.115 14.538 ( 9.042 0.000 4.295) 10.011 14.950 ( -6.135 0.000 -4.822) 7.804 14.969 ( -6.658 0.000 -5.642) 8.727 15.213 ( 1.968 0.000 0.888) 2.159 15.343 ( -3.961 0.000 -5.630) 6.884 15.538 ( 1.345 0.000 -2.457) 2.800 15.617 ( -4.449 0.000 1.588) 4.724 16.158 ( 7.978 0.000 0.381) 7.988 16.279 ( 1.903 0.000 3.238) 3.756 24.717 ( -1.020 0.000 0.773) 1.280 24.739 ( -0.273 0.000 -0.487) 0.558 24.863 ( 1.404 0.000 2.883) 3.206 24.911 ( -1.048 0.000 -2.809) 2.998 25.033 ( 2.929 0.000 -2.500) 3.850 25.137 ( -3.600 0.000 -0.456) 3.629 25.643 ( 11.116 0.000 0.907) 11.153 25.727 ( 4.697 0.000 17.031) 17.667 26.311 ( 1.487 0.000 -5.658) 5.851 26.415 ( 1.280 0.000 7.605) 7.712 26.650 ( -16.112 0.000 -3.401) 16.467 26.771 ( -7.412 0.000 -12.831) 14.818 28.913 ( 2.314 0.000 12.399) 12.613 28.933 ( 3.618 0.000 -7.686) 8.495 28.940 ( -1.906 0.000 3.276) 3.790 29.038 ( 3.441 0.000 -9.705) 10.297 ======================= Grid point 179 (92/104) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.824 ( -1.840 0.000 -17.623) 17.719 1.824 ( 1.840 0.000 17.623) 17.719 2.063 ( 14.958 0.000 -8.147) 17.033 2.063 ( -14.958 0.000 8.147) 17.033 2.571 ( -6.058 0.000 -6.809) 9.114 2.571 ( 6.058 0.000 6.809) 9.114 2.773 ( -1.787 0.000 -1.506) 2.337 2.773 ( 1.787 0.000 1.506) 2.337 2.843 ( -2.429 0.000 -0.913) 2.595 2.843 ( 2.429 0.000 0.913) 2.595 3.250 ( 0.400 0.000 -5.253) 5.269 3.250 ( -0.400 0.000 5.253) 5.269 3.543 ( 5.113 0.000 -2.380) 5.640 3.543 ( -5.113 0.000 2.380) 5.640 4.025 ( 0.189 0.000 -6.770) 6.773 4.025 ( -0.189 0.000 6.770) 6.773 4.242 ( 14.033 0.000 -21.201) 25.424 4.242 ( -14.033 0.000 21.201) 25.424 4.455 ( 1.645 0.000 -7.452) 7.632 4.455 ( -1.645 0.000 7.452) 7.632 4.577 ( -1.800 0.000 -8.842) 9.023 4.577 ( 1.800 0.000 8.842) 9.023 4.695 ( 3.133 0.000 -7.257) 7.904 4.695 ( -3.133 0.000 7.257) 7.904 5.284 ( -6.117 0.000 -0.578) 6.145 5.284 ( 6.117 0.000 0.578) 6.145 5.530 ( 1.731 0.000 -9.891) 10.041 5.530 ( -1.731 0.000 9.891) 10.041 5.781 ( -5.148 0.000 -5.841) 7.786 5.781 ( 5.148 0.000 5.841) 7.786 6.028 ( -4.826 0.000 -1.699) 5.116 6.028 ( 4.826 0.000 1.699) 5.116 6.183 ( 3.557 0.000 -1.417) 3.829 6.183 ( -3.557 0.000 1.417) 3.829 6.557 ( 2.469 0.000 -1.780) 3.044 6.557 ( -2.469 0.000 1.780) 3.044 6.720 ( 1.737 0.000 -7.833) 8.023 6.720 ( -1.737 0.000 7.833) 8.023 7.134 ( -11.046 0.000 -2.092) 11.242 7.134 ( 11.046 0.000 2.092) 11.242 7.186 ( -6.628 0.000 -0.599) 6.655 7.186 ( 6.628 0.000 0.599) 6.655 7.473 ( -5.157 0.000 -5.073) 7.234 7.473 ( 5.157 0.000 5.073) 7.234 7.707 ( -1.855 0.000 -2.824) 3.379 7.707 ( 1.855 0.000 2.824) 3.379 7.929 ( -8.267 0.000 -8.275) 11.697 7.929 ( 8.267 0.000 8.275) 11.697 9.046 ( 0.024 0.000 -3.273) 3.273 9.046 ( -0.024 0.000 3.273) 3.273 9.217 ( 0.798 0.000 -9.234) 9.269 9.217 ( -0.798 0.000 9.234) 9.269 9.759 ( -1.595 0.000 -11.331) 11.443 9.759 ( 1.595 0.000 11.331) 11.443 10.175 ( 13.210 0.000 -10.327) 16.768 10.175 ( -13.210 0.000 10.327) 16.768 10.391 ( -2.771 0.000 -0.197) 2.778 10.391 ( 2.771 0.000 0.197) 2.778 11.130 ( 6.139 0.000 -3.005) 6.835 11.130 ( -6.139 0.000 3.005) 6.835 11.609 ( 5.868 0.000 -3.891) 7.041 11.609 ( -5.868 0.000 3.891) 7.041 12.237 ( 1.122 0.000 -1.592) 1.948 12.237 ( -1.122 0.000 1.592) 1.948 12.627 ( -10.362 0.000 -1.261) 10.438 12.627 ( 10.362 0.000 1.261) 10.438 12.804 ( -0.092 0.000 -10.534) 10.535 12.804 ( 0.092 0.000 10.534) 10.535 13.816 ( -10.253 0.000 -9.831) 14.205 13.816 ( 10.253 0.000 9.831) 14.205 14.647 ( -0.304 0.000 -1.760) 1.786 14.647 ( 0.304 0.000 1.760) 1.786 14.861 ( 1.159 0.000 -0.829) 1.425 14.861 ( -1.159 0.000 0.829) 1.425 15.261 ( -2.551 0.000 -2.138) 3.329 15.261 ( 2.551 0.000 2.138) 3.329 15.562 ( 3.075 0.000 -2.877) 4.211 15.562 ( -3.075 0.000 2.877) 4.211 16.270 ( -4.066 0.000 0.964) 4.179 16.270 ( 4.066 0.000 -0.964) 4.179 24.722 ( -0.745 0.000 -0.861) 1.139 24.722 ( 0.745 0.000 0.861) 1.139 24.890 ( -0.084 0.000 -2.144) 2.146 24.890 ( 0.084 0.000 2.144) 2.146 25.078 ( 3.294 0.000 -1.478) 3.611 25.078 ( -3.294 0.000 1.478) 3.611 25.804 ( 7.279 0.000 -11.119) 13.289 25.804 ( -7.279 0.000 11.119) 13.289 26.352 ( -6.216 0.000 -2.068) 6.551 26.352 ( 6.216 0.000 2.068) 6.551 26.582 ( -5.113 0.000 -9.130) 10.465 26.582 ( 5.113 0.000 9.130) 10.465 28.936 ( 1.572 0.000 -5.061) 5.299 28.936 ( -1.572 0.000 5.061) 5.299 29.010 ( 0.760 0.000 -12.877) 12.899 29.010 ( -0.760 0.000 12.877) 12.899 ======================= Grid point 183 (93/104) ======================= q-point: ( 0.00 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( -2.690 -12.249 -18.552) 22.393 2.104 ( 2.690 -12.249 18.552) 22.393 2.280 ( 12.468 0.352 -17.573) 21.550 2.280 ( -12.468 0.352 17.573) 21.550 2.607 ( 1.713 -10.735 -7.424) 13.164 2.607 ( -1.713 -10.735 7.424) 13.164 2.826 ( -4.348 -0.740 -4.683) 6.433 2.826 ( 4.348 -0.740 4.683) 6.433 2.981 ( -1.843 -4.442 -0.364) 4.823 2.981 ( 1.843 -4.442 0.364) 4.823 3.336 ( -2.185 1.403 -3.577) 4.420 3.336 ( 2.185 1.403 3.577) 4.420 3.652 ( -8.007 -9.185 -4.005) 12.826 3.652 ( 8.007 -9.185 4.005) 12.826 3.921 ( -6.605 1.255 -10.903) 12.810 3.921 ( 6.605 1.255 10.903) 12.810 4.310 ( -0.898 4.205 -19.089) 19.567 4.310 ( 0.898 4.205 19.089) 19.567 4.385 ( 5.459 0.466 -11.552) 12.785 4.385 ( -5.459 0.466 11.552) 12.785 4.650 ( 2.814 2.037 -4.499) 5.684 4.650 ( -2.814 2.037 4.499) 5.684 4.804 ( 2.203 9.588 -9.949) 13.992 4.804 ( -2.203 9.588 9.949) 13.992 4.984 ( -5.657 4.645 -7.206) 10.271 4.984 ( 5.657 4.645 7.206) 10.271 5.460 ( 3.014 5.901 -4.179) 7.834 5.460 ( -3.014 5.901 4.179) 7.834 5.816 ( -0.433 -0.690 -3.209) 3.311 5.816 ( 0.433 -0.690 3.209) 3.311 5.947 ( 5.944 -4.292 -3.494) 8.122 5.947 ( -5.944 -4.292 3.494) 8.122 6.117 ( -3.146 -0.177 -8.410) 8.981 6.117 ( 3.146 -0.177 8.410) 8.981 6.422 ( -1.780 3.722 -3.387) 5.338 6.422 ( 1.780 3.722 3.387) 5.338 6.718 ( -1.795 -0.704 -3.222) 3.754 6.718 ( 1.795 -0.704 3.222) 3.754 6.855 ( -5.225 3.195 -4.819) 7.793 6.855 ( 5.225 3.195 4.819) 7.793 7.076 ( -9.863 0.923 -2.871) 10.313 7.076 ( 9.863 0.923 2.871) 10.313 7.430 ( -1.992 8.297 -8.396) 11.971 7.430 ( 1.992 8.297 8.396) 11.971 7.930 ( -1.039 -2.429 -4.828) 5.503 7.930 ( 1.039 -2.429 4.828) 5.503 8.032 ( 3.003 -4.852 -6.371) 8.553 8.032 ( -3.003 -4.852 6.371) 8.553 8.986 ( 2.367 -0.629 -4.276) 4.928 8.986 ( -2.367 -0.629 4.276) 4.928 9.241 ( 3.634 1.498 -5.915) 7.102 9.241 ( -3.634 1.498 5.915) 7.102 9.715 ( 6.079 -2.372 -11.560) 13.274 9.715 ( -6.079 -2.372 11.560) 13.274 10.300 ( -0.259 -1.392 -9.944) 10.044 10.300 ( 0.259 -1.392 9.944) 10.044 10.633 ( -0.783 1.288 -0.087) 1.510 10.633 ( 0.783 1.288 0.087) 1.510 11.075 ( -8.658 -8.629 -8.850) 15.091 11.075 ( 8.658 -8.629 8.850) 15.091 11.366 ( 0.779 -0.849 -8.796) 8.871 11.366 ( -0.779 -0.849 8.796) 8.871 11.924 ( -1.619 -3.250 -6.834) 7.739 11.924 ( 1.619 -3.250 6.834) 7.739 12.801 ( -7.993 4.290 -8.455) 12.401 12.801 ( 7.993 4.290 8.455) 12.401 13.267 ( -1.468 2.025 -8.133) 8.509 13.267 ( 1.468 2.025 8.133) 8.509 13.866 ( -12.797 -3.660 -3.057) 13.657 13.866 ( 12.797 -3.660 3.057) 13.657 14.296 ( -6.817 6.278 -10.083) 13.695 14.296 ( 6.817 6.278 10.083) 13.695 15.097 ( -6.197 -3.722 -0.871) 7.281 15.097 ( 6.197 -3.722 0.871) 7.281 15.290 ( -1.734 -0.613 -3.946) 4.353 15.290 ( 1.734 -0.613 3.946) 4.353 15.778 ( 0.229 1.568 -1.919) 2.489 15.778 ( -0.229 1.568 1.919) 2.489 15.984 ( -5.353 0.737 -5.192) 7.493 15.984 ( 5.353 0.737 5.192) 7.493 24.765 ( -1.021 0.978 -1.550) 2.098 24.765 ( 1.021 0.978 1.550) 2.098 24.834 ( 0.647 -0.220 -0.876) 1.111 24.834 ( -0.647 -0.220 0.876) 1.111 25.194 ( -6.048 -2.410 -5.726) 8.670 25.194 ( 6.048 -2.410 5.726) 8.670 25.341 ( -5.646 0.198 -4.428) 7.178 25.341 ( 5.646 0.198 4.428) 7.178 26.343 ( 1.390 1.178 -6.177) 6.440 26.343 ( -1.390 1.178 6.177) 6.440 26.983 ( 1.676 -9.183 -10.927) 14.371 26.983 ( -1.676 -9.183 10.927) 14.371 28.717 ( 1.825 -5.118 -3.134) 6.273 28.717 ( -1.825 -5.118 3.134) 6.273 29.160 ( 1.558 12.098 -1.378) 12.275 29.160 ( -1.558 12.098 1.378) 12.275 ======================= Grid point 185 (94/104) ======================= q-point: ( 0.17 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( -3.196 -10.122 -16.889) 19.947 2.031 ( -15.783 -2.160 8.628) 18.117 2.301 ( 3.515 -6.004 1.726) 7.168 2.327 ( 0.428 -3.167 -6.058) 6.849 2.483 ( -7.308 -5.898 5.010) 10.644 2.563 ( -6.025 -7.431 2.370) 9.856 2.794 ( 2.724 -4.199 -4.663) 6.840 2.846 ( -5.599 1.401 -2.086) 6.137 2.974 ( -1.849 -3.417 0.571) 3.927 3.039 ( 4.200 -3.372 -4.121) 6.781 3.207 ( -5.999 -3.761 -0.869) 7.133 3.383 ( -0.679 1.776 -1.084) 2.188 3.489 ( -6.399 -2.684 -2.105) 7.251 3.727 ( -7.352 -3.822 -0.806) 8.325 3.821 ( 5.262 -2.731 3.641) 6.958 4.078 ( 0.607 0.364 4.339) 4.396 4.178 ( 5.647 4.607 -23.906) 24.992 4.345 ( -2.304 -2.991 5.210) 6.434 4.377 ( -4.709 1.707 11.720) 12.745 4.429 ( 7.558 1.717 -11.067) 13.511 4.581 ( -4.993 3.057 6.201) 8.528 4.697 ( 0.326 1.323 -1.218) 1.828 4.747 ( -2.726 5.514 -1.222) 6.272 4.848 ( 1.579 10.461 7.214) 12.805 4.962 ( 4.103 4.156 -1.963) 6.161 5.191 ( 7.542 0.232 8.838) 11.621 5.462 ( -0.241 5.672 8.434) 10.167 5.523 ( 5.187 5.499 -0.221) 7.563 5.742 ( -5.209 2.016 2.780) 6.239 5.799 ( 0.686 -0.098 1.798) 1.926 5.956 ( -2.294 -1.261 -6.886) 7.367 6.060 ( 5.095 -0.074 3.582) 6.229 6.129 ( 11.212 -5.075 -6.178) 13.771 6.203 ( 1.801 1.297 5.346) 5.789 6.337 ( -2.157 2.587 2.486) 4.186 6.474 ( 0.192 -0.138 -1.811) 1.827 6.682 ( -0.128 -2.871 0.864) 3.001 6.744 ( -0.976 6.678 -6.052) 9.065 6.781 ( 1.197 -0.531 0.975) 1.632 6.889 ( 3.580 -2.081 -5.110) 6.577 7.098 ( 4.442 2.373 6.858) 8.509 7.341 ( 11.989 -0.567 6.286) 13.549 7.363 ( 3.729 12.453 -6.980) 14.755 7.470 ( -2.554 4.010 7.007) 8.468 7.777 ( -9.775 -6.486 -0.033) 11.731 7.879 ( -8.514 -1.402 5.633) 10.304 8.015 ( -1.606 -1.588 -1.891) 2.945 8.115 ( 4.189 -2.835 -3.199) 5.985 8.975 ( -1.017 -0.518 2.894) 3.111 9.004 ( 1.645 -0.745 -2.270) 2.901 9.202 ( -2.387 3.060 2.753) 4.758 9.254 ( 1.831 -1.085 -6.917) 7.237 9.666 ( -4.105 -3.002 8.347) 9.774 9.808 ( 7.816 -0.535 -5.892) 9.803 10.164 ( -5.496 0.952 -10.796) 12.152 10.330 ( -1.242 -2.889 1.076) 3.323 10.536 ( -10.812 -5.358 3.998) 12.712 10.572 ( -5.622 1.536 -1.885) 6.126 11.010 ( 4.608 -2.728 -4.803) 7.194 11.310 ( 3.245 -12.061 2.759) 12.791 11.321 ( 4.108 0.644 -3.854) 5.670 11.385 ( 2.519 3.631 5.161) 6.795 11.967 ( 8.116 -0.304 1.566) 8.271 12.047 ( 4.174 -6.216 11.008) 13.313 12.616 ( -5.488 4.535 -9.476) 11.853 12.956 ( 1.785 1.381 5.204) 5.672 13.082 ( -11.086 -1.025 -5.784) 12.546 13.262 ( -7.414 5.077 1.468) 9.105 13.607 ( -9.808 2.230 -2.441) 10.350 14.039 ( 2.787 -3.226 -1.285) 4.453 14.225 ( 5.253 -3.878 -2.109) 6.862 14.518 ( 9.091 10.860 9.976) 17.324 14.931 ( -9.183 -9.471 -3.084) 13.548 15.181 ( 2.482 0.284 0.527) 2.553 15.225 ( -2.219 4.139 -2.819) 5.478 15.368 ( 2.674 -2.780 0.736) 3.927 15.637 ( -8.038 2.465 -6.525) 10.643 15.715 ( -4.580 1.622 -1.305) 5.031 16.015 ( 7.239 0.772 0.103) 7.281 16.164 ( 7.596 0.015 5.321) 9.275 24.741 ( -0.963 0.415 -0.367) 1.111 24.765 ( -1.663 1.232 0.141) 2.074 24.819 ( 1.533 0.493 2.739) 3.177 24.904 ( 3.578 -1.058 -2.588) 4.541 25.060 ( -4.130 0.063 -3.422) 5.364 25.215 ( -3.848 0.446 -1.127) 4.034 25.366 ( 6.329 -6.012 5.522) 10.329 25.520 ( 8.900 -0.630 7.125) 11.418 26.333 ( 1.269 1.410 -4.875) 5.231 26.370 ( 0.461 1.321 6.008) 6.169 26.817 ( -10.193 -8.857 -4.704) 14.299 26.982 ( -4.764 -3.976 -2.960) 6.875 28.661 ( -1.809 -7.300 2.235) 7.846 28.779 ( 1.938 -6.968 -0.627) 7.260 29.158 ( 0.842 12.705 0.245) 12.735 29.191 ( 3.431 11.874 -3.996) 12.989 ======================= Grid point 186 (95/104) ======================= q-point: ( 0.33 0.14 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( -4.273 -2.264 3.270) 5.838 1.900 ( 3.092 -2.872 -6.599) 7.833 2.129 ( -8.625 4.725 -17.503) 20.076 2.301 ( -12.537 -6.710 4.386) 14.881 2.462 ( 1.909 0.433 9.022) 9.232 2.551 ( 1.269 -6.927 6.533) 9.606 2.714 ( -3.852 -7.684 -5.559) 10.236 2.777 ( -2.195 -1.365 -6.503) 6.998 2.895 ( -6.672 -0.708 2.778) 7.262 2.949 ( -4.611 3.185 -9.709) 11.210 3.211 ( 0.521 -4.613 5.757) 7.396 3.312 ( -4.525 -0.048 -0.650) 4.572 3.423 ( 1.503 -2.368 -5.598) 6.261 3.578 ( -7.761 -5.279 0.168) 9.388 3.942 ( 3.809 -1.642 7.134) 8.252 4.086 ( 2.058 4.909 -5.664) 7.773 4.168 ( 8.858 2.502 -22.005) 23.852 4.354 ( -6.405 0.255 13.191) 14.666 4.363 ( 0.762 -2.333 2.986) 3.865 4.510 ( 3.497 -1.165 -1.488) 3.975 4.533 ( -5.164 2.842 8.320) 10.196 4.642 ( -3.374 -1.309 -5.565) 6.638 4.731 ( 1.490 6.528 3.155) 7.402 4.879 ( -1.290 10.944 -0.365) 11.025 5.080 ( 7.506 -1.138 3.557) 8.383 5.285 ( -0.511 -4.045 1.944) 4.517 5.535 ( 1.627 4.069 8.716) 9.756 5.638 ( 5.827 7.758 0.998) 9.754 5.692 ( -2.573 2.502 2.684) 4.482 5.867 ( -1.366 -1.144 -7.928) 8.126 5.889 ( 7.037 -0.813 2.790) 7.613 6.110 ( -2.671 1.664 1.248) 3.386 6.191 ( 1.287 1.625 -2.993) 3.641 6.266 ( -0.815 3.249 5.753) 6.657 6.411 ( 6.343 -6.196 0.737) 8.898 6.490 ( 3.388 -2.168 -0.757) 4.093 6.681 ( -0.487 -1.921 3.873) 4.351 6.735 ( 3.215 5.068 -5.689) 8.269 6.891 ( 3.099 -6.538 -1.074) 7.315 6.924 ( 10.605 -1.053 -1.322) 10.739 7.193 ( 1.467 -0.914 2.436) 2.987 7.327 ( -5.975 1.807 -2.357) 6.672 7.502 ( 2.044 0.341 6.709) 7.022 7.569 ( 4.981 7.616 -0.150) 9.102 7.636 ( -4.011 -5.101 0.329) 6.497 7.787 ( -3.631 3.420 11.078) 12.149 7.907 ( -5.435 0.782 -5.913) 8.069 8.116 ( -1.941 0.939 -4.083) 4.618 8.989 ( 1.154 -1.601 1.595) 2.538 9.023 ( 1.112 -1.497 -0.709) 1.995 9.190 ( -0.421 0.140 1.061) 1.150 9.234 ( 0.120 -0.962 -4.895) 4.990 9.678 ( -0.058 -0.962 8.806) 8.858 9.882 ( 0.679 1.579 -5.331) 5.601 10.038 ( 3.398 -0.428 -12.533) 12.993 10.297 ( -5.486 -2.027 4.044) 7.110 10.353 ( -7.421 -6.557 1.458) 10.010 10.460 ( -6.115 -0.583 -0.420) 6.157 11.057 ( 3.893 -2.017 -5.043) 6.682 11.228 ( -6.009 -3.541 -2.501) 7.409 11.452 ( 11.273 2.092 0.537) 11.478 11.575 ( 5.713 0.797 9.215) 10.872 12.156 ( 6.585 -1.957 4.880) 8.427 12.170 ( 4.910 -3.047 5.142) 7.735 12.525 ( 1.945 2.715 -6.632) 7.426 12.824 ( -12.817 -2.514 -1.458) 13.142 12.883 ( -9.138 0.125 -2.418) 9.454 13.042 ( -13.327 4.039 -4.037) 14.499 13.615 ( 7.094 4.408 6.425) 10.537 13.985 ( -4.483 -1.799 -6.142) 7.814 14.374 ( 7.545 -8.415 4.053) 12.007 14.643 ( -2.412 -1.816 -1.787) 3.508 14.835 ( 2.723 1.361 5.132) 5.967 15.126 ( -5.181 6.800 -4.542) 9.680 15.239 ( 2.610 2.840 0.372) 3.875 15.358 ( -2.882 1.158 -2.092) 3.745 15.529 ( -0.254 -0.365 -2.620) 2.658 15.627 ( -4.292 0.834 -0.907) 4.465 16.162 ( 7.950 0.482 0.220) 7.967 16.280 ( 2.042 0.034 3.085) 3.700 24.724 ( -0.591 0.773 0.741) 1.223 24.752 ( -0.411 1.266 -0.419) 1.396 24.862 ( 0.991 -0.140 2.529) 2.720 24.899 ( -0.794 -1.215 -2.814) 3.166 25.043 ( 2.893 1.070 -2.193) 3.785 25.144 ( -3.396 0.840 -0.243) 3.507 25.532 ( 7.720 -8.603 6.393) 13.210 25.691 ( 4.183 -5.732 5.211) 8.804 26.335 ( 1.540 2.919 -1.034) 3.458 26.441 ( 3.102 2.091 6.562) 7.553 26.597 ( -9.488 -3.170 -5.569) 11.449 26.806 ( -9.427 1.027 -8.080) 12.459 28.681 ( 2.204 -10.551 1.347) 10.862 28.777 ( -1.742 -9.318 0.540) 9.494 29.187 ( 1.168 12.353 2.489) 12.655 29.222 ( 3.022 11.735 -6.044) 13.542 ======================= Grid point 187 (96/104) ======================= q-point: (-0.50 0.14 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -5.699 4.242 -15.062) 16.653 1.878 ( 5.699 4.242 15.062) 16.653 2.045 ( -8.052 -1.984 1.460) 8.420 2.045 ( 8.052 -1.984 -1.460) 8.420 2.589 ( -1.599 -1.502 -9.903) 10.144 2.589 ( 1.599 -1.502 9.903) 10.144 2.663 ( 2.285 -8.047 -5.832) 10.197 2.663 ( -2.285 -8.047 5.832) 10.197 2.850 ( 0.399 2.554 -6.069) 6.597 2.850 ( -0.399 2.554 6.069) 6.597 3.248 ( -1.152 -0.639 -3.458) 3.701 3.248 ( 1.152 -0.639 3.458) 3.701 3.466 ( 2.888 -5.982 -5.439) 8.585 3.466 ( -2.888 -5.982 5.439) 8.585 4.038 ( -1.185 1.410 -8.048) 8.256 4.038 ( 1.185 1.410 8.048) 8.256 4.262 ( 12.129 2.156 -20.034) 23.519 4.262 ( -12.128 2.156 20.034) 23.519 4.446 ( 0.832 0.140 -8.087) 8.131 4.446 ( -0.832 0.140 8.087) 8.131 4.558 ( 0.057 -1.884 -9.756) 9.937 4.558 ( -0.057 -1.884 9.756) 9.937 4.818 ( -1.854 9.809 -5.938) 11.615 4.818 ( 1.854 9.809 5.938) 11.615 5.223 ( -4.331 -4.363 -3.869) 7.263 5.223 ( 4.331 -4.363 3.869) 7.263 5.619 ( -1.442 4.748 -6.781) 8.403 5.619 ( 1.442 4.748 6.781) 8.403 5.773 ( -4.995 1.367 -4.418) 6.807 5.773 ( 4.995 1.367 4.418) 6.807 6.027 ( -4.807 -1.578 -1.593) 5.304 6.027 ( 4.807 -1.578 1.593) 5.304 6.230 ( 4.632 5.206 -3.667) 7.874 6.230 ( -4.632 5.206 3.667) 7.874 6.502 ( -0.789 -5.222 -1.192) 5.414 6.502 ( 0.789 -5.222 1.192) 5.414 6.716 ( -0.087 -0.489 -6.858) 6.876 6.716 ( 0.087 -0.489 6.858) 6.876 7.039 ( -7.850 -6.674 -4.542) 11.261 7.039 ( 7.850 -6.674 4.542) 11.261 7.169 ( -8.051 -0.471 0.557) 8.084 7.169 ( 8.051 -0.471 -0.557) 8.084 7.568 ( -0.868 2.891 -5.110) 5.935 7.568 ( 0.868 2.891 5.110) 5.935 7.684 ( -4.030 1.772 -9.915) 10.849 7.684 ( 4.030 1.772 9.915) 10.849 7.989 ( -7.887 4.753 -6.775) 11.432 7.989 ( 7.887 4.753 6.775) 11.432 9.020 ( 0.311 -2.373 -2.718) 3.622 9.020 ( -0.311 -2.373 2.718) 3.622 9.203 ( 2.207 -1.349 -7.477) 7.912 9.203 ( -2.207 -1.349 7.477) 7.912 9.773 ( -4.015 1.740 -8.678) 9.718 9.773 ( 4.015 1.740 8.678) 9.718 10.142 ( 12.355 -3.176 -10.605) 16.589 10.142 ( -12.355 -3.176 10.605) 16.589 10.362 ( -2.491 -2.618 0.179) 3.618 10.362 ( 2.491 -2.618 -0.179) 3.618 11.119 ( -0.272 -1.760 -2.335) 2.936 11.119 ( 0.272 -1.760 2.335) 2.936 11.621 ( 2.233 1.396 -4.632) 5.329 11.621 ( -2.233 1.396 4.632) 5.329 12.234 ( -1.120 -0.429 -3.851) 4.033 12.234 ( 1.120 -0.429 3.851) 4.033 12.612 ( -7.501 -1.217 -0.648) 7.627 12.612 ( 7.501 -1.217 0.648) 7.627 12.826 ( -1.594 1.889 -8.410) 8.766 12.826 ( 1.594 1.889 8.410) 8.766 13.819 ( -8.446 0.633 -8.506) 12.004 13.819 ( 8.446 0.633 8.506) 12.004 14.522 ( -5.721 -9.431 -5.643) 12.390 14.522 ( 5.721 -9.431 5.643) 12.390 14.983 ( -6.380 8.791 -7.303) 13.089 14.983 ( 6.380 8.791 7.303) 13.089 15.292 ( -2.668 2.962 -1.706) 4.336 15.292 ( 2.668 2.962 1.706) 4.336 15.555 ( -0.180 -0.730 -3.179) 3.266 15.555 ( 0.180 -0.730 3.179) 3.266 16.273 ( -3.189 0.265 0.646) 3.265 16.273 ( 3.189 0.265 -0.646) 3.265 24.733 ( -0.733 1.164 -1.123) 1.776 24.733 ( 0.733 1.164 1.123) 1.776 24.882 ( 0.131 -0.906 -2.216) 2.397 24.882 ( -0.131 -0.906 2.216) 2.397 25.089 ( 3.190 1.205 -1.446) 3.704 25.089 ( -3.190 1.205 1.446) 3.704 25.689 ( -0.441 -10.113 -8.054) 12.936 25.689 ( 0.441 -10.113 8.054) 12.936 26.406 ( -5.097 4.117 -5.434) 8.512 26.406 ( 5.097 4.117 5.434) 8.512 26.598 ( -6.831 1.383 -8.772) 11.203 26.598 ( 6.831 1.383 8.772) 11.203 28.735 ( 0.197 -10.879 -3.182) 11.336 28.735 ( -0.197 -10.879 3.182) 11.336 29.219 ( 0.671 11.737 -5.513) 12.984 29.219 ( -0.671 11.737 5.513) 12.984 ======================= Grid point 191 (97/104) ======================= q-point: ( 0.00 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -1.438 -14.326 -17.590) 22.731 1.828 ( 1.438 -14.326 17.590) 22.731 2.212 ( -0.612 -15.929 -1.644) 16.025 2.212 ( 0.612 -15.929 1.644) 16.025 2.350 ( 0.657 -4.656 -12.234) 13.106 2.350 ( -0.657 -4.656 12.234) 13.106 2.789 ( -2.574 -2.167 -2.025) 3.927 2.789 ( 2.574 -2.167 2.025) 3.927 3.019 ( 3.516 5.515 -5.759) 8.715 3.019 ( -3.516 5.515 5.759) 8.715 3.358 ( -2.345 0.935 -9.084) 9.428 3.358 ( 2.345 0.935 9.084) 9.428 3.494 ( -1.951 -7.000 -2.072) 7.556 3.494 ( 1.951 -7.000 2.072) 7.556 3.920 ( -1.460 -1.058 -7.004) 7.232 3.920 ( 1.460 -1.058 7.004) 7.232 4.383 ( 1.432 2.879 -13.512) 13.890 4.383 ( -1.432 2.879 13.512) 13.890 4.440 ( 0.534 4.902 -11.503) 12.515 4.440 ( -0.534 4.902 11.503) 12.515 4.704 ( 3.405 3.868 -2.524) 5.738 4.704 ( -3.405 3.868 2.524) 5.738 4.950 ( 1.140 3.783 -7.619) 8.583 4.950 ( -1.140 3.783 7.619) 8.583 5.076 ( -4.119 4.861 -4.400) 7.743 5.076 ( 4.119 4.861 4.400) 7.743 5.500 ( -3.384 -1.703 -1.719) 4.160 5.500 ( 3.384 -1.703 1.719) 4.160 5.835 ( 6.072 -0.234 -6.854) 9.160 5.835 ( -6.072 -0.234 6.854) 9.160 5.918 ( -1.739 4.618 -2.700) 5.625 5.918 ( 1.739 4.618 2.700) 5.625 6.145 ( -5.112 1.895 -7.834) 9.544 6.145 ( 5.112 1.895 7.834) 9.544 6.429 ( 0.146 -2.796 -2.748) 3.923 6.429 ( -0.146 -2.796 2.748) 3.923 6.748 ( -4.644 3.636 -4.440) 7.382 6.748 ( 4.644 3.636 4.440) 7.382 6.914 ( -1.778 3.421 -2.552) 4.624 6.914 ( 1.778 3.421 2.552) 4.624 7.132 ( -4.685 4.242 -4.308) 7.649 7.132 ( 4.685 4.242 4.308) 7.649 7.582 ( -0.211 5.875 -4.592) 7.460 7.582 ( 0.211 5.875 4.592) 7.460 7.885 ( -2.974 -2.787 -7.352) 8.406 7.885 ( 2.974 -2.787 7.352) 8.406 7.914 ( -2.665 -5.356 -11.539) 12.997 7.914 ( 2.665 -5.356 11.539) 12.997 8.978 ( 2.121 -0.053 -4.276) 4.774 8.978 ( -2.121 -0.053 4.276) 4.774 9.257 ( 0.364 -0.541 -5.259) 5.299 9.257 ( -0.364 -0.541 5.259) 5.299 9.705 ( 4.542 2.717 -12.540) 13.611 9.705 ( -4.542 2.717 12.540) 13.611 10.247 ( 3.905 -5.072 -10.774) 12.532 10.247 ( -3.905 -5.072 10.774) 12.532 10.644 ( -6.008 -0.514 -3.158) 6.807 10.644 ( 6.008 -0.514 3.158) 6.807 10.873 ( -0.103 -10.195 -9.854) 14.179 10.873 ( 0.103 -10.195 9.854) 14.179 11.388 ( 1.965 3.313 -8.665) 9.483 11.388 ( -1.965 3.313 8.665) 9.483 11.825 ( 2.643 -7.309 -6.424) 10.084 11.825 ( -2.643 -7.309 6.424) 10.084 12.919 ( -7.641 8.016 -6.930) 13.064 12.919 ( 7.641 8.016 6.930) 13.064 13.296 ( -5.196 0.231 -10.215) 11.463 13.296 ( 5.196 0.231 10.215) 11.463 13.787 ( -8.092 -4.170 -0.835) 9.142 13.787 ( 8.092 -4.170 0.835) 9.142 14.444 ( -12.119 8.835 -12.574) 19.571 14.444 ( 12.119 8.835 12.574) 19.571 15.007 ( -12.494 -5.784 -4.050) 14.351 15.007 ( 12.494 -5.784 4.050) 14.351 15.264 ( 2.519 -1.880 -3.657) 4.822 15.264 ( -2.519 -1.880 3.657) 4.822 15.814 ( 0.185 1.951 -1.109) 2.252 15.814 ( -0.185 1.951 1.109) 2.252 16.000 ( -3.862 0.820 -3.767) 5.456 16.000 ( 3.862 0.820 3.767) 5.456 24.790 ( -1.172 1.624 -1.685) 2.617 24.790 ( 1.172 1.624 1.685) 2.617 24.832 ( 1.944 0.061 -1.231) 2.302 24.832 ( -1.944 0.061 1.231) 2.302 25.145 ( -4.131 -2.449 -3.702) 6.064 25.145 ( 4.131 -2.449 3.702) 6.064 25.329 ( -4.848 -1.430 -3.698) 6.263 25.329 ( 4.848 -1.430 3.698) 6.263 26.382 ( 0.891 3.168 -3.472) 4.784 26.382 ( -0.891 3.168 3.472) 4.784 26.784 ( -0.917 -10.609 -7.092) 12.794 26.784 ( 0.917 -10.609 7.092) 12.794 28.645 ( -2.418 -2.628 0.126) 3.573 28.645 ( 2.418 -2.628 -0.126) 3.573 29.373 ( -0.028 9.409 -0.404) 9.418 29.373 ( 0.028 9.409 0.404) 9.418 ======================= Grid point 193 (98/104) ======================= q-point: ( 0.17 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( 1.219 -10.671 -16.676) 19.836 1.912 ( -4.286 -10.834 12.301) 16.943 2.130 ( -7.138 -9.375 8.161) 14.333 2.241 ( 2.466 -18.577 -2.752) 18.941 2.293 ( 3.068 -6.202 -3.587) 7.794 2.382 ( -4.608 -2.481 4.431) 6.858 2.703 ( -3.452 -2.436 -3.675) 5.600 2.904 ( 4.432 -4.828 -2.282) 6.939 2.965 ( -5.082 7.708 6.640) 11.372 3.030 ( 2.852 2.458 -7.860) 8.715 3.183 ( -8.691 1.195 -5.142) 10.169 3.413 ( -3.756 1.536 9.051) 9.919 3.456 ( -0.107 -1.457 -1.205) 1.894 3.573 ( -1.061 -9.768 4.387) 10.760 3.844 ( -1.249 2.897 0.170) 3.159 4.030 ( 3.387 -3.787 11.638) 12.698 4.313 ( 3.417 5.494 -19.431) 20.480 4.341 ( -0.911 3.339 -12.589) 13.056 4.418 ( -5.345 2.901 8.057) 10.095 4.495 ( 5.634 5.690 -4.533) 9.201 4.646 ( -4.936 3.184 6.176) 8.523 4.713 ( -1.383 1.646 -2.146) 3.037 4.844 ( -5.588 4.202 0.401) 7.002 5.026 ( 3.122 1.032 -2.775) 4.303 5.037 ( 1.155 7.268 3.096) 7.984 5.177 ( 3.138 -1.647 0.713) 3.615 5.486 ( 1.720 -1.424 3.092) 3.814 5.581 ( 3.099 1.458 4.321) 5.514 5.824 ( 0.900 1.941 6.628) 6.964 5.845 ( -1.264 5.510 1.041) 5.748 5.932 ( 3.402 -4.510 -4.600) 7.285 6.005 ( -1.728 -1.445 -6.452) 6.833 6.089 ( 8.534 2.129 2.180) 9.062 6.249 ( 3.148 2.684 2.954) 5.083 6.411 ( -1.058 2.768 2.054) 3.606 6.453 ( -0.639 -1.852 1.976) 2.783 6.633 ( -2.010 0.061 -4.262) 4.712 6.774 ( -1.660 -0.183 1.828) 2.476 6.891 ( 0.994 6.056 -5.456) 8.212 6.938 ( 3.123 8.118 -5.266) 10.168 7.121 ( 0.627 0.124 6.734) 6.764 7.321 ( 7.992 -1.833 2.384) 8.539 7.511 ( -5.337 3.033 -1.188) 6.252 7.582 ( -2.547 1.237 5.024) 5.767 7.700 ( -3.622 3.215 -8.445) 9.735 7.839 ( -1.099 -2.187 1.883) 3.088 7.955 ( -0.856 -3.855 2.457) 4.651 8.061 ( 3.679 -2.621 5.569) 7.171 8.970 ( -1.042 0.149 2.360) 2.584 8.990 ( 1.511 -0.314 -2.944) 3.324 9.214 ( -0.952 -1.298 -6.231) 6.436 9.263 ( -1.986 0.032 3.508) 4.031 9.649 ( -1.244 3.421 3.778) 5.246 9.818 ( 6.754 2.110 -1.642) 7.264 10.172 ( -4.636 -1.207 -4.338) 6.463 10.244 ( 0.427 -7.291 -5.884) 9.379 10.425 ( -12.451 -3.400 1.597) 13.006 10.606 ( -7.879 1.367 -1.962) 8.234 10.935 ( 4.799 -5.306 -3.838) 8.119 11.020 ( 9.048 -15.218 2.951) 17.949 11.379 ( 3.539 4.754 -0.222) 5.931 11.474 ( 4.523 5.507 6.484) 9.635 11.891 ( 2.723 -9.014 12.199) 15.411 11.923 ( 9.211 -5.434 2.290) 10.937 12.726 ( -7.173 6.763 -8.903) 13.283 13.010 ( -6.248 2.202 0.524) 6.646 13.087 ( -5.895 3.120 -7.837) 10.291 13.319 ( -8.801 0.507 3.236) 9.391 13.666 ( -2.508 3.604 0.694) 4.445 13.956 ( 7.940 -5.690 0.557) 9.784 14.205 ( -5.157 2.418 -8.880) 10.550 14.726 ( -7.909 -0.942 -3.387) 8.655 14.744 ( 6.021 1.552 7.865) 10.026 15.193 ( 5.018 0.704 1.759) 5.364 15.248 ( 0.165 -1.960 2.719) 3.356 15.312 ( 2.465 -2.501 1.709) 3.905 15.691 ( -7.573 2.878 -5.244) 9.651 15.746 ( -4.638 1.313 -3.463) 5.935 16.042 ( 7.056 2.083 -0.141) 7.359 16.158 ( 7.622 -0.769 3.782) 8.544 24.758 ( -1.221 1.338 -0.468) 1.871 24.790 ( -1.342 1.301 0.498) 1.934 24.832 ( 1.384 0.825 1.824) 2.434 24.879 ( 2.080 -1.486 -2.356) 3.477 25.067 ( -1.545 0.878 -2.171) 2.805 25.226 ( -2.342 0.407 1.292) 2.705 25.258 ( 3.433 -4.731 1.626) 6.067 25.457 ( 5.885 -5.433 2.265) 8.323 26.387 ( 1.110 4.292 -0.874) 4.518 26.405 ( 0.999 2.462 4.078) 4.867 26.664 ( -5.378 -6.876 -4.024) 9.612 26.843 ( -0.155 -9.590 0.059) 9.592 28.575 ( -4.045 -2.168 1.043) 4.706 28.666 ( -0.854 -4.814 0.115) 4.890 29.367 ( 0.692 9.139 -0.849) 9.204 29.399 ( 2.326 8.854 -2.422) 9.470 ======================= Grid point 194 (99/104) ======================= q-point: ( 0.33 0.29 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.706 ( 8.102 -6.225 -9.974) 14.279 1.888 ( -2.212 -0.561 10.016) 10.273 2.083 ( -7.409 -11.493 9.812) 16.831 2.225 ( -5.414 0.712 -9.880) 11.288 2.295 ( 4.387 -15.349 -2.575) 16.170 2.416 ( 4.866 -4.743 10.112) 12.183 2.566 ( -7.425 -3.323 -8.999) 12.131 2.832 ( -8.377 0.876 -2.304) 8.732 2.949 ( -2.731 6.948 7.311) 10.450 3.035 ( -0.258 4.362 -8.476) 9.536 3.094 ( 3.845 -4.608 2.076) 6.350 3.362 ( -7.324 5.592 8.057) 12.240 3.429 ( -0.543 1.306 -5.681) 5.854 3.469 ( -7.835 -5.777 -1.949) 9.928 3.923 ( 5.593 -0.132 6.599) 8.651 4.137 ( -0.038 -0.666 4.008) 4.063 4.268 ( 5.344 6.819 -16.858) 18.954 4.305 ( 3.820 -1.175 -4.072) 5.706 4.370 ( -3.046 0.294 4.781) 5.677 4.538 ( -0.567 4.909 -3.140) 5.854 4.605 ( -1.615 1.027 0.068) 1.915 4.628 ( -7.151 2.717 1.934) 7.890 4.817 ( 1.953 3.074 5.701) 6.765 5.036 ( -0.267 3.089 -4.332) 5.327 5.096 ( 2.116 1.799 4.758) 5.510 5.189 ( 0.267 -5.973 -4.411) 7.430 5.561 ( 2.919 0.553 4.560) 5.443 5.669 ( 2.112 -0.395 4.293) 4.800 5.799 ( -1.468 3.211 -4.737) 5.908 5.884 ( 2.943 1.603 2.239) 4.030 5.896 ( -1.318 1.852 0.103) 2.276 6.056 ( -1.133 -9.929 -0.854) 10.030 6.190 ( 6.718 1.987 1.474) 7.159 6.336 ( 2.746 2.311 0.500) 3.624 6.371 ( -0.466 2.959 -0.290) 3.010 6.475 ( 0.398 1.289 1.522) 2.034 6.634 ( 1.679 -1.945 2.020) 3.269 6.806 ( 2.482 -3.638 6.055) 7.487 6.854 ( -5.439 4.200 -8.638) 11.038 6.945 ( 7.552 4.954 -4.600) 10.135 7.162 ( -0.717 -1.096 -2.060) 2.441 7.324 ( -6.216 -0.717 -1.247) 6.380 7.457 ( -0.089 -3.285 4.451) 5.533 7.527 ( -0.731 -5.908 -0.196) 5.957 7.776 ( 5.556 9.987 -1.919) 11.588 7.851 ( -3.792 2.232 9.324) 10.310 7.919 ( 2.334 1.638 0.182) 2.857 8.121 ( 0.136 -0.925 1.760) 1.993 8.967 ( 0.109 -0.278 -0.052) 0.303 8.992 ( -0.232 -1.181 -0.700) 1.392 9.167 ( 0.386 -1.327 -5.388) 5.563 9.227 ( -4.047 -1.344 3.070) 5.254 9.706 ( 4.452 4.759 3.986) 7.639 9.903 ( 2.551 0.922 -1.697) 3.199 10.057 ( -1.257 2.139 -10.750) 11.033 10.201 ( -5.517 -8.275 0.143) 9.947 10.258 ( -3.933 -1.897 1.809) 4.727 10.441 ( -9.182 -1.863 0.426) 9.378 10.980 ( 4.292 -5.398 -3.732) 7.842 11.108 ( 0.021 -8.293 -2.048) 8.542 11.511 ( 8.899 3.941 3.064) 10.203 11.625 ( 4.419 3.812 9.301) 10.981 12.040 ( 6.192 -6.358 10.326) 13.616 12.144 ( 10.762 -3.280 4.008) 11.943 12.586 ( -1.578 3.583 -8.299) 9.176 12.777 ( -11.895 -2.240 -3.689) 12.654 12.927 ( -10.230 4.282 -4.677) 12.036 13.093 ( -13.743 1.164 -2.841) 14.082 13.722 ( 5.267 6.354 4.251) 9.284 13.970 ( -3.577 0.638 -4.795) 6.016 14.216 ( 6.325 -7.821 0.785) 10.090 14.487 ( -8.598 -10.793 -6.244) 15.146 14.977 ( 8.100 9.405 8.196) 14.874 15.210 ( -2.509 2.747 1.895) 4.175 15.300 ( 3.613 2.364 -1.502) 4.572 15.365 ( 0.723 -0.678 4.837) 4.938 15.546 ( -3.820 2.243 -5.255) 6.873 15.638 ( -4.645 0.134 -4.156) 6.234 16.180 ( 7.445 1.438 -0.179) 7.584 16.275 ( 2.722 -0.689 2.389) 3.687 24.746 ( -0.103 1.478 0.655) 1.620 24.780 ( -0.377 1.554 -0.204) 1.612 24.854 ( -0.398 -0.895 1.620) 1.893 24.871 ( -0.030 -1.543 -2.731) 3.137 25.077 ( 3.054 2.617 -1.529) 4.303 25.173 ( -2.733 2.349 0.240) 3.612 25.371 ( 4.995 -7.877 5.640) 10.900 25.531 ( 1.471 -9.724 -1.682) 9.977 26.416 ( 1.592 5.159 2.750) 6.059 26.477 ( 4.075 1.711 5.315) 6.913 26.557 ( -3.340 -1.239 -5.235) 6.332 26.771 ( -6.199 -4.527 -3.228) 8.327 28.539 ( -0.297 -4.440 0.894) 4.539 28.626 ( -3.253 -6.447 0.203) 7.224 29.384 ( 1.231 8.386 0.179) 8.478 29.416 ( 1.349 8.000 -3.213) 8.726 ======================= Grid point 195 (100/104) ======================= q-point: (-0.50 0.29 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.857 ( 4.756 -6.152 -8.699) 11.668 1.857 ( -4.756 -6.152 8.699) 11.668 2.067 ( -2.458 2.052 -12.479) 12.883 2.067 ( 2.458 2.052 12.479) 12.883 2.385 ( -3.829 -9.799 -7.432) 12.881 2.385 ( 3.829 -9.799 7.432) 12.881 2.621 ( -8.210 -2.211 -8.527) 12.042 2.621 ( 8.210 -2.211 8.527) 12.042 2.978 ( 0.769 8.146 -10.482) 13.298 2.978 ( -0.769 8.146 10.482) 13.298 3.229 ( -8.361 -0.797 -1.840) 8.598 3.229 ( 8.361 -0.797 1.840) 8.598 3.394 ( 3.383 -0.114 -10.063) 10.617 3.394 ( -3.383 -0.114 10.063) 10.617 4.063 ( -3.258 0.670 -7.715) 8.401 4.063 ( 3.258 0.670 7.715) 8.401 4.319 ( 7.383 2.984 -16.174) 18.028 4.319 ( -7.383 2.984 16.174) 18.028 4.428 ( -0.761 -2.413 -10.080) 10.393 4.428 ( 0.761 -2.413 10.080) 10.393 4.574 ( 2.292 4.412 -9.341) 10.582 4.574 ( -2.292 4.412 9.341) 10.582 4.945 ( -4.948 2.438 -7.816) 9.566 4.945 ( 4.948 2.438 7.816) 9.566 5.156 ( -0.902 -3.031 -4.891) 5.825 5.156 ( 0.902 -3.031 4.891) 5.825 5.641 ( -2.924 0.173 -4.013) 4.968 5.641 ( 2.924 0.173 4.013) 4.968 5.838 ( -3.604 1.514 -1.335) 4.131 5.838 ( 3.604 1.514 1.335) 4.131 5.971 ( -2.627 -3.034 -3.121) 5.084 5.971 ( 2.627 -3.034 3.121) 5.084 6.312 ( 2.279 1.323 -4.377) 5.109 6.312 ( -2.279 1.323 4.377) 5.109 6.432 ( -4.367 0.152 0.643) 4.417 6.432 ( 4.367 0.152 -0.643) 4.417 6.715 ( -4.178 1.068 -6.331) 7.660 6.715 ( 4.178 1.068 6.331) 7.660 6.941 ( -5.809 -4.594 -8.930) 11.601 6.941 ( 5.809 -4.594 8.930) 11.601 7.177 ( 6.092 2.089 -2.352) 6.857 7.177 ( -6.092 2.089 2.352) 6.857 7.522 ( -0.584 -4.382 -6.085) 7.521 7.522 ( 0.584 -4.382 6.085) 7.521 7.798 ( 1.370 6.783 -8.401) 10.884 7.798 ( -1.370 6.783 8.401) 10.884 8.064 ( -5.951 2.465 -3.791) 7.474 8.064 ( 5.951 2.465 3.791) 7.474 8.977 ( 0.062 -1.433 -0.339) 1.474 8.977 ( -0.062 -1.433 0.339) 1.474 9.174 ( 3.357 -1.640 -4.145) 5.580 9.174 ( -3.357 -1.640 4.145) 5.580 9.834 ( -5.951 4.550 -4.499) 8.738 9.834 ( 5.951 4.550 4.499) 8.738 10.076 ( 9.269 -2.969 -10.896) 14.610 10.076 ( -9.269 -2.969 10.896) 14.610 10.302 ( 2.131 -3.702 -4.136) 5.946 10.302 ( -2.131 -3.702 4.136) 5.946 11.051 ( -1.226 -4.992 -1.728) 5.423 11.051 ( 1.226 -4.992 1.728) 5.423 11.658 ( 0.812 2.112 -4.448) 4.991 11.658 ( -0.812 2.112 4.448) 4.991 12.217 ( -4.251 -1.377 -6.012) 7.491 12.217 ( 4.251 -1.377 6.012) 7.491 12.596 ( 4.073 -0.252 -2.480) 4.775 12.596 ( -4.073 -0.252 2.480) 4.775 12.858 ( -3.892 1.219 -5.266) 6.660 12.858 ( 3.892 1.219 5.266) 6.660 13.854 ( -4.887 3.312 -5.731) 8.228 13.854 ( 4.887 3.312 5.731) 8.228 14.337 ( -4.600 -9.735 -4.700) 11.748 14.337 ( 4.600 -9.735 4.700) 11.748 15.134 ( -5.167 6.674 -4.124) 9.394 15.134 ( 5.167 6.674 4.124) 9.394 15.357 ( -2.987 3.332 -0.021) 4.474 15.357 ( 2.987 3.332 0.021) 4.474 15.538 ( -2.223 -0.867 -3.733) 4.431 15.538 ( 2.223 -0.867 3.733) 4.431 16.279 ( -2.430 0.281 0.610) 2.521 16.279 ( 2.430 0.281 -0.610) 2.521 24.761 ( -0.474 1.653 -1.771) 2.468 24.761 ( 0.474 1.653 1.771) 2.468 24.858 ( 0.342 -1.515 -2.447) 2.899 24.858 ( -0.342 -1.515 2.447) 2.899 25.127 ( 1.239 2.877 -1.390) 3.427 25.127 ( -1.239 2.877 1.390) 3.427 25.487 ( -3.327 -10.220 -5.469) 12.060 25.487 ( 3.327 -10.220 5.469) 12.060 26.476 ( -2.181 3.260 -5.347) 6.631 26.476 ( 2.181 3.260 5.347) 6.631 26.615 ( -6.895 -0.081 -5.586) 8.874 26.615 ( 6.895 -0.081 5.586) 8.874 28.568 ( -0.940 -6.459 -1.888) 6.795 28.568 ( 0.940 -6.459 1.888) 6.795 29.407 ( 0.338 7.797 -3.306) 8.475 29.407 ( -0.338 7.797 3.306) 8.475 ======================= Grid point 199 (101/104) ======================= q-point: ( 0.00 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( -0.100 -3.170 -11.351) 11.786 1.650 ( 0.100 -3.170 11.351) 11.786 1.870 ( 0.785 -13.466 -4.982) 14.380 1.870 ( -0.785 -13.466 4.982) 14.380 2.354 ( 2.491 1.034 -6.087) 6.658 2.354 ( -2.491 1.034 6.087) 6.658 2.754 ( 1.695 -1.199 -1.500) 2.561 2.754 ( -1.695 -1.199 1.500) 2.561 3.110 ( 1.777 2.950 -4.792) 5.901 3.110 ( -1.777 2.950 4.792) 5.901 3.369 ( 0.139 -0.126 -11.882) 11.883 3.369 ( -0.139 -0.126 11.882) 11.883 3.402 ( 0.784 -2.147 -3.905) 4.525 3.402 ( -0.784 -2.147 3.905) 4.525 3.897 ( 0.124 -0.901 -2.614) 2.767 3.897 ( -0.124 -0.901 2.614) 2.767 4.435 ( 1.543 2.166 -8.402) 8.813 4.435 ( -1.543 2.166 8.402) 8.813 4.504 ( 1.620 1.289 -7.558) 7.836 4.504 ( -1.620 1.289 7.558) 7.836 4.790 ( -1.054 4.198 -1.821) 4.696 4.790 ( 1.054 4.198 1.821) 4.696 4.948 ( 0.810 -2.157 -2.426) 3.346 4.948 ( -0.810 -2.157 2.426) 3.346 5.153 ( -0.923 2.346 -1.925) 3.172 5.153 ( 0.923 2.346 1.925) 3.172 5.457 ( -2.363 -1.752 -2.093) 3.611 5.457 ( 2.363 -1.752 2.094) 3.611 5.863 ( 4.077 3.760 -6.917) 8.866 5.863 ( -4.077 3.760 6.917) 8.866 5.990 ( 1.024 -0.492 -6.043) 6.149 5.990 ( -1.024 -0.492 6.043) 6.149 6.147 ( -5.117 -0.601 -2.860) 5.893 6.147 ( 5.117 -0.601 2.860) 5.893 6.388 ( 0.007 -0.579 -1.381) 1.498 6.388 ( -0.007 -0.579 1.381) 1.498 6.804 ( -1.491 1.472 -2.015) 2.907 6.804 ( 1.491 1.471 2.015) 2.907 7.006 ( -1.406 5.272 -1.729) 5.724 7.006 ( 1.406 5.272 1.729) 5.724 7.176 ( -3.325 -0.533 -2.636) 4.276 7.176 ( 3.325 -0.533 2.636) 4.276 7.649 ( -2.726 2.904 0.012) 3.983 7.649 ( 2.726 2.904 -0.012) 3.983 7.765 ( -4.056 -6.110 -5.591) 9.223 7.765 ( 4.056 -6.110 5.591) 9.223 7.920 ( -1.665 1.596 -7.282) 7.638 7.920 ( 1.665 1.596 7.282) 7.638 8.986 ( 1.272 0.688 -2.515) 2.902 8.986 ( -1.272 0.688 2.516) 2.902 9.222 ( -0.281 -2.077 -1.587) 2.629 9.222 ( 0.281 -2.077 1.587) 2.629 9.841 ( 3.597 11.072 -12.285) 16.925 9.841 ( -3.597 11.072 12.285) 16.925 10.078 ( 2.838 -12.264 -12.332) 17.622 10.078 ( -2.838 -12.264 12.332) 17.622 10.624 ( -5.971 -0.702 -4.736) 7.654 10.624 ( 5.971 -0.702 4.736) 7.654 10.753 ( -1.598 -2.647 -4.550) 5.501 10.753 ( 1.598 -2.647 4.550) 5.501 11.492 ( 2.399 7.447 -8.395) 11.476 11.492 ( -2.399 7.447 8.395) 11.476 11.659 ( 3.357 -9.452 -6.909) 12.180 11.659 ( -3.357 -9.452 6.909) 12.180 13.082 ( -7.084 7.996 -5.784) 12.148 13.082 ( 7.084 7.996 5.784) 12.148 13.256 ( -6.173 -4.249 -7.362) 10.506 13.256 ( 6.173 -4.249 7.362) 10.506 13.727 ( -2.505 -1.738 -0.019) 3.049 13.727 ( 2.505 -1.738 0.019) 3.049 14.608 ( -10.986 7.146 -9.557) 16.220 14.608 ( 10.986 7.146 9.557) 16.220 14.886 ( -11.359 -5.992 -6.524) 14.405 14.886 ( 11.359 -5.992 6.524) 14.405 15.235 ( 1.436 -0.852 -1.245) 2.082 15.235 ( -1.436 -0.852 1.245) 2.082 15.842 ( 0.224 0.829 -0.386) 0.941 15.842 ( -0.224 0.829 0.386) 0.941 16.012 ( -1.358 0.336 -1.411) 1.986 16.012 ( 1.358 0.336 1.411) 1.986 24.819 ( -0.788 1.153 -1.566) 2.098 24.819 ( 0.788 1.153 1.566) 2.098 24.833 ( 1.006 -0.068 -1.099) 1.491 24.833 ( -1.006 -0.068 1.099) 1.491 25.110 ( -1.517 -1.041 -1.379) 2.299 25.110 ( 1.517 -1.041 1.379) 2.299 25.300 ( -1.658 -1.143 -1.301) 2.397 25.300 ( 1.658 -1.143 1.301) 2.397 26.466 ( 0.509 5.543 -1.675) 5.813 26.466 ( -0.509 5.543 1.675) 5.813 26.603 ( -0.694 -8.182 -4.037) 9.150 26.603 ( 0.694 -8.182 4.037) 9.150 28.613 ( -1.107 -0.802 0.097) 1.370 28.613 ( 1.107 -0.802 -0.097) 1.370 29.496 ( -0.425 3.347 -0.029) 3.374 29.496 ( 0.425 3.347 0.029) 3.374 ======================= Grid point 201 (102/104) ======================= q-point: ( 0.17 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( 3.466 1.255 -10.749) 11.364 1.725 ( 1.349 -8.157 7.434) 11.119 1.883 ( 1.640 -9.769 2.819) 10.299 1.924 ( 2.599 -11.763 5.110) 13.086 2.295 ( -3.724 3.904 4.668) 7.135 2.361 ( -2.788 -2.118 1.672) 3.880 2.710 ( -2.052 2.777 -3.081) 4.628 2.795 ( 2.507 -5.763 -3.898) 7.395 3.081 ( -1.962 3.200 -0.800) 3.838 3.087 ( -2.481 2.737 -0.946) 3.813 3.239 ( -6.013 4.758 -3.139) 8.286 3.369 ( -2.191 -8.217 3.022) 9.025 3.437 ( -1.301 0.955 10.322) 10.447 3.456 ( 2.026 -1.512 1.320) 2.852 3.900 ( -0.305 2.987 4.447) 5.366 3.960 ( 2.222 -3.408 9.045) 9.918 4.371 ( 1.867 2.282 -14.419) 14.717 4.393 ( 2.375 0.487 -17.637) 17.803 4.497 ( -5.286 4.744 9.732) 12.048 4.568 ( 0.564 -1.225 6.795) 6.927 4.726 ( -2.068 6.749 -6.413) 9.537 4.775 ( -2.044 2.788 -1.930) 3.959 4.899 ( -2.882 1.724 -0.750) 3.441 4.964 ( 1.586 -5.485 -2.660) 6.299 5.123 ( -0.406 1.959 -2.368) 3.100 5.149 ( -1.405 -1.216 -2.852) 3.404 5.497 ( 4.383 3.322 4.854) 7.336 5.581 ( 5.325 -3.188 7.063) 9.402 5.809 ( -0.848 1.586 3.044) 3.536 5.876 ( -0.525 -0.917 -2.913) 3.099 5.933 ( -2.245 0.991 -1.912) 3.111 5.962 ( -3.769 -3.814 -2.991) 6.140 6.165 ( 5.719 5.185 1.142) 7.803 6.247 ( 4.097 -2.984 -0.323) 5.079 6.433 ( 3.833 0.847 2.884) 4.871 6.440 ( 2.691 0.054 3.499) 4.414 6.689 ( -5.659 4.164 -5.051) 8.653 6.754 ( -4.167 -2.296 -1.503) 4.989 7.019 ( -0.045 7.192 -4.434) 8.449 7.101 ( 5.611 7.948 -1.133) 9.795 7.110 ( -1.270 -1.801 2.116) 3.055 7.248 ( 4.573 -6.310 -2.789) 8.277 7.513 ( -9.964 -0.872 -2.224) 10.247 7.538 ( -8.664 -2.375 -1.361) 9.086 7.794 ( 4.418 2.739 4.634) 6.964 7.833 ( 1.851 -0.601 1.881) 2.707 7.922 ( 1.937 2.973 2.916) 4.593 8.006 ( 2.512 -3.746 5.632) 7.215 8.985 ( -0.351 1.238 1.390) 1.894 8.995 ( 1.142 0.394 -2.555) 2.826 9.190 ( -1.993 -0.645 -1.099) 2.365 9.217 ( -1.994 -3.326 1.581) 4.188 9.811 ( 0.682 12.018 -1.152) 12.093 9.907 ( 2.671 7.493 1.640) 8.122 10.045 ( 2.036 -11.542 -10.722) 15.884 10.084 ( -3.462 -8.880 7.898) 12.378 10.455 ( -8.851 5.357 -3.437) 10.902 10.577 ( -10.224 -5.629 -1.977) 11.837 10.810 ( 7.717 -2.602 -0.826) 8.186 10.850 ( 7.636 -4.875 -2.802) 9.483 11.499 ( 1.998 7.546 4.498) 9.010 11.581 ( 2.405 3.904 7.620) 8.893 11.722 ( 7.180 -6.202 8.103) 12.477 11.789 ( 10.284 -8.003 4.442) 13.767 12.863 ( -10.178 7.321 -8.479) 15.135 12.981 ( -12.092 -4.463 -7.860) 15.097 13.201 ( -3.051 6.569 0.296) 7.249 13.293 ( -6.830 -3.012 1.906) 7.704 13.737 ( 3.982 4.192 0.916) 5.854 13.837 ( 8.252 -6.244 0.412) 10.356 14.316 ( -11.201 8.816 -9.874) 17.341 14.515 ( -12.966 -11.526 -8.014) 19.110 14.953 ( 10.025 10.724 8.223) 16.827 15.130 ( 8.864 -7.515 5.747) 12.965 15.236 ( 0.180 1.538 4.284) 4.555 15.272 ( 1.979 -2.017 2.839) 4.005 15.737 ( -6.535 1.819 -4.586) 8.188 15.757 ( -5.446 -0.214 -4.343) 6.969 16.088 ( 7.218 2.608 0.188) 7.677 16.133 ( 7.502 -1.915 1.709) 7.928 24.788 ( -1.257 1.641 -0.285) 2.086 24.807 ( -1.200 0.092 0.907) 1.507 24.843 ( 0.483 0.298 0.117) 0.579 24.853 ( 0.801 -0.976 -1.885) 2.269 25.099 ( 1.274 2.633 -0.502) 2.968 25.163 ( 3.055 -4.027 2.019) 5.443 25.265 ( -1.250 2.797 -0.682) 3.138 25.345 ( 2.142 -5.550 -0.172) 5.952 26.464 ( 0.554 3.761 1.428) 4.061 26.492 ( 0.984 6.129 1.882) 6.487 26.556 ( -0.910 -4.135 -2.063) 4.710 26.657 ( 1.446 -9.334 1.564) 9.574 28.563 ( -4.005 0.683 0.433) 4.086 28.596 ( -2.814 -2.704 0.231) 3.909 29.493 ( 0.594 3.864 -1.403) 4.153 29.507 ( 1.157 2.477 -1.660) 3.198 ======================= Grid point 202 (103/104) ======================= q-point: ( 0.33 0.43 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.655 ( 8.135 2.227 -8.377) 11.887 1.786 ( 1.941 -9.437 1.542) 9.758 1.927 ( -2.230 -2.963 10.624) 11.253 1.996 ( 0.746 -10.080 3.951) 10.852 2.292 ( 1.038 3.743 1.385) 4.124 2.359 ( 3.229 -2.510 7.357) 8.417 2.605 ( -6.347 6.085 -8.313) 12.100 2.749 ( -5.661 -7.802 -5.867) 11.285 3.040 ( -2.062 1.673 5.101) 5.751 3.053 ( 0.441 0.597 -1.863) 2.006 3.168 ( -2.136 7.929 3.291) 8.847 3.323 ( -5.519 -8.078 2.698) 10.148 3.463 ( -0.113 3.673 3.063) 4.784 3.484 ( 0.171 1.779 1.052) 2.074 3.953 ( 3.651 3.732 3.911) 6.523 4.056 ( 2.004 -6.234 7.136) 9.685 4.335 ( 4.222 2.344 -14.149) 14.950 4.361 ( 4.293 0.047 -14.515) 15.137 4.404 ( -8.880 6.338 7.424) 13.196 4.529 ( -8.665 -5.473 3.976) 10.993 4.692 ( 2.398 6.905 -7.078) 10.175 4.719 ( -3.391 3.970 1.147) 5.345 4.884 ( 1.975 4.463 1.654) 5.153 4.996 ( 3.145 -5.886 -1.075) 6.760 5.078 ( -3.183 -1.947 -4.948) 6.197 5.103 ( -0.628 -3.130 -2.047) 3.792 5.596 ( 2.301 3.426 5.239) 6.670 5.663 ( -0.649 -1.445 6.068) 6.271 5.823 ( -0.114 -2.015 -5.529) 5.886 5.846 ( 1.238 -3.451 -4.629) 5.905 5.901 ( -0.627 -0.012 3.555) 3.609 5.937 ( -0.706 -0.380 4.559) 4.629 6.264 ( 4.734 3.784 0.248) 6.065 6.316 ( 5.164 -2.289 -3.060) 6.424 6.456 ( -2.725 3.940 -0.291) 4.799 6.497 ( -0.135 -0.390 0.344) 0.538 6.637 ( 2.275 2.461 3.401) 4.776 6.714 ( 0.699 -5.094 4.490) 6.826 6.930 ( -5.190 4.582 -8.760) 11.165 7.008 ( -4.686 -1.853 -8.054) 9.501 7.208 ( 4.066 7.092 -4.158) 9.171 7.341 ( 2.322 1.059 3.455) 4.296 7.362 ( -3.573 -5.042 -1.782) 6.432 7.426 ( -1.289 -4.778 2.253) 5.438 7.873 ( 0.936 1.852 3.304) 3.901 7.898 ( 0.982 0.697 3.466) 3.669 7.983 ( 4.601 5.406 3.962) 8.130 8.076 ( 0.926 -3.775 4.575) 6.003 8.984 ( -0.204 1.465 -0.232) 1.497 8.991 ( -0.311 0.690 -1.111) 1.344 9.149 ( -1.385 -0.444 -1.092) 1.818 9.176 ( -3.271 -3.155 1.593) 4.815 9.849 ( 4.116 8.756 -1.840) 9.849 9.933 ( -0.213 1.755 -0.268) 1.788 10.036 ( 1.828 -4.173 -4.596) 6.471 10.079 ( 1.180 -5.156 0.658) 5.330 10.271 ( -9.260 4.235 -0.718) 10.208 10.374 ( -10.694 -5.215 -0.219) 11.900 10.905 ( 5.408 -1.026 -3.191) 6.362 10.960 ( 3.829 -6.236 -2.048) 7.599 11.597 ( 4.466 4.852 6.202) 9.052 11.665 ( 1.078 -1.011 8.579) 8.705 11.972 ( 12.905 0.560 8.959) 15.720 12.048 ( 12.857 -5.906 6.543) 15.589 12.659 ( -5.736 4.018 -8.065) 10.682 12.729 ( -9.467 -3.123 -6.468) 11.883 13.020 ( -13.095 4.769 -4.243) 14.568 13.086 ( -13.632 -1.911 -3.327) 14.162 13.845 ( 5.647 6.718 1.820) 8.963 13.964 ( 3.302 -4.168 0.037) 5.318 14.141 ( -2.179 2.837 -4.453) 5.712 14.283 ( -7.284 -10.078 -5.707) 13.682 15.139 ( 5.596 7.197 5.419) 10.605 15.229 ( 0.207 -1.671 4.177) 4.504 15.319 ( 4.959 0.674 2.972) 5.820 15.343 ( 2.899 -1.417 5.807) 6.644 15.595 ( -5.136 2.442 -5.924) 8.212 15.629 ( -5.108 -1.109 -5.615) 7.671 16.215 ( 5.999 2.066 -0.116) 6.346 16.252 ( 4.156 -1.702 1.030) 4.608 24.778 ( 0.022 1.797 0.584) 1.890 24.803 ( 0.033 0.087 0.845) 0.850 24.830 ( -1.072 -0.519 -1.238) 1.718 24.846 ( -0.340 -1.228 -1.389) 1.885 25.144 ( 3.289 4.343 -0.014) 5.448 25.238 ( -0.188 0.954 2.365) 2.557 25.241 ( 2.283 -2.068 0.347) 3.100 25.360 ( -0.030 -7.900 -2.077) 8.169 26.504 ( 2.291 1.971 1.751) 3.492 26.520 ( 0.970 2.839 3.046) 4.275 26.545 ( 0.617 1.778 -2.256) 2.938 26.657 ( -2.213 -6.815 0.381) 7.175 28.501 ( -2.530 0.091 0.416) 2.566 28.534 ( -3.518 -3.299 0.127) 4.825 29.499 ( 0.810 3.535 -1.083) 3.785 29.513 ( 0.605 2.135 -1.866) 2.899 ======================= Grid point 203 (104/104) ======================= q-point: (-0.50 0.43 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 4.65e-08 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( 4.436 -2.342 -6.062) 7.868 1.764 ( -4.436 -2.342 6.062) 7.868 1.967 ( -0.227 -7.075 -5.877) 9.200 1.967 ( 0.227 -7.075 5.877) 9.200 2.408 ( -7.204 7.764 -9.938) 14.524 2.408 ( 7.204 7.764 9.938) 14.524 2.546 ( -8.871 -5.790 -8.817) 13.783 2.546 ( 8.871 -5.790 8.817) 13.783 3.059 ( 1.106 1.113 -3.883) 4.188 3.059 ( -1.106 1.113 3.883) 4.188 3.212 ( -4.917 -1.030 -2.334) 5.540 3.212 ( 4.917 -1.030 2.334) 5.540 3.478 ( 1.551 5.770 -4.732) 7.622 3.478 ( -1.551 5.770 4.732) 7.622 4.057 ( -2.576 -0.883 -2.983) 4.039 4.057 ( 2.576 -0.883 2.983) 4.039 4.349 ( 3.689 0.884 -10.902) 11.543 4.349 ( -3.689 0.884 10.902) 11.543 4.383 ( 1.520 -2.214 -3.973) 4.795 4.383 ( -1.520 -2.214 3.973) 4.795 4.689 ( 2.193 5.556 -5.816) 8.337 4.689 ( -2.193 5.556 5.816) 8.337 4.969 ( -1.300 2.312 -8.064) 8.489 4.969 ( 1.300 2.312 8.064) 8.489 5.065 ( 0.533 -6.489 -5.781) 8.707 5.065 ( -0.533 -6.489 5.781) 8.707 5.649 ( -0.660 -0.026 -2.141) 2.241 5.649 ( 0.660 -0.026 2.141) 2.241 5.821 ( 1.430 -0.706 -1.329) 2.075 5.821 ( -1.430 -0.706 1.329) 2.075 5.930 ( 3.041 -1.577 -4.373) 5.555 5.930 ( -3.041 -1.577 4.373) 5.555 6.339 ( -0.567 1.976 -2.855) 3.518 6.339 ( 0.567 1.976 2.855) 3.518 6.444 ( 1.333 -0.222 -2.061) 2.465 6.444 ( -1.333 -0.222 2.061) 2.465 6.761 ( -5.531 3.298 -8.111) 10.357 6.761 ( 5.531 3.298 8.111) 10.357 6.847 ( -6.015 -4.784 -10.161) 12.740 6.847 ( 6.015 -4.784 10.161) 12.740 7.253 ( 3.539 4.699 -3.127) 6.662 7.253 ( -3.539 4.699 3.127) 6.662 7.433 ( 0.379 -4.473 -3.394) 5.628 7.433 ( -0.379 -4.473 3.394) 5.628 7.901 ( 0.869 3.510 -4.364) 5.668 7.901 ( -0.869 3.510 4.364) 5.668 8.075 ( -2.777 -0.720 -0.125) 2.871 8.075 ( 2.777 -0.720 0.125) 2.871 8.980 ( 0.256 1.213 -0.420) 1.309 8.980 ( -0.256 1.213 0.420) 1.309 9.139 ( 1.342 -1.728 -1.426) 2.612 9.139 ( -1.342 -1.728 1.426) 2.612 9.910 ( -2.247 2.067 0.257) 3.064 9.910 ( 2.247 2.067 -0.257) 3.064 10.069 ( 3.766 2.739 -11.201) 12.131 10.069 ( -3.766 2.739 11.201) 12.131 10.217 ( 1.861 -4.808 -7.271) 8.913 10.217 ( -1.861 -4.808 7.271) 8.913 10.964 ( -0.046 -3.047 -0.964) 3.196 10.964 ( 0.046 -3.047 0.964) 3.196 11.688 ( -0.039 0.863 -2.051) 2.226 11.688 ( 0.039 0.863 2.051) 2.226 12.192 ( -2.519 -0.866 -3.099) 4.087 12.192 ( 2.519 -0.866 3.099) 4.087 12.600 ( 2.959 0.363 -1.624) 3.395 12.600 ( -2.959 0.363 1.624) 3.395 12.870 ( -2.214 0.200 -1.882) 2.913 12.870 ( 2.214 0.200 1.882) 2.913 13.938 ( -2.277 4.625 -3.026) 5.978 13.938 ( 2.277 4.625 3.026) 5.978 14.169 ( -2.481 -6.903 -2.973) 7.915 14.169 ( 2.481 -6.903 2.973) 7.915 15.225 ( -1.886 2.667 -0.894) 3.386 15.225 ( 1.886 2.667 0.894) 3.386 15.400 ( 0.727 1.007 -0.449) 1.321 15.400 ( -0.727 1.007 0.449) 1.321 15.527 ( -1.398 -0.208 -1.739) 2.241 15.527 ( 1.398 -0.208 1.739) 2.241 16.282 ( -1.336 0.087 0.437) 1.408 16.282 ( 1.336 0.087 -0.437) 1.408 24.793 ( -0.066 1.721 -2.384) 2.941 24.793 ( 0.066 1.721 2.384) 2.941 24.827 ( 0.228 -1.740 -2.605) 3.141 24.827 ( -0.228 -1.740 2.605) 3.141 25.201 ( -0.181 4.959 -2.520) 5.565 25.201 ( 0.181 4.959 2.520) 5.565 25.318 ( -1.910 -7.481 -3.954) 8.674 25.318 ( 1.910 -7.481 3.954) 8.674 26.534 ( 0.452 2.921 -3.575) 4.638 26.534 ( -0.452 2.921 3.575) 4.638 26.591 ( -2.905 -2.208 -2.479) 4.411 26.591 ( 2.905 -2.208 2.479) 4.411 28.489 ( -0.580 -1.987 -0.571) 2.147 28.489 ( 0.580 -1.987 0.571) 2.147 29.508 ( 0.091 2.673 -1.097) 2.891 29.508 ( -0.091 2.673 1.097) 2.891 =================== 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 3/32256 10.0 371.235 195.740 401.423 0.000 18.891 0.000 3/32256 20.0 137.419 91.828 183.918 0.000 -7.675 0.000 3/32256 30.0 68.109 50.252 93.625 0.000 -5.582 0.000 3/32256 40.0 39.887 30.994 55.059 0.000 -3.449 0.000 3/32256 50.0 26.106 20.991 36.282 0.000 -2.295 0.000 3/32256 60.0 18.600 15.335 26.062 0.000 -1.651 0.000 3/32256 70.0 14.134 11.875 19.952 0.000 -1.262 0.000 3/32256 80.0 11.273 9.609 16.012 0.000 -1.009 0.000 3/32256 90.0 9.328 8.040 13.311 0.000 -0.834 0.000 3/32256 100.0 7.938 6.901 11.367 0.000 -0.708 0.000 3/32256 110.0 6.905 6.044 9.912 0.000 -0.612 0.000 3/32256 120.0 6.111 5.378 8.788 0.000 -0.538 0.000 3/32256 130.0 5.485 4.847 7.895 0.000 -0.479 0.000 3/32256 140.0 4.980 4.415 7.171 0.000 -0.430 0.000 3/32256 150.0 4.563 4.057 6.573 0.000 -0.389 0.000 3/32256 160.0 4.215 3.755 6.070 0.000 -0.355 0.000 3/32256 170.0 3.919 3.498 5.643 0.000 -0.326 0.000 3/32256 180.0 3.665 3.276 5.274 0.000 -0.300 0.000 3/32256 190.0 3.443 3.082 4.953 0.000 -0.278 0.000 3/32256 200.0 3.249 2.911 4.671 0.000 -0.259 0.000 3/32256 210.0 3.078 2.760 4.421 0.000 -0.241 0.000 3/32256 220.0 2.924 2.624 4.199 0.000 -0.226 0.000 3/32256 230.0 2.787 2.503 3.999 0.000 -0.212 0.000 3/32256 240.0 2.663 2.393 3.818 0.000 -0.200 0.000 3/32256 250.0 2.550 2.292 3.654 0.000 -0.189 0.000 3/32256 260.0 2.447 2.201 3.504 0.000 -0.179 0.000 3/32256 270.0 2.352 2.117 3.367 0.000 -0.170 0.000 3/32256 280.0 2.266 2.040 3.241 0.000 -0.161 0.000 3/32256 290.0 2.185 1.968 3.125 0.000 -0.154 0.000 3/32256 300.0 2.111 1.902 3.017 0.000 -0.147 0.000 3/32256 310.0 2.042 1.841 2.916 0.000 -0.140 0.000 3/32256 320.0 1.977 1.783 2.823 0.000 -0.134 0.000 3/32256 330.0 1.917 1.729 2.736 0.000 -0.129 0.000 3/32256 340.0 1.860 1.679 2.654 0.000 -0.124 0.000 3/32256 350.0 1.807 1.631 2.577 0.000 -0.119 0.000 3/32256 360.0 1.757 1.587 2.505 0.000 -0.115 0.000 3/32256 370.0 1.709 1.544 2.436 0.000 -0.111 0.000 3/32256 380.0 1.665 1.504 2.372 0.000 -0.107 0.000 3/32256 390.0 1.622 1.467 2.311 0.000 -0.103 0.000 3/32256 400.0 1.582 1.431 2.253 0.000 -0.100 0.000 3/32256 410.0 1.544 1.397 2.198 0.000 -0.097 0.000 3/32256 420.0 1.508 1.364 2.146 0.000 -0.094 0.000 3/32256 430.0 1.473 1.333 2.096 0.000 -0.091 0.000 3/32256 440.0 1.440 1.304 2.049 0.000 -0.088 0.000 3/32256 450.0 1.409 1.276 2.004 0.000 -0.086 0.000 3/32256 460.0 1.378 1.249 1.960 0.000 -0.083 0.000 3/32256 470.0 1.350 1.223 1.919 0.000 -0.081 0.000 3/32256 480.0 1.322 1.198 1.879 0.000 -0.079 0.000 3/32256 490.0 1.295 1.174 1.841 0.000 -0.077 0.000 3/32256 500.0 1.270 1.152 1.805 0.000 -0.075 0.000 3/32256 510.0 1.246 1.130 1.770 0.000 -0.073 0.000 3/32256 520.0 1.222 1.109 1.736 0.000 -0.071 0.000 3/32256 530.0 1.199 1.088 1.704 0.000 -0.070 0.000 3/32256 540.0 1.178 1.069 1.673 0.000 -0.068 0.000 3/32256 550.0 1.157 1.050 1.643 0.000 -0.067 0.000 3/32256 560.0 1.136 1.032 1.614 0.000 -0.065 0.000 3/32256 570.0 1.117 1.014 1.586 0.000 -0.064 0.000 3/32256 580.0 1.098 0.997 1.559 0.000 -0.062 0.000 3/32256 590.0 1.080 0.981 1.533 0.000 -0.061 0.000 3/32256 600.0 1.062 0.965 1.508 0.000 -0.060 0.000 3/32256 610.0 1.045 0.950 1.483 0.000 -0.059 0.000 3/32256 620.0 1.028 0.935 1.460 0.000 -0.058 0.000 3/32256 630.0 1.012 0.920 1.437 0.000 -0.057 0.000 3/32256 640.0 0.997 0.906 1.415 0.000 -0.056 0.000 3/32256 650.0 0.982 0.893 1.393 0.000 -0.055 0.000 3/32256 660.0 0.967 0.880 1.372 0.000 -0.054 0.000 3/32256 670.0 0.953 0.867 1.352 0.000 -0.053 0.000 3/32256 680.0 0.939 0.855 1.333 0.000 -0.052 0.000 3/32256 690.0 0.926 0.842 1.314 0.000 -0.051 0.000 3/32256 700.0 0.913 0.831 1.295 0.000 -0.050 0.000 3/32256 710.0 0.900 0.819 1.277 0.000 -0.049 0.000 3/32256 720.0 0.888 0.808 1.260 0.000 -0.048 0.000 3/32256 730.0 0.876 0.798 1.243 0.000 -0.048 0.000 3/32256 740.0 0.864 0.787 1.226 0.000 -0.047 0.000 3/32256 750.0 0.853 0.777 1.210 0.000 -0.046 0.000 3/32256 760.0 0.842 0.767 1.194 0.000 -0.046 0.000 3/32256 770.0 0.831 0.757 1.179 0.000 -0.045 0.000 3/32256 780.0 0.821 0.748 1.164 0.000 -0.044 0.000 3/32256 790.0 0.811 0.738 1.149 0.000 -0.044 0.000 3/32256 800.0 0.801 0.729 1.135 0.000 -0.043 0.000 3/32256 810.0 0.791 0.721 1.121 0.000 -0.042 0.000 3/32256 820.0 0.781 0.712 1.108 0.000 -0.042 0.000 3/32256 830.0 0.772 0.704 1.095 0.000 -0.041 0.000 3/32256 840.0 0.763 0.695 1.082 0.000 -0.041 0.000 3/32256 850.0 0.754 0.687 1.069 0.000 -0.040 0.000 3/32256 860.0 0.746 0.680 1.057 0.000 -0.040 0.000 3/32256 870.0 0.737 0.672 1.045 0.000 -0.039 0.000 3/32256 880.0 0.729 0.665 1.033 0.000 -0.039 0.000 3/32256 890.0 0.721 0.657 1.022 0.000 -0.038 0.000 3/32256 900.0 0.713 0.650 1.011 0.000 -0.038 0.000 3/32256 910.0 0.705 0.643 1.000 0.000 -0.037 0.000 3/32256 920.0 0.698 0.636 0.989 0.000 -0.037 0.000 3/32256 930.0 0.690 0.630 0.978 0.000 -0.036 0.000 3/32256 940.0 0.683 0.623 0.968 0.000 -0.036 0.000 3/32256 950.0 0.676 0.617 0.958 0.000 -0.035 0.000 3/32256 960.0 0.669 0.610 0.948 0.000 -0.035 0.000 3/32256 970.0 0.662 0.604 0.938 0.000 -0.035 0.000 3/32256 980.0 0.655 0.598 0.929 0.000 -0.034 0.000 3/32256 990.0 0.649 0.592 0.920 0.000 -0.034 0.000 3/32256 1000.0 0.642 0.586 0.911 0.000 -0.034 0.000 3/32256 Thermal conductivity related properties were written into "kappa-m678.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:55:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|