----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 04:17:04]------------------------- 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 3 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 12 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.227931322172319 0.000000000000000 0.000000000000000 b 0.000000000000000 3.112914360000000 0.000000000000000 c -3.075536461147406 0.000000000000000 11.959467966587422 Atomic positions (fractional): *1 B 0.83024071720967 0.15509708058023 0.56035489869987 10.811 2 B 0.16975928279033 0.65509708058023 0.93964510130013 10.811 3 B 0.16975928279033 0.84490291941977 0.43964510130013 10.811 4 B 0.83024071720967 0.34490291941977 0.06035489869988 10.811 *5 B 0.64356127809413 0.72638938670831 0.15928673417029 10.811 6 B 0.35643872190587 0.22638938670831 0.34071326582971 10.811 7 B 0.35643872190587 0.27361061329169 0.84071326582971 10.811 8 B 0.64356127809413 0.77361061329169 0.65928673417029 10.811 *9 O 0.50443723344307 0.19668286863416 0.86225292962854 15.999 10 O 0.49556276655693 0.69668286863416 0.63774707037146 15.999 11 O 0.49556276655693 0.80331713136584 0.13774707037146 15.999 12 O 0.50443723344307 0.30331713136584 0.36225292962854 15.999 *13 O 0.74242364680302 0.72299889969012 0.76184325576079 15.999 14 O 0.25757635319698 0.22299889969012 0.73815674423921 15.999 15 O 0.25757635319698 0.27700110030988 0.23815674423921 15.999 16 O 0.74242364680302 0.77700110030988 0.26184325576079 15.999 *17 O 0.81907929798500 0.21927776010704 0.95306990280390 15.999 18 O 0.18092070201500 0.71927776010704 0.54693009719610 15.999 19 O 0.18092070201500 0.78072223989296 0.04693009719610 15.999 20 O 0.81907929798500 0.28072223989296 0.45306990280390 15.999 *21 O 0.05376738905637 0.71439998041521 0.84765865620295 15.999 22 O 0.94623261094363 0.21439998041520 0.65234134379705 15.999 23 O 0.94623261094363 0.28560001958479 0.15234134379705 15.999 24 O 0.05376738905637 0.78560001958479 0.34765865620295 15.999 *25 O 0.69942884649698 0.57371888230807 0.06913236282457 15.999 26 O 0.30057115350302 0.07371888230807 0.43086763717543 15.999 27 O 0.30057115350302 0.42628111769193 0.93086763717543 15.999 28 O 0.69942884649698 0.92628111769193 0.56913236282457 15.999 *29 Mg 0.35504973515111 0.20594025814315 0.60535742946470 24.305 30 Mg 0.64495026484889 0.70594025814315 0.89464257053530 24.305 31 Mg 0.64495026484889 0.79405974185685 0.39464257053530 24.305 32 Mg 0.35504973515111 0.29405974185685 0.10535742946470 24.305 *33 Mg 0.89778616767984 0.28632296284151 0.31380396782609 24.305 34 Mg 0.10221383232016 0.78632296284151 0.18619603217391 24.305 35 Mg 0.10221383232016 0.71367703715849 0.68619603217391 24.305 36 Mg 0.89778616767984 0.21367703715849 0.81380396782609 24.305 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.227931322172319 0.000000000000000 0.000000000000000 b 0.000000000000000 3.112914360000000 0.000000000000000 c -3.075536461147406 0.000000000000000 11.959467966587422 Atomic positions (fractional): *1 B 0.83024071720967 0.15509708058023 0.56035489869987 10.811 > 1 2 B 0.16975928279033 0.65509708058023 0.93964510130013 10.811 > 2 3 B 0.16975928279033 0.84490291941977 0.43964510130013 10.811 > 3 4 B 0.83024071720967 0.34490291941977 0.06035489869988 10.811 > 4 *5 B 0.64356127809413 0.72638938670831 0.15928673417029 10.811 > 5 6 B 0.35643872190587 0.22638938670831 0.34071326582971 10.811 > 6 7 B 0.35643872190587 0.27361061329169 0.84071326582971 10.811 > 7 8 B 0.64356127809413 0.77361061329169 0.65928673417029 10.811 > 8 *9 O 0.50443723344307 0.19668286863416 0.86225292962854 15.999 > 9 10 O 0.49556276655693 0.69668286863416 0.63774707037146 15.999 > 10 11 O 0.49556276655693 0.80331713136584 0.13774707037146 15.999 > 11 12 O 0.50443723344307 0.30331713136584 0.36225292962854 15.999 > 12 *13 O 0.74242364680302 0.72299889969012 0.76184325576079 15.999 > 13 14 O 0.25757635319698 0.22299889969012 0.73815674423921 15.999 > 14 15 O 0.25757635319698 0.27700110030988 0.23815674423921 15.999 > 15 16 O 0.74242364680302 0.77700110030988 0.26184325576079 15.999 > 16 *17 O 0.81907929798500 0.21927776010704 0.95306990280390 15.999 > 17 18 O 0.18092070201500 0.71927776010704 0.54693009719610 15.999 > 18 19 O 0.18092070201500 0.78072223989296 0.04693009719610 15.999 > 19 20 O 0.81907929798500 0.28072223989296 0.45306990280390 15.999 > 20 *21 O 0.05376738905637 0.71439998041521 0.84765865620295 15.999 > 21 22 O 0.94623261094363 0.21439998041520 0.65234134379705 15.999 > 22 23 O 0.94623261094363 0.28560001958479 0.15234134379705 15.999 > 23 24 O 0.05376738905637 0.78560001958479 0.34765865620295 15.999 > 24 *25 O 0.69942884649698 0.57371888230807 0.06913236282457 15.999 > 25 26 O 0.30057115350302 0.07371888230807 0.43086763717543 15.999 > 26 27 O 0.30057115350302 0.42628111769193 0.93086763717543 15.999 > 27 28 O 0.69942884649698 0.92628111769193 0.56913236282457 15.999 > 28 *29 Mg 0.35504973515111 0.20594025814315 0.60535742946470 24.305 > 29 30 Mg 0.64495026484889 0.70594025814315 0.89464257053530 24.305 > 30 31 Mg 0.64495026484889 0.79405974185685 0.39464257053530 24.305 > 31 32 Mg 0.35504973515111 0.29405974185685 0.10535742946470 24.305 > 32 *33 Mg 0.89778616767984 0.28632296284151 0.31380396782609 24.305 > 33 34 Mg 0.10221383232016 0.78632296284151 0.18619603217391 24.305 > 34 35 Mg 0.10221383232016 0.71367703715849 0.68619603217391 24.305 > 35 36 Mg 0.89778616767984 0.21367703715849 0.81380396782609 24.305 > 36 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.227931322172319 0.000000000000000 0.000000000000000 b 0.000000000000000 9.338743080000000 0.000000000000000 c -3.075536461147406 0.000000000000000 11.959467966587422 Atomic positions (fractional): *1 B 0.83024071720967 0.05169902686008 0.56035489869987 10.811 > 1 2 B 0.83024071720967 0.38503236019341 0.56035489869987 10.811 > 1 3 B 0.83024071720967 0.71836569352674 0.56035489869987 10.811 > 1 4 B 0.16975928279033 0.21836569352674 0.93964510130013 10.811 > 2 5 B 0.16975928279033 0.55169902686008 0.93964510130013 10.811 > 2 6 B 0.16975928279033 0.88503236019341 0.93964510130013 10.811 > 2 7 B 0.16975928279033 0.28163430647326 0.43964510130013 10.811 > 3 8 B 0.16975928279033 0.61496763980659 0.43964510130013 10.811 > 3 9 B 0.16975928279033 0.94830097313992 0.43964510130013 10.811 > 3 10 B 0.83024071720967 0.11496763980659 0.06035489869988 10.811 > 4 11 B 0.83024071720967 0.44830097313992 0.06035489869988 10.811 > 4 12 B 0.83024071720967 0.78163430647326 0.06035489869988 10.811 > 4 *13 B 0.64356127809413 0.24212979556944 0.15928673417029 10.811 > 5 14 B 0.64356127809413 0.57546312890277 0.15928673417029 10.811 > 5 15 B 0.64356127809413 0.90879646223610 0.15928673417029 10.811 > 5 16 B 0.35643872190587 0.07546312890277 0.34071326582971 10.811 > 6 17 B 0.35643872190587 0.40879646223610 0.34071326582971 10.811 > 6 18 B 0.35643872190587 0.74212979556944 0.34071326582971 10.811 > 6 19 B 0.35643872190587 0.09120353776390 0.84071326582971 10.811 > 7 20 B 0.35643872190587 0.42453687109723 0.84071326582971 10.811 > 7 21 B 0.35643872190587 0.75787020443056 0.84071326582971 10.811 > 7 22 B 0.64356127809413 0.25787020443056 0.65928673417029 10.811 > 8 23 B 0.64356127809413 0.59120353776390 0.65928673417029 10.811 > 8 24 B 0.64356127809413 0.92453687109723 0.65928673417029 10.811 > 8 *25 O 0.50443723344307 0.06556095621139 0.86225292962854 15.999 > 9 26 O 0.50443723344307 0.39889428954472 0.86225292962854 15.999 > 9 27 O 0.50443723344307 0.73222762287805 0.86225292962854 15.999 > 9 28 O 0.49556276655693 0.23222762287805 0.63774707037146 15.999 > 10 29 O 0.49556276655693 0.56556095621139 0.63774707037146 15.999 > 10 30 O 0.49556276655693 0.89889428954472 0.63774707037146 15.999 > 10 31 O 0.49556276655693 0.26777237712195 0.13774707037146 15.999 > 11 32 O 0.49556276655693 0.60110571045528 0.13774707037146 15.999 > 11 33 O 0.49556276655693 0.93443904378861 0.13774707037146 15.999 > 11 34 O 0.50443723344307 0.10110571045528 0.36225292962854 15.999 > 12 35 O 0.50443723344307 0.43443904378861 0.36225292962854 15.999 > 12 36 O 0.50443723344307 0.76777237712195 0.36225292962854 15.999 > 12 *37 O 0.74242364680302 0.24099963323004 0.76184325576079 15.999 > 13 38 O 0.74242364680302 0.57433296656337 0.76184325576079 15.999 > 13 39 O 0.74242364680302 0.90766629989671 0.76184325576079 15.999 > 13 40 O 0.25757635319698 0.07433296656337 0.73815674423921 15.999 > 14 41 O 0.25757635319698 0.40766629989671 0.73815674423921 15.999 > 14 42 O 0.25757635319698 0.74099963323004 0.73815674423921 15.999 > 14 43 O 0.25757635319698 0.09233370010329 0.23815674423921 15.999 > 15 44 O 0.25757635319698 0.42566703343663 0.23815674423921 15.999 > 15 45 O 0.25757635319698 0.75900036676996 0.23815674423921 15.999 > 15 46 O 0.74242364680302 0.25900036676996 0.26184325576079 15.999 > 16 47 O 0.74242364680302 0.59233370010329 0.26184325576079 15.999 > 16 48 O 0.74242364680302 0.92566703343663 0.26184325576079 15.999 > 16 *49 O 0.81907929798500 0.07309258670235 0.95306990280390 15.999 > 17 50 O 0.81907929798500 0.40642592003568 0.95306990280390 15.999 > 17 51 O 0.81907929798500 0.73975925336901 0.95306990280390 15.999 > 17 52 O 0.18092070201500 0.23975925336901 0.54693009719610 15.999 > 18 53 O 0.18092070201500 0.57309258670235 0.54693009719610 15.999 > 18 54 O 0.18092070201500 0.90642592003568 0.54693009719610 15.999 > 18 55 O 0.18092070201500 0.26024074663099 0.04693009719610 15.999 > 19 56 O 0.18092070201500 0.59357407996432 0.04693009719610 15.999 > 19 57 O 0.18092070201500 0.92690741329765 0.04693009719610 15.999 > 19 58 O 0.81907929798500 0.09357407996432 0.45306990280390 15.999 > 20 59 O 0.81907929798500 0.42690741329765 0.45306990280390 15.999 > 20 60 O 0.81907929798500 0.76024074663099 0.45306990280390 15.999 > 20 *61 O 0.05376738905637 0.23813332680507 0.84765865620295 15.999 > 21 62 O 0.05376738905637 0.57146666013840 0.84765865620295 15.999 > 21 63 O 0.05376738905637 0.90479999347174 0.84765865620295 15.999 > 21 64 O 0.94623261094363 0.07146666013840 0.65234134379705 15.999 > 22 65 O 0.94623261094363 0.40479999347174 0.65234134379705 15.999 > 22 66 O 0.94623261094363 0.73813332680507 0.65234134379705 15.999 > 22 67 O 0.94623261094363 0.09520000652826 0.15234134379705 15.999 > 23 68 O 0.94623261094363 0.42853333986160 0.15234134379705 15.999 > 23 69 O 0.94623261094363 0.76186667319493 0.15234134379705 15.999 > 23 70 O 0.05376738905637 0.26186667319493 0.34765865620295 15.999 > 24 71 O 0.05376738905637 0.59520000652826 0.34765865620295 15.999 > 24 72 O 0.05376738905637 0.92853333986160 0.34765865620295 15.999 > 24 *73 O 0.69942884649698 0.19123962743602 0.06913236282457 15.999 > 25 74 O 0.69942884649698 0.52457296076936 0.06913236282457 15.999 > 25 75 O 0.69942884649698 0.85790629410269 0.06913236282457 15.999 > 25 76 O 0.30057115350302 0.02457296076936 0.43086763717543 15.999 > 26 77 O 0.30057115350302 0.35790629410269 0.43086763717543 15.999 > 26 78 O 0.30057115350302 0.69123962743602 0.43086763717543 15.999 > 26 79 O 0.30057115350302 0.14209370589731 0.93086763717543 15.999 > 27 80 O 0.30057115350302 0.47542703923064 0.93086763717543 15.999 > 27 81 O 0.30057115350302 0.80876037256398 0.93086763717543 15.999 > 27 82 O 0.69942884649698 0.30876037256398 0.56913236282457 15.999 > 28 83 O 0.69942884649698 0.64209370589731 0.56913236282457 15.999 > 28 84 O 0.69942884649698 0.97542703923064 0.56913236282457 15.999 > 28 *85 Mg 0.35504973515111 0.06864675271438 0.60535742946470 24.305 > 29 86 Mg 0.35504973515111 0.40198008604772 0.60535742946470 24.305 > 29 87 Mg 0.35504973515111 0.73531341938105 0.60535742946470 24.305 > 29 88 Mg 0.64495026484889 0.23531341938105 0.89464257053530 24.305 > 30 89 Mg 0.64495026484889 0.56864675271438 0.89464257053530 24.305 > 30 90 Mg 0.64495026484889 0.90198008604772 0.89464257053530 24.305 > 30 91 Mg 0.64495026484889 0.26468658061895 0.39464257053530 24.305 > 31 92 Mg 0.64495026484889 0.59801991395228 0.39464257053530 24.305 > 31 93 Mg 0.64495026484889 0.93135324728562 0.39464257053530 24.305 > 31 94 Mg 0.35504973515111 0.09801991395228 0.10535742946470 24.305 > 32 95 Mg 0.35504973515111 0.43135324728562 0.10535742946470 24.305 > 32 96 Mg 0.35504973515111 0.76468658061895 0.10535742946470 24.305 > 32 *97 Mg 0.89778616767984 0.09544098761384 0.31380396782609 24.305 > 33 98 Mg 0.89778616767984 0.42877432094717 0.31380396782609 24.305 > 33 99 Mg 0.89778616767984 0.76210765428050 0.31380396782609 24.305 > 33 100 Mg 0.10221383232016 0.26210765428050 0.18619603217391 24.305 > 34 101 Mg 0.10221383232016 0.59544098761384 0.18619603217391 24.305 > 34 102 Mg 0.10221383232016 0.92877432094717 0.18619603217391 24.305 > 34 103 Mg 0.10221383232016 0.23789234571950 0.68619603217391 24.305 > 35 104 Mg 0.10221383232016 0.57122567905283 0.68619603217391 24.305 > 35 105 Mg 0.10221383232016 0.90455901238616 0.68619603217391 24.305 > 35 106 Mg 0.89778616767984 0.07122567905283 0.81380396782609 24.305 > 36 107 Mg 0.89778616767984 0.40455901238616 0.81380396782609 24.305 > 36 108 Mg 0.89778616767984 0.73789234571950 0.81380396782609 24.305 > 36 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.8952310 0.0000000 0.0255704 0.0000000 2.7217269 0.0000000 0.0255702 0.0000000 2.9452669 -------------------------- Born effective charges -------------------------- 1 B 2.1708616 0.6138211 0.3165858 0.6511836 1.5075387 -0.2058709 0.0195536 -0.3402122 2.6614517 2 B 2.1708616 -0.6138211 0.3165858 -0.6511836 1.5075387 0.2058709 0.0195536 0.3402122 2.6614517 3 B 2.1708616 0.6138211 0.3165858 0.6511836 1.5075387 -0.2058709 0.0195536 -0.3402122 2.6614517 4 B 2.1708616 -0.6138211 0.3165858 -0.6511836 1.5075387 0.2058709 0.0195536 0.3402122 2.6614517 5 B 2.6721265 -0.4249708 -0.0817880 -0.3740039 1.1428637 0.3981614 0.1872693 0.3564693 2.4200206 6 B 2.6721265 0.4249708 -0.0817880 0.3740039 1.1428637 -0.3981614 0.1872693 -0.3564693 2.4200206 7 B 2.6721265 -0.4249708 -0.0817880 -0.3740039 1.1428637 0.3981614 0.1872693 0.3564693 2.4200206 8 B 2.6721265 0.4249708 -0.0817880 0.3740039 1.1428637 -0.3981614 0.1872693 -0.3564693 2.4200206 9 O -2.3439809 0.1902202 -0.2633431 0.2015569 -1.3776781 0.0175920 -0.3140927 -0.0150031 -1.2623669 10 O -2.3439809 -0.1902202 -0.2633431 -0.2015569 -1.3776781 -0.0175920 -0.3140927 0.0150031 -1.2623669 11 O -2.3439809 0.1902202 -0.2633431 0.2015569 -1.3776781 0.0175920 -0.3140927 -0.0150031 -1.2623669 12 O -2.3439809 -0.1902202 -0.2633431 -0.2015569 -1.3776781 -0.0175920 -0.3140927 0.0150031 -1.2623669 13 O -1.5771093 0.0160632 -0.2502323 0.0454399 -1.3181695 0.1415726 -0.3828001 0.1492015 -2.1994684 14 O -1.5771093 -0.0160632 -0.2502323 -0.0454399 -1.3181695 -0.1415726 -0.3828001 -0.1492015 -2.1994684 15 O -1.5771093 0.0160632 -0.2502323 0.0454399 -1.3181695 0.1415726 -0.3828001 0.1492015 -2.1994684 16 O -1.5771093 -0.0160632 -0.2502323 -0.0454399 -1.3181695 -0.1415726 -0.3828001 -0.1492015 -2.1994684 17 O -1.3915974 0.0821257 0.1888580 0.0749129 -1.4229491 -0.2249624 0.1717024 -0.3051117 -2.3761243 18 O -1.3915974 -0.0821257 0.1888580 -0.0749129 -1.4229491 0.2249624 0.1717024 0.3051117 -2.3761243 19 O -1.3915974 0.0821257 0.1888580 0.0749129 -1.4229491 -0.2249624 0.1717024 -0.3051117 -2.3761243 20 O -1.3915974 -0.0821257 0.1888580 -0.0749129 -1.4229491 0.2249624 0.1717024 0.3051117 -2.3761243 21 O -1.8058858 0.1151712 -0.5716516 0.1415080 -1.3408189 0.0974778 -0.4702233 0.0413441 -1.9715228 22 O -1.8058858 -0.1151712 -0.5716516 -0.1415080 -1.3408189 -0.0974778 -0.4702233 -0.0413441 -1.9715228 23 O -1.8058858 0.1151712 -0.5716516 0.1415080 -1.3408189 0.0974778 -0.4702233 0.0413441 -1.9715228 24 O -1.8058858 -0.1151712 -0.5716516 -0.1415080 -1.3408189 -0.0974778 -0.4702233 -0.0413441 -1.9715228 25 O -1.9968338 0.6361675 0.5186820 0.6292522 -1.3424555 -0.2856114 0.5603343 -0.3179949 -1.7153073 26 O -1.9968338 -0.6361675 0.5186820 -0.6292522 -1.3424555 0.2856114 0.5603343 0.3179949 -1.7153073 27 O -1.9968338 0.6361675 0.5186820 0.6292522 -1.3424555 -0.2856114 0.5603343 -0.3179949 -1.7153073 28 O -1.9968338 -0.6361675 0.5186820 -0.6292522 -1.3424555 0.2856114 0.5603343 0.3179949 -1.7153073 29 Mg 2.0407354 -0.0133177 0.1068401 -0.0227611 2.0833967 0.0727589 0.1804853 0.0330696 2.2163916 30 Mg 2.0407354 0.0133177 0.1068401 0.0227611 2.0833967 -0.0727589 0.1804853 -0.0330696 2.2163916 31 Mg 2.0407354 -0.0133177 0.1068401 -0.0227611 2.0833967 0.0727589 0.1804853 0.0330696 2.2163916 32 Mg 2.0407354 0.0133177 0.1068401 0.0227611 2.0833967 -0.0727589 0.1804853 -0.0330696 2.2163916 33 Mg 2.2316836 0.0041329 0.0360489 0.0820807 2.0682722 -0.0355727 0.0477711 -0.0089996 2.2269258 34 Mg 2.2316836 -0.0041329 0.0360489 -0.0820807 2.0682722 0.0355727 0.0477711 0.0089996 2.2269258 35 Mg 2.2316836 0.0041329 0.0360489 0.0820807 2.0682722 -0.0355727 0.0477711 -0.0089996 2.2269258 36 Mg 2.2316836 -0.0041329 0.0360489 -0.0820807 2.0682722 0.0355727 0.0477711 0.0089996 2.2269258 ---------------------------------------------------------------------------- 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: 324/324 Permutation basis: 17766/17766 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4482 Number of blocks in projector: 4482 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: 972 Use submatrix version of eigh solver. (1) Block: 500 / 972 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 234 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 972 / 972 (1) 454 eigenvectors found. (1) Complementary block size: 36 (1) Compute compressed projector. (1) Use standard solver. (1) 18 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 972 Use submatrix version of eigh solver. (1) Block: 500 / 972 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 234 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 972 / 972 (1) 454 eigenvectors found. (1) Complementary block size: 36 (1) Compute compressed projector. (1) Use standard solver. (1) 18 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 972 Use submatrix version of eigh solver. (1) Block: 500 / 972 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 32 (2) Compute compressed projector. (2) Use standard solver. (2) 15 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 972 / 972 (1) 459 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 522 Use submatrix version of eigh solver. (1) Block: 522 / 522 (2) Block: 250 / 522 (2) 241 eigenvectors found. (2) Block: 522 / 522 (2) 263 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 522 Use submatrix version of eigh solver. (1) Block: 522 / 522 (2) Block: 250 / 522 (2) 241 eigenvectors found. (2) Block: 522 / 522 (2) 263 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 522 Use submatrix version of eigh solver. (1) Block: 522 / 522 (2) Block: 250 / 522 (2) 241 eigenvectors found. (2) Block: 522 / 522 (2) 263 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4482, 4402), data: False |-- (522, 513), data: False |-- (522, 513), data: False |-- (522, 9), data: (522, 18) @ (18, 9) |-- (272, 263), data: True |-- (250, 241), data: True |-- (522, 513), data: False |-- (522, 513), data: False |-- (522, 9), data: (522, 18) @ (18, 9) |-- (272, 263), data: True |-- (250, 241), data: True |-- (522, 513), data: False |-- (522, 513), data: False |-- (522, 9), data: (522, 18) @ (18, 9) |-- (272, 263), data: True |-- (250, 241), data: True |-- (972, 955), data: False |-- (972, 13), data: (972, 30) @ (30, 13) |-- (472, 459), data: True |-- (500, 483), data: False |-- (500, 15), data: (500, 32) @ (32, 15) |-- (250, 235), data: True |-- (250, 233), data: True |-- (972, 954), data: False |-- (972, 18), data: (972, 36) @ (36, 18) |-- (472, 454), data: True |-- (500, 482), data: False |-- (500, 16), data: (500, 34) @ (34, 16) |-- (250, 234), data: True |-- (250, 232), data: True |-- (972, 954), data: False |-- (972, 18), data: (972, 36) @ (36, 18) |-- (472, 454), data: True |-- (500, 482), data: False |-- (500, 16), data: (500, 34) @ (34, 16) |-- (250, 234), data: True |-- (250, 232), data: True ----- Solver_atoms: 1 -- 108 / 108 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 1120 - Time: 1.266 Solver_block: 200 / 1120 - Time: 1.015 Solver_block: 300 / 1120 - Time: 1.024 Solver_block: 400 / 1120 - Time: 1.023 Solver_block: 500 / 1120 - Time: 1.022 Solver_block: 600 / 1120 - Time: 1.024 Solver_block: 700 / 1120 - Time: 1.023 Solver_block: 800 / 1120 - Time: 1.021 Solver_block: 900 / 1120 - Time: 1.018 Solver_block: 1000 / 1120 - Time: 0.993 Solver_block: 1100 / 1120 - Time: 1.024 Solver_block: 1120 / 1120 - Time: 0.316 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 12.062 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 324/324 Permutation basis: 17766/17766 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4482 Number of blocks in projector: 4482 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: 972 Use submatrix version of eigh solver. (1) Block: 500 / 972 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 234 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 972 / 972 (1) 454 eigenvectors found. (1) Complementary block size: 36 (1) Compute compressed projector. (1) Use standard solver. (1) 18 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 972 Use submatrix version of eigh solver. (1) Block: 500 / 972 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 234 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 972 / 972 (1) 454 eigenvectors found. (1) Complementary block size: 36 (1) Compute compressed projector. (1) Use standard solver. (1) 18 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 972 Use submatrix version of eigh solver. (1) Block: 500 / 972 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 32 (2) Compute compressed projector. (2) Use standard solver. (2) 15 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 972 / 972 (1) 459 eigenvectors found. (1) Complementary block size: 30 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 522 Use submatrix version of eigh solver. (1) Block: 522 / 522 (2) Block: 250 / 522 (2) 241 eigenvectors found. (2) Block: 522 / 522 (2) 263 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 522 Use submatrix version of eigh solver. (1) Block: 522 / 522 (2) Block: 250 / 522 (2) 241 eigenvectors found. (2) Block: 522 / 522 (2) 263 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 522 Use submatrix version of eigh solver. (1) Block: 522 / 522 (2) Block: 250 / 522 (2) 241 eigenvectors found. (2) Block: 522 / 522 (2) 263 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 8 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4482, 4402), data: False |-- (522, 513), data: False |-- (522, 513), data: False |-- (522, 9), data: (522, 18) @ (18, 9) |-- (272, 263), data: True |-- (250, 241), data: True |-- (522, 513), data: False |-- (522, 513), data: False |-- (522, 9), data: (522, 18) @ (18, 9) |-- (272, 263), data: True |-- (250, 241), data: True |-- (522, 513), data: False |-- (522, 513), data: False |-- (522, 9), data: (522, 18) @ (18, 9) |-- (272, 263), data: True |-- (250, 241), data: True |-- (972, 955), data: False |-- (972, 13), data: (972, 30) @ (30, 13) |-- (472, 459), data: True |-- (500, 483), data: False |-- (500, 15), data: (500, 32) @ (32, 15) |-- (250, 235), data: True |-- (250, 233), data: True |-- (972, 954), data: False |-- (972, 18), data: (972, 36) @ (36, 18) |-- (472, 454), data: True |-- (500, 482), data: False |-- (500, 16), data: (500, 34) @ (34, 16) |-- (250, 234), data: True |-- (250, 232), data: True |-- (972, 954), data: False |-- (972, 18), data: (972, 36) @ (36, 18) |-- (472, 454), data: True |-- (500, 482), data: False |-- (500, 16), data: (500, 34) @ (34, 16) |-- (250, 234), data: True |-- (250, 232), 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 2026-01-08 04:18:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 04:18:02]------------------------- 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 3 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.227931322172319 0.000000000000000 0.000000000000000 b 0.000000000000000 3.112914360000000 0.000000000000000 c -3.075536461147406 0.000000000000000 11.959467966587422 Atomic positions (fractional): 1 B 0.83024071720967 0.15509708058023 0.56035489869987 10.811 2 B 0.16975928279033 0.65509708058023 0.93964510130013 10.811 3 B 0.16975928279033 0.84490291941977 0.43964510130013 10.811 4 B 0.83024071720967 0.34490291941977 0.06035489869988 10.811 5 B 0.64356127809413 0.72638938670831 0.15928673417029 10.811 6 B 0.35643872190587 0.22638938670831 0.34071326582971 10.811 7 B 0.35643872190587 0.27361061329169 0.84071326582971 10.811 8 B 0.64356127809413 0.77361061329169 0.65928673417029 10.811 9 O 0.50443723344307 0.19668286863416 0.86225292962854 15.999 10 O 0.49556276655693 0.69668286863416 0.63774707037146 15.999 11 O 0.49556276655693 0.80331713136584 0.13774707037146 15.999 12 O 0.50443723344307 0.30331713136584 0.36225292962854 15.999 13 O 0.74242364680302 0.72299889969012 0.76184325576079 15.999 14 O 0.25757635319698 0.22299889969012 0.73815674423921 15.999 15 O 0.25757635319698 0.27700110030988 0.23815674423921 15.999 16 O 0.74242364680302 0.77700110030988 0.26184325576079 15.999 17 O 0.81907929798500 0.21927776010704 0.95306990280390 15.999 18 O 0.18092070201500 0.71927776010704 0.54693009719610 15.999 19 O 0.18092070201500 0.78072223989296 0.04693009719610 15.999 20 O 0.81907929798500 0.28072223989296 0.45306990280390 15.999 21 O 0.05376738905637 0.71439998041521 0.84765865620295 15.999 22 O 0.94623261094363 0.21439998041520 0.65234134379705 15.999 23 O 0.94623261094363 0.28560001958479 0.15234134379705 15.999 24 O 0.05376738905637 0.78560001958479 0.34765865620295 15.999 25 O 0.69942884649698 0.57371888230807 0.06913236282457 15.999 26 O 0.30057115350302 0.07371888230807 0.43086763717543 15.999 27 O 0.30057115350302 0.42628111769193 0.93086763717543 15.999 28 O 0.69942884649698 0.92628111769193 0.56913236282457 15.999 29 Mg 0.35504973515111 0.20594025814315 0.60535742946470 24.305 30 Mg 0.64495026484889 0.70594025814315 0.89464257053530 24.305 31 Mg 0.64495026484889 0.79405974185685 0.39464257053530 24.305 32 Mg 0.35504973515111 0.29405974185685 0.10535742946470 24.305 33 Mg 0.89778616767984 0.28632296284151 0.31380396782609 24.305 34 Mg 0.10221383232016 0.78632296284151 0.18619603217391 24.305 35 Mg 0.10221383232016 0.71367703715849 0.68619603217391 24.305 36 Mg 0.89778616767984 0.21367703715849 0.81380396782609 24.305 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.227931322172319 0.000000000000000 0.000000000000000 b 0.000000000000000 9.338743080000000 0.000000000000000 c -3.075536461147406 0.000000000000000 11.959467966587422 Atomic positions (fractional): 1 B 0.83024071720967 0.05169902686008 0.56035489869987 10.811 > 1 2 B 0.83024071720967 0.38503236019341 0.56035489869987 10.811 > 1 3 B 0.83024071720967 0.71836569352674 0.56035489869987 10.811 > 1 4 B 0.16975928279033 0.21836569352674 0.93964510130013 10.811 > 4 5 B 0.16975928279033 0.55169902686008 0.93964510130013 10.811 > 4 6 B 0.16975928279033 0.88503236019341 0.93964510130013 10.811 > 4 7 B 0.16975928279033 0.28163430647326 0.43964510130013 10.811 > 7 8 B 0.16975928279033 0.61496763980659 0.43964510130013 10.811 > 7 9 B 0.16975928279033 0.94830097313992 0.43964510130013 10.811 > 7 10 B 0.83024071720967 0.11496763980659 0.06035489869988 10.811 > 10 11 B 0.83024071720967 0.44830097313992 0.06035489869988 10.811 > 10 12 B 0.83024071720967 0.78163430647326 0.06035489869988 10.811 > 10 13 B 0.64356127809413 0.24212979556944 0.15928673417029 10.811 > 13 14 B 0.64356127809413 0.57546312890277 0.15928673417029 10.811 > 13 15 B 0.64356127809413 0.90879646223610 0.15928673417029 10.811 > 13 16 B 0.35643872190587 0.07546312890277 0.34071326582971 10.811 > 16 17 B 0.35643872190587 0.40879646223610 0.34071326582971 10.811 > 16 18 B 0.35643872190587 0.74212979556944 0.34071326582971 10.811 > 16 19 B 0.35643872190587 0.09120353776390 0.84071326582971 10.811 > 19 20 B 0.35643872190587 0.42453687109723 0.84071326582971 10.811 > 19 21 B 0.35643872190587 0.75787020443056 0.84071326582971 10.811 > 19 22 B 0.64356127809413 0.25787020443056 0.65928673417029 10.811 > 22 23 B 0.64356127809413 0.59120353776390 0.65928673417029 10.811 > 22 24 B 0.64356127809413 0.92453687109723 0.65928673417029 10.811 > 22 25 O 0.50443723344307 0.06556095621139 0.86225292962854 15.999 > 25 26 O 0.50443723344307 0.39889428954472 0.86225292962854 15.999 > 25 27 O 0.50443723344307 0.73222762287805 0.86225292962854 15.999 > 25 28 O 0.49556276655693 0.23222762287805 0.63774707037146 15.999 > 28 29 O 0.49556276655693 0.56556095621139 0.63774707037146 15.999 > 28 30 O 0.49556276655693 0.89889428954472 0.63774707037146 15.999 > 28 31 O 0.49556276655693 0.26777237712195 0.13774707037146 15.999 > 31 32 O 0.49556276655693 0.60110571045528 0.13774707037146 15.999 > 31 33 O 0.49556276655693 0.93443904378861 0.13774707037146 15.999 > 31 34 O 0.50443723344307 0.10110571045528 0.36225292962854 15.999 > 34 35 O 0.50443723344307 0.43443904378861 0.36225292962854 15.999 > 34 36 O 0.50443723344307 0.76777237712195 0.36225292962854 15.999 > 34 37 O 0.74242364680302 0.24099963323004 0.76184325576079 15.999 > 37 38 O 0.74242364680302 0.57433296656337 0.76184325576079 15.999 > 37 39 O 0.74242364680302 0.90766629989671 0.76184325576079 15.999 > 37 40 O 0.25757635319698 0.07433296656337 0.73815674423921 15.999 > 40 41 O 0.25757635319698 0.40766629989671 0.73815674423921 15.999 > 40 42 O 0.25757635319698 0.74099963323004 0.73815674423921 15.999 > 40 43 O 0.25757635319698 0.09233370010329 0.23815674423921 15.999 > 43 44 O 0.25757635319698 0.42566703343663 0.23815674423921 15.999 > 43 45 O 0.25757635319698 0.75900036676996 0.23815674423921 15.999 > 43 46 O 0.74242364680302 0.25900036676996 0.26184325576079 15.999 > 46 47 O 0.74242364680302 0.59233370010329 0.26184325576079 15.999 > 46 48 O 0.74242364680302 0.92566703343663 0.26184325576079 15.999 > 46 49 O 0.81907929798500 0.07309258670235 0.95306990280390 15.999 > 49 50 O 0.81907929798500 0.40642592003568 0.95306990280390 15.999 > 49 51 O 0.81907929798500 0.73975925336901 0.95306990280390 15.999 > 49 52 O 0.18092070201500 0.23975925336901 0.54693009719610 15.999 > 52 53 O 0.18092070201500 0.57309258670235 0.54693009719610 15.999 > 52 54 O 0.18092070201500 0.90642592003568 0.54693009719610 15.999 > 52 55 O 0.18092070201500 0.26024074663099 0.04693009719610 15.999 > 55 56 O 0.18092070201500 0.59357407996432 0.04693009719610 15.999 > 55 57 O 0.18092070201500 0.92690741329765 0.04693009719610 15.999 > 55 58 O 0.81907929798500 0.09357407996432 0.45306990280390 15.999 > 58 59 O 0.81907929798500 0.42690741329765 0.45306990280390 15.999 > 58 60 O 0.81907929798500 0.76024074663099 0.45306990280390 15.999 > 58 61 O 0.05376738905637 0.23813332680507 0.84765865620295 15.999 > 61 62 O 0.05376738905637 0.57146666013840 0.84765865620295 15.999 > 61 63 O 0.05376738905637 0.90479999347174 0.84765865620295 15.999 > 61 64 O 0.94623261094363 0.07146666013840 0.65234134379705 15.999 > 64 65 O 0.94623261094363 0.40479999347174 0.65234134379705 15.999 > 64 66 O 0.94623261094363 0.73813332680507 0.65234134379705 15.999 > 64 67 O 0.94623261094363 0.09520000652826 0.15234134379705 15.999 > 67 68 O 0.94623261094363 0.42853333986160 0.15234134379705 15.999 > 67 69 O 0.94623261094363 0.76186667319493 0.15234134379705 15.999 > 67 70 O 0.05376738905637 0.26186667319493 0.34765865620295 15.999 > 70 71 O 0.05376738905637 0.59520000652826 0.34765865620295 15.999 > 70 72 O 0.05376738905637 0.92853333986160 0.34765865620295 15.999 > 70 73 O 0.69942884649698 0.19123962743602 0.06913236282457 15.999 > 73 74 O 0.69942884649698 0.52457296076936 0.06913236282457 15.999 > 73 75 O 0.69942884649698 0.85790629410269 0.06913236282457 15.999 > 73 76 O 0.30057115350302 0.02457296076936 0.43086763717543 15.999 > 76 77 O 0.30057115350302 0.35790629410269 0.43086763717543 15.999 > 76 78 O 0.30057115350302 0.69123962743602 0.43086763717543 15.999 > 76 79 O 0.30057115350302 0.14209370589731 0.93086763717543 15.999 > 79 80 O 0.30057115350302 0.47542703923064 0.93086763717543 15.999 > 79 81 O 0.30057115350302 0.80876037256398 0.93086763717543 15.999 > 79 82 O 0.69942884649698 0.30876037256398 0.56913236282457 15.999 > 82 83 O 0.69942884649698 0.64209370589731 0.56913236282457 15.999 > 82 84 O 0.69942884649698 0.97542703923064 0.56913236282457 15.999 > 82 85 Mg 0.35504973515111 0.06864675271438 0.60535742946470 24.305 > 85 86 Mg 0.35504973515111 0.40198008604772 0.60535742946470 24.305 > 85 87 Mg 0.35504973515111 0.73531341938105 0.60535742946470 24.305 > 85 88 Mg 0.64495026484889 0.23531341938105 0.89464257053530 24.305 > 88 89 Mg 0.64495026484889 0.56864675271438 0.89464257053530 24.305 > 88 90 Mg 0.64495026484889 0.90198008604772 0.89464257053530 24.305 > 88 91 Mg 0.64495026484889 0.26468658061895 0.39464257053530 24.305 > 91 92 Mg 0.64495026484889 0.59801991395228 0.39464257053530 24.305 > 91 93 Mg 0.64495026484889 0.93135324728562 0.39464257053530 24.305 > 91 94 Mg 0.35504973515111 0.09801991395228 0.10535742946470 24.305 > 94 95 Mg 0.35504973515111 0.43135324728562 0.10535742946470 24.305 > 94 96 Mg 0.35504973515111 0.76468658061895 0.10535742946470 24.305 > 94 97 Mg 0.89778616767984 0.09544098761384 0.31380396782609 24.305 > 97 98 Mg 0.89778616767984 0.42877432094717 0.31380396782609 24.305 > 97 99 Mg 0.89778616767984 0.76210765428050 0.31380396782609 24.305 > 97 100 Mg 0.10221383232016 0.26210765428050 0.18619603217391 24.305 > 100 101 Mg 0.10221383232016 0.59544098761384 0.18619603217391 24.305 > 100 102 Mg 0.10221383232016 0.92877432094717 0.18619603217391 24.305 > 100 103 Mg 0.10221383232016 0.23789234571950 0.68619603217391 24.305 > 103 104 Mg 0.10221383232016 0.57122567905283 0.68619603217391 24.305 > 103 105 Mg 0.10221383232016 0.90455901238616 0.68619603217391 24.305 > 103 106 Mg 0.89778616767984 0.07122567905283 0.81380396782609 24.305 > 106 107 Mg 0.89778616767984 0.40455901238616 0.81380396782609 24.305 > 106 108 Mg 0.89778616767984 0.73789234571950 0.81380396782609 24.305 > 106 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.8952310 0.0000000 0.0255704 0.0000000 2.7217269 0.0000000 0.0255702 0.0000000 2.9452669 -------------------------- Born effective charges -------------------------- 1 B 2.1708616 0.6138211 0.3165858 0.6511836 1.5075387 -0.2058709 0.0195536 -0.3402122 2.6614517 2 B 2.1708616 -0.6138211 0.3165858 -0.6511836 1.5075387 0.2058709 0.0195536 0.3402122 2.6614517 3 B 2.1708616 0.6138211 0.3165858 0.6511836 1.5075387 -0.2058709 0.0195536 -0.3402122 2.6614517 4 B 2.1708616 -0.6138211 0.3165858 -0.6511836 1.5075387 0.2058709 0.0195536 0.3402122 2.6614517 5 B 2.6721265 -0.4249708 -0.0817880 -0.3740039 1.1428637 0.3981614 0.1872693 0.3564693 2.4200206 6 B 2.6721265 0.4249708 -0.0817880 0.3740039 1.1428637 -0.3981614 0.1872693 -0.3564693 2.4200206 7 B 2.6721265 -0.4249708 -0.0817880 -0.3740039 1.1428637 0.3981614 0.1872693 0.3564693 2.4200206 8 B 2.6721265 0.4249708 -0.0817880 0.3740039 1.1428637 -0.3981614 0.1872693 -0.3564693 2.4200206 9 O -2.3439809 0.1902202 -0.2633431 0.2015569 -1.3776781 0.0175920 -0.3140927 -0.0150031 -1.2623669 10 O -2.3439809 -0.1902202 -0.2633431 -0.2015569 -1.3776781 -0.0175920 -0.3140927 0.0150031 -1.2623669 11 O -2.3439809 0.1902202 -0.2633431 0.2015569 -1.3776781 0.0175920 -0.3140927 -0.0150031 -1.2623669 12 O -2.3439809 -0.1902202 -0.2633431 -0.2015569 -1.3776781 -0.0175920 -0.3140927 0.0150031 -1.2623669 13 O -1.5771093 0.0160632 -0.2502323 0.0454399 -1.3181695 0.1415726 -0.3828001 0.1492015 -2.1994684 14 O -1.5771093 -0.0160632 -0.2502323 -0.0454399 -1.3181695 -0.1415726 -0.3828001 -0.1492015 -2.1994684 15 O -1.5771093 0.0160632 -0.2502323 0.0454399 -1.3181695 0.1415726 -0.3828001 0.1492015 -2.1994684 16 O -1.5771093 -0.0160632 -0.2502323 -0.0454399 -1.3181695 -0.1415726 -0.3828001 -0.1492015 -2.1994684 17 O -1.3915974 0.0821257 0.1888580 0.0749129 -1.4229491 -0.2249624 0.1717024 -0.3051117 -2.3761243 18 O -1.3915974 -0.0821257 0.1888580 -0.0749129 -1.4229491 0.2249624 0.1717024 0.3051117 -2.3761243 19 O -1.3915974 0.0821257 0.1888580 0.0749129 -1.4229491 -0.2249624 0.1717024 -0.3051117 -2.3761243 20 O -1.3915974 -0.0821257 0.1888580 -0.0749129 -1.4229491 0.2249624 0.1717024 0.3051117 -2.3761243 21 O -1.8058858 0.1151712 -0.5716516 0.1415080 -1.3408189 0.0974778 -0.4702233 0.0413441 -1.9715228 22 O -1.8058858 -0.1151712 -0.5716516 -0.1415080 -1.3408189 -0.0974778 -0.4702233 -0.0413441 -1.9715228 23 O -1.8058858 0.1151712 -0.5716516 0.1415080 -1.3408189 0.0974778 -0.4702233 0.0413441 -1.9715228 24 O -1.8058858 -0.1151712 -0.5716516 -0.1415080 -1.3408189 -0.0974778 -0.4702233 -0.0413441 -1.9715228 25 O -1.9968338 0.6361675 0.5186820 0.6292522 -1.3424555 -0.2856114 0.5603343 -0.3179949 -1.7153073 26 O -1.9968338 -0.6361675 0.5186820 -0.6292522 -1.3424555 0.2856114 0.5603343 0.3179949 -1.7153073 27 O -1.9968338 0.6361675 0.5186820 0.6292522 -1.3424555 -0.2856114 0.5603343 -0.3179949 -1.7153073 28 O -1.9968338 -0.6361675 0.5186820 -0.6292522 -1.3424555 0.2856114 0.5603343 0.3179949 -1.7153073 29 Mg 2.0407354 -0.0133177 0.1068401 -0.0227611 2.0833967 0.0727589 0.1804853 0.0330696 2.2163916 30 Mg 2.0407354 0.0133177 0.1068401 0.0227611 2.0833967 -0.0727589 0.1804853 -0.0330696 2.2163916 31 Mg 2.0407354 -0.0133177 0.1068401 -0.0227611 2.0833967 0.0727589 0.1804853 0.0330696 2.2163916 32 Mg 2.0407354 0.0133177 0.1068401 0.0227611 2.0833967 -0.0727589 0.1804853 -0.0330696 2.2163916 33 Mg 2.2316836 0.0041329 0.0360489 0.0820807 2.0682722 -0.0355727 0.0477711 -0.0089996 2.2269258 34 Mg 2.2316836 -0.0041329 0.0360489 -0.0820807 2.0682722 0.0355727 0.0477711 0.0089996 2.2269258 35 Mg 2.2316836 0.0041329 0.0360489 0.0820807 2.0682722 -0.0355727 0.0477711 -0.0089996 2.2269258 36 Mg 2.2316836 -0.0041329 0.0360489 -0.0820807 2.0682722 0.0355727 0.0477711 0.0089996 2.2269258 ---------------------------------------------------------------------------- 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 37, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 61, 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Computing fc3[ 85, 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] 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] [-0.0025 0.0000 0.0097] [ 0.0025 0.0000 -0.0097] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:18:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 04:18:41]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 3 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.227931322172319 0.000000000000000 0.000000000000000 b 0.000000000000000 3.112914360000000 0.000000000000000 c -3.075536461147406 0.000000000000000 11.959467966587422 Atomic positions (fractional): 1 B 0.83024071720967 0.15509708058023 0.56035489869987 10.811 2 B 0.16975928279033 0.65509708058023 0.93964510130013 10.811 3 B 0.16975928279033 0.84490291941977 0.43964510130013 10.811 4 B 0.83024071720967 0.34490291941977 0.06035489869988 10.811 5 B 0.64356127809413 0.72638938670831 0.15928673417029 10.811 6 B 0.35643872190587 0.22638938670831 0.34071326582971 10.811 7 B 0.35643872190587 0.27361061329169 0.84071326582971 10.811 8 B 0.64356127809413 0.77361061329169 0.65928673417029 10.811 9 O 0.50443723344307 0.19668286863416 0.86225292962854 15.999 10 O 0.49556276655693 0.69668286863416 0.63774707037146 15.999 11 O 0.49556276655693 0.80331713136584 0.13774707037146 15.999 12 O 0.50443723344307 0.30331713136584 0.36225292962854 15.999 13 O 0.74242364680302 0.72299889969012 0.76184325576079 15.999 14 O 0.25757635319698 0.22299889969012 0.73815674423921 15.999 15 O 0.25757635319698 0.27700110030988 0.23815674423921 15.999 16 O 0.74242364680302 0.77700110030988 0.26184325576079 15.999 17 O 0.81907929798500 0.21927776010704 0.95306990280390 15.999 18 O 0.18092070201500 0.71927776010704 0.54693009719610 15.999 19 O 0.18092070201500 0.78072223989296 0.04693009719610 15.999 20 O 0.81907929798500 0.28072223989296 0.45306990280390 15.999 21 O 0.05376738905637 0.71439998041521 0.84765865620295 15.999 22 O 0.94623261094363 0.21439998041520 0.65234134379705 15.999 23 O 0.94623261094363 0.28560001958479 0.15234134379705 15.999 24 O 0.05376738905637 0.78560001958479 0.34765865620295 15.999 25 O 0.69942884649698 0.57371888230807 0.06913236282457 15.999 26 O 0.30057115350302 0.07371888230807 0.43086763717543 15.999 27 O 0.30057115350302 0.42628111769193 0.93086763717543 15.999 28 O 0.69942884649698 0.92628111769193 0.56913236282457 15.999 29 Mg 0.35504973515111 0.20594025814315 0.60535742946470 24.305 30 Mg 0.64495026484889 0.70594025814315 0.89464257053530 24.305 31 Mg 0.64495026484889 0.79405974185685 0.39464257053530 24.305 32 Mg 0.35504973515111 0.29405974185685 0.10535742946470 24.305 33 Mg 0.89778616767984 0.28632296284151 0.31380396782609 24.305 34 Mg 0.10221383232016 0.78632296284151 0.18619603217391 24.305 35 Mg 0.10221383232016 0.71367703715849 0.68619603217391 24.305 36 Mg 0.89778616767984 0.21367703715849 0.81380396782609 24.305 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.227931322172319 0.000000000000000 0.000000000000000 b 0.000000000000000 9.338743080000000 0.000000000000000 c -3.075536461147406 0.000000000000000 11.959467966587422 Atomic positions (fractional): 1 B 0.83024071720967 0.05169902686008 0.56035489869987 10.811 > 1 2 B 0.83024071720967 0.38503236019341 0.56035489869987 10.811 > 1 3 B 0.83024071720967 0.71836569352674 0.56035489869987 10.811 > 1 4 B 0.16975928279033 0.21836569352674 0.93964510130013 10.811 > 4 5 B 0.16975928279033 0.55169902686008 0.93964510130013 10.811 > 4 6 B 0.16975928279033 0.88503236019341 0.93964510130013 10.811 > 4 7 B 0.16975928279033 0.28163430647326 0.43964510130013 10.811 > 7 8 B 0.16975928279033 0.61496763980659 0.43964510130013 10.811 > 7 9 B 0.16975928279033 0.94830097313992 0.43964510130013 10.811 > 7 10 B 0.83024071720967 0.11496763980659 0.06035489869988 10.811 > 10 11 B 0.83024071720967 0.44830097313992 0.06035489869988 10.811 > 10 12 B 0.83024071720967 0.78163430647326 0.06035489869988 10.811 > 10 13 B 0.64356127809413 0.24212979556944 0.15928673417029 10.811 > 13 14 B 0.64356127809413 0.57546312890277 0.15928673417029 10.811 > 13 15 B 0.64356127809413 0.90879646223610 0.15928673417029 10.811 > 13 16 B 0.35643872190587 0.07546312890277 0.34071326582971 10.811 > 16 17 B 0.35643872190587 0.40879646223610 0.34071326582971 10.811 > 16 18 B 0.35643872190587 0.74212979556944 0.34071326582971 10.811 > 16 19 B 0.35643872190587 0.09120353776390 0.84071326582971 10.811 > 19 20 B 0.35643872190587 0.42453687109723 0.84071326582971 10.811 > 19 21 B 0.35643872190587 0.75787020443056 0.84071326582971 10.811 > 19 22 B 0.64356127809413 0.25787020443056 0.65928673417029 10.811 > 22 23 B 0.64356127809413 0.59120353776390 0.65928673417029 10.811 > 22 24 B 0.64356127809413 0.92453687109723 0.65928673417029 10.811 > 22 25 O 0.50443723344307 0.06556095621139 0.86225292962854 15.999 > 25 26 O 0.50443723344307 0.39889428954472 0.86225292962854 15.999 > 25 27 O 0.50443723344307 0.73222762287805 0.86225292962854 15.999 > 25 28 O 0.49556276655693 0.23222762287805 0.63774707037146 15.999 > 28 29 O 0.49556276655693 0.56556095621139 0.63774707037146 15.999 > 28 30 O 0.49556276655693 0.89889428954472 0.63774707037146 15.999 > 28 31 O 0.49556276655693 0.26777237712195 0.13774707037146 15.999 > 31 32 O 0.49556276655693 0.60110571045528 0.13774707037146 15.999 > 31 33 O 0.49556276655693 0.93443904378861 0.13774707037146 15.999 > 31 34 O 0.50443723344307 0.10110571045528 0.36225292962854 15.999 > 34 35 O 0.50443723344307 0.43443904378861 0.36225292962854 15.999 > 34 36 O 0.50443723344307 0.76777237712195 0.36225292962854 15.999 > 34 37 O 0.74242364680302 0.24099963323004 0.76184325576079 15.999 > 37 38 O 0.74242364680302 0.57433296656337 0.76184325576079 15.999 > 37 39 O 0.74242364680302 0.90766629989671 0.76184325576079 15.999 > 37 40 O 0.25757635319698 0.07433296656337 0.73815674423921 15.999 > 40 41 O 0.25757635319698 0.40766629989671 0.73815674423921 15.999 > 40 42 O 0.25757635319698 0.74099963323004 0.73815674423921 15.999 > 40 43 O 0.25757635319698 0.09233370010329 0.23815674423921 15.999 > 43 44 O 0.25757635319698 0.42566703343663 0.23815674423921 15.999 > 43 45 O 0.25757635319698 0.75900036676996 0.23815674423921 15.999 > 43 46 O 0.74242364680302 0.25900036676996 0.26184325576079 15.999 > 46 47 O 0.74242364680302 0.59233370010329 0.26184325576079 15.999 > 46 48 O 0.74242364680302 0.92566703343663 0.26184325576079 15.999 > 46 49 O 0.81907929798500 0.07309258670235 0.95306990280390 15.999 > 49 50 O 0.81907929798500 0.40642592003568 0.95306990280390 15.999 > 49 51 O 0.81907929798500 0.73975925336901 0.95306990280390 15.999 > 49 52 O 0.18092070201500 0.23975925336901 0.54693009719610 15.999 > 52 53 O 0.18092070201500 0.57309258670235 0.54693009719610 15.999 > 52 54 O 0.18092070201500 0.90642592003568 0.54693009719610 15.999 > 52 55 O 0.18092070201500 0.26024074663099 0.04693009719610 15.999 > 55 56 O 0.18092070201500 0.59357407996432 0.04693009719610 15.999 > 55 57 O 0.18092070201500 0.92690741329765 0.04693009719610 15.999 > 55 58 O 0.81907929798500 0.09357407996432 0.45306990280390 15.999 > 58 59 O 0.81907929798500 0.42690741329765 0.45306990280390 15.999 > 58 60 O 0.81907929798500 0.76024074663099 0.45306990280390 15.999 > 58 61 O 0.05376738905637 0.23813332680507 0.84765865620295 15.999 > 61 62 O 0.05376738905637 0.57146666013840 0.84765865620295 15.999 > 61 63 O 0.05376738905637 0.90479999347174 0.84765865620295 15.999 > 61 64 O 0.94623261094363 0.07146666013840 0.65234134379705 15.999 > 64 65 O 0.94623261094363 0.40479999347174 0.65234134379705 15.999 > 64 66 O 0.94623261094363 0.73813332680507 0.65234134379705 15.999 > 64 67 O 0.94623261094363 0.09520000652826 0.15234134379705 15.999 > 67 68 O 0.94623261094363 0.42853333986160 0.15234134379705 15.999 > 67 69 O 0.94623261094363 0.76186667319493 0.15234134379705 15.999 > 67 70 O 0.05376738905637 0.26186667319493 0.34765865620295 15.999 > 70 71 O 0.05376738905637 0.59520000652826 0.34765865620295 15.999 > 70 72 O 0.05376738905637 0.92853333986160 0.34765865620295 15.999 > 70 73 O 0.69942884649698 0.19123962743602 0.06913236282457 15.999 > 73 74 O 0.69942884649698 0.52457296076936 0.06913236282457 15.999 > 73 75 O 0.69942884649698 0.85790629410269 0.06913236282457 15.999 > 73 76 O 0.30057115350302 0.02457296076936 0.43086763717543 15.999 > 76 77 O 0.30057115350302 0.35790629410269 0.43086763717543 15.999 > 76 78 O 0.30057115350302 0.69123962743602 0.43086763717543 15.999 > 76 79 O 0.30057115350302 0.14209370589731 0.93086763717543 15.999 > 79 80 O 0.30057115350302 0.47542703923064 0.93086763717543 15.999 > 79 81 O 0.30057115350302 0.80876037256398 0.93086763717543 15.999 > 79 82 O 0.69942884649698 0.30876037256398 0.56913236282457 15.999 > 82 83 O 0.69942884649698 0.64209370589731 0.56913236282457 15.999 > 82 84 O 0.69942884649698 0.97542703923064 0.56913236282457 15.999 > 82 85 Mg 0.35504973515111 0.06864675271438 0.60535742946470 24.305 > 85 86 Mg 0.35504973515111 0.40198008604772 0.60535742946470 24.305 > 85 87 Mg 0.35504973515111 0.73531341938105 0.60535742946470 24.305 > 85 88 Mg 0.64495026484889 0.23531341938105 0.89464257053530 24.305 > 88 89 Mg 0.64495026484889 0.56864675271438 0.89464257053530 24.305 > 88 90 Mg 0.64495026484889 0.90198008604772 0.89464257053530 24.305 > 88 91 Mg 0.64495026484889 0.26468658061895 0.39464257053530 24.305 > 91 92 Mg 0.64495026484889 0.59801991395228 0.39464257053530 24.305 > 91 93 Mg 0.64495026484889 0.93135324728562 0.39464257053530 24.305 > 91 94 Mg 0.35504973515111 0.09801991395228 0.10535742946470 24.305 > 94 95 Mg 0.35504973515111 0.43135324728562 0.10535742946470 24.305 > 94 96 Mg 0.35504973515111 0.76468658061895 0.10535742946470 24.305 > 94 97 Mg 0.89778616767984 0.09544098761384 0.31380396782609 24.305 > 97 98 Mg 0.89778616767984 0.42877432094717 0.31380396782609 24.305 > 97 99 Mg 0.89778616767984 0.76210765428050 0.31380396782609 24.305 > 97 100 Mg 0.10221383232016 0.26210765428050 0.18619603217391 24.305 > 100 101 Mg 0.10221383232016 0.59544098761384 0.18619603217391 24.305 > 100 102 Mg 0.10221383232016 0.92877432094717 0.18619603217391 24.305 > 100 103 Mg 0.10221383232016 0.23789234571950 0.68619603217391 24.305 > 103 104 Mg 0.10221383232016 0.57122567905283 0.68619603217391 24.305 > 103 105 Mg 0.10221383232016 0.90455901238616 0.68619603217391 24.305 > 103 106 Mg 0.89778616767984 0.07122567905283 0.81380396782609 24.305 > 106 107 Mg 0.89778616767984 0.40455901238616 0.81380396782609 24.305 > 106 108 Mg 0.89778616767984 0.73789234571950 0.81380396782609 24.305 > 106 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.8952310 0.0000000 0.0255704 0.0000000 2.7217269 0.0000000 0.0255702 0.0000000 2.9452669 -------------------------- Born effective charges -------------------------- 1 B 2.1708616 0.6138211 0.3165858 0.6511836 1.5075387 -0.2058709 0.0195536 -0.3402122 2.6614517 2 B 2.1708616 -0.6138211 0.3165858 -0.6511836 1.5075387 0.2058709 0.0195536 0.3402122 2.6614517 3 B 2.1708616 0.6138211 0.3165858 0.6511836 1.5075387 -0.2058709 0.0195536 -0.3402122 2.6614517 4 B 2.1708616 -0.6138211 0.3165858 -0.6511836 1.5075387 0.2058709 0.0195536 0.3402122 2.6614517 5 B 2.6721265 -0.4249708 -0.0817880 -0.3740039 1.1428637 0.3981614 0.1872693 0.3564693 2.4200206 6 B 2.6721265 0.4249708 -0.0817880 0.3740039 1.1428637 -0.3981614 0.1872693 -0.3564693 2.4200206 7 B 2.6721265 -0.4249708 -0.0817880 -0.3740039 1.1428637 0.3981614 0.1872693 0.3564693 2.4200206 8 B 2.6721265 0.4249708 -0.0817880 0.3740039 1.1428637 -0.3981614 0.1872693 -0.3564693 2.4200206 9 O -2.3439809 0.1902202 -0.2633431 0.2015569 -1.3776781 0.0175920 -0.3140927 -0.0150031 -1.2623669 10 O -2.3439809 -0.1902202 -0.2633431 -0.2015569 -1.3776781 -0.0175920 -0.3140927 0.0150031 -1.2623669 11 O -2.3439809 0.1902202 -0.2633431 0.2015569 -1.3776781 0.0175920 -0.3140927 -0.0150031 -1.2623669 12 O -2.3439809 -0.1902202 -0.2633431 -0.2015569 -1.3776781 -0.0175920 -0.3140927 0.0150031 -1.2623669 13 O -1.5771093 0.0160632 -0.2502323 0.0454399 -1.3181695 0.1415726 -0.3828001 0.1492015 -2.1994684 14 O -1.5771093 -0.0160632 -0.2502323 -0.0454399 -1.3181695 -0.1415726 -0.3828001 -0.1492015 -2.1994684 15 O -1.5771093 0.0160632 -0.2502323 0.0454399 -1.3181695 0.1415726 -0.3828001 0.1492015 -2.1994684 16 O -1.5771093 -0.0160632 -0.2502323 -0.0454399 -1.3181695 -0.1415726 -0.3828001 -0.1492015 -2.1994684 17 O -1.3915974 0.0821257 0.1888580 0.0749129 -1.4229491 -0.2249624 0.1717024 -0.3051117 -2.3761243 18 O -1.3915974 -0.0821257 0.1888580 -0.0749129 -1.4229491 0.2249624 0.1717024 0.3051117 -2.3761243 19 O -1.3915974 0.0821257 0.1888580 0.0749129 -1.4229491 -0.2249624 0.1717024 -0.3051117 -2.3761243 20 O -1.3915974 -0.0821257 0.1888580 -0.0749129 -1.4229491 0.2249624 0.1717024 0.3051117 -2.3761243 21 O -1.8058858 0.1151712 -0.5716516 0.1415080 -1.3408189 0.0974778 -0.4702233 0.0413441 -1.9715228 22 O -1.8058858 -0.1151712 -0.5716516 -0.1415080 -1.3408189 -0.0974778 -0.4702233 -0.0413441 -1.9715228 23 O -1.8058858 0.1151712 -0.5716516 0.1415080 -1.3408189 0.0974778 -0.4702233 0.0413441 -1.9715228 24 O -1.8058858 -0.1151712 -0.5716516 -0.1415080 -1.3408189 -0.0974778 -0.4702233 -0.0413441 -1.9715228 25 O -1.9968338 0.6361675 0.5186820 0.6292522 -1.3424555 -0.2856114 0.5603343 -0.3179949 -1.7153073 26 O -1.9968338 -0.6361675 0.5186820 -0.6292522 -1.3424555 0.2856114 0.5603343 0.3179949 -1.7153073 27 O -1.9968338 0.6361675 0.5186820 0.6292522 -1.3424555 -0.2856114 0.5603343 -0.3179949 -1.7153073 28 O -1.9968338 -0.6361675 0.5186820 -0.6292522 -1.3424555 0.2856114 0.5603343 0.3179949 -1.7153073 29 Mg 2.0407354 -0.0133177 0.1068401 -0.0227611 2.0833967 0.0727589 0.1804853 0.0330696 2.2163916 30 Mg 2.0407354 0.0133177 0.1068401 0.0227611 2.0833967 -0.0727589 0.1804853 -0.0330696 2.2163916 31 Mg 2.0407354 -0.0133177 0.1068401 -0.0227611 2.0833967 0.0727589 0.1804853 0.0330696 2.2163916 32 Mg 2.0407354 0.0133177 0.1068401 0.0227611 2.0833967 -0.0727589 0.1804853 -0.0330696 2.2163916 33 Mg 2.2316836 0.0041329 0.0360489 0.0820807 2.0682722 -0.0355727 0.0477711 -0.0089996 2.2269258 34 Mg 2.2316836 -0.0041329 0.0360489 -0.0820807 2.0682722 0.0355727 0.0477711 0.0089996 2.2269258 35 Mg 2.2316836 0.0041329 0.0360489 0.0820807 2.0682722 -0.0355727 0.0477711 -0.0089996 2.2269258 36 Mg 2.2316836 -0.0041329 0.0360489 -0.0820807 2.0682722 0.0355727 0.0477711 0.0089996 2.2269258 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz) 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 16 4 ] 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: 0.59, Number of G-points: 297, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/126) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 126 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 2.949 ( 0.000 0.000 0.000) 0.000 3.009 ( 0.000 0.000 0.000) 0.000 3.483 ( 0.000 0.000 0.000) 0.000 4.058 ( 0.000 0.000 0.000) 0.000 4.133 ( 0.000 0.000 0.000) 0.000 4.362 ( 0.000 0.000 0.000) 0.000 4.525 ( 0.000 0.000 0.000) 0.000 4.545 ( 0.000 0.000 0.000) 0.000 4.788 ( 0.000 0.000 0.000) 0.000 4.800 ( 0.000 0.000 0.000) 0.000 4.961 ( 0.000 0.000 0.000) 0.000 5.255 ( 0.000 0.000 0.000) 0.000 5.503 ( 0.000 0.000 0.000) 0.000 5.556 ( 0.000 0.000 0.000) 0.000 5.877 ( 0.000 0.000 0.000) 0.000 5.878 ( 0.000 0.000 0.000) 0.000 6.301 ( 0.000 0.000 0.000) 0.000 6.679 ( 0.000 0.000 0.000) 0.000 6.787 ( 0.000 0.000 0.000) 0.000 6.794 ( 0.000 0.000 0.000) 0.000 7.511 ( 0.000 0.000 0.000) 0.000 7.664 ( 0.000 0.000 0.000) 0.000 7.859 ( 0.000 0.000 0.000) 0.000 7.883 ( 0.000 0.000 0.000) 0.000 8.139 ( 0.000 0.000 0.000) 0.000 8.174 ( 0.000 0.000 0.000) 0.000 8.177 ( 0.000 0.000 0.000) 0.000 8.236 ( 0.000 0.000 0.000) 0.000 8.278 ( 0.000 0.000 0.000) 0.000 8.299 ( 0.000 0.000 0.000) 0.000 8.537 ( 0.000 0.000 0.000) 0.000 8.890 ( 0.000 0.000 0.000) 0.000 9.040 ( 0.000 0.000 0.000) 0.000 9.404 ( 0.000 0.000 0.000) 0.000 9.519 ( 0.000 0.000 0.000) 0.000 9.747 ( 0.000 0.000 0.000) 0.000 9.785 ( 0.000 0.000 0.000) 0.000 9.966 ( 0.000 0.000 0.000) 0.000 10.150 ( 0.000 0.000 0.000) 0.000 10.234 ( 0.000 0.000 0.000) 0.000 10.362 ( 0.000 0.000 0.000) 0.000 10.382 ( 0.000 0.000 0.000) 0.000 10.384 ( 0.000 0.000 0.000) 0.000 10.755 ( 0.000 0.000 0.000) 0.000 10.882 ( 0.000 0.000 0.000) 0.000 10.883 ( 0.000 0.000 0.000) 0.000 10.993 ( 0.000 0.000 0.000) 0.000 11.268 ( 0.000 0.000 0.000) 0.000 11.301 ( 0.000 0.000 0.000) 0.000 11.972 ( 0.000 0.000 0.000) 0.000 12.089 ( 0.000 0.000 0.000) 0.000 12.283 ( 0.000 0.000 0.000) 0.000 12.419 ( 0.000 0.000 0.000) 0.000 12.493 ( 0.000 0.000 0.000) 0.000 12.544 ( 0.000 0.000 0.000) 0.000 12.843 ( 0.000 0.000 0.000) 0.000 13.045 ( 0.000 0.000 0.000) 0.000 14.058 ( 0.000 0.000 0.000) 0.000 14.328 ( 0.000 0.000 0.000) 0.000 14.630 ( 0.000 0.000 0.000) 0.000 14.653 ( 0.000 0.000 0.000) 0.000 15.697 ( 0.000 0.000 0.000) 0.000 15.904 ( 0.000 0.000 0.000) 0.000 16.025 ( 0.000 0.000 0.000) 0.000 16.101 ( 0.000 0.000 0.000) 0.000 17.446 ( 0.000 0.000 0.000) 0.000 18.063 ( 0.000 0.000 0.000) 0.000 18.143 ( 0.000 0.000 0.000) 0.000 18.205 ( 0.000 0.000 0.000) 0.000 19.123 ( 0.000 0.000 0.000) 0.000 19.307 ( 0.000 0.000 0.000) 0.000 19.542 ( 0.000 0.000 0.000) 0.000 19.800 ( 0.000 0.000 0.000) 0.000 20.113 ( 0.000 0.000 0.000) 0.000 20.139 ( 0.000 0.000 0.000) 0.000 20.144 ( 0.000 0.000 0.000) 0.000 20.151 ( 0.000 0.000 0.000) 0.000 20.467 ( 0.000 0.000 0.000) 0.000 20.513 ( 0.000 0.000 0.000) 0.000 20.556 ( 0.000 0.000 0.000) 0.000 20.564 ( 0.000 0.000 0.000) 0.000 24.378 ( 0.000 0.000 0.000) 0.000 24.491 ( 0.000 0.000 0.000) 0.000 24.492 ( 0.000 0.000 0.000) 0.000 24.631 ( 0.000 0.000 0.000) 0.000 30.051 ( 0.000 0.000 0.000) 0.000 30.076 ( 0.000 0.000 0.000) 0.000 30.354 ( 0.000 0.000 0.000) 0.000 30.462 ( 0.000 0.000 0.000) 0.000 34.175 ( 0.000 0.000 0.000) 0.000 35.215 ( 0.000 0.000 0.000) 0.000 35.695 ( 0.000 0.000 0.000) 0.000 35.747 ( 0.000 0.000 0.000) 0.000 37.658 ( 0.000 0.000 0.000) 0.000 37.680 ( 0.000 0.000 0.000) 0.000 37.933 ( 0.000 0.000 0.000) 0.000 37.938 ( 0.000 0.000 0.000) 0.000 40.834 ( 0.000 0.000 0.000) 0.000 41.804 ( 0.000 0.000 0.000) 0.000 41.860 ( 0.000 0.000 0.000) 0.000 42.392 ( 0.000 0.000 0.000) 0.000 43.516 ( 0.000 0.000 0.000) 0.000 44.054 ( 0.000 0.000 0.000) 0.000 44.371 ( 0.000 0.000 0.000) 0.000 45.783 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/126) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.763 ( 39.373 0.000 7.643) 40.108 0.862 ( 48.542 0.000 -2.204) 48.592 1.691 ( 76.425 0.000 51.058) 91.911 2.994 ( 10.676 0.000 -22.182) 24.618 3.064 ( 2.281 0.000 15.866) 16.029 3.272 ( -21.023 0.000 -0.348) 21.026 3.949 ( -12.880 0.000 5.593) 14.042 4.000 ( -8.437 0.000 -29.807) 30.978 4.318 ( -13.179 0.000 -15.073) 20.022 4.403 ( -12.442 0.000 -3.365) 12.889 4.566 ( 12.254 0.000 1.005) 12.295 4.812 ( -1.404 0.000 1.993) 2.438 4.839 ( -1.363 0.000 21.799) 21.842 4.950 ( -19.662 0.000 -0.888) 19.682 5.051 ( 5.002 0.000 2.568) 5.623 5.358 ( -6.790 0.000 4.020) 7.891 5.652 ( -1.268 0.000 5.334) 5.483 5.833 ( -3.702 0.000 -5.737) 6.828 5.907 ( 1.910 0.000 1.032) 2.171 6.113 ( 2.619 0.000 -7.014) 7.488 6.731 ( -1.991 0.000 -3.985) 4.455 6.929 ( 14.245 0.000 -5.719) 15.350 7.139 ( 14.743 0.000 1.062) 14.782 7.382 ( -13.593 0.000 -14.174) 19.639 7.707 ( 4.137 0.000 -2.607) 4.890 7.728 ( -14.135 0.000 4.463) 14.823 7.947 ( -0.181 0.000 15.461) 15.462 7.992 ( -12.017 0.000 -1.147) 12.072 8.047 ( -8.927 0.000 -0.025) 8.927 8.140 ( 1.653 0.000 -2.734) 3.195 8.238 ( 6.050 0.000 7.839) 9.902 8.310 ( 3.782 0.000 -10.046) 10.734 8.353 ( -7.031 0.000 -0.649) 7.061 8.649 ( 5.106 0.000 1.713) 5.385 8.686 ( -23.983 0.000 -9.946) 25.964 8.839 ( -3.774 0.000 11.613) 12.211 9.346 ( -11.602 0.000 4.842) 12.572 9.428 ( -8.244 0.000 -2.100) 8.508 9.698 ( 14.506 0.000 12.218) 18.966 9.828 ( 6.216 0.000 -4.213) 7.509 9.908 ( -10.874 0.000 -3.378) 11.386 10.280 ( 0.748 0.000 -1.808) 1.957 10.322 ( -2.797 0.000 -0.439) 2.831 10.432 ( 7.534 0.000 2.523) 7.946 10.521 ( 24.773 0.000 0.217) 24.774 10.540 ( 11.384 0.000 -0.903) 11.420 10.704 ( -3.675 0.000 -1.677) 4.040 10.952 ( 6.537 0.000 3.047) 7.212 11.041 ( 1.527 0.000 11.826) 11.924 11.455 ( 18.743 0.000 -7.345) 20.131 11.523 ( 19.148 0.000 5.392) 19.893 11.886 ( -0.668 0.000 -2.710) 2.791 12.046 ( -2.114 0.000 -7.680) 7.965 12.057 ( -19.285 0.000 2.609) 19.460 12.401 ( -1.883 0.000 -4.118) 4.528 12.467 ( 1.423 0.000 1.495) 2.064 12.529 ( -2.159 0.000 2.606) 3.384 12.709 ( 9.605 0.000 -23.752) 25.621 13.132 ( 7.787 0.000 -22.765) 24.060 13.599 ( -4.321 0.000 43.940) 44.152 14.013 ( -6.546 0.000 7.505) 9.959 14.504 ( -10.442 0.000 -2.565) 10.753 14.669 ( 0.391 0.000 2.526) 2.556 14.979 ( -18.651 0.000 53.584) 56.738 15.582 ( -18.135 0.000 -9.987) 20.703 15.712 ( -7.432 0.000 -1.512) 7.585 16.188 ( 4.986 0.000 8.822) 10.134 16.300 ( 13.884 0.000 7.513) 15.786 17.803 ( 1.950 0.000 -1.511) 2.467 18.038 ( -3.369 0.000 3.477) 4.841 18.106 ( -4.056 0.000 1.030) 4.184 18.177 ( -2.723 0.000 -1.131) 2.949 19.281 ( -2.989 0.000 2.838) 4.122 19.557 ( 1.272 0.000 -0.786) 1.495 19.592 ( 10.088 0.000 -34.573) 36.015 19.783 ( -2.285 0.000 1.879) 2.958 20.111 ( -0.181 0.000 0.100) 0.206 20.137 ( 0.109 0.000 -0.550) 0.560 20.147 ( 0.297 0.000 -0.514) 0.594 20.157 ( 0.272 0.000 0.542) 0.606 20.480 ( 1.057 0.000 1.360) 1.723 20.486 ( -1.995 0.000 -1.333) 2.399 20.572 ( 0.241 0.000 2.713) 2.724 20.579 ( 1.608 0.000 -0.592) 1.713 24.314 ( -6.551 0.000 1.580) 6.739 24.392 ( 2.285 0.000 -3.235) 3.960 24.628 ( -1.242 0.000 3.431) 3.649 24.751 ( 15.190 0.000 -3.112) 15.506 30.066 ( -0.372 0.000 -2.260) 2.290 30.161 ( 2.930 0.000 -8.396) 8.893 30.361 ( 0.593 0.000 0.641) 0.873 30.458 ( -0.265 0.000 -0.894) 0.932 35.191 ( 3.539 0.000 -21.886) 22.170 35.364 ( 32.802 0.000 -119.873) 124.280 35.389 ( -18.862 0.000 10.708) 21.690 36.027 ( 16.401 0.000 -12.273) 20.485 37.747 ( 7.700 0.000 6.589) 10.135 37.853 ( -4.911 0.000 20.669) 21.245 37.931 ( 0.244 0.000 -1.774) 1.790 37.981 ( 3.932 0.000 1.346) 4.156 40.933 ( 9.082 0.000 8.473) 12.420 41.880 ( 9.337 0.000 -4.301) 10.280 42.402 ( 1.263 0.000 -1.005) 1.614 43.079 ( -33.789 0.000 73.215) 80.635 43.623 ( 5.892 0.000 6.541) 8.804 43.882 ( -43.433 0.000 -8.088) 44.180 45.838 ( -13.475 0.000 51.091) 52.838 46.020 ( 20.074 0.000 -4.956) 20.677 ======================= Grid point 2 (3/126) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( 34.824 0.000 5.636) 35.277 1.723 ( 46.007 0.000 1.866) 46.045 2.812 ( -27.689 0.000 -0.214) 27.690 2.829 ( 9.906 0.000 19.591) 21.953 3.123 ( 13.311 0.000 -18.506) 22.796 3.433 ( 29.785 0.000 22.266) 37.188 3.440 ( -25.061 0.000 -38.252) 45.730 3.676 ( -14.282 0.000 -0.230) 14.284 4.176 ( -1.868 0.000 0.906) 2.076 4.190 ( 2.392 0.000 13.577) 13.786 4.554 ( -12.723 0.000 0.105) 12.723 4.714 ( -4.709 0.000 0.909) 4.796 4.853 ( 11.218 0.000 0.163) 11.220 5.005 ( 5.893 0.000 9.682) 11.334 5.146 ( 3.908 0.000 0.620) 3.957 5.491 ( 11.831 0.000 9.857) 15.399 5.593 ( -8.494 0.000 14.442) 16.755 5.784 ( 3.746 0.000 -5.108) 6.335 5.971 ( 4.787 0.000 4.503) 6.572 6.182 ( 0.303 0.000 -4.611) 4.621 6.427 ( -32.819 0.000 -14.276) 35.790 6.966 ( -11.372 0.000 -17.558) 20.919 6.992 ( -14.319 0.000 -18.060) 23.048 7.317 ( 10.145 0.000 -6.039) 11.806 7.430 ( -16.544 0.000 -2.797) 16.779 7.714 ( -14.219 0.000 -6.314) 15.557 7.721 ( -0.563 0.000 -1.012) 1.158 7.863 ( 1.421 0.000 7.161) 7.300 7.892 ( -9.422 0.000 8.538) 12.715 8.131 ( -4.528 0.000 2.218) 5.043 8.245 ( 3.286 0.000 2.978) 4.434 8.284 ( -1.829 0.000 -8.819) 9.006 8.445 ( 10.092 0.000 -4.709) 11.137 8.619 ( 3.216 0.000 4.358) 5.416 8.724 ( 2.776 0.000 0.835) 2.899 8.978 ( -2.869 0.000 31.325) 31.456 9.213 ( 6.138 0.000 9.305) 11.147 9.296 ( -5.633 0.000 -6.214) 8.387 9.766 ( -3.958 0.000 -0.423) 3.981 9.841 ( 1.111 0.000 -13.710) 13.755 9.992 ( 7.756 0.000 4.539) 8.987 10.284 ( -1.106 0.000 0.064) 1.108 10.301 ( 1.834 0.000 9.518) 9.693 10.548 ( 1.002 0.000 1.369) 1.697 10.629 ( -2.863 0.000 -3.821) 4.774 10.670 ( 5.836 0.000 -2.608) 6.392 10.883 ( 14.189 0.000 -3.318) 14.571 11.093 ( -4.886 0.000 10.076) 11.198 11.112 ( 6.393 0.000 8.816) 10.890 11.716 ( 12.464 0.000 -1.887) 12.606 11.787 ( 0.975 0.000 2.764) 2.931 11.919 ( 7.411 0.000 -6.943) 10.155 11.927 ( 5.461 0.000 -2.967) 6.215 11.984 ( 5.552 0.000 -8.392) 10.062 12.338 ( -4.225 0.000 -0.259) 4.233 12.495 ( -3.315 0.000 4.579) 5.653 12.555 ( 10.231 0.000 -7.271) 12.551 12.793 ( 7.951 0.000 -10.750) 13.371 13.015 ( -9.901 0.000 -12.156) 15.678 13.741 ( 2.571 0.000 18.254) 18.434 13.918 ( -7.799 0.000 11.159) 13.614 14.275 ( -12.025 0.000 -0.794) 12.051 14.704 ( 1.677 0.000 -1.602) 2.319 14.871 ( -9.223 0.000 12.281) 15.359 15.254 ( -11.832 0.000 -6.184) 13.351 15.579 ( -4.925 0.000 -3.898) 6.281 16.308 ( 3.683 0.000 5.886) 6.943 16.532 ( 8.300 0.000 3.924) 9.181 17.843 ( 2.304 0.000 1.073) 2.542 17.989 ( -3.260 0.000 3.406) 4.715 18.026 ( -4.620 0.000 0.883) 4.704 18.108 ( -3.695 0.000 -1.661) 4.051 19.245 ( -1.998 0.000 2.106) 2.903 19.567 ( 0.149 0.000 -0.415) 0.441 19.622 ( 5.700 0.000 -14.608) 15.681 19.741 ( -3.492 0.000 3.716) 5.099 20.108 ( -0.172 0.000 0.107) 0.203 20.138 ( 0.228 0.000 -0.410) 0.470 20.150 ( 0.200 0.000 -0.142) 0.246 20.162 ( -0.017 0.000 0.429) 0.429 20.449 ( -1.155 0.000 -1.561) 1.942 20.510 ( 1.209 0.000 1.457) 1.893 20.582 ( -0.204 0.000 1.407) 1.422 20.606 ( 1.465 0.000 -0.580) 1.576 24.261 ( -0.893 0.000 1.249) 1.535 24.423 ( 2.617 0.000 -3.870) 4.672 24.619 ( -1.581 0.000 4.070) 4.366 24.969 ( 9.541 0.000 -2.396) 9.837 30.049 ( -0.327 0.000 -1.655) 1.687 30.174 ( 1.124 0.000 -2.148) 2.424 30.377 ( 0.647 0.000 0.831) 1.054 30.447 ( -0.313 0.000 -1.080) 1.125 35.156 ( 1.863 0.000 -13.217) 13.348 35.164 ( -10.138 0.000 6.241) 11.905 35.397 ( 10.158 0.000 -33.965) 35.451 36.184 ( 6.656 0.000 -7.788) 10.245 37.862 ( -1.646 0.000 8.310) 8.472 37.926 ( 0.283 0.000 -2.245) 2.263 37.947 ( 8.974 0.000 6.099) 10.850 38.064 ( 3.575 0.000 1.731) 3.972 41.255 ( 20.135 0.000 16.314) 25.915 42.085 ( 16.146 0.000 -9.446) 18.706 42.423 ( 1.293 0.000 -1.001) 1.636 42.780 ( -25.818 0.000 33.669) 42.429 42.969 ( -46.492 0.000 -17.057) 49.522 43.733 ( 4.031 0.000 0.979) 4.148 45.831 ( -4.808 0.000 17.380) 18.033 46.303 ( 12.112 0.000 -3.890) 12.721 ======================= Grid point 3 (4/126) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 63 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( 0.000 0.000 0.000) 0.000 2.368 ( -0.000 0.000 0.000) 0.000 2.434 ( 0.000 0.000 0.000) 0.000 2.692 ( 0.000 0.000 0.000) 0.000 3.077 ( 0.000 0.000 -0.000) 0.000 3.242 ( 0.000 0.000 0.000) 0.000 3.392 ( -0.000 0.000 0.000) 0.000 3.680 ( 0.000 0.000 -0.000) 0.000 4.166 ( 0.000 0.000 0.000) 0.000 4.428 ( 0.000 0.000 0.000) 0.000 4.529 ( 0.000 0.000 0.000) 0.000 4.991 ( 0.000 0.000 0.000) 0.000 5.077 ( 0.000 0.000 0.000) 0.000 5.184 ( 0.000 0.000 0.000) 0.000 5.229 ( -0.000 0.000 -0.000) 0.000 5.255 ( 0.000 0.000 0.000) 0.000 5.533 ( 0.000 0.000 -0.000) 0.000 5.840 ( 0.000 0.000 0.000) 0.000 5.900 ( 0.000 0.000 0.000) 0.000 6.063 ( 0.000 0.000 0.000) 0.000 6.112 ( 0.000 0.000 0.000) 0.000 6.619 ( 0.000 0.000 0.000) 0.000 6.826 ( 0.000 0.000 -0.000) 0.000 7.394 ( 0.000 0.000 0.000) 0.000 7.437 ( 0.000 0.000 0.000) 0.000 7.525 ( -0.000 0.000 -0.000) 0.000 7.691 ( -0.000 0.000 0.000) 0.000 7.802 ( 0.000 0.000 0.000) 0.000 7.971 ( 0.000 0.000 0.000) 0.000 8.090 ( 0.000 0.000 0.000) 0.000 8.222 ( 0.000 0.000 0.000) 0.000 8.267 ( 0.000 0.000 0.000) 0.000 8.547 ( 0.000 0.000 0.000) 0.000 8.668 ( 0.000 0.000 0.000) 0.000 8.764 ( 0.000 0.000 -0.000) 0.000 8.898 ( 0.000 0.000 0.000) 0.000 9.217 ( 0.000 0.000 0.000) 0.000 9.572 ( 0.000 0.000 0.000) 0.000 9.661 ( -0.000 0.000 -0.000) 0.000 9.733 ( 0.000 0.000 0.000) 0.000 10.080 ( 0.000 0.000 0.000) 0.000 10.276 ( 0.000 0.000 0.000) 0.000 10.382 ( 0.000 0.000 0.000) 0.000 10.511 ( -0.000 0.000 0.000) 0.000 10.591 ( 0.000 0.000 -0.000) 0.000 10.718 ( 0.000 0.000 0.000) 0.000 11.008 ( -0.000 0.000 0.000) 0.000 11.037 ( 0.000 0.000 0.000) 0.000 11.198 ( 0.000 0.000 -0.000) 0.000 11.788 ( 0.000 0.000 0.000) 0.000 11.858 ( 0.000 0.000 0.000) 0.000 11.896 ( 0.000 0.000 0.000) 0.000 12.045 ( 0.000 0.000 0.000) 0.000 12.103 ( 0.000 0.000 0.000) 0.000 12.263 ( 0.000 0.000 0.000) 0.000 12.468 ( -0.000 0.000 0.000) 0.000 12.754 ( -0.000 0.000 0.000) 0.000 12.761 ( 0.000 0.000 -0.000) 0.000 12.852 ( 0.000 0.000 0.000) 0.000 13.810 ( 0.000 0.000 -0.000) 0.000 13.873 ( 0.000 0.000 0.000) 0.000 14.149 ( 0.000 0.000 0.000) 0.000 14.697 ( 0.000 0.000 0.000) 0.000 14.806 ( 0.000 0.000 0.000) 0.000 15.141 ( 0.000 0.000 -0.000) 0.000 15.522 ( 0.000 0.000 0.000) 0.000 16.358 ( 0.000 0.000 0.000) 0.000 16.619 ( 0.000 0.000 0.000) 0.000 17.874 ( 0.000 0.000 0.000) 0.000 17.971 ( 0.000 0.000 0.000) 0.000 17.975 ( -0.000 0.000 -0.000) 0.000 18.060 ( 0.000 0.000 0.000) 0.000 19.232 ( 0.000 0.000 0.000) 0.000 19.566 ( 0.000 0.000 0.000) 0.000 19.648 ( 0.000 0.000 0.000) 0.000 19.710 ( 0.000 0.000 -0.000) 0.000 20.107 ( 0.000 0.000 0.000) 0.000 20.140 ( 0.000 0.000 -0.000) 0.000 20.152 ( 0.000 0.000 -0.000) 0.000 20.162 ( 0.000 0.000 0.000) 0.000 20.435 ( 0.000 0.000 0.000) 0.000 20.526 ( 0.000 0.000 -0.000) 0.000 20.582 ( 0.000 0.000 0.000) 0.000 20.619 ( 0.000 0.000 0.000) 0.000 24.261 ( 0.000 0.000 -0.000) 0.000 24.439 ( 0.000 0.000 -0.000) 0.000 24.613 ( 0.000 0.000 0.000) 0.000 25.052 ( 0.000 0.000 0.000) 0.000 30.042 ( 0.000 0.000 0.000) 0.000 30.180 ( 0.000 0.000 0.000) 0.000 30.386 ( 0.000 0.000 0.000) 0.000 30.441 ( 0.000 0.000 0.000) 0.000 35.086 ( 0.000 0.000 -0.000) 0.000 35.142 ( 0.000 0.000 -0.000) 0.000 35.410 ( 0.000 0.000 0.000) 0.000 36.222 ( 0.000 0.000 0.000) 0.000 37.867 ( 0.000 0.000 0.000) 0.000 37.923 ( 0.000 0.000 -0.000) 0.000 38.054 ( 0.000 0.000 -0.000) 0.000 38.103 ( 0.000 0.000 0.000) 0.000 41.643 ( 0.000 0.000 0.000) 0.000 42.285 ( 0.000 0.000 -0.000) 0.000 42.326 ( 0.000 0.000 0.000) 0.000 42.433 ( 0.000 0.000 -0.000) 0.000 42.550 ( -0.000 0.000 0.000) 0.000 43.772 ( 0.000 0.000 0.000) 0.000 45.828 ( 0.000 0.000 0.000) 0.000 46.404 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 7 (5/126) ======================= q-point: ( 0.00 0.06 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.641 ( 0.000 32.821 0.000) 32.821 0.822 ( 0.000 41.341 0.000) 41.341 1.500 ( 0.000 73.397 0.000) 73.397 3.232 ( 0.000 20.289 0.000) 20.289 3.250 ( 0.000 27.713 0.000) 27.713 3.737 ( 0.000 22.762 0.000) 22.762 4.212 ( 0.000 13.218 0.000) 13.218 4.372 ( 0.000 19.151 0.000) 19.151 4.498 ( 0.000 10.853 0.000) 10.853 4.637 ( 0.000 8.722 0.000) 8.722 4.693 ( 0.000 16.518 0.000) 16.518 4.858 ( 0.000 10.197 0.000) 10.197 5.040 ( 0.000 7.264 0.000) 7.264 5.063 ( 0.000 8.824 0.000) 8.824 5.332 ( 0.000 8.947 0.000) 8.947 5.531 ( 0.000 3.371 0.000) 3.371 5.875 ( 0.000 6.089 0.000) 6.089 5.962 ( 0.000 10.545 0.000) 10.545 6.080 ( 0.000 16.564 0.000) 16.564 6.403 ( 0.000 0.520 0.000) 0.520 6.711 ( 0.000 3.373 0.000) 3.373 6.794 ( 0.000 0.940 0.000) 0.940 6.853 ( 0.000 6.045 0.000) 6.045 7.649 ( 0.000 -1.650 0.000) 1.650 7.676 ( 0.000 -1.781 0.000) 1.781 7.852 ( 0.000 -2.005 0.000) 2.005 7.928 ( 0.000 3.023 0.000) 3.023 7.944 ( 0.000 -10.502 0.000) 10.502 8.009 ( 0.000 -8.915 0.000) 8.915 8.295 ( 0.000 7.356 0.000) 7.356 8.339 ( 0.000 7.168 0.000) 7.168 8.365 ( 0.000 7.490 0.000) 7.490 8.531 ( 0.000 11.958 0.000) 11.958 8.687 ( 0.000 7.346 0.000) 7.346 8.929 ( 0.000 4.076 0.000) 4.076 9.149 ( 0.000 8.673 0.000) 8.673 9.394 ( 0.000 -1.473 0.000) 1.473 9.519 ( 0.000 0.218 0.000) 0.218 9.682 ( 0.000 -7.368 0.000) 7.368 9.725 ( 0.000 -2.041 0.000) 2.041 9.984 ( 0.000 -0.336 0.000) 0.336 10.058 ( 0.000 -6.585 0.000) 6.585 10.243 ( 0.000 0.089 0.000) 0.089 10.350 ( 0.000 -3.367 0.000) 3.367 10.406 ( 0.000 1.208 0.000) 1.208 10.522 ( 0.000 9.256 0.000) 9.256 10.857 ( 0.000 -1.456 0.000) 1.456 10.962 ( 0.000 9.306 0.000) 9.306 10.987 ( 0.000 1.037 0.000) 1.037 11.074 ( 0.000 4.146 0.000) 4.146 11.344 ( 0.000 3.133 0.000) 3.133 11.754 ( 0.000 -1.413 0.000) 1.413 12.041 ( 0.000 6.039 0.000) 6.039 12.115 ( 0.000 2.005 0.000) 2.005 12.380 ( 0.000 8.915 0.000) 8.915 12.385 ( 0.000 -7.508 0.000) 7.508 12.610 ( 0.000 4.199 0.000) 4.199 12.825 ( 0.000 -5.629 0.000) 5.629 12.968 ( 0.000 -3.027 0.000) 3.027 13.410 ( 0.000 2.923 0.000) 2.923 14.053 ( 0.000 -0.468 0.000) 0.468 14.297 ( 0.000 -3.152 0.000) 3.152 14.599 ( 0.000 -3.471 0.000) 3.471 14.632 ( 0.000 -1.984 0.000) 1.984 15.631 ( 0.000 -5.760 0.000) 5.760 15.883 ( 0.000 -1.910 0.000) 1.910 15.935 ( 0.000 -7.570 0.000) 7.570 16.172 ( 0.000 1.677 0.000) 1.677 17.474 ( 0.000 2.560 0.000) 2.560 18.132 ( 0.000 -1.275 0.000) 1.275 18.225 ( 0.000 0.069 0.000) 0.069 18.396 ( 0.000 0.186 0.000) 0.186 19.220 ( 0.000 9.158 0.000) 9.158 19.599 ( 0.000 5.979 0.000) 5.979 19.651 ( 0.000 -4.126 0.000) 4.126 20.042 ( 0.000 11.100 0.000) 11.100 20.223 ( 0.000 7.326 0.000) 7.326 20.242 ( 0.000 11.626 0.000) 11.626 20.272 ( 0.000 10.194 0.000) 10.194 20.467 ( 0.000 0.621 0.000) 0.621 20.528 ( 0.000 2.155 0.000) 2.155 20.544 ( 0.000 -1.340 0.000) 1.340 20.565 ( 0.000 0.907 0.000) 0.907 22.104 ( 0.000 -0.905 0.000) 0.905 24.349 ( 0.000 -2.694 0.000) 2.694 24.473 ( 0.000 -1.775 0.000) 1.775 24.607 ( 0.000 -2.049 0.000) 2.049 24.627 ( 0.000 -0.970 0.000) 0.970 30.056 ( 0.000 0.480 0.000) 0.480 30.076 ( 0.000 0.010 0.000) 0.010 30.391 ( 0.000 -0.366 0.000) 0.366 30.456 ( 0.000 -0.606 0.000) 0.606 34.173 ( 0.000 -0.154 0.000) 0.154 35.140 ( 0.000 -7.148 0.000) 7.148 35.649 ( 0.000 -9.271 0.000) 9.271 36.511 ( 0.000 -5.907 0.000) 5.907 37.621 ( 0.000 -9.997 0.000) 9.997 37.660 ( 0.000 -2.173 0.000) 2.173 37.870 ( 0.000 -6.501 0.000) 6.501 37.968 ( 0.000 0.902 0.000) 0.902 40.818 ( 0.000 -1.581 0.000) 1.581 41.758 ( 0.000 -4.536 0.000) 4.536 41.819 ( 0.000 -4.044 0.000) 4.044 42.400 ( 0.000 -6.948 0.000) 6.948 43.417 ( 0.000 -9.630 0.000) 9.630 43.940 ( 0.000 -11.068 0.000) 11.068 44.214 ( 0.000 -15.118 0.000) 15.118 45.567 ( 0.000 -22.299 0.000) 22.299 ======================= Grid point 8 (6/126) ======================= q-point: ( 0.17 0.06 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( 27.131 28.392 5.069) 39.597 1.322 ( 36.713 26.574 22.887) 50.772 2.109 ( 54.274 42.928 24.335) 73.353 3.246 ( 8.118 20.763 -22.418) 31.615 3.281 ( -3.149 23.050 11.330) 25.877 3.574 ( -14.262 26.427 3.544) 30.239 4.105 ( -12.667 13.680 4.308) 19.135 4.132 ( -13.984 10.854 -37.473) 41.443 4.521 ( -12.666 12.720 1.212) 17.991 4.555 ( -7.301 16.488 -1.010) 18.060 4.751 ( 7.296 16.709 0.553) 18.241 4.869 ( -1.666 6.325 0.626) 6.570 4.939 ( -10.788 6.042 0.400) 12.371 4.991 ( -3.408 10.706 16.272) 19.774 5.225 ( -0.105 13.533 0.412) 13.540 5.414 ( -5.718 6.783 2.867) 9.323 5.830 ( -4.322 11.098 2.493) 12.168 5.981 ( 0.152 13.084 -1.117) 13.133 6.042 ( -4.712 11.490 -7.044) 14.278 6.226 ( 2.925 12.162 -1.836) 12.642 6.756 ( -1.269 2.617 -3.148) 4.286 6.924 ( 12.744 -0.075 -3.569) 13.235 7.162 ( 12.810 1.904 0.496) 12.960 7.392 ( -17.854 -1.095 -18.308) 25.596 7.653 ( -16.386 -4.679 7.045) 18.440 7.730 ( 5.946 -0.620 -2.503) 6.481 7.910 ( -0.254 -1.943 12.630) 12.782 7.978 ( 1.431 1.994 -0.389) 2.485 8.086 ( 7.902 -2.620 -6.710) 10.693 8.205 ( -8.136 8.075 5.063) 12.532 8.299 ( -7.920 7.878 0.950) 11.211 8.434 ( 2.237 9.212 -10.553) 14.185 8.470 ( -6.558 11.120 7.363) 14.862 8.709 ( 2.489 5.724 -1.406) 6.398 8.746 ( -22.047 5.608 -5.077) 23.309 8.853 ( -6.641 1.504 10.609) 12.606 9.370 ( -11.074 1.983 4.841) 12.247 9.442 ( -3.619 1.747 -4.179) 5.798 9.681 ( 11.616 -1.984 11.388) 16.387 9.782 ( 4.879 -4.007 -2.357) 6.739 9.873 ( -10.110 -3.102 -2.126) 10.786 10.201 ( 7.069 -4.792 -10.289) 13.371 10.365 ( -4.969 3.834 8.890) 10.882 10.445 ( 13.226 -4.259 -5.370) 14.896 10.539 ( 17.989 2.011 -1.127) 18.136 10.626 ( 6.796 8.138 6.356) 12.362 10.813 ( -2.986 8.625 -0.904) 9.172 10.977 ( 4.163 -1.194 4.355) 6.142 11.051 ( 8.039 6.465 4.587) 11.290 11.336 ( 17.613 -7.191 0.780) 19.040 11.537 ( 16.058 -0.379 -0.600) 16.074 11.944 ( 3.607 -1.558 -3.723) 5.413 11.968 ( -5.040 -3.235 3.471) 6.922 12.046 ( -15.591 -1.587 -0.544) 15.681 12.221 ( 4.875 -3.944 2.281) 6.672 12.432 ( 0.658 3.205 -4.948) 5.932 12.622 ( 0.733 3.589 4.409) 5.733 12.882 ( 1.496 9.451 -12.932) 16.087 12.995 ( 7.439 -12.252 -17.769) 22.829 13.459 ( -1.965 -7.914 30.261) 31.341 13.999 ( -4.754 0.033 1.979) 5.149 14.374 ( -4.501 -9.965 4.001) 11.644 14.588 ( -0.337 -4.012 5.379) 6.719 14.783 ( 8.641 -5.787 10.762) 14.966 15.524 ( -12.249 -4.060 -6.345) 14.380 15.689 ( -4.451 -0.363 -4.606) 6.416 16.065 ( 5.698 -6.202 0.842) 8.464 16.306 ( 8.018 -3.300 9.069) 12.547 17.570 ( 9.079 -2.441 -2.152) 9.645 18.076 ( -6.678 -1.554 7.413) 10.098 18.232 ( 0.872 2.957 -4.674) 5.599 18.312 ( -8.328 3.396 0.805) 9.030 19.242 ( 2.636 6.286 -1.508) 6.980 19.533 ( -6.623 3.811 3.777) 8.524 19.660 ( 0.596 -1.811 -1.411) 2.372 19.969 ( -7.030 12.552 -1.027) 14.423 20.223 ( 0.301 8.722 -0.711) 8.756 20.243 ( 0.001 9.384 0.689) 9.410 20.268 ( -0.635 10.781 0.518) 10.812 20.470 ( -0.340 0.402 -0.555) 0.765 20.525 ( 0.536 3.533 1.571) 3.903 20.554 ( 0.837 -0.103 -1.618) 1.825 20.572 ( 0.424 0.368 0.704) 0.901 21.203 ( -42.951 50.547 -17.861) 68.693 24.317 ( -6.098 -0.458 0.533) 6.138 24.379 ( 0.678 -1.049 -2.393) 2.700 24.608 ( -0.527 -1.658 1.226) 2.128 24.727 ( 11.238 -2.666 -2.115) 11.742 30.060 ( 0.145 -0.368 -2.592) 2.622 30.131 ( 3.923 -1.561 -2.906) 5.126 30.373 ( -0.570 0.427 -0.049) 0.714 30.452 ( -0.224 -0.559 -0.846) 1.039 34.678 ( 38.681 -26.015 -45.769) 65.328 35.132 ( -3.506 -7.811 9.177) 12.551 35.528 ( -10.591 -4.748 -3.746) 12.196 36.167 ( -3.555 3.049 -33.314) 33.642 37.560 ( 0.314 -10.389 1.670) 10.527 37.808 ( -0.679 -5.428 13.697) 14.749 37.927 ( 4.498 -4.938 -2.837) 7.257 38.057 ( 7.617 3.817 2.755) 8.955 40.914 ( 8.699 -1.924 8.165) 12.085 41.829 ( 9.151 -5.034 -4.146) 11.237 42.318 ( 3.597 -8.364 3.487) 9.749 42.788 ( -2.959 -27.879 84.217) 88.761 43.337 ( 1.974 -18.451 2.373) 18.707 43.734 ( -40.856 -14.393 -10.158) 44.492 44.616 ( 51.375 -53.438 2.253) 74.162 45.808 ( 19.824 -21.235 -2.830) 29.187 ======================= Grid point 9 (7/126) ======================= q-point: ( 0.33 0.06 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( 35.260 18.963 7.522) 40.736 2.031 ( 35.642 26.727 4.918) 44.820 2.981 ( -13.158 17.786 1.965) 22.211 3.082 ( 1.798 19.946 11.325) 23.007 3.321 ( 8.760 17.869 -16.391) 25.781 3.533 ( -22.902 9.845 -28.487) 37.854 3.633 ( 13.429 19.480 14.419) 27.707 3.846 ( -10.114 16.252 -1.340) 19.189 4.355 ( -0.068 16.357 14.054) 21.566 4.460 ( -2.819 21.992 3.549) 22.454 4.564 ( -11.016 2.482 -1.936) 11.457 4.835 ( -2.553 12.406 -2.068) 12.834 5.025 ( 10.697 15.706 1.331) 19.049 5.117 ( 7.531 11.419 9.720) 16.781 5.285 ( 3.296 13.254 1.299) 13.719 5.543 ( 10.193 6.559 8.774) 14.963 5.705 ( -7.908 9.300 9.934) 15.738 5.943 ( 2.806 14.262 -6.563) 15.948 6.051 ( 2.557 8.288 3.409) 9.319 6.288 ( -3.830 9.358 -3.076) 10.569 6.498 ( -26.016 7.893 -9.409) 28.769 6.937 ( -13.213 -0.645 -15.659) 20.498 7.032 ( -9.173 2.413 -16.793) 19.287 7.235 ( 1.914 -3.156 -7.986) 8.798 7.521 ( -2.132 4.869 0.043) 5.316 7.731 ( -5.795 2.786 -0.072) 6.431 7.782 ( -4.690 3.424 -6.037) 8.376 7.905 ( -7.865 7.256 2.946) 11.099 7.999 ( -8.380 4.581 2.790) 9.950 8.174 ( 5.786 -3.944 -4.029) 8.078 8.206 ( -2.164 8.628 7.376) 11.556 8.337 ( -2.444 4.609 1.094) 5.331 8.506 ( 4.558 6.074 -8.417) 11.337 8.695 ( 0.742 6.201 3.535) 7.176 8.781 ( 4.130 5.671 5.890) 9.160 8.976 ( 1.777 0.008 28.880) 28.935 9.242 ( 1.204 3.212 7.291) 8.057 9.320 ( -4.211 2.293 -6.920) 8.419 9.732 ( -4.065 -3.518 0.128) 5.378 9.817 ( 2.880 -2.023 -11.983) 12.489 9.934 ( 5.251 -3.403 6.698) 9.166 10.270 ( 4.154 -6.810 -5.962) 9.959 10.343 ( -1.360 5.374 8.207) 9.904 10.512 ( 3.148 0.777 -6.501) 7.265 10.643 ( -4.281 6.024 5.523) 9.226 10.868 ( 5.635 10.451 -1.252) 11.939 10.877 ( 13.391 -0.525 -1.884) 13.533 11.056 ( -0.068 -1.045 7.949) 8.018 11.193 ( 2.035 6.201 6.109) 8.939 11.631 ( 9.765 -6.545 -0.322) 11.760 11.781 ( 10.518 -7.860 -0.050) 13.131 11.842 ( 3.839 -4.283 -0.813) 5.809 11.911 ( 1.940 -1.329 -1.091) 2.592 11.999 ( 0.137 4.424 -7.888) 9.045 12.323 ( 2.819 -5.275 2.006) 6.308 12.423 ( 4.798 1.002 -10.482) 11.572 12.641 ( 0.156 3.983 0.077) 3.987 12.797 ( -4.385 -3.595 -10.901) 12.288 12.957 ( -4.952 -1.943 -4.029) 6.673 13.576 ( 0.455 -15.176 19.887) 25.020 13.929 ( -3.057 3.266 1.773) 4.812 14.235 ( -8.211 -3.293 -0.661) 8.871 14.653 ( 4.267 -2.481 3.885) 6.282 14.860 ( -3.395 -1.818 5.767) 6.935 15.276 ( -9.662 2.185 -4.928) 11.064 15.592 ( -4.314 1.095 -4.070) 6.031 16.195 ( 6.508 -8.485 2.212) 10.920 16.452 ( 4.106 -7.746 4.955) 10.070 17.731 ( 9.280 -3.046 -1.112) 9.830 17.992 ( -5.345 -1.588 4.513) 7.173 18.125 ( -10.457 5.214 2.026) 11.859 18.228 ( -0.464 5.894 -3.215) 6.729 19.288 ( 2.517 4.593 -0.289) 5.246 19.441 ( -4.073 -0.764 0.900) 4.241 19.662 ( 0.308 0.185 -0.217) 0.420 19.835 ( -5.908 11.863 -1.493) 13.337 20.228 ( 0.459 9.471 -0.364) 9.489 20.249 ( 0.372 8.076 0.388) 8.094 20.255 ( -0.867 10.957 0.175) 10.993 20.444 ( -1.686 1.740 -0.558) 2.486 20.547 ( 0.015 3.213 -3.163) 4.508 20.562 ( 1.134 6.757 2.789) 7.397 20.580 ( 0.326 0.066 0.580) 0.668 20.759 ( -7.684 32.172 -5.645) 33.555 24.258 ( -1.110 -0.210 1.109) 1.583 24.404 ( 2.492 -1.745 -3.553) 4.677 24.600 ( -1.387 -1.774 3.280) 3.979 24.908 ( 8.353 -5.804 -2.155) 10.397 30.049 ( -0.143 0.057 -1.496) 1.504 30.166 ( 1.373 -0.774 -1.438) 2.133 30.374 ( 0.287 -0.303 0.611) 0.740 30.443 ( -0.244 -0.430 -0.996) 1.112 34.941 ( 12.370 -16.364 -25.838) 32.992 35.077 ( -7.574 -8.661 11.506) 16.272 35.394 ( 1.011 -2.161 -11.930) 12.167 36.097 ( 2.210 -8.504 -8.930) 12.528 37.588 ( 0.897 -15.373 2.727) 15.638 37.824 ( -1.223 -4.607 4.292) 6.415 38.005 ( 4.190 -5.414 -0.746) 6.887 38.208 ( 6.541 8.118 3.531) 11.007 41.222 ( 19.260 -3.231 15.829) 25.138 42.030 ( 15.666 -5.435 -8.876) 18.808 42.358 ( 1.651 -6.267 -1.341) 6.618 42.697 ( -23.855 -8.200 34.386) 42.646 42.850 ( -43.893 -11.051 -16.819) 48.286 43.485 ( 5.439 -22.592 3.866) 23.556 45.242 ( 16.077 -47.591 8.530) 50.952 46.097 ( 12.096 -20.165 -2.623) 23.661 ======================= Grid point 10 (8/126) ======================= q-point: (-0.50 0.06 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( 0.000 24.116 0.000) 24.116 2.446 ( 0.000 12.499 0.000) 12.499 2.779 ( -0.000 25.591 0.000) 25.591 2.859 ( 0.000 15.016 0.000) 15.016 3.121 ( 0.000 5.589 -0.000) 5.589 3.463 ( 0.000 21.448 0.000) 21.448 3.624 ( -0.000 20.453 0.000) 20.453 3.879 ( 0.000 18.304 -0.000) 18.304 4.401 ( 0.000 -0.961 0.000) 0.961 4.451 ( 0.000 23.967 0.000) 23.967 4.633 ( 0.000 9.727 0.000) 9.727 5.048 ( -0.000 2.345 -0.000) 2.345 5.166 ( 0.000 7.489 0.000) 7.489 5.308 ( 0.000 12.231 0.000) 12.231 5.314 ( 0.000 16.428 0.000) 16.428 5.387 ( -0.000 14.773 -0.000) 14.773 5.766 ( 0.000 17.301 0.000) 17.301 5.947 ( 0.000 9.610 0.000) 9.610 6.018 ( 0.000 11.180 0.000) 11.180 6.156 ( 0.000 4.849 0.000) 4.849 6.186 ( -0.000 12.331 -0.000) 12.331 6.604 ( 0.000 -0.522 0.000) 0.522 6.903 ( 0.000 7.046 0.000) 7.046 7.288 ( 0.000 -1.657 0.000) 1.657 7.542 ( 0.000 2.017 -0.000) 2.017 7.665 ( 0.000 14.314 0.000) 14.314 7.731 ( -0.000 3.864 0.000) 3.864 7.837 ( 0.000 1.921 0.000) 1.921 7.960 ( 0.000 -1.344 0.000) 1.344 8.196 ( 0.000 10.224 0.000) 10.224 8.240 ( 0.000 -1.559 0.000) 1.559 8.283 ( 0.000 6.330 0.000) 6.330 8.544 ( 0.000 -0.337 0.000) 0.337 8.692 ( 0.000 2.248 0.000) 2.248 8.866 ( -0.000 10.114 0.000) 10.114 8.967 ( 0.000 6.712 0.000) 6.712 9.204 ( 0.000 -1.233 0.000) 1.233 9.550 ( 0.000 -2.597 0.000) 2.597 9.694 ( 0.000 3.363 -0.000) 3.363 9.698 ( -0.000 -3.502 0.000) 3.502 9.991 ( 0.000 -4.084 0.000) 4.084 10.295 ( 0.000 -13.326 0.000) 13.326 10.361 ( 0.000 5.689 -0.000) 5.689 10.546 ( 0.000 13.080 0.000) 13.080 10.586 ( 0.000 -0.267 0.000) 0.267 10.926 ( -0.000 11.717 0.000) 11.717 10.999 ( -0.000 -0.434 0.000) 0.434 11.036 ( 0.000 0.430 -0.000) 0.430 11.220 ( 0.000 2.494 0.000) 2.494 11.695 ( 0.000 -6.888 0.000) 6.888 11.898 ( -0.000 0.186 0.000) 0.186 11.921 ( 0.000 -4.324 -0.000) 4.324 11.950 ( 0.000 -6.227 -0.000) 6.227 12.004 ( 0.000 -3.192 -0.000) 3.192 12.320 ( 0.000 3.640 0.000) 3.640 12.507 ( -0.000 0.678 0.000) 0.678 12.656 ( -0.000 -5.690 0.000) 5.690 12.668 ( 0.000 -7.480 -0.000) 7.480 12.874 ( 0.000 1.539 -0.000) 1.539 13.628 ( 0.000 -17.889 0.000) 17.889 13.912 ( 0.000 6.085 -0.000) 6.085 14.150 ( 0.000 -0.028 0.000) 0.028 14.735 ( 0.000 2.199 0.000) 2.199 14.795 ( 0.000 -0.890 0.000) 0.890 15.177 ( 0.000 3.597 -0.000) 3.597 15.536 ( 0.000 1.466 0.000) 1.466 16.267 ( 0.000 -7.737 0.000) 7.737 16.500 ( 0.000 -10.459 0.000) 10.459 17.880 ( 0.000 0.092 0.000) 0.092 17.905 ( -0.000 -1.946 0.000) 1.946 18.010 ( 0.000 2.724 0.000) 2.724 18.215 ( 0.000 7.608 0.000) 7.608 19.314 ( 0.000 8.128 0.000) 8.128 19.405 ( 0.000 -7.387 0.000) 7.387 19.668 ( 0.000 1.812 0.000) 1.812 19.771 ( 0.000 10.170 0.000) 10.170 20.233 ( 0.000 8.971 0.000) 8.971 20.245 ( 0.000 11.307 0.000) 11.307 20.255 ( 0.000 8.110 -0.000) 8.110 20.424 ( 0.000 3.152 0.000) 3.152 20.537 ( 0.000 7.478 -0.000) 7.478 20.572 ( 0.000 1.673 0.000) 1.673 20.596 ( 0.000 6.096 0.000) 6.096 20.693 ( 0.000 20.295 -0.000) 20.295 24.256 ( 0.000 -0.419 -0.000) 0.419 24.420 ( 0.000 -1.769 -0.000) 1.769 24.594 ( 0.000 -1.802 0.000) 1.802 24.981 ( 0.000 -6.739 0.000) 6.739 30.044 ( 0.000 0.224 0.000) 0.224 30.174 ( 0.000 -0.549 0.000) 0.549 30.380 ( 0.000 -0.611 0.000) 0.611 30.437 ( 0.000 -0.328 0.000) 0.328 34.986 ( 0.000 -8.901 -0.000) 8.901 35.021 ( -0.000 -11.134 0.000) 11.134 35.388 ( 0.000 -2.636 0.000) 2.636 36.100 ( 0.000 -11.647 0.000) 11.647 37.604 ( 0.000 -17.160 0.000) 17.160 37.822 ( 0.000 -4.439 0.000) 4.439 38.044 ( 0.000 -5.826 -0.000) 5.826 38.283 ( 0.000 8.756 0.000) 8.756 41.597 ( 0.000 -4.456 0.000) 4.456 42.220 ( 0.000 -6.228 -0.000) 6.228 42.225 ( 0.000 -9.962 0.000) 9.962 42.380 ( 0.000 -4.851 -0.000) 4.851 42.489 ( -0.000 -6.021 0.000) 6.021 43.542 ( 0.000 -20.981 0.000) 20.981 45.391 ( 0.000 -39.527 0.000) 39.527 46.201 ( 0.000 -19.801 0.000) 19.801 ======================= Grid point 14 (9/126) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 0.000 35.926 0.000) 35.926 1.665 ( 0.000 42.667 0.000) 42.667 2.916 ( 0.000 66.574 0.000) 66.574 3.726 ( 0.000 26.700 0.000) 26.700 3.926 ( 0.000 35.923 0.000) 35.923 4.243 ( 0.000 24.188 0.000) 24.188 4.503 ( 0.000 14.679 0.000) 14.679 4.718 ( 0.000 9.289 0.000) 9.289 4.733 ( 0.000 12.559 0.000) 12.559 4.891 ( 0.000 21.212 0.000) 21.212 5.179 ( 0.000 21.502 0.000) 21.502 5.201 ( 0.000 16.120 0.000) 16.120 5.280 ( 0.000 17.983 0.000) 17.983 5.290 ( 0.000 21.952 0.000) 21.952 5.655 ( 0.000 21.905 0.000) 21.905 5.708 ( 0.000 17.452 0.000) 17.452 6.044 ( 0.000 10.734 0.000) 10.734 6.243 ( 0.000 15.790 0.000) 15.790 6.446 ( 0.000 4.483 0.000) 4.483 6.494 ( 0.000 22.667 0.000) 22.667 6.828 ( 0.000 8.858 0.000) 8.858 6.839 ( 0.000 4.099 0.000) 4.099 7.053 ( 0.000 14.315 0.000) 14.315 7.541 ( 0.000 -9.338 0.000) 9.338 7.607 ( 0.000 -5.343 0.000) 5.343 7.775 ( 0.000 -4.273 0.000) 4.273 7.841 ( 0.000 -0.134 0.000) 0.134 7.850 ( 0.000 -1.714 0.000) 1.714 8.050 ( 0.000 4.731 0.000) 4.731 8.371 ( 0.000 4.444 0.000) 4.444 8.587 ( 0.000 12.905 0.000) 12.905 8.587 ( 0.000 16.064 0.000) 16.064 8.746 ( 0.000 9.910 0.000) 9.910 8.938 ( 0.000 13.437 0.000) 13.437 9.063 ( 0.000 9.215 0.000) 9.215 9.341 ( 0.000 8.782 0.000) 8.782 9.397 ( 0.000 5.199 0.000) 5.199 9.488 ( 0.000 -4.223 0.000) 4.223 9.622 ( 0.000 3.971 0.000) 3.971 9.675 ( 0.000 -2.583 0.000) 2.583 9.938 ( 0.000 -3.317 0.000) 3.317 9.940 ( 0.000 -4.729 0.000) 4.729 10.204 ( 0.000 -10.083 0.000) 10.083 10.222 ( 0.000 -2.672 0.000) 2.672 10.459 ( 0.000 3.988 0.000) 3.988 10.641 ( 0.000 3.258 0.000) 3.258 10.857 ( 0.000 0.965 0.000) 0.965 11.046 ( 0.000 4.244 0.000) 4.244 11.157 ( 0.000 2.997 0.000) 2.997 11.267 ( 0.000 18.565 0.000) 18.565 11.403 ( 0.000 2.496 0.000) 2.496 11.725 ( 0.000 -1.239 0.000) 1.239 12.121 ( 0.000 -3.306 0.000) 3.306 12.158 ( 0.000 4.268 0.000) 4.268 12.249 ( 0.000 -3.404 0.000) 3.404 12.550 ( 0.000 -17.110 0.000) 17.110 12.607 ( 0.000 12.161 0.000) 12.161 12.712 ( 0.000 5.992 0.000) 5.992 13.033 ( 0.000 6.509 0.000) 6.509 13.484 ( 0.000 4.035 0.000) 4.035 14.046 ( 0.000 0.002 0.000) 0.002 14.210 ( 0.000 -4.900 0.000) 4.900 14.506 ( 0.000 -5.305 0.000) 5.305 14.580 ( 0.000 -3.065 0.000) 3.065 15.509 ( 0.000 -5.305 0.000) 5.305 15.806 ( 0.000 -4.895 0.000) 4.895 15.841 ( 0.000 -1.978 0.000) 1.978 16.158 ( 0.000 -2.867 0.000) 2.867 17.535 ( 0.000 3.222 0.000) 3.222 18.092 ( 0.000 -2.563 0.000) 2.563 18.171 ( 0.000 -4.531 0.000) 4.531 18.397 ( 0.000 -1.590 0.000) 1.590 19.451 ( 0.000 12.643 0.000) 12.643 19.682 ( 0.000 7.057 0.000) 7.057 19.782 ( 0.000 11.578 0.000) 11.578 20.238 ( 0.000 6.733 0.000) 6.733 20.345 ( 0.000 2.993 0.000) 2.993 20.408 ( 0.000 1.506 0.000) 1.506 20.467 ( 0.000 5.881 0.000) 5.881 20.525 ( 0.000 2.016 0.000) 2.016 20.617 ( 0.000 15.618 0.000) 15.618 20.663 ( 0.000 11.773 0.000) 11.773 20.666 ( 0.000 12.808 0.000) 12.808 22.082 ( 0.000 -1.075 0.000) 1.075 24.283 ( 0.000 -3.491 0.000) 3.491 24.426 ( 0.000 -2.744 0.000) 2.744 24.555 ( 0.000 -2.954 0.000) 2.954 24.599 ( 0.000 -1.749 0.000) 1.749 30.069 ( 0.000 0.823 0.000) 0.823 30.077 ( 0.000 0.147 0.000) 0.147 30.380 ( 0.000 -0.727 0.000) 0.727 30.438 ( 0.000 -1.156 0.000) 1.156 34.169 ( 0.000 -0.209 0.000) 0.209 34.953 ( 0.000 -10.796 0.000) 10.796 35.402 ( 0.000 -14.536 0.000) 14.536 36.323 ( 0.000 -12.883 0.000) 12.883 37.407 ( 0.000 -10.665 0.000) 10.665 37.583 ( 0.000 -5.824 0.000) 5.824 37.693 ( 0.000 -10.620 0.000) 10.620 37.929 ( 0.000 -4.885 0.000) 4.885 40.775 ( 0.000 -2.590 0.000) 2.590 41.627 ( 0.000 -8.340 0.000) 8.340 41.701 ( 0.000 -7.473 0.000) 7.473 42.206 ( 0.000 -11.878 0.000) 11.878 43.148 ( 0.000 -16.565 0.000) 16.565 43.627 ( 0.000 -19.467 0.000) 19.467 43.801 ( 0.000 -24.880 0.000) 24.880 44.966 ( 0.000 -35.836 0.000) 35.836 ======================= Grid point 15 (10/126) ======================= q-point: ( 0.17 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 21.527 32.023 8.499) 39.511 1.863 ( 25.901 31.417 23.280) 46.902 3.169 ( 23.223 55.614 5.799) 60.546 3.733 ( 2.161 26.473 -8.364) 27.847 3.867 ( -8.489 30.411 -7.218) 32.388 4.152 ( -5.942 26.549 0.216) 27.207 4.384 ( -22.044 14.086 -18.439) 32.006 4.448 ( -7.733 19.986 -11.812) 24.470 4.766 ( -0.145 12.138 7.345) 14.188 4.898 ( -11.565 15.073 14.266) 23.758 4.933 ( -18.222 6.912 5.337) 20.207 5.192 ( 3.832 17.070 3.196) 17.784 5.308 ( 1.089 20.290 7.003) 21.492 5.364 ( 6.619 35.686 -4.265) 36.544 5.539 ( -3.467 18.452 -5.809) 19.653 5.715 ( 0.427 22.848 1.320) 22.890 6.029 ( -1.121 9.529 -1.717) 9.747 6.279 ( -3.501 13.305 -2.435) 13.972 6.341 ( 2.416 20.950 -0.057) 21.089 6.586 ( 1.820 20.775 2.863) 21.050 6.843 ( 0.347 5.840 -0.731) 5.895 6.940 ( 8.187 2.334 -1.324) 8.616 7.229 ( 5.254 6.208 -8.611) 11.845 7.360 ( -8.903 -0.482 -10.140) 13.502 7.602 ( -8.590 -0.627 2.619) 9.002 7.635 ( 7.539 -5.934 -1.719) 9.747 7.929 ( 2.394 1.814 8.256) 8.786 8.026 ( 14.712 0.455 8.886) 17.193 8.059 ( 1.291 3.158 -9.682) 10.265 8.351 ( -12.475 7.773 -1.273) 14.754 8.510 ( -4.393 10.910 1.215) 11.824 8.685 ( -5.774 8.444 9.908) 14.241 8.719 ( -0.082 18.859 -1.473) 18.917 8.849 ( -7.550 6.222 -1.576) 9.910 8.906 ( -8.083 5.500 5.783) 11.359 8.929 ( -14.868 13.075 -5.833) 20.641 9.426 ( -8.277 3.376 2.220) 9.211 9.511 ( 3.663 4.965 -3.980) 7.342 9.654 ( 7.534 0.864 7.592) 10.730 9.709 ( 0.005 -1.902 3.124) 3.658 9.816 ( -7.337 -1.380 -0.286) 7.471 10.109 ( 8.092 -4.728 -11.344) 14.714 10.343 ( 15.646 -5.628 -7.913) 18.414 10.403 ( 4.360 -1.127 7.735) 8.950 10.532 ( 11.361 -1.905 5.379) 12.714 10.755 ( 8.605 4.687 4.718) 10.875 10.947 ( 7.835 -0.350 -0.416) 7.854 10.994 ( -2.719 7.581 2.222) 8.355 11.199 ( 4.350 1.085 -1.855) 4.852 11.333 ( 8.965 10.394 -0.054) 13.726 11.522 ( 9.533 -0.267 -0.316) 9.542 11.779 ( 2.693 -6.447 1.674) 7.185 11.939 ( -18.068 -4.335 9.486) 20.862 12.074 ( -5.258 2.188 0.341) 5.706 12.247 ( 1.637 4.062 -3.538) 5.630 12.564 ( -0.977 -0.555 -1.430) 1.818 12.581 ( 3.601 -3.145 -20.546) 21.095 12.776 ( 0.722 -2.516 7.001) 7.474 13.050 ( 1.194 6.810 -2.464) 7.340 13.389 ( -9.426 0.203 7.349) 11.954 14.028 ( -0.850 2.681 0.483) 2.854 14.215 ( -1.742 -5.977 2.528) 6.719 14.521 ( 2.009 -3.115 2.992) 4.763 14.696 ( 8.868 -3.869 1.996) 9.879 15.462 ( -4.777 -1.838 -3.123) 5.996 15.679 ( -3.775 -0.543 -5.597) 6.773 15.944 ( 4.607 -5.581 -0.258) 7.242 16.210 ( 2.761 -5.722 6.447) 9.051 17.586 ( 5.779 2.279 -1.342) 6.355 18.033 ( -6.417 -2.667 6.845) 9.754 18.209 ( 4.017 -4.195 -6.363) 8.615 18.336 ( -6.682 -0.769 1.336) 6.857 19.450 ( 0.183 12.544 -0.965) 12.582 19.657 ( -3.971 8.909 3.006) 10.207 19.759 ( -1.299 10.169 -0.265) 10.255 20.171 ( -6.820 6.803 0.798) 9.666 20.347 ( 0.286 2.766 -0.296) 2.796 20.415 ( 0.222 1.913 -0.052) 1.927 20.456 ( -0.640 6.664 -0.429) 6.708 20.520 ( -0.603 1.898 0.458) 2.043 20.625 ( 0.515 15.202 0.498) 15.219 20.643 ( -0.072 10.292 -0.543) 10.307 20.730 ( 3.758 14.830 3.035) 15.597 21.793 ( -22.602 14.742 -10.395) 28.918 24.286 ( -0.773 -2.335 -0.271) 2.475 24.357 ( -2.985 -1.165 -0.683) 3.277 24.569 ( -0.120 -2.245 -1.327) 2.611 24.647 ( 6.153 -4.801 -0.645) 7.831 30.059 ( 0.084 0.356 -1.826) 1.862 30.113 ( 2.484 -0.421 0.021) 2.519 30.371 ( -0.662 -0.558 -0.051) 0.867 30.436 ( -0.110 -1.059 -0.715) 1.282 34.358 ( 20.653 -8.750 -16.329) 27.744 34.934 ( -4.311 -11.171 7.845) 14.316 35.347 ( -5.230 -11.979 1.454) 13.151 36.087 ( -12.294 -9.550 -17.979) 23.782 37.361 ( -2.096 -9.701 -2.000) 10.125 37.672 ( 0.418 -7.978 10.409) 13.121 37.761 ( 6.732 -11.013 -5.477) 14.022 38.041 ( 10.643 -5.028 3.945) 12.414 40.859 ( 7.648 -3.329 7.326) 11.101 41.687 ( 8.552 -8.822 -3.849) 12.875 42.072 ( 12.892 -15.240 23.498) 30.832 42.289 ( 7.581 -18.990 28.981) 35.468 43.007 ( -11.823 -16.454 5.479) 20.989 43.344 ( -37.101 -23.191 -12.935) 45.625 43.871 ( 26.107 -30.052 -17.461) 43.469 45.227 ( 20.199 -35.099 0.783) 40.504 ======================= Grid point 16 (11/126) ======================= q-point: ( 0.33 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.162 ( 29.099 26.499 5.759) 39.776 2.577 ( 33.057 25.099 17.694) 45.119 3.414 ( -18.097 22.921 -9.699) 30.773 3.556 ( -6.645 24.435 -11.183) 27.682 3.722 ( -20.783 20.349 0.095) 29.087 3.852 ( 2.773 23.152 -13.722) 27.056 4.127 ( -1.183 24.863 11.569) 27.448 4.292 ( -5.265 25.577 -5.364) 26.659 4.616 ( -9.763 8.771 -3.431) 13.565 4.813 ( -0.880 24.962 14.900) 29.084 4.887 ( 2.275 17.994 10.701) 21.059 5.196 ( -3.529 21.186 -5.128) 22.082 5.367 ( 2.591 14.013 3.878) 14.769 5.529 ( 13.295 27.221 1.990) 30.359 5.635 ( 9.686 23.096 5.278) 25.595 5.806 ( 9.301 19.916 4.677) 22.473 5.920 ( -7.892 12.997 -1.372) 15.267 6.240 ( 2.266 14.931 -2.506) 15.309 6.380 ( 0.348 23.476 -0.067) 23.479 6.495 ( -14.435 11.560 -3.893) 18.898 6.709 ( -13.015 8.845 -0.064) 15.737 6.996 ( -8.549 5.557 -12.885) 16.431 7.138 ( -4.587 13.126 -6.387) 15.302 7.260 ( 8.121 6.553 -12.229) 16.076 7.628 ( 5.363 5.891 0.654) 7.993 7.743 ( -2.273 -1.003 0.540) 2.543 7.870 ( -4.588 3.760 -7.873) 9.858 8.010 ( -6.227 0.756 -7.921) 10.104 8.083 ( 4.580 3.057 4.500) 7.112 8.192 ( -8.305 10.395 -1.917) 13.442 8.445 ( -0.923 12.411 10.358) 16.191 8.488 ( -4.213 10.752 2.950) 11.918 8.697 ( -8.010 11.605 -3.223) 14.465 8.799 ( -4.346 4.382 6.639) 9.064 8.921 ( 7.443 5.938 15.347) 18.061 9.045 ( 11.404 9.958 9.339) 17.789 9.334 ( -0.927 4.552 4.977) 6.808 9.392 ( -7.750 5.188 -10.245) 13.854 9.655 ( -3.695 -2.343 0.091) 4.376 9.792 ( 5.018 0.398 -3.152) 5.939 9.888 ( 5.475 -1.338 8.114) 9.880 10.137 ( 0.493 -4.501 -13.968) 14.684 10.437 ( -0.277 2.741 5.051) 5.753 10.494 ( 7.489 -1.665 -3.157) 8.296 10.811 ( 1.735 5.297 3.607) 6.640 10.843 ( 7.872 -1.572 4.574) 9.239 11.034 ( 5.915 5.674 -3.304) 8.837 11.080 ( 4.419 3.453 2.184) 6.018 11.319 ( 7.381 0.747 -0.771) 7.458 11.479 ( 0.682 -3.432 6.473) 7.358 11.597 ( -4.153 -7.262 1.641) 8.525 11.736 ( 5.871 -6.655 -4.221) 9.827 11.888 ( 4.892 -1.480 0.511) 5.136 12.071 ( 3.657 -1.302 -4.193) 5.714 12.219 ( -1.299 0.138 -0.084) 1.309 12.492 ( -0.830 0.455 -18.531) 18.555 12.539 ( -2.981 -8.948 1.466) 9.544 12.783 ( -3.449 3.201 5.444) 7.196 12.987 ( -5.995 3.455 -0.748) 6.960 13.287 ( -6.168 -11.088 8.426) 15.231 14.039 ( 1.751 6.887 0.477) 7.122 14.176 ( -2.188 -1.990 -0.768) 3.055 14.626 ( 6.780 -0.773 4.977) 8.446 14.806 ( 1.374 -3.055 1.477) 3.661 15.342 ( -5.266 4.279 -3.324) 7.555 15.617 ( -2.010 1.340 -3.677) 4.399 16.031 ( 5.856 -7.354 -0.872) 9.441 16.265 ( -0.232 -9.789 4.945) 10.970 17.720 ( 9.355 0.763 -1.514) 9.507 17.953 ( -4.697 -2.276 3.579) 6.329 18.169 ( -9.909 -0.911 2.853) 10.352 18.256 ( 1.738 -2.018 -4.344) 5.095 19.449 ( 0.231 11.848 -0.891) 11.884 19.580 ( -4.967 11.867 3.050) 13.221 19.760 ( 1.473 8.594 -0.539) 8.736 20.036 ( -7.332 7.027 0.438) 10.165 20.354 ( 0.690 2.372 -0.508) 2.522 20.400 ( -1.546 2.100 0.272) 2.622 20.457 ( 0.791 8.935 -0.722) 8.999 20.510 ( -0.709 0.540 0.455) 1.000 20.633 ( 0.206 13.405 0.257) 13.409 20.643 ( -0.016 11.082 -0.357) 11.087 20.818 ( 4.008 17.132 3.319) 17.905 21.393 ( -14.202 25.596 -7.973) 30.339 24.255 ( -1.272 -0.090 0.894) 1.557 24.360 ( 2.144 -2.437 -2.641) 4.185 24.556 ( -1.162 -2.453 1.690) 3.197 24.757 ( 5.448 -8.586 -1.625) 10.297 30.054 ( 0.057 0.470 -1.069) 1.169 30.148 ( 1.389 -0.844 -0.408) 1.676 30.363 ( -0.228 -0.846 0.267) 0.916 30.430 ( -0.101 -0.864 -0.764) 1.158 34.621 ( 15.667 -13.814 -18.115) 27.648 34.865 ( -7.964 -11.538 11.272) 17.989 35.290 ( -0.308 -7.915 -1.160) 8.006 35.864 ( -5.589 -13.878 -8.315) 17.117 37.326 ( -1.205 -11.095 -0.189) 11.161 37.694 ( -0.960 -8.147 4.196) 9.215 37.840 ( 4.124 -10.749 -2.860) 11.863 38.248 ( 8.369 -3.876 3.533) 9.876 41.131 ( 16.911 -5.635 14.441) 22.941 41.876 ( 14.394 -9.583 -7.476) 18.839 42.179 ( 1.274 -11.313 -2.838) 11.733 42.459 ( -16.993 -15.023 33.233) 40.235 42.562 ( -36.468 -16.999 -12.382) 42.097 42.958 ( 5.253 -26.587 2.365) 27.205 44.271 ( 20.466 -45.901 -7.333) 50.789 45.535 ( 12.236 -34.517 -0.207) 36.622 ======================= Grid point 17 (12/126) ======================= q-point: (-0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.708 ( -0.000 22.585 0.000) 22.585 2.817 ( 0.000 22.829 0.000) 22.829 3.265 ( 0.000 24.765 0.000) 24.765 3.286 ( 0.000 19.232 -0.000) 19.232 3.350 ( -0.000 20.486 -0.000) 20.486 3.976 ( 0.000 24.349 0.000) 24.349 4.101 ( 0.000 24.761 0.000) 24.761 4.251 ( 0.000 11.738 -0.000) 11.738 4.543 ( 0.000 22.672 0.000) 22.672 4.868 ( 0.000 12.287 0.000) 12.287 4.950 ( 0.000 23.119 0.000) 23.119 5.212 ( -0.000 15.854 -0.000) 15.854 5.349 ( 0.000 11.856 0.000) 11.856 5.714 ( 0.000 23.455 0.000) 23.455 5.786 ( 0.000 25.152 -0.000) 25.152 5.812 ( -0.000 28.210 0.000) 28.210 6.095 ( 0.000 13.279 0.000) 13.279 6.191 ( 0.000 15.790 -0.000) 15.790 6.287 ( 0.000 13.207 0.000) 13.207 6.384 ( -0.000 21.224 -0.000) 21.224 6.519 ( 0.000 16.772 0.000) 16.772 6.649 ( -0.000 8.015 0.000) 8.015 7.108 ( 0.000 14.049 0.000) 14.049 7.390 ( 0.000 12.235 -0.000) 12.235 7.597 ( 0.000 2.911 -0.000) 2.911 7.832 ( -0.000 2.955 -0.000) 2.955 7.870 ( 0.000 5.010 0.000) 5.010 7.910 ( 0.000 -0.969 0.000) 0.969 7.996 ( -0.000 16.524 0.000) 16.524 8.195 ( 0.000 -1.111 0.000) 1.111 8.433 ( 0.000 5.610 -0.000) 5.610 8.505 ( 0.000 17.633 0.000) 17.633 8.575 ( 0.000 6.201 -0.000) 6.201 8.766 ( 0.000 5.739 0.000) 5.739 9.140 ( -0.000 9.210 0.000) 9.210 9.142 ( 0.000 11.399 -0.000) 11.399 9.189 ( -0.000 5.513 -0.000) 5.513 9.447 ( 0.000 -7.438 0.000) 7.438 9.641 ( 0.000 -0.710 0.000) 0.710 9.799 ( 0.000 6.824 0.000) 6.824 9.953 ( 0.000 -0.387 0.000) 0.387 10.075 ( 0.000 -7.252 0.000) 7.252 10.456 ( 0.000 2.828 0.000) 2.828 10.571 ( 0.000 -1.288 0.000) 1.288 10.797 ( 0.000 10.214 0.000) 10.214 10.943 ( -0.000 -3.858 0.000) 3.858 11.092 ( 0.000 5.805 0.000) 5.805 11.134 ( -0.000 5.575 0.000) 5.575 11.313 ( 0.000 6.973 0.000) 6.973 11.519 ( 0.000 -9.946 0.000) 9.946 11.588 ( 0.000 -19.192 0.000) 19.192 11.807 ( 0.000 -7.981 0.000) 7.981 11.959 ( -0.000 -1.923 0.000) 1.923 12.045 ( 0.000 7.401 0.000) 7.401 12.331 ( 0.000 -12.364 0.000) 12.364 12.360 ( -0.000 -2.765 -0.000) 2.765 12.521 ( 0.000 -3.614 -0.000) 3.614 12.732 ( 0.000 7.866 0.000) 7.866 12.919 ( 0.000 3.158 -0.000) 3.158 13.245 ( 0.000 -17.159 0.000) 17.159 14.068 ( 0.000 8.706 0.000) 8.706 14.149 ( 0.000 0.069 0.000) 0.069 14.748 ( 0.000 -0.945 0.000) 0.945 14.780 ( -0.000 -0.563 -0.000) 0.563 15.281 ( 0.000 6.520 -0.000) 6.520 15.581 ( 0.000 2.933 0.000) 2.933 16.102 ( 0.000 -7.774 0.000) 7.774 16.262 ( 0.000 -12.103 0.000) 12.103 17.867 ( 0.000 -1.369 0.000) 1.369 17.889 ( -0.000 -0.470 0.000) 0.470 18.044 ( 0.000 0.424 0.000) 0.424 18.265 ( 0.000 -2.268 0.000) 2.268 19.450 ( 0.000 10.810 0.000) 10.810 19.538 ( 0.000 13.148 0.000) 13.148 19.782 ( 0.000 8.928 -0.000) 8.928 19.957 ( 0.000 6.608 0.000) 6.608 20.364 ( 0.000 2.358 -0.000) 2.358 20.380 ( -0.000 1.988 0.000) 1.988 20.465 ( 0.000 11.352 0.000) 11.352 20.503 ( 0.000 -1.591 0.000) 1.591 20.637 ( -0.000 15.208 -0.000) 15.208 20.639 ( 0.000 9.169 0.000) 9.169 20.874 ( 0.000 18.488 -0.000) 18.488 21.240 ( 0.000 25.841 -0.000) 25.841 24.249 ( 0.000 -0.204 -0.000) 0.204 24.376 ( 0.000 -2.446 -0.000) 2.446 24.548 ( 0.000 -2.570 0.000) 2.570 24.805 ( 0.000 -10.068 -0.000) 10.068 30.052 ( 0.000 0.585 0.000) 0.585 30.160 ( 0.000 -0.834 0.000) 0.834 30.362 ( 0.000 -1.110 0.000) 1.110 30.427 ( 0.000 -0.752 0.000) 0.752 34.751 ( 0.000 -14.218 -0.000) 14.218 34.779 ( -0.000 -10.707 0.000) 10.707 35.296 ( 0.000 -6.433 0.000) 6.433 35.795 ( 0.000 -17.425 0.000) 17.425 37.315 ( 0.000 -11.865 0.000) 11.865 37.694 ( 0.000 -8.122 -0.000) 8.122 37.873 ( 0.000 -10.995 0.000) 10.995 38.337 ( 0.000 -3.341 0.000) 3.341 41.472 ( 0.000 -7.765 0.000) 7.765 41.954 ( 0.000 -15.972 0.000) 15.972 42.048 ( 0.000 -10.582 -0.000) 10.582 42.245 ( 0.000 -8.503 -0.000) 8.503 42.317 ( -0.000 -10.793 0.000) 10.793 43.032 ( 0.000 -27.574 0.000) 27.574 44.447 ( 0.000 -50.020 0.000) 50.020 45.646 ( 0.000 -34.271 0.000) 34.271 ======================= Grid point 21 (13/126) ======================= q-point: ( 0.00 0.19 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( 0.000 38.576 0.000) 38.576 2.533 ( 0.000 43.642 0.000) 43.642 4.106 ( 0.000 49.069 0.000) 49.069 4.224 ( 0.000 20.965 0.000) 20.965 4.549 ( 0.000 23.148 0.000) 23.148 4.677 ( 0.000 20.762 0.000) 20.762 4.781 ( 0.000 13.581 0.000) 13.581 4.947 ( 0.000 16.349 0.000) 16.349 4.991 ( 0.000 12.673 0.000) 12.673 5.298 ( 0.000 17.418 0.000) 17.418 5.390 ( 0.000 7.334 0.000) 7.334 5.443 ( 0.000 10.353 0.000) 10.353 5.654 ( 0.000 18.501 0.000) 18.501 5.994 ( 0.000 33.761 0.000) 33.761 6.097 ( 0.000 21.899 0.000) 21.899 6.150 ( 0.000 17.829 0.000) 17.829 6.349 ( 0.000 20.003 0.000) 20.003 6.547 ( 0.000 14.161 0.000) 14.161 6.617 ( 0.000 14.804 0.000) 14.804 6.883 ( 0.000 14.769 0.000) 14.769 6.984 ( 0.000 10.631 0.000) 10.631 7.094 ( 0.000 16.338 0.000) 16.338 7.280 ( 0.000 -4.305 0.000) 4.305 7.498 ( 0.000 -3.298 0.000) 3.298 7.501 ( 0.000 19.069 0.000) 19.069 7.767 ( 0.000 0.652 0.000) 0.652 7.861 ( 0.000 2.153 0.000) 2.153 7.871 ( 0.000 5.577 0.000) 5.577 8.185 ( 0.000 9.519 0.000) 9.519 8.535 ( 0.000 11.740 0.000) 11.740 8.842 ( 0.000 12.337 0.000) 12.337 8.874 ( 0.000 12.892 0.000) 12.892 8.963 ( 0.000 8.768 0.000) 8.768 9.092 ( 0.000 1.947 0.000) 1.947 9.269 ( 0.000 10.312 0.000) 10.312 9.484 ( 0.000 6.131 0.000) 6.131 9.502 ( 0.000 3.519 0.000) 3.519 9.597 ( 0.000 10.755 0.000) 10.755 9.718 ( 0.000 1.570 0.000) 1.570 9.719 ( 0.000 13.758 0.000) 13.758 9.886 ( 0.000 -0.443 0.000) 0.443 9.924 ( 0.000 1.018 0.000) 1.018 10.052 ( 0.000 2.506 0.000) 2.506 10.141 ( 0.000 -4.555 0.000) 4.555 10.557 ( 0.000 5.531 0.000) 5.531 10.695 ( 0.000 2.840 0.000) 2.840 10.883 ( 0.000 1.790 0.000) 1.790 11.117 ( 0.000 1.756 0.000) 1.756 11.162 ( 0.000 -2.533 0.000) 2.533 11.436 ( 0.000 0.960 0.000) 0.960 11.545 ( 0.000 3.743 0.000) 3.743 11.697 ( 0.000 -1.697 0.000) 1.697 12.076 ( 0.000 4.149 0.000) 4.149 12.174 ( 0.000 -6.146 0.000) 6.146 12.242 ( 0.000 -7.462 0.000) 7.462 12.264 ( 0.000 3.871 0.000) 3.871 12.834 ( 0.000 5.658 0.000) 5.658 12.852 ( 0.000 10.585 0.000) 10.585 13.153 ( 0.000 4.126 0.000) 4.126 13.553 ( 0.000 2.254 0.000) 2.254 14.056 ( 0.000 0.958 0.000) 0.958 14.133 ( 0.000 -1.896 0.000) 1.896 14.414 ( 0.000 -3.037 0.000) 3.037 14.516 ( 0.000 -2.984 0.000) 2.984 15.443 ( 0.000 -1.098 0.000) 1.098 15.742 ( 0.000 -1.643 0.000) 1.643 15.813 ( 0.000 -0.649 0.000) 0.649 16.071 ( 0.000 -5.429 0.000) 5.429 17.598 ( 0.000 3.022 0.000) 3.022 18.039 ( 0.000 -2.433 0.000) 2.433 18.075 ( 0.000 -4.662 0.000) 4.662 18.317 ( 0.000 -5.775 0.000) 5.775 19.683 ( 0.000 9.601 0.000) 9.601 19.878 ( 0.000 10.265 0.000) 10.265 20.006 ( 0.000 8.524 0.000) 8.524 20.278 ( 0.000 -1.438 0.000) 1.438 20.392 ( 0.000 3.926 0.000) 3.926 20.437 ( 0.000 2.384 0.000) 2.384 20.479 ( 0.000 0.093 0.000) 0.093 20.677 ( 0.000 9.208 0.000) 9.208 20.973 ( 0.000 18.594 0.000) 18.594 20.991 ( 0.000 18.465 0.000) 18.465 20.994 ( 0.000 18.312 0.000) 18.312 22.069 ( 0.000 -0.075 0.000) 0.075 24.223 ( 0.000 -2.126 0.000) 2.126 24.373 ( 0.000 -2.325 0.000) 2.325 24.496 ( 0.000 -2.776 0.000) 2.776 24.563 ( 0.000 -1.688 0.000) 1.688 30.083 ( 0.000 0.437 0.000) 0.437 30.087 ( 0.000 0.995 0.000) 0.995 30.362 ( 0.000 -1.050 0.000) 1.050 30.411 ( 0.000 -1.594 0.000) 1.594 34.167 ( 0.000 0.032 0.000) 0.032 34.731 ( 0.000 -10.781 0.000) 10.781 35.096 ( 0.000 -15.277 0.000) 15.277 36.009 ( 0.000 -17.697 0.000) 17.697 37.202 ( 0.000 -9.849 0.000) 9.849 37.416 ( 0.000 -10.847 0.000) 10.847 37.473 ( 0.000 -10.675 0.000) 10.675 37.776 ( 0.000 -10.044 0.000) 10.044 40.721 ( 0.000 -2.603 0.000) 2.603 41.432 ( 0.000 -10.777 0.000) 10.777 41.526 ( 0.000 -9.734 0.000) 9.734 41.943 ( 0.000 -13.915 0.000) 13.915 42.778 ( 0.000 -19.619 0.000) 19.619 43.186 ( 0.000 -23.778 0.000) 23.778 43.257 ( 0.000 -28.374 0.000) 28.374 44.194 ( 0.000 -39.684 0.000) 39.684 ======================= Grid point 22 (14/126) ======================= q-point: ( 0.17 0.19 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( 21.847 32.857 11.755) 41.171 2.595 ( 7.610 39.501 10.005) 41.453 4.151 ( 0.693 37.540 -1.030) 37.561 4.233 ( 2.129 22.098 -8.327) 23.711 4.389 ( -14.689 20.977 -7.521) 26.690 4.583 ( -6.568 18.793 -12.260) 23.380 4.683 ( -20.284 15.629 -3.970) 25.913 4.833 ( -5.341 15.024 -4.513) 16.571 5.077 ( 6.025 18.635 8.466) 21.336 5.099 ( -9.035 13.383 -4.146) 16.671 5.262 ( -5.549 18.786 23.513) 30.604 5.457 ( -2.911 12.014 5.933) 13.711 5.707 ( 1.742 15.691 1.359) 15.846 5.983 ( -9.362 22.312 -7.214) 25.249 6.087 ( 5.626 27.244 -1.215) 27.846 6.206 ( 7.840 26.742 -0.094) 27.868 6.291 ( -1.511 19.557 -1.774) 19.695 6.552 ( -1.051 14.352 -0.229) 14.392 6.762 ( 9.117 17.130 2.913) 19.622 6.945 ( -5.473 8.867 -0.148) 10.421 6.984 ( 3.782 15.043 0.413) 15.516 7.059 ( -0.790 10.242 -0.060) 10.272 7.315 ( 5.046 0.268 -2.943) 5.848 7.512 ( 8.926 -1.248 -15.059) 17.550 7.574 ( 7.912 21.473 -8.919) 24.561 7.678 ( -3.750 4.426 2.402) 6.279 7.949 ( 3.283 2.490 11.905) 12.598 8.054 ( 11.516 3.901 7.195) 14.128 8.210 ( 5.079 10.519 -2.835) 12.020 8.512 ( -12.019 8.129 -0.636) 14.524 8.720 ( -8.393 10.063 6.467) 14.613 8.849 ( -4.812 10.543 1.271) 11.659 8.973 ( -9.024 5.137 3.841) 11.071 9.002 ( 1.020 5.562 -6.463) 8.587 9.126 ( -7.497 19.075 0.306) 20.498 9.258 ( -4.336 15.637 -3.206) 16.541 9.454 ( -3.400 1.288 -3.677) 5.171 9.644 ( -7.959 5.311 0.809) 9.602 9.715 ( -1.398 4.839 13.443) 14.356 9.762 ( 5.539 9.082 -4.311) 11.478 9.891 ( -5.583 8.206 6.593) 11.915 10.041 ( 11.542 -0.059 -7.793) 13.927 10.203 ( 20.027 -7.670 -4.209) 21.855 10.322 ( 13.113 -2.755 -2.904) 13.710 10.567 ( -1.035 4.935 8.401) 9.798 10.831 ( 11.270 2.997 0.928) 11.698 10.923 ( 4.867 -1.916 0.408) 5.247 11.098 ( -1.937 1.949 2.855) 3.963 11.180 ( 3.904 -2.789 -6.938) 8.436 11.435 ( 0.495 0.655 -0.746) 1.109 11.540 ( -0.271 -3.097 -1.248) 3.350 11.687 ( -2.662 -3.452 2.941) 5.258 11.968 ( -9.998 9.037 9.410) 16.437 12.087 ( -8.008 -0.447 1.070) 8.092 12.239 ( 4.823 -8.189 -7.495) 12.104 12.379 ( 6.155 1.612 -6.628) 9.187 12.714 ( -9.633 2.967 -5.253) 11.366 12.834 ( -2.562 6.840 4.719) 8.696 13.145 ( -2.655 2.253 2.602) 4.347 13.426 ( -12.359 2.830 -0.513) 12.689 14.101 ( 4.487 4.280 1.208) 6.317 14.133 ( 0.227 -2.042 0.692) 2.168 14.467 ( 5.335 -2.053 2.062) 6.077 14.627 ( 9.018 -2.744 0.122) 9.427 15.454 ( 1.036 0.986 -1.550) 2.109 15.678 ( -2.465 0.590 -5.239) 5.820 15.855 ( 2.608 -3.149 -0.256) 4.096 16.087 ( -0.130 -6.358 4.765) 7.947 17.635 ( 4.299 2.462 -1.022) 5.058 17.977 ( -5.706 -2.647 5.399) 8.290 18.117 ( 3.498 -4.402 -5.028) 7.543 18.272 ( -4.893 -4.984 0.902) 7.042 19.691 ( 1.138 10.268 -0.933) 10.373 19.863 ( -2.041 9.928 1.569) 10.257 19.976 ( -2.507 9.119 -0.198) 9.460 20.232 ( -5.261 0.100 0.721) 5.311 20.385 ( -0.715 2.632 0.211) 2.736 20.431 ( 0.072 1.341 -0.741) 1.534 20.474 ( -0.462 0.902 -0.390) 1.086 20.678 ( -0.292 9.616 1.070) 9.680 20.953 ( -1.111 18.310 -0.005) 18.343 20.984 ( 0.884 18.581 -0.597) 18.612 21.071 ( 4.504 17.982 3.568) 18.878 21.971 ( -8.329 5.293 -5.383) 11.241 24.241 ( 1.656 -1.735 -0.053) 2.399 24.335 ( -2.890 -0.933 0.235) 3.046 24.515 ( 1.634 -3.248 -3.224) 4.860 24.561 ( 0.316 -3.168 1.133) 3.379 30.072 ( -0.145 0.889 -0.964) 1.319 30.110 ( 1.409 0.092 0.439) 1.479 30.354 ( -0.707 -1.081 -0.069) 1.294 30.410 ( 0.041 -1.465 -0.465) 1.538 34.249 ( 9.885 -3.122 -7.204) 12.624 34.709 ( -4.113 -10.670 6.359) 13.084 35.081 ( -0.990 -13.885 0.041) 13.920 35.831 ( -13.385 -15.057 -8.103) 21.715 37.169 ( -2.238 -9.402 -1.988) 9.867 37.489 ( 0.656 -10.380 6.961) 12.515 37.510 ( 6.338 -13.340 -4.947) 15.576 37.874 ( 9.552 -11.090 3.503) 15.050 40.788 ( 6.073 -3.561 5.982) 9.238 41.486 ( 7.701 -10.872 -3.548) 13.788 41.761 ( 13.379 -15.154 26.125) 33.033 41.960 ( 1.585 -15.107 3.340) 15.553 42.651 ( -13.057 -18.841 4.293) 23.322 42.850 ( -31.092 -25.009 -12.448) 41.799 43.284 ( 12.350 -28.708 -17.294) 35.718 44.459 ( 19.213 -40.089 4.447) 44.677 ======================= Grid point 23 (15/126) ======================= q-point: ( 0.33 0.19 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.734 ( 20.015 29.899 3.830) 36.183 3.065 ( 30.395 25.020 20.535) 44.402 3.863 ( -25.213 20.897 -7.322) 33.556 3.949 ( -22.574 18.596 -20.805) 35.892 4.224 ( -18.479 26.356 2.588) 32.293 4.283 ( 3.850 15.673 -9.321) 18.637 4.575 ( -4.764 19.638 6.353) 21.182 4.640 ( -8.648 13.224 -5.041) 16.585 5.008 ( 2.124 20.892 -4.687) 21.517 5.132 ( -3.945 15.657 15.429) 22.333 5.438 ( -1.132 26.077 12.219) 28.820 5.508 ( 7.996 13.144 5.654) 16.390 5.751 ( 0.165 23.610 -3.418) 23.857 5.819 ( 5.022 10.479 2.712) 11.933 6.163 ( 3.087 15.517 0.466) 15.828 6.264 ( 0.365 19.859 -2.564) 20.028 6.389 ( 10.281 37.317 -3.644) 38.879 6.556 ( 2.550 15.961 -0.930) 16.190 6.718 ( -11.743 11.201 4.756) 16.911 6.869 ( -10.191 11.797 -2.921) 15.861 6.918 ( 1.230 24.805 -4.510) 25.242 7.142 ( 4.297 11.266 -2.234) 12.263 7.399 ( 2.831 10.713 -9.029) 14.293 7.555 ( 8.153 7.475 -6.636) 12.899 7.720 ( 4.191 3.386 10.885) 12.146 7.790 ( 9.080 12.951 -9.142) 18.269 7.961 ( -8.693 11.214 -8.389) 16.483 8.093 ( -1.054 6.427 -9.869) 11.825 8.149 ( -1.776 5.572 6.141) 8.480 8.440 ( 0.205 12.793 4.997) 13.736 8.692 ( -10.751 9.833 2.797) 14.835 8.742 ( -0.913 13.956 12.341) 18.652 8.825 ( -2.750 6.898 10.577) 12.924 8.942 ( -1.379 8.002 -0.414) 8.130 9.134 ( -3.274 13.692 0.581) 14.090 9.256 ( 3.876 7.428 1.081) 8.448 9.431 ( 0.231 6.579 -3.948) 7.677 9.472 ( -2.484 2.274 -3.564) 4.903 9.703 ( -4.323 6.761 3.993) 8.964 9.858 ( 5.100 6.071 -0.756) 7.965 9.922 ( 3.254 6.653 5.620) 9.297 10.124 ( 2.375 3.933 -7.665) 8.937 10.424 ( 11.195 -1.671 -14.763) 18.603 10.528 ( -0.020 4.382 11.697) 12.491 10.661 ( 11.704 -10.676 2.550) 16.046 10.931 ( -0.289 0.051 1.998) 2.019 11.038 ( 2.986 -6.641 1.547) 7.444 11.114 ( 4.794 -1.116 -2.409) 5.480 11.252 ( 3.854 0.993 1.277) 4.179 11.436 ( -0.945 -3.578 -0.443) 3.727 11.558 ( -0.419 -3.131 -3.212) 4.505 11.599 ( -2.587 -3.979 1.550) 4.992 11.899 ( -0.511 3.687 4.364) 5.736 12.000 ( -0.316 -2.994 -1.879) 3.549 12.248 ( -1.084 -4.012 -3.019) 5.137 12.357 ( -6.786 1.790 -3.396) 7.796 12.580 ( 0.011 2.965 -5.104) 5.902 12.817 ( -2.023 1.023 5.875) 6.297 13.066 ( -6.536 1.998 2.724) 7.357 13.184 ( -11.807 2.163 -0.871) 12.035 14.144 ( 1.505 1.130 -0.651) 1.991 14.199 ( 4.012 6.095 0.604) 7.322 14.607 ( 7.578 -1.286 3.605) 8.489 14.752 ( 3.888 -2.252 -0.809) 4.565 15.443 ( -1.112 5.673 -1.731) 6.035 15.647 ( 0.723 1.679 -3.316) 3.787 15.906 ( 4.125 -5.086 -1.565) 6.733 16.084 ( -3.014 -8.044 4.533) 9.712 17.738 ( 7.253 0.872 -1.192) 7.402 17.907 ( -3.691 -2.137 2.245) 4.820 18.115 ( -4.878 -3.588 1.556) 6.253 18.188 ( -1.395 -4.184 -2.350) 4.998 19.712 ( 1.547 12.281 -1.311) 12.447 19.822 ( -3.107 10.379 2.171) 11.050 19.948 ( 0.172 8.305 -0.225) 8.309 20.115 ( -7.134 1.695 0.566) 7.355 20.373 ( -0.592 0.529 0.285) 0.844 20.434 ( 0.384 1.669 -0.908) 1.939 20.463 ( -0.431 1.186 -0.391) 1.321 20.676 ( -0.362 10.148 0.852) 10.191 20.944 ( -0.084 18.317 0.340) 18.321 20.991 ( 0.021 18.361 -0.069) 18.361 21.178 ( 5.114 17.612 2.943) 18.574 21.777 ( -8.724 13.714 -5.221) 17.072 24.257 ( -0.396 0.360 0.767) 0.935 24.316 ( 1.333 -1.603 -1.343) 2.480 24.508 ( -0.888 -2.231 0.047) 2.401 24.590 ( 1.943 -7.476 -0.870) 7.773 30.068 ( 0.068 0.977 -0.595) 1.146 30.134 ( 0.983 -0.538 0.057) 1.122 30.342 ( -0.510 -1.240 0.018) 1.341 30.408 ( 0.007 -1.278 -0.454) 1.356 34.404 ( 10.372 -8.018 -9.708) 16.313 34.644 ( -6.478 -9.894 8.246) 14.417 35.093 ( 2.519 -11.250 0.346) 11.534 35.569 ( -10.668 -14.980 -5.461) 19.184 37.124 ( -1.647 -9.377 -1.119) 9.586 37.504 ( -0.850 -10.597 3.517) 11.197 37.588 ( 3.983 -13.869 -3.530) 14.855 38.076 ( 8.610 -12.491 3.640) 15.602 41.006 ( 13.612 -6.483 12.207) 19.399 41.658 ( 12.753 -11.726 -5.871) 18.292 41.915 ( -3.054 -14.671 -6.849) 16.476 42.117 ( -3.692 -18.593 35.238) 40.013 42.196 ( -24.684 -18.168 -12.480) 33.093 42.487 ( -4.445 -20.385 -1.663) 20.930 43.426 ( 10.368 -38.449 -14.285) 42.307 44.766 ( 11.632 -40.785 2.206) 42.469 ======================= Grid point 24 (16/126) ======================= q-point: (-0.50 0.19 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.120 ( 0.000 19.690 0.000) 19.690 3.321 ( 0.000 26.822 0.000) 26.822 3.671 ( 0.000 21.635 0.000) 21.635 3.763 ( 0.000 22.656 0.000) 22.656 3.780 ( -0.000 20.059 -0.000) 20.059 4.298 ( 0.000 9.910 0.000) 9.910 4.513 ( -0.000 17.091 0.000) 17.091 4.572 ( 0.000 21.851 -0.000) 21.851 5.091 ( -0.000 9.030 0.000) 9.030 5.114 ( 0.000 24.524 0.000) 24.524 5.343 ( 0.000 18.186 0.000) 18.186 5.613 ( 0.000 21.183 -0.000) 21.183 5.747 ( 0.000 27.964 0.000) 27.964 6.069 ( -0.000 13.726 0.000) 13.726 6.123 ( 0.000 7.646 0.000) 7.646 6.276 ( 0.000 6.677 0.000) 6.677 6.461 ( 0.000 30.535 0.000) 30.535 6.609 ( 0.000 19.116 -0.000) 19.116 6.616 ( -0.000 20.219 0.000) 20.219 6.759 ( 0.000 16.376 0.000) 16.376 6.936 ( -0.000 30.658 -0.000) 30.658 7.030 ( 0.000 24.116 0.000) 24.116 7.446 ( 0.000 16.521 0.000) 16.521 7.639 ( 0.000 0.821 0.000) 0.821 7.667 ( 0.000 7.150 -0.000) 7.150 7.846 ( -0.000 1.770 0.000) 1.770 7.956 ( 0.000 12.746 0.000) 12.746 8.057 ( 0.000 10.183 0.000) 10.183 8.227 ( 0.000 6.128 0.000) 6.128 8.369 ( -0.000 17.601 0.000) 17.601 8.554 ( 0.000 12.213 0.000) 12.213 8.787 ( 0.000 13.140 0.000) 13.140 8.804 ( 0.000 10.451 0.000) 10.451 8.981 ( 0.000 15.821 0.000) 15.821 9.158 ( 0.000 0.014 0.000) 0.014 9.277 ( 0.000 -0.182 0.000) 0.182 9.301 ( 0.000 -1.409 0.000) 1.409 9.563 ( 0.000 20.439 0.000) 20.439 9.665 ( 0.000 1.393 0.000) 1.393 9.907 ( 0.000 3.894 -0.000) 3.894 9.985 ( 0.000 4.829 0.000) 4.829 10.095 ( 0.000 9.688 0.000) 9.688 10.495 ( -0.000 2.805 0.000) 2.805 10.543 ( 0.000 -0.659 0.000) 0.659 10.804 ( 0.000 -11.865 0.000) 11.865 10.914 ( 0.000 0.115 0.000) 0.115 11.048 ( 0.000 -11.184 0.000) 11.184 11.197 ( 0.000 -8.319 0.000) 8.319 11.279 ( 0.000 3.045 0.000) 3.045 11.415 ( 0.000 -1.342 0.000) 1.342 11.471 ( 0.000 7.112 0.000) 7.112 11.637 ( -0.000 -7.063 0.000) 7.063 11.906 ( 0.000 -3.386 0.000) 3.386 12.117 ( 0.000 -8.459 0.000) 8.459 12.150 ( 0.000 -9.344 -0.000) 9.344 12.251 ( 0.000 8.028 0.000) 8.028 12.584 ( 0.000 6.781 0.000) 6.781 12.813 ( 0.000 -2.066 0.000) 2.066 12.998 ( 0.000 4.447 0.000) 4.447 13.064 ( 0.000 1.092 -0.000) 1.092 14.160 ( 0.000 1.085 0.000) 1.085 14.238 ( 0.000 7.788 0.000) 7.788 14.710 ( 0.000 -2.547 0.000) 2.547 14.767 ( 0.000 -0.933 -0.000) 0.933 15.425 ( 0.000 7.522 -0.000) 7.522 15.646 ( 0.000 3.275 0.000) 3.275 15.969 ( 0.000 -5.422 0.000) 5.422 16.040 ( 0.000 -9.666 0.000) 9.666 17.835 ( 0.000 -1.480 0.000) 1.480 17.873 ( -0.000 -1.085 0.000) 1.085 18.031 ( 0.000 -1.415 0.000) 1.415 18.182 ( 0.000 -4.795 0.000) 4.795 19.726 ( 0.000 13.901 0.000) 13.901 19.794 ( 0.000 10.953 0.000) 10.953 19.974 ( 0.000 8.307 -0.000) 8.307 20.023 ( 0.000 0.678 0.000) 0.678 20.368 ( 0.000 -0.337 0.000) 0.337 20.434 ( 0.000 3.121 0.000) 3.121 20.458 ( 0.000 0.246 0.000) 0.246 20.674 ( 0.000 10.337 0.000) 10.337 20.946 ( 0.000 18.445 -0.000) 18.445 20.990 ( 0.000 18.235 0.000) 18.235 21.244 ( 0.000 17.213 0.000) 17.213 21.671 ( 0.000 17.134 -0.000) 17.134 24.254 ( 0.000 0.783 0.000) 0.783 24.332 ( 0.000 -1.765 -0.000) 1.765 24.499 ( 0.000 -2.216 0.000) 2.216 24.606 ( 0.000 -9.090 -0.000) 9.090 30.068 ( 0.000 1.023 0.000) 1.023 30.143 ( 0.000 -0.721 0.000) 0.721 30.337 ( 0.000 -1.361 0.000) 1.361 30.407 ( 0.000 -1.205 0.000) 1.205 34.494 ( 0.000 -10.860 -0.000) 10.860 34.585 ( -0.000 -8.256 0.000) 8.256 35.137 ( 0.000 -9.200 0.000) 9.200 35.442 ( 0.000 -16.983 0.000) 16.983 37.105 ( 0.000 -9.442 -0.000) 9.442 37.503 ( 0.000 -10.635 -0.000) 10.635 37.617 ( 0.000 -14.076 0.000) 14.076 38.168 ( 0.000 -12.758 0.000) 12.758 41.296 ( 0.000 -9.448 0.000) 9.448 41.621 ( 0.000 -16.423 0.000) 16.423 41.810 ( 0.000 -12.795 -0.000) 12.795 42.046 ( 0.000 -11.078 -0.000) 11.078 42.069 ( -0.000 -13.468 0.000) 13.468 42.497 ( 0.000 -24.961 0.000) 24.961 43.492 ( 0.000 -43.872 0.000) 43.872 44.878 ( 0.000 -40.994 0.000) 40.994 ======================= Grid point 28 (17/126) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.867 ( 0.000 39.495 0.000) 39.495 3.408 ( 0.000 43.183 0.000) 43.183 4.527 ( 0.000 9.845 0.000) 9.845 4.763 ( 0.000 18.202 0.000) 18.202 4.840 ( 0.000 7.849 0.000) 7.849 5.087 ( 0.000 15.870 0.000) 15.870 5.126 ( 0.000 22.277 0.000) 22.277 5.232 ( 0.000 12.241 0.000) 12.241 5.361 ( 0.000 20.281 0.000) 20.281 5.508 ( 0.000 4.637 0.000) 4.637 5.542 ( 0.000 8.765 0.000) 8.765 5.713 ( 0.000 15.766 0.000) 15.766 6.018 ( 0.000 16.683 0.000) 16.683 6.291 ( 0.000 5.956 0.000) 5.956 6.367 ( 0.000 6.021 0.000) 6.021 6.617 ( 0.000 13.585 0.000) 13.585 6.669 ( 0.000 13.225 0.000) 13.225 6.814 ( 0.000 14.359 0.000) 14.359 7.048 ( 0.000 20.626 0.000) 20.626 7.124 ( 0.000 9.374 0.000) 9.374 7.198 ( 0.000 0.115 0.000) 0.115 7.249 ( 0.000 16.676 0.000) 16.676 7.373 ( 0.000 11.921 0.000) 11.921 7.541 ( 0.000 6.592 0.000) 6.592 7.766 ( 0.000 1.278 0.000) 1.278 7.930 ( 0.000 6.259 0.000) 6.259 8.009 ( 0.000 25.760 0.000) 25.760 8.090 ( 0.000 14.551 0.000) 14.551 8.410 ( 0.000 10.845 0.000) 10.845 8.802 ( 0.000 12.815 0.000) 12.815 9.018 ( 0.000 0.247 0.000) 0.247 9.081 ( 0.000 3.582 0.000) 3.582 9.107 ( 0.000 9.044 0.000) 9.044 9.201 ( 0.000 16.594 0.000) 16.594 9.376 ( 0.000 -0.224 0.000) 0.224 9.436 ( 0.000 -4.316 0.000) 4.316 9.630 ( 0.000 3.023 0.000) 3.023 9.788 ( 0.000 10.774 0.000) 10.774 9.819 ( 0.000 -2.798 0.000) 2.798 9.940 ( 0.000 15.154 0.000) 15.154 9.986 ( 0.000 9.968 0.000) 9.968 10.107 ( 0.000 17.941 0.000) 17.941 10.124 ( 0.000 7.713 0.000) 7.713 10.383 ( 0.000 22.530 0.000) 22.530 10.680 ( 0.000 8.046 0.000) 8.046 10.777 ( 0.000 5.813 0.000) 5.813 10.939 ( 0.000 3.944 0.000) 3.944 11.089 ( 0.000 -3.321 0.000) 3.321 11.117 ( 0.000 0.176 0.000) 0.176 11.433 ( 0.000 -9.555 0.000) 9.555 11.473 ( 0.000 3.479 0.000) 3.479 11.637 ( 0.000 -4.985 0.000) 4.985 12.021 ( 0.000 -4.823 0.000) 4.823 12.195 ( 0.000 -1.634 0.000) 1.634 12.222 ( 0.000 5.551 0.000) 5.551 12.434 ( 0.000 13.112 0.000) 13.112 12.929 ( 0.000 3.746 0.000) 3.746 12.982 ( 0.000 1.603 0.000) 1.603 13.174 ( 0.000 -1.793 0.000) 1.793 13.546 ( 0.000 -3.555 0.000) 3.555 14.088 ( 0.000 2.538 0.000) 2.538 14.149 ( 0.000 3.045 0.000) 3.045 14.405 ( 0.000 1.929 0.000) 1.929 14.478 ( 0.000 -0.514 0.000) 0.514 15.461 ( 0.000 2.566 0.000) 2.566 15.732 ( 0.000 0.472 0.000) 0.472 15.816 ( 0.000 0.873 0.000) 0.873 15.953 ( 0.000 -5.993 0.000) 5.993 17.657 ( 0.000 2.867 0.000) 2.867 17.994 ( 0.000 -3.298 0.000) 3.298 17.999 ( 0.000 -1.505 0.000) 1.505 18.191 ( 0.000 -6.334 0.000) 6.334 19.815 ( 0.000 3.510 0.000) 3.510 20.012 ( 0.000 2.048 0.000) 2.048 20.074 ( 0.000 -0.682 0.000) 0.682 20.233 ( 0.000 -2.496 0.000) 2.496 20.512 ( 0.000 5.431 0.000) 5.431 20.524 ( 0.000 4.853 0.000) 4.853 20.543 ( 0.000 9.359 0.000) 9.359 20.836 ( 0.000 6.096 0.000) 6.096 21.339 ( 0.000 17.592 0.000) 17.592 21.363 ( 0.000 18.054 0.000) 18.054 21.364 ( 0.000 17.872 0.000) 17.872 22.084 ( 0.000 1.649 0.000) 1.649 24.206 ( 0.000 0.490 0.000) 0.490 24.340 ( 0.000 -0.841 0.000) 0.841 24.449 ( 0.000 -1.810 0.000) 1.810 24.535 ( 0.000 -0.963 0.000) 0.963 30.095 ( 0.000 0.815 0.000) 0.815 30.108 ( 0.000 1.068 0.000) 1.068 30.338 ( 0.000 -1.300 0.000) 1.300 30.375 ( 0.000 -1.884 0.000) 1.884 34.174 ( 0.000 0.766 0.000) 0.766 34.534 ( 0.000 -8.587 0.000) 8.587 34.809 ( 0.000 -12.962 0.000) 12.962 35.639 ( 0.000 -18.591 0.000) 18.591 37.011 ( 0.000 -9.165 0.000) 9.165 37.180 ( 0.000 -11.751 0.000) 11.751 37.256 ( 0.000 -11.117 0.000) 11.117 37.541 ( 0.000 -13.010 0.000) 13.010 40.678 ( 0.000 -1.459 0.000) 1.459 41.206 ( 0.000 -11.404 0.000) 11.404 41.321 ( 0.000 -10.400 0.000) 10.400 41.666 ( 0.000 -13.297 0.000) 13.297 42.384 ( 0.000 -19.151 0.000) 19.151 42.686 ( 0.000 -26.995 0.000) 26.995 42.706 ( 0.000 -24.384 0.000) 24.384 43.412 ( 0.000 -37.553 0.000) 37.553 ======================= Grid point 29 (18/126) ======================= q-point: ( 0.17 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.037 ( 15.417 35.427 6.514) 39.181 3.406 ( -0.037 40.688 6.942) 41.276 4.512 ( -1.302 9.342 -3.096) 9.928 4.659 ( -13.832 14.413 -4.374) 20.449 4.818 ( -0.299 18.745 -5.406) 19.512 4.894 ( -18.597 13.924 -18.020) 29.401 5.030 ( -8.443 18.438 -1.139) 20.311 5.062 ( -12.151 9.350 -0.489) 15.340 5.334 ( -3.768 12.428 2.854) 13.296 5.489 ( 5.367 9.206 11.609) 15.758 5.554 ( -9.134 15.402 10.821) 20.922 5.774 ( 10.238 16.996 -2.368) 19.982 5.981 ( -4.490 14.225 4.976) 15.725 6.311 ( -2.334 10.708 -2.864) 11.327 6.363 ( 1.763 7.338 4.723) 8.902 6.632 ( -1.431 11.651 3.026) 12.122 6.764 ( 8.893 17.643 -0.250) 19.759 6.898 ( 3.975 17.388 -2.968) 18.082 7.029 ( -1.302 14.185 1.724) 14.349 7.122 ( 7.394 10.990 -5.228) 14.240 7.226 ( 3.094 4.968 0.558) 5.879 7.314 ( 2.271 14.547 -1.420) 14.792 7.387 ( 4.166 8.910 -3.403) 10.407 7.600 ( 5.550 8.219 -5.111) 11.157 7.684 ( -1.860 -0.952 -3.833) 4.366 7.998 ( 5.796 10.106 -1.281) 11.720 8.131 ( 13.494 20.939 -4.515) 25.316 8.248 ( 6.516 14.745 11.027) 19.531 8.421 ( 0.788 9.269 11.891) 15.097 8.693 ( -9.615 9.550 -6.402) 14.988 8.918 ( -12.910 7.454 2.324) 15.088 9.043 ( -0.159 2.378 -8.038) 8.384 9.075 ( 2.399 9.591 -2.140) 10.115 9.215 ( -1.123 18.118 1.875) 18.250 9.318 ( -0.616 0.975 -3.219) 3.420 9.448 ( -1.293 5.946 2.072) 6.428 9.626 ( -9.435 3.489 1.962) 10.249 9.681 ( -4.285 10.054 -0.952) 10.971 9.840 ( 3.447 -3.515 11.099) 12.142 9.974 ( -2.363 16.338 4.316) 17.063 10.046 ( 4.480 3.666 -5.125) 7.732 10.139 ( 4.917 15.572 3.505) 16.701 10.225 ( 13.006 9.702 -6.670) 17.544 10.453 ( 6.371 15.562 -2.617) 17.018 10.680 ( -0.855 5.106 0.745) 5.231 10.867 ( -3.036 2.564 1.562) 4.270 10.911 ( 10.078 2.108 -2.249) 10.539 11.078 ( -2.132 -2.462 4.129) 5.259 11.136 ( 2.951 0.524 -5.541) 6.300 11.392 ( -3.959 -8.472 0.956) 9.400 11.477 ( 0.914 3.816 -1.575) 4.228 11.619 ( -2.407 -3.442 3.268) 5.322 12.026 ( -0.597 -3.961 0.484) 4.035 12.074 ( -8.257 0.791 3.701) 9.083 12.275 ( 0.421 6.907 -5.405) 8.781 12.465 ( 3.392 7.135 0.816) 7.942 12.736 ( -13.436 0.519 -3.018) 13.780 12.962 ( -3.943 4.209 -0.809) 5.824 13.140 ( -4.477 -1.901 4.258) 6.464 13.480 ( -7.835 1.743 -1.058) 8.096 14.106 ( 2.155 -0.222 1.291) 2.521 14.206 ( 5.839 5.208 -0.194) 7.826 14.441 ( 5.494 -0.620 0.550) 5.556 14.597 ( 8.744 -0.195 -0.316) 8.752 15.497 ( 3.766 3.089 -0.594) 4.907 15.703 ( -1.534 1.730 -3.632) 4.305 15.817 ( 0.497 -0.695 -0.943) 1.273 15.961 ( -0.716 -5.934 4.029) 7.208 17.683 ( 3.072 2.371 -0.792) 3.961 17.933 ( -4.610 -1.649 3.731) 6.156 18.042 ( 2.617 -3.082 -3.576) 5.398 18.162 ( -3.224 -5.570 0.796) 6.485 19.831 ( 1.960 3.555 -0.742) 4.126 19.988 ( -2.973 1.714 2.467) 4.226 20.066 ( -0.417 0.319 -2.112) 2.176 20.206 ( -3.278 -2.195 0.549) 3.983 20.474 ( -3.357 5.854 1.012) 6.824 20.493 ( -2.011 4.870 -0.179) 5.272 20.578 ( 2.294 8.760 -1.410) 9.165 20.846 ( 0.605 6.582 0.899) 6.671 21.324 ( -0.949 18.048 -0.194) 18.074 21.351 ( 0.485 17.637 -0.845) 17.664 21.425 ( 3.486 16.905 3.079) 17.533 22.055 ( -2.406 3.645 -2.653) 5.110 24.226 ( 2.003 0.334 0.143) 2.036 24.325 ( -1.518 0.035 0.584) 1.627 24.452 ( 0.727 -2.595 -2.092) 3.412 24.521 ( -1.577 -1.138 0.421) 1.990 30.093 ( -0.059 1.145 -0.297) 1.184 30.116 ( 0.638 0.528 0.188) 0.850 30.329 ( -0.761 -1.332 -0.158) 1.542 30.377 ( 0.184 -1.762 -0.177) 1.781 34.212 ( 4.844 -0.825 -4.257) 6.501 34.520 ( -2.930 -7.914 5.251) 9.939 34.812 ( 0.991 -12.444 -0.528) 12.495 35.511 ( -11.110 -16.237 -3.857) 20.048 36.985 ( -1.931 -8.875 -1.659) 9.233 37.236 ( 5.360 -13.067 -3.583) 14.571 37.272 ( -0.144 -11.442 4.636) 12.346 37.614 ( 7.216 -14.317 2.611) 16.244 40.725 ( 4.262 -2.492 4.321) 6.561 41.261 ( 7.009 -11.252 -2.749) 13.539 41.470 ( 9.463 -13.694 19.531) 25.662 41.671 ( 0.624 -13.470 -1.216) 13.539 42.258 ( -14.982 -20.183 -3.416) 25.367 42.373 ( -20.905 -21.721 -5.168) 30.587 42.726 ( 4.899 -26.537 -14.541) 30.654 43.658 ( 16.973 -38.906 6.633) 42.963 ======================= Grid point 30 (19/126) ======================= q-point: ( 0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.340 ( 12.457 29.954 2.820) 32.563 3.614 ( 19.904 29.809 15.207) 38.936 4.232 ( -25.161 17.653 -2.593) 30.846 4.394 ( -17.657 23.749 -14.157) 32.806 4.504 ( -1.107 8.613 -7.248) 11.311 4.668 ( -22.356 16.290 -5.165) 28.139 4.880 ( 0.261 14.635 -4.909) 15.438 4.976 ( -1.130 16.278 2.399) 16.493 5.246 ( -5.324 7.617 1.808) 9.468 5.436 ( -5.625 10.215 10.020) 15.375 5.715 ( 6.208 12.643 7.697) 16.051 5.953 ( 2.957 9.991 10.390) 14.714 5.962 ( 7.231 16.223 -2.110) 17.886 6.256 ( 0.675 18.469 -5.860) 19.388 6.407 ( 0.070 10.512 4.528) 11.445 6.576 ( -6.051 13.516 -3.674) 15.257 6.815 ( 0.336 8.186 1.201) 8.281 6.951 ( 1.135 19.756 1.578) 19.851 7.065 ( -0.796 19.768 0.410) 19.788 7.177 ( 1.408 17.632 0.138) 17.689 7.302 ( 8.172 10.151 -5.845) 14.283 7.398 ( 5.576 10.065 1.108) 11.559 7.478 ( 7.146 -3.831 -7.430) 10.998 7.641 ( 6.499 14.763 -11.027) 19.538 7.764 ( 5.583 0.119 8.798) 10.421 8.070 ( 0.156 11.739 -9.088) 14.847 8.243 ( -2.834 10.237 4.427) 11.507 8.305 ( -7.075 9.757 -1.900) 12.201 8.422 ( 8.153 24.483 1.132) 25.830 8.705 ( -2.632 10.683 5.091) 12.123 8.808 ( 5.980 5.535 14.519) 16.649 8.974 ( -2.139 7.038 -4.506) 8.626 9.072 ( 0.917 18.393 -10.252) 21.077 9.206 ( -3.399 -0.609 2.094) 4.039 9.247 ( -2.780 19.994 3.455) 20.480 9.455 ( -8.279 5.325 -6.197) 11.632 9.505 ( 0.020 5.283 6.070) 8.047 9.596 ( -1.029 11.101 1.244) 11.217 9.888 ( -2.000 9.386 -2.157) 9.836 9.990 ( 5.655 2.568 4.039) 7.409 10.113 ( 2.886 9.809 -0.557) 10.240 10.271 ( 5.370 10.123 2.637) 11.759 10.418 ( 8.970 -1.679 -2.732) 9.526 10.533 ( 5.847 8.908 -12.994) 16.804 10.696 ( 2.189 -2.375 4.943) 5.905 10.734 ( -9.373 2.162 6.310) 11.504 11.011 ( -5.466 -0.468 0.533) 5.512 11.106 ( 2.683 2.197 -1.631) 3.833 11.245 ( 11.998 -2.506 0.681) 12.276 11.344 ( 0.034 -7.062 -0.388) 7.073 11.502 ( 3.670 3.336 -2.961) 5.777 11.597 ( -1.385 1.659 3.595) 4.195 11.927 ( -9.110 -0.794 2.780) 9.558 11.991 ( -3.106 0.083 -1.450) 3.429 12.166 ( -9.940 -1.717 -1.162) 10.154 12.470 ( -1.646 6.136 -4.927) 8.040 12.641 ( 4.428 3.618 0.813) 5.776 12.863 ( -6.243 3.600 0.658) 7.237 13.082 ( -3.460 1.088 5.927) 6.949 13.290 ( -10.217 5.515 -3.344) 12.083 14.161 ( 2.975 0.895 -0.446) 3.138 14.316 ( 4.962 4.662 0.630) 6.837 14.572 ( 6.784 -2.198 2.281) 7.487 14.714 ( 4.071 -1.598 -1.914) 4.774 15.559 ( 2.106 5.532 -0.206) 5.923 15.682 ( 1.819 1.603 -3.535) 4.287 15.830 ( 1.712 -2.406 -0.940) 3.098 15.945 ( -3.324 -5.721 3.856) 7.659 17.755 ( 4.945 0.924 -0.807) 5.095 17.874 ( -2.816 -0.986 1.142) 3.195 18.044 ( -2.641 -3.329 1.092) 4.387 18.104 ( -1.606 -3.915 -1.270) 4.418 19.879 ( 3.751 3.820 -1.231) 5.493 19.944 ( -2.585 1.718 1.858) 3.618 20.042 ( -1.382 0.983 -0.820) 1.884 20.126 ( -5.145 -0.591 0.471) 5.200 20.426 ( -2.027 5.438 0.627) 5.837 20.462 ( -1.091 3.380 -0.289) 3.564 20.604 ( 1.207 9.831 -0.988) 9.954 20.858 ( 0.250 7.392 0.752) 7.434 21.316 ( -0.003 18.066 0.188) 18.067 21.352 ( -0.147 17.362 -0.100) 17.363 21.508 ( 3.850 15.182 2.063) 15.798 21.986 ( -3.317 7.869 -2.682) 8.950 24.267 ( 1.899 0.647 0.310) 2.030 24.305 ( -0.424 0.597 0.172) 0.752 24.453 ( 0.603 -3.637 -2.175) 4.280 24.489 ( -2.085 -1.930 0.884) 2.976 30.092 ( 0.061 1.346 -0.190) 1.361 30.128 ( 0.508 -0.049 0.056) 0.513 30.315 ( -0.590 -1.353 -0.119) 1.481 30.379 ( 0.073 -1.610 -0.177) 1.621 34.284 ( 4.954 -4.311 -5.385) 8.493 34.481 ( -3.879 -6.186 5.668) 9.243 34.861 ( 4.615 -11.340 0.321) 12.247 35.278 ( -11.481 -13.827 -3.245) 18.262 36.944 ( -1.490 -8.524 -1.226) 8.739 37.278 ( -0.577 -11.752 2.281) 11.985 37.303 ( 3.171 -13.966 -2.639) 14.563 37.776 ( 7.232 -16.762 3.195) 18.533 40.882 ( 9.895 -5.620 9.247) 14.663 41.419 ( 11.249 -11.806 -4.242) 16.850 41.610 ( -9.331 -15.097 -11.161) 20.966 41.747 ( 4.024 -17.489 28.840) 33.968 41.861 ( -12.104 -15.299 -7.463) 20.887 42.115 ( -9.997 -17.090 -1.274) 19.840 42.724 ( 2.500 -31.459 -14.833) 34.870 43.940 ( 10.300 -40.603 3.736) 42.055 ======================= Grid point 31 (20/126) ======================= q-point: (-0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.527 ( 0.000 21.077 0.000) 21.077 3.879 ( 0.000 28.409 -0.000) 28.409 4.117 ( 0.000 21.177 0.000) 21.177 4.162 ( -0.000 18.187 -0.000) 18.187 4.210 ( 0.000 24.467 0.000) 24.467 4.487 ( 0.000 8.998 0.000) 8.998 4.881 ( 0.000 18.654 0.000) 18.654 4.967 ( 0.000 17.130 0.000) 17.130 5.207 ( 0.000 2.666 -0.000) 2.666 5.410 ( 0.000 10.025 0.000) 10.025 5.746 ( 0.000 17.574 0.000) 17.574 5.995 ( 0.000 16.090 -0.000) 16.090 6.173 ( 0.000 0.012 0.000) 0.012 6.215 ( -0.000 12.081 0.000) 12.081 6.419 ( 0.000 7.174 0.000) 7.174 6.442 ( -0.000 27.329 -0.000) 27.329 6.849 ( 0.000 9.547 0.000) 9.547 6.961 ( -0.000 20.521 0.000) 20.521 7.015 ( -0.000 15.536 0.000) 15.536 7.197 ( 0.000 20.164 0.000) 20.164 7.409 ( -0.000 8.547 -0.000) 8.547 7.452 ( 0.000 12.359 -0.000) 12.359 7.514 ( 0.000 -5.540 0.000) 5.540 7.721 ( 0.000 14.602 0.000) 14.602 7.881 ( 0.000 17.450 -0.000) 17.450 7.909 ( 0.000 1.712 0.000) 1.712 8.234 ( -0.000 10.604 0.000) 10.604 8.288 ( 0.000 15.286 -0.000) 15.286 8.492 ( 0.000 16.029 0.000) 16.029 8.632 ( 0.000 8.926 0.000) 8.926 8.970 ( -0.000 6.967 0.000) 6.967 8.982 ( 0.000 8.802 -0.000) 8.802 9.051 ( -0.000 23.800 -0.000) 23.800 9.179 ( 0.000 -2.189 0.000) 2.189 9.261 ( 0.000 9.831 0.000) 9.831 9.291 ( -0.000 21.261 -0.000) 21.261 9.454 ( 0.000 12.332 0.000) 12.332 9.660 ( 0.000 -0.982 0.000) 0.982 9.862 ( 0.000 5.655 -0.000) 5.655 10.063 ( 0.000 9.603 0.000) 9.603 10.145 ( 0.000 9.924 -0.000) 9.924 10.326 ( 0.000 11.625 0.000) 11.625 10.445 ( 0.000 -17.137 0.000) 17.137 10.620 ( 0.000 6.586 -0.000) 6.586 10.633 ( -0.000 10.089 0.000) 10.089 10.759 ( 0.000 -7.488 0.000) 7.488 10.921 ( 0.000 -0.858 0.000) 0.858 11.113 ( 0.000 1.363 0.000) 1.363 11.318 ( 0.000 -5.527 0.000) 5.527 11.411 ( 0.000 2.335 0.000) 2.335 11.555 ( 0.000 3.078 -0.000) 3.078 11.606 ( -0.000 2.654 0.000) 2.654 11.833 ( 0.000 -3.369 0.000) 3.369 11.983 ( 0.000 -2.736 0.000) 2.736 11.991 ( 0.000 -4.387 0.000) 4.387 12.451 ( 0.000 8.780 0.000) 8.780 12.749 ( 0.000 9.327 -0.000) 9.327 12.753 ( -0.000 -2.149 0.000) 2.149 13.089 ( 0.000 4.448 0.000) 4.448 13.151 ( -0.000 4.779 -0.000) 4.779 14.190 ( 0.000 1.706 0.000) 1.706 14.365 ( 0.000 4.567 0.000) 4.567 14.654 ( 0.000 -2.980 0.000) 2.980 14.736 ( 0.000 -2.283 -0.000) 2.283 15.571 ( 0.000 6.755 0.000) 6.755 15.702 ( -0.000 1.991 0.000) 1.991 15.881 ( 0.000 -5.927 -0.000) 5.927 15.883 ( -0.000 -3.264 0.000) 3.264 17.816 ( 0.000 -0.374 0.000) 0.374 17.851 ( -0.000 -0.929 0.000) 0.929 17.996 ( 0.000 -1.940 0.000) 1.940 18.095 ( 0.000 -3.780 0.000) 3.780 19.923 ( 0.000 1.654 0.000) 1.654 19.930 ( 0.000 5.464 0.000) 5.464 20.013 ( 0.000 -1.451 0.000) 1.451 20.071 ( -0.000 1.582 -0.000) 1.582 20.410 ( 0.000 5.083 0.000) 5.083 20.452 ( 0.000 2.783 -0.000) 2.783 20.612 ( 0.000 10.305 0.000) 10.305 20.862 ( 0.000 7.732 0.000) 7.732 21.318 ( 0.000 18.018 -0.000) 18.018 21.349 ( 0.000 17.332 0.000) 17.332 21.555 ( 0.000 13.966 0.000) 13.966 21.942 ( 0.000 10.313 -0.000) 10.313 24.281 ( 0.000 1.937 0.000) 1.937 24.310 ( 0.000 -0.312 -0.000) 0.312 24.459 ( 0.000 -5.391 -0.000) 5.391 24.463 ( 0.000 -1.236 0.000) 1.236 30.092 ( 0.000 1.399 0.000) 1.399 30.133 ( 0.000 -0.267 0.000) 0.267 30.309 ( 0.000 -1.367 0.000) 1.367 30.379 ( 0.000 -1.555 0.000) 1.555 34.320 ( 0.000 -6.556 -0.000) 6.556 34.454 ( 0.000 -4.777 0.000) 4.777 34.938 ( 0.000 -10.264 0.000) 10.264 35.131 ( 0.000 -13.756 0.000) 13.756 36.927 ( 0.000 -8.397 -0.000) 8.397 37.276 ( 0.000 -11.707 -0.000) 11.707 37.326 ( 0.000 -14.353 0.000) 14.353 37.855 ( 0.000 -17.696 0.000) 17.696 41.104 ( 0.000 -9.466 0.000) 9.466 41.321 ( 0.000 -12.987 0.000) 12.987 41.549 ( 0.000 -12.773 -0.000) 12.773 41.792 ( 0.000 -13.824 -0.000) 13.824 41.813 ( -0.000 -11.785 0.000) 11.785 42.041 ( 0.000 -20.393 -0.000) 20.393 42.704 ( 0.000 -34.684 0.000) 34.684 44.044 ( 0.000 -41.187 0.000) 41.187 ======================= Grid point 35 (21/126) ======================= q-point: ( 0.00 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.651 ( 0.000 38.162 0.000) 38.162 4.246 ( 0.000 39.562 0.000) 39.562 4.665 ( 0.000 4.891 0.000) 4.891 4.907 ( 0.000 -0.273 0.000) 0.273 5.037 ( 0.000 11.528 0.000) 11.528 5.376 ( 0.000 12.595 0.000) 12.595 5.379 ( 0.000 7.073 0.000) 7.073 5.544 ( 0.000 6.540 0.000) 6.540 5.633 ( 0.000 5.999 0.000) 5.999 5.668 ( 0.000 18.924 0.000) 18.924 5.713 ( 0.000 10.108 0.000) 10.108 5.974 ( 0.000 7.771 0.000) 7.771 6.261 ( 0.000 8.021 0.000) 8.021 6.333 ( 0.000 -1.440 0.000) 1.440 6.472 ( 0.000 6.035 0.000) 6.035 6.674 ( 0.000 -0.734 0.000) 0.734 6.899 ( 0.000 7.995 0.000) 7.995 7.035 ( 0.000 5.367 0.000) 5.367 7.209 ( 0.000 0.234 0.000) 0.234 7.276 ( 0.000 5.577 0.000) 5.577 7.407 ( 0.000 18.335 0.000) 18.335 7.537 ( 0.000 -0.042 0.000) 0.042 7.646 ( 0.000 13.567 0.000) 13.567 7.655 ( 0.000 11.712 0.000) 11.712 7.917 ( 0.000 12.559 0.000) 12.559 8.067 ( 0.000 7.499 0.000) 7.499 8.390 ( 0.000 13.746 0.000) 13.746 8.464 ( 0.000 12.993 0.000) 12.993 8.575 ( 0.000 9.147 0.000) 9.147 8.895 ( 0.000 -6.854 0.000) 6.854 9.032 ( 0.000 1.115 0.000) 1.115 9.097 ( 0.000 3.444 0.000) 3.444 9.254 ( 0.000 -3.280 0.000) 3.280 9.353 ( 0.000 7.706 0.000) 7.706 9.401 ( 0.000 -1.178 0.000) 1.178 9.501 ( 0.000 15.639 0.000) 15.639 9.693 ( 0.000 -6.718 0.000) 6.718 9.826 ( 0.000 9.711 0.000) 9.711 10.049 ( 0.000 15.916 0.000) 15.916 10.201 ( 0.000 9.690 0.000) 9.690 10.202 ( 0.000 11.264 0.000) 11.264 10.303 ( 0.000 9.794 0.000) 9.794 10.524 ( 0.000 18.119 0.000) 18.119 10.780 ( 0.000 18.011 0.000) 18.011 10.913 ( 0.000 6.607 0.000) 6.607 11.011 ( 0.000 19.321 0.000) 19.321 11.064 ( 0.000 0.666 0.000) 0.666 11.085 ( 0.000 14.634 0.000) 14.634 11.191 ( 0.000 7.933 0.000) 7.933 11.328 ( 0.000 3.047 0.000) 3.047 11.527 ( 0.000 -3.716 0.000) 3.716 11.579 ( 0.000 6.660 0.000) 6.660 11.966 ( 0.000 -1.248 0.000) 1.248 12.170 ( 0.000 -0.130 0.000) 0.130 12.288 ( 0.000 1.747 0.000) 1.747 12.695 ( 0.000 11.159 0.000) 11.159 12.926 ( 0.000 -5.913 0.000) 5.913 12.983 ( 0.000 1.404 0.000) 1.404 13.093 ( 0.000 -6.344 0.000) 6.344 13.416 ( 0.000 -8.694 0.000) 8.694 14.158 ( 0.000 3.938 0.000) 3.938 14.228 ( 0.000 4.255 0.000) 4.255 14.462 ( 0.000 2.995 0.000) 2.995 14.490 ( 0.000 1.204 0.000) 1.204 15.528 ( 0.000 3.621 0.000) 3.621 15.746 ( 0.000 0.211 0.000) 0.211 15.846 ( 0.000 1.993 0.000) 1.993 15.848 ( 0.000 -3.692 0.000) 3.692 17.714 ( 0.000 2.813 0.000) 2.813 17.945 ( 0.000 -1.565 0.000) 1.565 17.979 ( 0.000 -0.563 0.000) 0.563 18.074 ( 0.000 -5.091 0.000) 5.091 19.841 ( 0.000 -0.357 0.000) 0.357 19.988 ( 0.000 -3.147 0.000) 3.147 20.032 ( 0.000 -2.729 0.000) 2.729 20.174 ( 0.000 -3.546 0.000) 3.546 20.623 ( 0.000 5.139 0.000) 5.139 20.647 ( 0.000 6.247 0.000) 6.247 20.721 ( 0.000 7.534 0.000) 7.534 20.918 ( 0.000 2.288 0.000) 2.288 21.668 ( 0.000 14.945 0.000) 14.945 21.695 ( 0.000 14.842 0.000) 14.842 21.699 ( 0.000 15.162 0.000) 15.162 22.130 ( 0.000 2.719 0.000) 2.719 24.241 ( 0.000 2.833 0.000) 2.833 24.340 ( 0.000 0.843 0.000) 0.843 24.424 ( 0.000 -0.741 0.000) 0.741 24.524 ( 0.000 -0.198 0.000) 0.198 30.116 ( 0.000 1.192 0.000) 1.192 30.130 ( 0.000 1.145 0.000) 1.145 30.310 ( 0.000 -1.469 0.000) 1.469 30.336 ( 0.000 -2.023 0.000) 2.023 34.201 ( 0.000 2.012 0.000) 2.012 34.391 ( 0.000 -5.619 0.000) 5.619 34.585 ( 0.000 -9.285 0.000) 9.285 35.281 ( 0.000 -16.817 0.000) 16.817 36.837 ( 0.000 -7.942 0.000) 7.942 36.962 ( 0.000 -9.746 0.000) 9.746 37.033 ( 0.000 -10.807 0.000) 10.807 37.272 ( 0.000 -13.353 0.000) 13.353 40.668 ( 0.000 0.520 0.000) 0.520 40.987 ( 0.000 -10.135 0.000) 10.135 41.122 ( 0.000 -9.032 0.000) 9.032 41.422 ( 0.000 -10.612 0.000) 10.612 42.026 ( 0.000 -16.163 0.000) 16.163 42.167 ( 0.000 -24.031 0.000) 24.031 42.254 ( 0.000 -20.544 0.000) 20.544 42.704 ( 0.000 -32.704 0.000) 32.704 ======================= Grid point 36 (22/126) ======================= q-point: ( 0.17 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.751 ( 9.369 35.090 2.268) 36.390 4.205 ( -4.524 38.071 5.686) 38.758 4.648 ( -1.010 4.987 -3.584) 6.224 4.881 ( -5.713 5.442 -0.517) 7.908 4.993 ( -3.266 8.309 -3.347) 9.535 5.230 ( -14.472 7.520 -0.175) 16.310 5.234 ( -13.084 13.484 -9.071) 20.863 5.385 ( -7.448 15.237 -3.940) 17.412 5.563 ( -8.120 9.542 -2.055) 12.696 5.637 ( 4.199 9.241 4.293) 11.021 5.791 ( -4.048 10.606 10.568) 15.509 6.009 ( 5.420 5.656 -3.001) 8.389 6.243 ( -1.114 9.789 6.142) 11.609 6.443 ( 5.783 2.438 8.817) 10.823 6.502 ( 2.685 9.080 -2.778) 9.868 6.712 ( 2.855 -1.651 2.579) 4.187 6.971 ( 3.184 5.201 4.743) 7.726 7.093 ( 8.137 3.308 -7.930) 11.834 7.243 ( -0.551 6.428 -3.466) 7.323 7.271 ( 6.009 2.134 0.723) 6.418 7.467 ( 2.806 8.887 0.692) 9.346 7.537 ( 3.337 6.796 -2.784) 8.067 7.601 ( -6.264 12.126 -4.075) 14.243 7.667 ( 0.607 11.081 6.033) 12.631 7.872 ( 3.371 12.429 -9.054) 15.742 8.131 ( 5.967 5.897 -0.362) 8.397 8.475 ( -0.790 7.162 8.474) 11.123 8.493 ( 6.476 6.690 -2.563) 9.657 8.633 ( 0.781 11.366 -0.986) 11.435 8.845 ( 6.181 5.323 -8.461) 11.753 8.978 ( -7.473 0.255 4.687) 8.825 9.095 ( -0.837 2.728 -2.774) 3.980 9.217 ( -0.916 2.238 -1.946) 3.104 9.385 ( -0.315 3.733 3.667) 5.242 9.438 ( 5.261 6.099 2.234) 8.359 9.575 ( 0.753 10.255 -0.484) 10.294 9.647 ( 0.246 -3.598 2.852) 4.598 9.840 ( 0.735 9.930 6.394) 11.833 9.977 ( -9.512 13.144 1.149) 16.265 10.160 ( 8.203 9.430 -9.487) 15.692 10.275 ( -4.226 11.890 4.276) 13.323 10.356 ( 3.473 4.418 -2.110) 6.003 10.531 ( 2.236 18.265 1.015) 18.429 10.792 ( -1.126 15.816 2.644) 16.075 10.858 ( -1.167 12.164 -8.685) 14.992 10.965 ( -5.565 4.311 3.377) 7.807 11.007 ( -1.153 7.528 -0.074) 7.616 11.120 ( 1.559 8.121 1.945) 8.495 11.226 ( 2.232 9.413 -2.417) 9.971 11.338 ( 1.312 7.848 -0.055) 7.957 11.563 ( 3.348 0.182 -0.589) 3.405 11.595 ( 1.305 6.708 2.889) 7.419 11.969 ( -0.248 -1.640 1.058) 1.968 12.095 ( -7.383 1.953 2.420) 8.011 12.330 ( 2.372 0.274 -4.906) 5.456 12.625 ( -9.684 5.345 1.486) 11.160 12.753 ( -7.520 1.310 -0.500) 7.650 12.976 ( -0.293 -1.967 -2.726) 3.375 13.111 ( -1.298 -0.943 3.854) 4.174 13.467 ( 0.472 -3.336 -0.206) 3.375 14.116 ( -0.141 1.051 0.684) 1.262 14.296 ( 4.659 3.456 -0.593) 5.831 14.444 ( 2.389 0.916 -0.662) 2.643 14.603 ( 6.727 0.120 -0.215) 6.732 15.563 ( 3.634 3.117 0.077) 4.789 15.740 ( -0.688 1.485 -0.941) 1.888 15.813 ( -0.767 -0.636 -2.106) 2.329 15.869 ( -0.388 -2.042 2.928) 3.591 17.731 ( 1.999 2.384 -0.617) 3.172 17.913 ( -3.117 -0.313 2.267) 3.867 17.992 ( 1.079 -1.947 -1.996) 2.990 18.061 ( -1.490 -4.264 0.489) 4.543 19.855 ( 1.733 -0.508 -0.683) 1.931 19.966 ( -2.633 -2.660 2.321) 4.403 20.031 ( 0.139 -2.939 -2.061) 3.592 20.150 ( -2.634 -3.339 0.484) 4.280 20.594 ( -2.374 5.529 -0.053) 6.017 20.613 ( -3.145 6.167 0.590) 6.948 20.752 ( 2.710 7.539 -1.152) 8.094 20.937 ( 1.461 2.629 0.665) 3.080 21.660 ( -0.678 15.176 0.117) 15.191 21.683 ( 0.166 15.126 -1.396) 15.191 21.737 ( 2.037 13.949 2.420) 14.303 22.126 ( -0.186 3.407 -1.234) 3.628 24.255 ( 1.444 2.452 0.089) 2.847 24.337 ( -0.410 1.221 0.612) 1.426 24.417 ( -0.441 -0.928 -1.035) 1.459 24.509 ( -1.618 -0.179 -0.038) 1.629 30.117 ( 0.101 1.272 0.275) 1.305 30.131 ( 0.170 0.980 -0.281) 1.034 30.301 ( -0.718 -1.445 -0.200) 1.625 30.340 ( 0.307 -1.921 0.025) 1.945 34.209 ( 1.650 0.421 -3.623) 4.003 34.399 ( -0.737 -4.069 4.849) 6.373 34.592 ( 1.358 -9.429 -0.265) 9.530 35.196 ( -7.800 -14.868 -2.342) 16.953 36.818 ( -1.476 -7.599 -1.352) 7.858 36.995 ( 3.430 -10.729 -2.570) 11.553 37.044 ( -0.114 -10.993 3.283) 11.473 37.319 ( 4.711 -14.587 1.805) 15.435 40.694 ( 2.380 -0.561 2.491) 3.490 41.046 ( 6.565 -9.897 -1.070) 11.925 41.218 ( 6.471 -11.214 13.311) 18.569 41.429 ( 0.517 -10.359 -1.486) 10.478 41.854 ( -16.902 -19.370 -9.316) 27.343 41.992 ( -10.666 -16.339 1.092) 19.543 42.234 ( 0.734 -22.068 -11.404) 24.851 42.919 ( 14.227 -34.375 7.279) 37.908 ======================= Grid point 37 (23/126) ======================= q-point: ( 0.33 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.920 ( 5.228 27.554 1.533) 28.088 4.244 ( 8.201 31.946 9.291) 34.265 4.572 ( -7.947 12.944 -4.116) 15.736 4.681 ( -8.417 12.895 -2.106) 15.542 4.835 ( -9.847 16.102 -6.140) 19.848 4.926 ( -17.773 12.390 -4.573) 22.143 5.120 ( 3.785 9.290 -4.838) 11.137 5.277 ( -3.609 13.509 -1.709) 14.087 5.383 ( -10.437 6.889 4.413) 13.261 5.640 ( -2.917 11.362 2.395) 11.973 5.907 ( 8.551 7.371 8.411) 14.078 6.074 ( 2.618 3.916 -0.723) 4.766 6.265 ( 0.245 12.117 6.450) 13.729 6.489 ( -3.270 7.919 -5.657) 10.267 6.540 ( 1.911 4.390 1.897) 5.150 6.825 ( 7.662 4.280 9.004) 12.574 6.989 ( -2.983 10.841 2.877) 11.606 7.174 ( 3.012 -0.005 -3.604) 4.697 7.255 ( 3.181 -3.432 -2.326) 5.226 7.334 ( -4.387 6.101 -8.831) 11.596 7.482 ( 1.471 2.694 3.184) 4.423 7.505 ( 3.151 13.977 -6.210) 15.615 7.620 ( 1.824 8.443 5.864) 10.440 7.747 ( 6.508 -0.045 1.066) 6.595 7.982 ( 10.314 16.142 -7.263) 20.486 8.245 ( 4.347 7.084 -0.036) 8.312 8.400 ( -3.601 1.663 -0.496) 3.997 8.529 ( -0.495 9.750 -4.491) 10.746 8.699 ( 6.774 4.695 0.048) 8.242 8.839 ( -7.986 3.484 3.414) 9.358 8.942 ( -3.251 4.002 2.876) 5.904 9.111 ( 2.178 5.815 -0.373) 6.221 9.217 ( 0.697 5.784 0.064) 5.827 9.396 ( 8.850 6.773 -4.285) 11.940 9.531 ( -0.993 7.676 0.275) 7.745 9.576 ( 4.900 8.608 8.607) 13.122 9.701 ( 1.708 5.698 -3.719) 7.015 9.829 ( -5.750 9.729 -3.949) 11.971 9.945 ( 5.071 7.135 7.317) 11.409 10.092 ( -12.456 12.040 0.022) 17.324 10.290 ( 0.279 5.636 3.357) 6.566 10.357 ( 5.523 2.046 -6.056) 8.448 10.572 ( -0.219 14.544 0.949) 14.576 10.702 ( -9.520 7.280 -1.069) 12.032 10.848 ( 1.794 11.631 -5.213) 12.872 10.901 ( 0.633 11.944 5.263) 13.067 11.070 ( 1.285 4.666 3.880) 6.203 11.174 ( 5.210 4.019 -1.754) 6.810 11.224 ( 1.609 6.988 -3.151) 7.833 11.371 ( 1.857 12.413 -0.523) 12.562 11.627 ( 4.715 6.229 -1.827) 8.023 11.647 ( 1.620 4.987 3.799) 6.476 11.935 ( -7.444 -0.710 0.012) 7.478 11.962 ( -4.792 1.449 3.607) 6.171 12.200 ( -11.344 4.957 -4.108) 13.044 12.547 ( 2.778 1.357 -5.764) 6.540 12.705 ( -1.132 1.628 5.881) 6.207 12.953 ( -1.136 4.901 -1.480) 5.245 13.110 ( 0.260 1.250 4.440) 4.620 13.369 ( -8.786 2.188 -2.207) 9.320 14.172 ( 4.165 -0.051 0.162) 4.168 14.376 ( 4.048 1.282 -0.466) 4.272 14.520 ( 4.937 -2.871 1.100) 5.816 14.679 ( 1.777 -2.242 -1.669) 3.312 15.642 ( 4.224 2.017 0.562) 4.714 15.717 ( -0.526 2.367 -2.511) 3.491 15.806 ( 0.384 -0.578 -0.117) 0.703 15.859 ( -1.900 -2.433 2.162) 3.769 17.777 ( 3.210 1.243 -0.652) 3.504 17.869 ( -2.328 0.389 0.594) 2.434 17.984 ( -1.900 -2.623 1.159) 3.440 18.037 ( -0.542 -2.644 -0.966) 2.867 19.897 ( 3.301 -0.991 -1.115) 3.623 19.929 ( -2.131 -2.150 1.693) 3.469 20.013 ( -1.446 -2.914 -1.003) 3.404 20.093 ( -3.325 -2.541 0.504) 4.215 20.556 ( -1.613 5.984 -0.036) 6.198 20.563 ( -2.192 6.009 0.271) 6.402 20.789 ( 1.741 7.784 -0.804) 8.017 20.963 ( 0.958 3.191 0.575) 3.382 21.653 ( -0.168 15.238 0.266) 15.241 21.680 ( -0.051 15.011 -0.565) 15.022 21.786 ( 2.042 12.418 1.455) 12.669 22.113 ( -0.568 5.039 -1.227) 5.218 24.289 ( 2.093 1.654 0.046) 2.668 24.333 ( -0.409 1.947 0.848) 2.163 24.401 ( -0.527 -1.284 -1.289) 1.894 24.472 ( -2.119 -0.199 0.046) 2.129 30.121 ( 0.110 1.479 0.346) 1.523 30.133 ( 0.164 0.598 -0.367) 0.720 30.288 ( -0.531 -1.334 -0.151) 1.444 30.344 ( 0.145 -1.795 -0.005) 1.801 34.220 ( 1.234 -2.232 -3.243) 4.126 34.397 ( -1.614 -2.247 3.864) 4.752 34.652 ( 5.226 -9.226 0.642) 10.623 35.020 ( -9.372 -11.678 -2.353) 15.157 36.785 ( -1.176 -7.116 -1.098) 7.296 37.036 ( 1.911 -11.716 -2.060) 12.048 37.051 ( -0.169 -11.239 1.720) 11.371 37.430 ( 5.133 -17.078 2.454) 18.000 40.788 ( 6.157 -3.731 5.819) 9.257 41.195 ( 9.754 -10.339 -2.480) 14.428 41.337 ( -11.111 -11.539 -10.923) 19.388 41.427 ( 5.631 -14.192 20.602) 25.643 41.583 ( -3.557 -12.190 -2.150) 12.879 41.799 ( -10.528 -14.144 -1.191) 17.672 42.163 ( -1.904 -24.354 -13.249) 27.790 43.162 ( 8.648 -36.440 4.295) 37.697 ======================= Grid point 38 (24/126) ======================= q-point: (-0.50 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.962 ( 0.000 21.964 0.000) 21.964 4.437 ( 0.000 25.881 0.000) 25.881 4.527 ( 0.000 17.070 0.000) 17.070 4.547 ( -0.000 22.796 -0.000) 22.796 4.661 ( -0.000 9.828 0.000) 9.828 4.721 ( 0.000 24.462 0.000) 24.462 5.191 ( -0.000 1.593 0.000) 1.593 5.214 ( 0.000 13.438 -0.000) 13.438 5.285 ( 0.000 9.983 0.000) 9.983 5.619 ( 0.000 11.255 0.000) 11.255 6.002 ( 0.000 9.096 0.000) 9.096 6.131 ( 0.000 -0.364 -0.000) 0.364 6.303 ( 0.000 11.365 0.000) 11.365 6.392 ( 0.000 7.359 0.000) 7.359 6.559 ( 0.000 7.020 0.000) 7.020 6.937 ( 0.000 19.354 0.000) 19.354 6.991 ( 0.000 1.490 0.000) 1.490 7.168 ( 0.000 -0.706 0.000) 0.706 7.219 ( 0.000 3.792 0.000) 3.792 7.295 ( 0.000 -6.075 -0.000) 6.075 7.500 ( 0.000 8.435 0.000) 8.435 7.540 ( 0.000 12.451 0.000) 12.451 7.650 ( -0.000 3.924 -0.000) 3.924 7.836 ( 0.000 -6.967 0.000) 6.967 8.079 ( 0.000 13.360 0.000) 13.360 8.200 ( 0.000 13.348 -0.000) 13.348 8.498 ( -0.000 12.221 0.000) 12.221 8.537 ( 0.000 7.202 0.000) 7.202 8.641 ( 0.000 -0.330 0.000) 0.330 8.803 ( 0.000 9.596 -0.000) 9.596 8.899 ( 0.000 -6.790 0.000) 6.790 9.104 ( 0.000 2.841 0.000) 2.841 9.226 ( 0.000 9.175 0.000) 9.175 9.507 ( 0.000 10.297 0.000) 10.297 9.637 ( -0.000 17.612 -0.000) 17.612 9.665 ( 0.000 4.126 -0.000) 4.126 9.696 ( -0.000 12.704 -0.000) 12.704 9.731 ( 0.000 -1.207 0.000) 1.207 9.860 ( 0.000 11.533 0.000) 11.533 10.011 ( 0.000 2.689 0.000) 2.689 10.362 ( 0.000 10.900 -0.000) 10.900 10.427 ( 0.000 8.587 0.000) 8.587 10.523 ( 0.000 -3.550 0.000) 3.550 10.567 ( -0.000 8.445 0.000) 8.445 10.855 ( 0.000 10.819 0.000) 10.819 10.953 ( 0.000 12.139 -0.000) 12.139 11.065 ( -0.000 17.034 0.000) 17.034 11.173 ( 0.000 4.687 -0.000) 4.687 11.330 ( -0.000 -3.004 0.000) 3.004 11.374 ( 0.000 12.408 0.000) 12.408 11.663 ( 0.000 1.130 -0.000) 1.130 11.699 ( 0.000 8.869 0.000) 8.869 11.813 ( -0.000 2.661 0.000) 2.661 11.934 ( 0.000 -0.562 0.000) 0.562 12.063 ( 0.000 9.729 0.000) 9.729 12.568 ( 0.000 2.848 0.000) 2.848 12.719 ( 0.000 -1.826 0.000) 1.826 12.935 ( 0.000 8.292 0.000) 8.292 13.165 ( 0.000 2.752 0.000) 2.752 13.228 ( -0.000 2.921 -0.000) 2.921 14.216 ( 0.000 0.566 0.000) 0.566 14.414 ( 0.000 0.291 0.000) 0.291 14.587 ( 0.000 -3.739 0.000) 3.739 14.673 ( -0.000 -3.929 -0.000) 3.929 15.688 ( 0.000 4.732 0.000) 4.732 15.707 ( -0.000 -1.539 0.000) 1.539 15.818 ( 0.000 -0.440 0.000) 0.440 15.834 ( 0.000 -1.727 0.000) 1.727 17.821 ( 0.000 0.847 0.000) 0.847 17.839 ( 0.000 -0.203 0.000) 0.203 17.960 ( 0.000 -1.559 0.000) 1.559 18.032 ( 0.000 -2.483 0.000) 2.483 19.910 ( 0.000 -1.753 0.000) 1.753 19.961 ( 0.000 -3.321 -0.000) 3.321 19.963 ( -0.000 -0.979 0.000) 0.979 20.061 ( 0.000 -2.029 0.000) 2.029 20.540 ( 0.000 6.675 -0.000) 6.675 20.544 ( 0.000 5.373 0.000) 5.373 20.803 ( 0.000 7.925 0.000) 7.925 20.974 ( 0.000 3.446 0.000) 3.446 21.653 ( 0.000 15.115 -0.000) 15.115 21.677 ( 0.000 15.080 0.000) 15.080 21.810 ( 0.000 11.514 0.000) 11.514 22.103 ( 0.000 6.056 -0.000) 6.056 24.318 ( 0.000 0.944 -0.000) 0.944 24.327 ( 0.000 2.498 -0.000) 2.498 24.392 ( 0.000 -1.321 0.000) 1.321 24.449 ( 0.000 -0.278 0.000) 0.278 30.123 ( 0.000 1.644 -0.000) 1.644 30.134 ( 0.000 0.344 0.000) 0.344 30.283 ( 0.000 -1.278 0.000) 1.278 30.346 ( 0.000 -1.741 0.000) 1.741 34.224 ( 0.000 -3.257 0.000) 3.257 34.389 ( 0.000 -1.862 0.000) 1.862 34.737 ( 0.000 -9.462 0.000) 9.462 34.895 ( 0.000 -9.846 0.000) 9.846 36.771 ( 0.000 -6.935 -0.000) 6.935 37.043 ( 0.000 -11.290 0.000) 11.290 37.058 ( 0.000 -12.057 0.000) 12.057 37.488 ( 0.000 -18.205 0.000) 18.205 40.926 ( 0.000 -7.955 0.000) 7.955 41.104 ( 0.000 -8.944 0.000) 8.944 41.316 ( 0.000 -9.913 -0.000) 9.913 41.528 ( 0.000 -12.162 0.000) 12.162 41.587 ( -0.000 -10.330 0.000) 10.330 41.679 ( -0.000 -15.612 -0.000) 15.612 42.095 ( 0.000 -26.096 0.000) 26.096 43.252 ( 0.000 -37.180 0.000) 37.180 ======================= Grid point 42 (25/126) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.368 ( 0.000 31.366 0.000) 31.366 4.739 ( 0.000 5.652 0.000) 5.652 4.865 ( 0.000 -3.229 0.000) 3.229 4.969 ( 0.000 29.168 0.000) 29.168 5.254 ( 0.000 10.064 0.000) 10.064 5.483 ( 0.000 4.002 0.000) 4.002 5.574 ( 0.000 5.433 0.000) 5.433 5.641 ( 0.000 5.693 0.000) 5.693 5.677 ( 0.000 1.195 0.000) 1.195 5.874 ( 0.000 2.882 0.000) 2.882 6.057 ( 0.000 16.732 0.000) 16.732 6.062 ( 0.000 4.215 0.000) 4.215 6.253 ( 0.000 -4.542 0.000) 4.542 6.401 ( 0.000 7.017 0.000) 7.017 6.636 ( 0.000 9.790 0.000) 9.790 6.698 ( 0.000 3.271 0.000) 3.271 7.006 ( 0.000 3.928 0.000) 3.928 7.050 ( 0.000 -2.448 0.000) 2.448 7.196 ( 0.000 -1.664 0.000) 1.664 7.385 ( 0.000 -10.560 0.000) 10.560 7.401 ( 0.000 7.755 0.000) 7.755 7.704 ( 0.000 5.995 0.000) 5.995 7.826 ( 0.000 4.470 0.000) 4.470 7.848 ( 0.000 5.578 0.000) 5.578 8.173 ( 0.000 1.025 0.000) 1.025 8.236 ( 0.000 18.191 0.000) 18.191 8.479 ( 0.000 -2.355 0.000) 2.355 8.559 ( 0.000 -3.816 0.000) 3.816 8.691 ( 0.000 -3.994 0.000) 3.994 8.824 ( 0.000 9.540 0.000) 9.540 9.036 ( 0.000 -0.834 0.000) 0.834 9.138 ( 0.000 0.373 0.000) 0.373 9.240 ( 0.000 1.982 0.000) 1.982 9.403 ( 0.000 1.799 0.000) 1.799 9.459 ( 0.000 1.530 0.000) 1.530 9.599 ( 0.000 -1.181 0.000) 1.181 9.858 ( 0.000 -1.161 0.000) 1.161 9.909 ( 0.000 19.489 0.000) 19.489 10.310 ( 0.000 8.564 0.000) 8.564 10.364 ( 0.000 6.478 0.000) 6.478 10.429 ( 0.000 4.319 0.000) 4.319 10.512 ( 0.000 15.192 0.000) 15.192 10.646 ( 0.000 -3.143 0.000) 3.143 11.103 ( 0.000 10.676 0.000) 10.676 11.104 ( 0.000 11.700 0.000) 11.700 11.240 ( 0.000 16.155 0.000) 16.155 11.288 ( 0.000 11.432 0.000) 11.432 11.363 ( 0.000 16.599 0.000) 16.599 11.364 ( 0.000 0.769 0.000) 0.769 11.579 ( 0.000 18.891 0.000) 18.891 11.698 ( 0.000 18.029 0.000) 18.029 11.709 ( 0.000 6.818 0.000) 6.818 11.983 ( 0.000 4.893 0.000) 4.893 12.230 ( 0.000 7.007 0.000) 7.007 12.308 ( 0.000 0.646 0.000) 0.646 12.798 ( 0.000 -5.773 0.000) 5.773 12.839 ( 0.000 1.889 0.000) 1.889 12.919 ( 0.000 -10.791 0.000) 10.791 12.975 ( 0.000 -1.927 0.000) 1.927 13.222 ( 0.000 -10.087 0.000) 10.087 14.230 ( 0.000 3.100 0.000) 3.100 14.304 ( 0.000 3.053 0.000) 3.053 14.505 ( 0.000 0.049 0.000) 0.049 14.506 ( 0.000 1.193 0.000) 1.193 15.591 ( 0.000 2.477 0.000) 2.477 15.709 ( 0.000 -3.006 0.000) 3.006 15.838 ( 0.000 1.788 0.000) 1.788 15.889 ( 0.000 2.053 0.000) 2.053 17.770 ( 0.000 2.726 0.000) 2.726 17.928 ( 0.000 -0.247 0.000) 0.247 17.973 ( 0.000 -0.088 0.000) 0.088 17.989 ( 0.000 -3.365 0.000) 3.365 19.821 ( 0.000 -1.183 0.000) 1.183 19.917 ( 0.000 -3.508 0.000) 3.508 19.982 ( 0.000 -2.026 0.000) 2.026 20.095 ( 0.000 -4.060 0.000) 4.060 20.707 ( 0.000 3.199 0.000) 3.199 20.747 ( 0.000 3.358 0.000) 3.358 20.838 ( 0.000 4.271 0.000) 4.271 20.941 ( 0.000 0.329 0.000) 0.329 21.930 ( 0.000 11.002 0.000) 11.002 21.952 ( 0.000 10.642 0.000) 10.642 21.961 ( 0.000 10.733 0.000) 10.733 22.183 ( 0.000 2.311 0.000) 2.311 24.308 ( 0.000 3.410 0.000) 3.410 24.372 ( 0.000 2.245 0.000) 2.245 24.415 ( 0.000 -0.192 0.000) 0.192 24.523 ( 0.000 -0.103 0.000) 0.103 30.143 ( 0.000 1.500 0.000) 1.500 30.155 ( 0.000 1.272 0.000) 1.272 30.279 ( 0.000 -1.564 0.000) 1.564 30.295 ( 0.000 -2.039 0.000) 2.039 34.255 ( 0.000 3.238 0.000) 3.238 34.307 ( 0.000 -2.821 0.000) 2.821 34.438 ( 0.000 -5.185 0.000) 5.185 34.971 ( 0.000 -13.958 0.000) 13.958 36.699 ( 0.000 -5.676 0.000) 5.676 36.795 ( 0.000 -6.852 0.000) 6.852 36.836 ( 0.000 -8.345 0.000) 8.345 37.021 ( 0.000 -11.293 0.000) 11.293 40.692 ( 0.000 1.208 0.000) 1.208 40.810 ( 0.000 -7.325 0.000) 7.325 40.983 ( 0.000 -3.801 0.000) 3.801 41.250 ( 0.000 -6.284 0.000) 6.284 41.734 ( 0.000 -18.856 0.000) 18.856 41.744 ( 0.000 -11.788 0.000) 11.788 41.894 ( 0.000 -14.987 0.000) 14.987 42.107 ( 0.000 -26.551 0.000) 26.551 ======================= Grid point 43 (26/126) ======================= q-point: ( 0.17 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.415 ( 4.066 29.506 -0.287) 29.786 4.716 ( -1.926 5.174 -1.722) 5.784 4.852 ( -2.211 6.113 3.043) 7.178 4.949 ( -0.499 20.646 -1.168) 20.685 5.224 ( -5.102 12.305 -1.343) 13.388 5.358 ( -12.359 5.658 1.719) 13.701 5.421 ( -5.658 6.724 -1.108) 8.857 5.586 ( -6.779 5.734 1.027) 8.938 5.717 ( -2.643 4.806 1.916) 5.810 5.872 ( 0.065 12.387 -7.992) 14.742 6.009 ( -0.636 5.148 -3.171) 6.080 6.070 ( 0.435 6.492 5.893) 8.779 6.329 ( 4.759 0.300 7.918) 9.243 6.523 ( 8.107 4.623 4.666) 10.434 6.635 ( 0.970 3.176 -6.330) 7.148 6.733 ( 3.504 7.364 3.000) 8.690 7.017 ( -1.327 0.002 7.903) 8.014 7.095 ( 5.228 -1.007 -1.680) 5.583 7.218 ( 2.945 -4.875 1.068) 5.795 7.357 ( -1.616 -2.438 -1.574) 3.321 7.403 ( 1.455 0.059 -8.479) 8.603 7.714 ( -1.433 4.986 -3.575) 6.301 7.771 ( -0.935 3.088 0.560) 3.275 7.917 ( 1.424 7.669 4.574) 9.043 8.153 ( -0.709 14.271 -5.564) 15.334 8.204 ( 2.435 1.188 -4.012) 4.842 8.473 ( -0.515 -0.903 -3.630) 3.775 8.589 ( 3.387 -4.603 0.972) 5.796 8.648 ( -2.139 -0.884 -3.107) 3.874 8.932 ( 6.083 2.065 -1.265) 6.548 8.995 ( -3.818 0.680 7.089) 8.080 9.102 ( -2.733 -0.763 1.455) 3.188 9.269 ( 3.115 3.717 0.193) 4.853 9.467 ( 2.952 -1.533 -0.083) 3.327 9.491 ( 1.285 4.214 6.671) 7.994 9.614 ( 1.165 3.222 2.658) 4.336 9.837 ( -2.326 -3.546 1.381) 4.460 9.930 ( 4.635 15.832 -4.315) 17.052 10.244 ( -4.424 13.648 0.928) 14.377 10.381 ( 0.923 7.554 -5.728) 9.525 10.420 ( 0.366 4.784 -0.730) 4.853 10.537 ( -2.444 9.672 5.463) 11.373 10.661 ( 4.493 -0.575 -1.235) 4.695 10.986 ( -5.631 8.297 -4.717) 11.082 11.109 ( -12.568 6.782 -1.810) 14.396 11.179 ( 0.232 15.654 4.903) 16.405 11.270 ( -0.852 7.944 0.178) 7.991 11.327 ( 4.471 22.013 -0.365) 22.465 11.455 ( 3.757 12.153 0.262) 12.724 11.620 ( -1.924 7.870 -4.339) 9.190 11.710 ( 8.514 17.578 2.062) 19.640 11.760 ( 1.705 10.952 0.904) 11.121 11.999 ( -0.590 6.807 2.003) 7.120 12.172 ( -6.043 5.657 3.849) 9.128 12.340 ( 3.765 1.713 -4.999) 6.488 12.631 ( -12.184 -3.620 -0.973) 12.748 12.757 ( -4.120 -1.835 2.277) 5.052 12.946 ( 5.630 -0.849 -1.148) 5.808 13.074 ( 1.559 -3.307 1.745) 4.051 13.346 ( 8.365 -8.487 -0.430) 11.924 14.147 ( -4.018 2.109 0.155) 4.540 14.342 ( 1.948 1.148 -0.464) 2.308 14.465 ( -0.884 0.870 -1.190) 1.719 14.585 ( 4.057 -2.014 -0.214) 4.535 15.613 ( 2.026 1.775 0.431) 2.728 15.723 ( 1.011 -2.532 1.747) 3.238 15.821 ( -1.319 2.071 -1.011) 2.655 15.880 ( -0.873 1.544 -0.559) 1.860 17.779 ( 1.123 2.374 -0.501) 2.673 17.918 ( -1.572 0.743 1.291) 2.166 17.954 ( -1.040 -2.120 -0.415) 2.397 17.999 ( 0.372 -1.818 -0.200) 1.866 19.832 ( 1.330 -1.352 -0.583) 1.984 19.907 ( -1.431 -2.899 1.594) 3.605 19.973 ( -0.527 -2.396 -1.435) 2.842 20.076 ( -2.181 -3.908 0.433) 4.496 20.685 ( -1.931 3.442 -0.182) 3.951 20.713 ( -2.886 3.544 0.432) 4.591 20.868 ( 2.620 4.143 -0.783) 4.964 20.964 ( 1.911 0.438 0.522) 2.029 21.925 ( -0.446 11.109 0.130) 11.119 21.947 ( 0.092 10.965 -1.202) 11.031 21.978 ( 0.908 9.924 1.672) 10.105 22.187 ( 0.477 2.480 -0.588) 2.593 24.315 ( 0.740 3.149 -0.011) 3.235 24.372 ( -0.030 2.181 0.414) 2.220 24.409 ( -0.592 -0.037 -0.342) 0.685 24.508 ( -1.492 -0.030 -0.179) 1.503 30.144 ( -0.039 1.358 0.486) 1.443 30.155 ( 0.207 1.386 -0.497) 1.487 30.271 ( -0.588 -1.511 -0.154) 1.629 30.301 ( 0.425 -1.946 0.092) 1.994 34.221 ( -1.305 0.599 -2.990) 3.317 34.362 ( 2.572 0.465 3.907) 4.701 34.435 ( 0.347 -6.208 0.261) 6.223 34.922 ( -4.560 -12.352 -1.732) 13.280 36.686 ( -0.925 -5.303 -0.975) 5.471 36.813 ( 1.868 -7.246 -1.402) 7.613 36.842 ( -0.040 -8.742 1.810) 8.927 37.046 ( 2.549 -12.259 1.152) 12.574 40.698 ( 0.669 0.606 0.679) 1.129 40.874 ( 6.115 -7.080 1.404) 9.460 41.034 ( 3.999 -6.569 7.354) 10.640 41.269 ( 0.911 -5.181 -0.476) 5.282 41.500 ( -13.282 -15.562 -7.754) 21.879 41.716 ( -6.659 -11.089 0.219) 12.936 41.851 ( -1.747 -15.911 -8.186) 17.978 42.289 ( 11.598 -28.174 6.948) 31.250 ======================= Grid point 44 (27/126) ======================= q-point: ( 0.33 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.438 ( -2.390 23.757 -0.075) 23.877 4.693 ( 1.429 4.916 -2.271) 5.601 4.857 ( 2.209 18.922 1.890) 19.144 4.950 ( -0.281 9.081 0.423) 9.095 5.052 ( -7.279 15.755 -3.239) 17.655 5.215 ( -8.490 15.887 0.930) 18.037 5.331 ( -2.703 9.595 3.444) 10.547 5.489 ( -3.632 7.007 0.213) 7.896 5.560 ( -9.788 11.739 -3.362) 15.650 5.843 ( -1.287 7.403 -4.126) 8.572 6.046 ( 4.610 4.261 3.631) 7.252 6.134 ( 2.707 4.509 2.249) 5.720 6.437 ( 2.307 5.112 8.239) 9.966 6.597 ( -2.135 3.498 -6.330) 7.540 6.649 ( 3.499 4.793 3.936) 7.121 6.817 ( 4.461 -0.130 -0.263) 4.471 7.078 ( 2.486 -0.663 10.892) 11.192 7.100 ( -2.023 -4.513 -2.109) 5.377 7.310 ( -3.597 6.056 0.447) 7.057 7.368 ( 4.136 -3.884 -10.464) 11.903 7.411 ( 9.859 -5.970 5.380) 12.719 7.633 ( -1.639 2.672 -6.126) 6.881 7.753 ( -1.860 -0.859 -5.203) 5.592 7.865 ( -7.454 10.140 3.100) 12.961 8.198 ( 2.561 1.451 -8.056) 8.577 8.310 ( 13.029 2.408 4.388) 13.957 8.438 ( -1.099 5.724 -2.594) 6.380 8.640 ( 3.341 1.777 -3.260) 4.994 8.662 ( 2.948 -7.774 0.820) 8.355 8.832 ( -10.512 -3.725 0.224) 11.155 8.997 ( -1.977 1.690 0.072) 2.602 9.136 ( 0.587 -1.713 4.082) 4.466 9.360 ( 7.535 3.220 -2.726) 8.636 9.482 ( -1.948 5.154 2.306) 5.973 9.503 ( 0.373 -0.442 3.897) 3.939 9.661 ( 0.340 -0.324 5.109) 5.131 9.767 ( -4.489 -3.452 -1.523) 5.864 10.061 ( 10.555 13.396 -8.518) 19.063 10.216 ( -2.555 16.881 9.596) 19.586 10.344 ( -7.415 12.102 2.966) 14.500 10.389 ( 3.023 3.469 0.269) 4.609 10.541 ( 4.561 10.841 -7.210) 13.796 10.730 ( -2.307 3.801 4.913) 6.626 10.835 ( -12.587 6.697 -4.262) 14.881 10.938 ( 3.078 1.390 -6.162) 7.027 11.171 ( -2.709 14.529 3.143) 15.109 11.279 ( 0.528 7.723 4.780) 9.098 11.441 ( 6.627 20.266 -0.305) 21.324 11.485 ( 0.505 19.234 -3.767) 19.606 11.619 ( 2.992 7.018 0.539) 7.648 11.774 ( 0.047 3.736 -0.984) 3.864 11.824 ( 0.928 17.530 -0.474) 17.561 11.940 ( -4.674 5.302 -0.233) 7.072 12.086 ( -3.769 9.261 3.997) 10.768 12.362 ( -0.969 10.333 -0.637) 10.398 12.532 ( 3.191 -2.725 -5.888) 7.230 12.703 ( -4.079 -0.979 4.784) 6.363 13.025 ( 3.114 1.483 -0.522) 3.488 13.113 ( 2.795 -1.333 2.677) 4.094 13.375 ( -4.377 -1.663 -1.271) 4.851 14.156 ( 3.830 -1.186 0.288) 4.019 14.370 ( 1.534 -1.777 -1.138) 2.609 14.464 ( 1.335 -2.643 0.010) 2.961 14.614 ( -0.758 -4.250 -0.938) 4.418 15.655 ( 2.034 0.174 0.440) 2.088 15.751 ( 0.766 -0.467 1.140) 1.451 15.798 ( -0.218 1.272 -0.199) 1.306 15.854 ( -1.521 0.856 -0.772) 1.909 17.805 ( 2.000 1.491 -0.647) 2.577 17.884 ( -2.384 0.890 0.466) 2.587 17.941 ( -0.575 -1.478 0.850) 1.799 17.997 ( -0.208 -1.420 -0.506) 1.522 19.862 ( 2.222 -1.964 -0.662) 3.038 19.887 ( -1.257 -1.739 1.228) 2.473 19.952 ( -1.166 -2.794 -1.066) 3.210 20.030 ( -2.666 -3.555 0.516) 4.473 20.652 ( -1.345 3.699 -0.217) 3.942 20.668 ( -1.983 3.926 0.315) 4.410 20.907 ( 1.771 4.073 -0.536) 4.474 20.998 ( 1.343 0.618 0.422) 1.538 21.920 ( -0.241 11.187 0.253) 11.193 21.944 ( 0.037 11.024 -0.682) 11.045 22.002 ( 0.858 8.966 1.009) 9.063 22.192 ( 0.355 2.907 -0.565) 2.983 24.332 ( 1.101 2.460 -0.082) 2.696 24.376 ( 0.095 2.135 0.773) 2.272 24.395 ( -0.514 0.366 -0.535) 0.827 24.473 ( -2.048 0.096 -0.272) 2.068 30.145 ( -0.032 1.068 0.505) 1.182 30.157 ( 0.192 1.611 -0.526) 1.705 30.261 ( -0.385 -1.322 -0.102) 1.381 30.308 ( 0.238 -1.844 0.052) 1.860 34.193 ( -0.494 -0.417 -1.921) 2.027 34.377 ( -1.501 -0.597 2.227) 2.751 34.500 ( 5.361 -5.349 1.173) 7.663 34.812 ( -5.969 -9.028 -1.902) 10.989 36.665 ( -0.809 -4.754 -0.865) 4.899 36.836 ( 1.154 -7.997 -1.356) 8.193 36.845 ( -0.249 -8.951 1.046) 9.015 37.111 ( 3.095 -14.307 1.697) 14.736 40.732 ( 2.656 -1.877 2.317) 3.994 41.003 ( 4.951 -8.846 -1.583) 10.260 41.159 ( -6.301 -6.433 -6.104) 10.879 41.186 ( 5.765 -9.514 12.592) 16.802 41.388 ( 1.387 -6.471 1.926) 6.892 41.556 ( -9.699 -9.862 -2.047) 13.983 41.749 ( -4.283 -16.868 -11.201) 20.696 42.491 ( 7.036 -30.173 4.215) 31.268 ======================= Grid point 45 (28/126) ======================= q-point: (-0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.399 ( 0.000 21.303 0.000) 21.303 4.713 ( 0.000 4.328 0.000) 4.328 4.874 ( 0.000 17.614 0.000) 17.614 4.952 ( 0.000 6.393 -0.000) 6.393 5.012 ( 0.000 21.738 0.000) 21.738 5.100 ( 0.000 19.558 0.000) 19.558 5.343 ( 0.000 17.627 0.000) 17.627 5.418 ( 0.000 7.607 -0.000) 7.607 5.469 ( 0.000 7.830 0.000) 7.830 5.818 ( 0.000 6.909 0.000) 6.909 6.117 ( 0.000 -1.551 0.000) 1.551 6.162 ( 0.000 7.126 -0.000) 7.126 6.485 ( -0.000 6.528 -0.000) 6.528 6.536 ( 0.000 7.695 0.000) 7.695 6.699 ( 0.000 5.756 0.000) 5.756 6.864 ( 0.000 -7.654 0.000) 7.654 7.048 ( 0.000 -7.831 -0.000) 7.831 7.161 ( 0.000 1.065 0.000) 1.065 7.290 ( -0.000 5.029 -0.000) 5.029 7.323 ( 0.000 4.516 0.000) 4.516 7.605 ( -0.000 3.488 -0.000) 3.488 7.650 ( -0.000 -3.085 -0.000) 3.085 7.652 ( 0.000 -10.048 0.000) 10.048 7.767 ( 0.000 6.836 0.000) 6.836 8.200 ( 0.000 -0.222 0.000) 0.222 8.419 ( 0.000 8.393 0.000) 8.393 8.577 ( -0.000 0.533 -0.000) 0.533 8.589 ( 0.000 -0.123 0.000) 0.123 8.698 ( -0.000 -12.706 0.000) 12.706 8.708 ( 0.000 3.342 -0.000) 3.342 8.965 ( 0.000 2.872 -0.000) 2.872 9.120 ( -0.000 0.016 0.000) 0.016 9.449 ( 0.000 9.833 0.000) 9.833 9.490 ( 0.000 -4.320 -0.000) 4.320 9.499 ( -0.000 -8.289 0.000) 8.289 9.671 ( 0.000 -2.792 0.000) 2.792 9.724 ( 0.000 1.294 -0.000) 1.294 10.150 ( 0.000 5.310 0.000) 5.310 10.162 ( 0.000 27.035 0.000) 27.035 10.299 ( 0.000 13.965 0.000) 13.965 10.525 ( 0.000 6.510 0.000) 6.510 10.586 ( 0.000 5.508 0.000) 5.508 10.592 ( 0.000 7.249 -0.000) 7.249 10.698 ( -0.000 11.591 0.000) 11.591 10.991 ( 0.000 -3.994 -0.000) 3.994 11.147 ( 0.000 12.323 0.000) 12.323 11.300 ( 0.000 7.747 0.000) 7.747 11.477 ( -0.000 21.995 0.000) 21.995 11.524 ( 0.000 17.629 0.000) 17.629 11.652 ( 0.000 3.202 0.000) 3.202 11.737 ( 0.000 14.452 0.000) 14.452 11.852 ( -0.000 5.068 -0.000) 5.068 11.858 ( 0.000 6.829 0.000) 6.829 12.081 ( 0.000 14.143 0.000) 14.143 12.338 ( 0.000 15.358 0.000) 15.358 12.581 ( 0.000 -0.298 0.000) 0.298 12.661 ( 0.000 -4.193 0.000) 4.193 13.052 ( 0.000 2.852 0.000) 2.852 13.184 ( 0.000 -1.236 0.000) 1.236 13.279 ( 0.000 2.351 -0.000) 2.351 14.206 ( 0.000 -1.440 0.000) 1.440 14.379 ( 0.000 -3.692 0.000) 3.692 14.501 ( 0.000 -4.732 0.000) 4.732 14.580 ( -0.000 -5.254 0.000) 5.254 15.677 ( 0.000 -0.773 0.000) 0.773 15.755 ( 0.000 1.687 0.000) 1.687 15.812 ( 0.000 -0.352 0.000) 0.352 15.827 ( -0.000 0.693 -0.000) 0.693 17.842 ( -0.000 0.438 0.000) 0.438 17.843 ( 0.000 1.120 -0.000) 1.120 17.938 ( 0.000 -0.471 0.000) 0.471 17.993 ( 0.000 -1.452 0.000) 1.452 19.873 ( 0.000 -1.681 0.000) 1.681 19.900 ( 0.000 -2.476 0.000) 2.476 19.926 ( -0.000 -2.141 -0.000) 2.141 20.004 ( 0.000 -3.474 0.000) 3.474 20.639 ( 0.000 3.777 -0.000) 3.777 20.651 ( 0.000 4.112 0.000) 4.112 20.922 ( 0.000 4.064 0.000) 4.064 21.012 ( 0.000 0.705 0.000) 0.705 21.918 ( 0.000 11.168 0.000) 11.168 21.942 ( 0.000 11.064 -0.000) 11.064 22.013 ( 0.000 8.490 0.000) 8.490 22.194 ( 0.000 3.178 -0.000) 3.178 24.345 ( 0.000 1.732 -0.000) 1.732 24.376 ( 0.000 2.184 0.000) 2.184 24.393 ( 0.000 0.991 0.000) 0.991 24.448 ( 0.000 0.041 0.000) 0.041 30.146 ( 0.000 0.907 -0.000) 0.907 30.157 ( 0.000 1.733 0.000) 1.733 30.258 ( 0.000 -1.226 0.000) 1.226 30.310 ( 0.000 -1.795 0.000) 1.795 34.185 ( 0.000 -0.706 0.000) 0.706 34.366 ( 0.000 -1.063 0.000) 1.063 34.574 ( 0.000 -6.171 0.000) 6.171 34.732 ( 0.000 -6.538 0.000) 6.538 36.654 ( 0.000 -4.554 -0.000) 4.554 36.840 ( 0.000 -8.706 0.000) 8.706 36.847 ( 0.000 -8.563 0.000) 8.563 37.147 ( 0.000 -15.299 0.000) 15.299 40.793 ( 0.000 -5.197 0.000) 5.197 40.942 ( 0.000 -7.474 -0.000) 7.474 41.174 ( 0.000 -4.096 -0.000) 4.096 41.313 ( 0.000 -9.014 0.000) 9.014 41.399 ( -0.000 -9.300 -0.000) 9.300 41.438 ( 0.000 -6.482 0.000) 6.482 41.652 ( 0.000 -18.090 0.000) 18.090 42.566 ( 0.000 -30.900 0.000) 30.900 ======================= Grid point 49 (29/126) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.694 ( 0.000 3.792 0.000) 3.792 4.798 ( 0.000 -3.154 0.000) 3.154 5.056 ( 0.000 22.512 0.000) 22.512 5.360 ( 0.000 9.188 0.000) 9.188 5.420 ( 0.000 5.214 0.000) 5.214 5.556 ( 0.000 -3.999 0.000) 3.999 5.610 ( 0.000 9.471 0.000) 9.471 5.747 ( 0.000 3.753 0.000) 3.753 5.775 ( 0.000 6.841 0.000) 6.841 5.841 ( 0.000 -3.719 0.000) 3.719 6.079 ( 0.000 -5.870 0.000) 5.870 6.142 ( 0.000 1.182 0.000) 1.182 6.470 ( 0.000 18.925 0.000) 18.925 6.563 ( 0.000 8.940 0.000) 8.940 6.769 ( 0.000 2.519 0.000) 2.519 6.828 ( 0.000 8.129 0.000) 8.129 6.979 ( 0.000 -3.883 0.000) 3.883 7.059 ( 0.000 -2.083 0.000) 2.083 7.157 ( 0.000 -7.724 0.000) 7.724 7.163 ( 0.000 -1.014 0.000) 1.014 7.572 ( 0.000 7.775 0.000) 7.775 7.680 ( 0.000 -5.639 0.000) 5.639 7.840 ( 0.000 -5.134 0.000) 5.134 7.882 ( 0.000 1.276 0.000) 1.276 8.110 ( 0.000 -4.196 0.000) 4.196 8.274 ( 0.000 -14.691 0.000) 14.691 8.516 ( 0.000 4.938 0.000) 4.938 8.549 ( 0.000 8.931 0.000) 8.931 8.772 ( 0.000 6.237 0.000) 6.237 8.937 ( 0.000 1.914 0.000) 1.914 9.028 ( 0.000 0.995 0.000) 0.995 9.125 ( 0.000 -1.439 0.000) 1.439 9.299 ( 0.000 3.253 0.000) 3.253 9.429 ( 0.000 -2.856 0.000) 2.856 9.452 ( 0.000 2.790 0.000) 2.790 9.591 ( 0.000 -1.733 0.000) 1.733 9.869 ( 0.000 2.512 0.000) 2.512 10.066 ( 0.000 -3.641 0.000) 3.641 10.410 ( 0.000 1.457 0.000) 1.457 10.430 ( 0.000 3.427 0.000) 3.427 10.614 ( 0.000 4.897 0.000) 4.897 10.691 ( 0.000 3.102 0.000) 3.102 10.726 ( 0.000 18.693 0.000) 18.693 11.199 ( 0.000 0.470 0.000) 0.470 11.310 ( 0.000 0.388 0.000) 0.388 11.344 ( 0.000 11.245 0.000) 11.245 11.442 ( 0.000 -0.482 0.000) 0.482 11.652 ( 0.000 11.428 0.000) 11.428 11.657 ( 0.000 15.574 0.000) 15.574 11.682 ( 0.000 -3.819 0.000) 3.819 11.972 ( 0.000 18.400 0.000) 18.400 12.046 ( 0.000 15.417 0.000) 15.417 12.237 ( 0.000 14.973 0.000) 14.973 12.327 ( 0.000 1.307 0.000) 1.307 12.439 ( 0.000 13.138 0.000) 13.138 12.659 ( 0.000 -13.606 0.000) 13.606 12.726 ( 0.000 -11.803 0.000) 11.803 12.749 ( 0.000 0.629 0.000) 0.629 12.931 ( 0.000 -3.357 0.000) 3.357 13.015 ( 0.000 -10.984 0.000) 10.984 14.283 ( 0.000 2.371 0.000) 2.371 14.343 ( 0.000 0.664 0.000) 0.664 14.494 ( 0.000 -0.688 0.000) 0.688 14.510 ( 0.000 -0.590 0.000) 0.590 15.625 ( 0.000 0.976 0.000) 0.976 15.660 ( 0.000 -1.708 0.000) 1.708 15.881 ( 0.000 2.169 0.000) 2.169 15.919 ( 0.000 0.739 0.000) 0.739 17.823 ( 0.000 2.525 0.000) 2.525 17.914 ( 0.000 -1.817 0.000) 1.817 17.951 ( 0.000 -0.005 0.000) 0.005 17.971 ( 0.000 -0.235 0.000) 0.235 19.805 ( 0.000 -0.248 0.000) 0.248 19.855 ( 0.000 -2.623 0.000) 2.623 19.957 ( 0.000 -0.414 0.000) 0.414 20.019 ( 0.000 -3.340 0.000) 3.340 20.754 ( 0.000 1.658 0.000) 1.658 20.783 ( 0.000 0.525 0.000) 0.525 20.900 ( 0.000 2.108 0.000) 2.108 20.941 ( 0.000 -0.257 0.000) 0.257 22.106 ( 0.000 6.491 0.000) 6.491 22.117 ( 0.000 5.745 0.000) 5.745 22.124 ( 0.000 5.421 0.000) 5.421 22.214 ( 0.000 0.528 0.000) 0.528 24.365 ( 0.000 2.157 0.000) 2.157 24.411 ( 0.000 -0.376 0.000) 0.376 24.427 ( 0.000 3.069 0.000) 3.069 24.514 ( 0.000 -0.914 0.000) 0.914 30.175 ( 0.000 1.676 0.000) 1.676 30.181 ( 0.000 1.379 0.000) 1.379 30.248 ( 0.000 -1.545 0.000) 1.545 30.255 ( 0.000 -1.933 0.000) 1.933 34.274 ( 0.000 -0.649 0.000) 0.649 34.298 ( 0.000 -0.301 0.000) 0.301 34.406 ( 0.000 3.199 0.000) 3.199 34.721 ( 0.000 -10.979 0.000) 10.979 36.616 ( 0.000 -2.402 0.000) 2.402 36.675 ( 0.000 -5.125 0.000) 5.125 36.725 ( 0.000 -2.489 0.000) 2.489 36.830 ( 0.000 -7.457 0.000) 7.457 40.686 ( 0.000 -1.602 0.000) 1.602 40.699 ( 0.000 -3.646 0.000) 3.646 41.013 ( 0.000 6.896 0.000) 6.896 41.179 ( 0.000 -0.632 0.000) 0.632 41.417 ( 0.000 -12.597 0.000) 12.597 41.530 ( 0.000 -12.276 0.000) 12.276 41.660 ( 0.000 -8.224 0.000) 8.224 41.670 ( 0.000 -14.072 0.000) 14.072 ======================= Grid point 50 (30/126) ======================= q-point: ( 0.17 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.712 ( 1.861 2.971 -0.571) 3.552 4.808 ( 0.753 -2.756 1.204) 3.100 5.019 ( -3.221 21.383 -3.670) 21.934 5.333 ( -3.021 9.110 -0.366) 9.605 5.417 ( -2.089 4.499 2.121) 5.395 5.492 ( -3.802 4.730 3.151) 6.838 5.581 ( -1.457 13.608 -1.429) 13.760 5.671 ( -7.172 3.573 -0.180) 8.015 5.749 ( 1.173 -0.862 -0.172) 1.466 5.969 ( 5.866 -1.029 2.689) 6.534 6.080 ( -3.774 2.205 1.647) 4.671 6.140 ( 2.377 -2.485 -3.225) 4.714 6.459 ( 1.209 13.266 3.808) 13.855 6.616 ( 2.865 7.078 -1.034) 7.706 6.748 ( -0.648 5.977 -1.497) 6.196 6.874 ( 4.012 4.509 2.022) 6.366 6.966 ( -0.625 -3.965 0.623) 4.062 7.102 ( -3.526 -0.571 2.187) 4.189 7.147 ( -0.475 -1.906 1.007) 2.208 7.157 ( 5.973 -8.766 4.090) 11.369 7.510 ( -3.077 4.827 -8.666) 10.386 7.690 ( 0.241 -6.266 -7.706) 9.935 7.794 ( -2.000 0.342 -1.703) 2.649 7.953 ( 3.490 -3.069 3.229) 5.659 8.114 ( 1.996 -3.489 -4.132) 5.765 8.296 ( 1.443 -9.553 0.163) 9.662 8.495 ( -4.002 6.689 2.906) 8.318 8.539 ( 2.816 5.808 -3.426) 7.307 8.725 ( -3.550 4.833 -2.240) 6.401 8.917 ( -4.560 -3.124 -2.308) 5.990 8.996 ( -2.942 0.377 6.812) 7.429 9.082 ( -2.966 -1.405 1.704) 3.698 9.339 ( 2.760 2.598 0.406) 3.812 9.440 ( 0.951 -0.955 2.107) 2.501 9.514 ( 3.516 -0.426 7.374) 8.180 9.637 ( 2.654 -3.612 -1.478) 4.720 9.839 ( -2.140 5.758 -0.083) 6.143 10.069 ( 0.998 -1.456 -0.523) 1.841 10.414 ( 1.245 3.729 -1.901) 4.367 10.497 ( 6.763 2.091 -2.511) 7.511 10.580 ( -1.412 4.767 0.750) 5.027 10.684 ( -5.073 10.960 9.681) 15.479 10.729 ( 3.655 9.089 -8.762) 13.143 11.111 ( -5.737 2.623 -4.885) 7.979 11.204 ( -9.273 3.497 -2.908) 10.329 11.372 ( -3.322 1.307 2.464) 4.337 11.412 ( 0.840 6.775 1.179) 6.928 11.654 ( 2.931 6.135 -0.495) 6.817 11.688 ( 1.771 7.192 2.662) 7.871 11.770 ( 3.914 10.388 0.712) 11.124 11.974 ( 2.232 17.072 -0.075) 17.217 12.098 ( 2.598 13.629 -0.646) 13.889 12.243 ( -0.909 14.068 -0.531) 14.107 12.290 ( -3.039 5.750 2.894) 7.118 12.437 ( 1.120 7.893 -1.734) 8.159 12.508 ( -6.499 -7.574 0.154) 9.981 12.718 ( 0.734 -2.030 -0.156) 2.164 12.874 ( 6.469 -8.211 0.947) 10.496 12.985 ( 3.960 -3.806 0.258) 5.499 13.155 ( 12.044 -9.449 -0.782) 15.328 14.204 ( -5.614 3.528 -0.122) 6.632 14.340 ( -1.011 -1.522 -0.279) 1.849 14.474 ( -2.586 0.117 -1.121) 2.821 14.530 ( 1.354 -3.002 -0.359) 3.313 15.638 ( 1.102 0.848 0.709) 1.561 15.679 ( 1.616 -1.671 1.537) 2.787 15.866 ( -1.428 2.113 -0.493) 2.598 15.903 ( -1.357 0.561 -0.914) 1.730 17.825 ( 0.418 2.231 -0.429) 2.310 17.909 ( -0.685 -2.111 -0.116) 2.222 17.939 ( -0.896 1.142 0.764) 1.640 17.977 ( 0.245 -0.734 -0.006) 0.774 19.812 ( 0.940 -0.382 -0.391) 1.087 19.855 ( -0.126 -2.264 0.577) 2.340 19.942 ( -1.312 -0.584 -0.553) 1.539 20.001 ( -1.928 -3.267 0.333) 3.808 20.735 ( -1.701 1.711 -0.110) 2.415 20.756 ( -2.324 0.896 0.176) 2.497 20.926 ( 2.310 1.918 -0.365) 3.024 20.964 ( 1.995 -0.307 0.310) 2.042 22.103 ( -0.265 6.515 0.008) 6.520 22.116 ( 0.002 5.785 -0.454) 5.803 22.131 ( 0.386 5.231 0.777) 5.303 22.219 ( 0.536 0.512 -0.312) 0.805 24.369 ( 0.419 2.070 0.088) 2.114 24.408 ( -0.195 -0.088 -0.358) 0.417 24.424 ( -0.471 2.700 0.425) 2.773 24.501 ( -1.288 -0.788 -0.183) 1.521 30.172 ( -0.274 1.462 0.295) 1.517 30.185 ( 0.367 1.514 -0.340) 1.594 30.241 ( -0.400 -1.450 -0.032) 1.504 30.263 ( 0.527 -1.856 0.045) 1.930 34.236 ( -1.953 1.059 -1.133) 2.494 34.330 ( 0.936 -3.845 0.359) 3.974 34.419 ( 1.484 4.306 1.717) 4.867 34.701 ( -1.716 -9.628 -1.115) 9.843 36.611 ( -0.366 -2.028 -0.516) 2.125 36.685 ( 0.580 -5.575 0.739) 5.654 36.725 ( 0.278 -2.518 -0.600) 2.603 36.840 ( 1.022 -8.052 0.567) 8.136 40.700 ( 1.328 -0.396 0.554) 1.492 40.762 ( 4.881 -4.205 3.349) 7.261 40.977 ( -0.927 0.924 0.156) 1.319 41.205 ( -7.870 -6.614 -6.075) 11.941 41.273 ( 2.049 -1.135 2.685) 3.563 41.553 ( -4.146 -5.065 -2.099) 6.874 41.599 ( -3.269 -9.355 -4.179) 10.755 41.796 ( 8.889 -20.498 5.658) 23.048 ======================= Grid point 51 (31/126) ======================= q-point: ( 0.33 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.749 ( 2.549 2.447 -1.298) 3.764 4.821 ( -0.986 5.230 2.494) 5.877 4.932 ( -2.672 10.690 -4.235) 11.805 5.222 ( -6.628 7.012 -1.390) 9.748 5.434 ( -2.142 12.946 0.101) 13.122 5.463 ( 4.324 9.700 4.628) 11.585 5.532 ( -6.625 9.692 2.047) 11.917 5.613 ( 2.190 8.450 -0.679) 8.756 5.752 ( -1.565 5.762 1.289) 6.108 5.961 ( -5.790 5.212 -5.288) 9.416 6.026 ( 0.363 -3.836 1.342) 4.080 6.195 ( 2.869 -2.426 0.910) 3.865 6.552 ( 3.504 7.601 6.585) 10.650 6.647 ( 3.167 4.698 -0.755) 5.716 6.746 ( 0.617 5.734 -0.623) 5.801 6.880 ( -1.883 1.720 -1.758) 3.097 6.967 ( -5.191 -6.123 2.894) 8.533 7.105 ( 3.498 3.227 5.011) 6.911 7.178 ( 6.071 -11.944 -2.469) 13.624 7.332 ( 6.322 -3.499 0.355) 7.235 7.417 ( -0.484 4.312 1.381) 4.554 7.623 ( -2.006 -5.039 -8.945) 10.461 7.742 ( -3.201 1.897 -2.515) 4.491 7.934 ( -5.369 -2.959 -6.644) 9.039 8.145 ( 2.094 -1.196 -1.115) 2.657 8.341 ( 3.141 -7.384 3.190) 8.635 8.488 ( 1.620 1.778 4.682) 5.264 8.574 ( 0.407 3.450 -1.003) 3.616 8.672 ( 0.745 1.538 -2.182) 2.772 8.757 ( -8.788 -3.131 -4.300) 10.273 8.988 ( -2.067 -1.495 2.704) 3.717 9.081 ( 1.400 -3.352 1.925) 4.111 9.362 ( 0.332 -0.799 -0.819) 1.192 9.442 ( -3.695 -4.309 4.710) 7.376 9.605 ( 3.638 1.836 3.539) 5.397 9.651 ( 0.318 0.690 -0.735) 1.058 9.799 ( -2.378 7.441 0.811) 7.853 10.103 ( 1.515 -4.151 0.528) 4.450 10.469 ( 5.456 5.498 -4.373) 8.895 10.542 ( 1.487 8.608 5.477) 10.311 10.618 ( -3.427 7.024 1.417) 7.943 10.677 ( 7.688 7.517 -0.533) 10.765 10.772 ( 3.889 5.741 -0.688) 6.968 10.950 ( -10.419 4.613 -4.473) 12.242 11.034 ( -6.038 4.867 -5.687) 9.617 11.285 ( -4.297 -2.317 0.862) 4.957 11.457 ( 1.125 8.667 3.054) 9.258 11.690 ( 0.757 -0.368 -0.091) 0.847 11.738 ( 2.555 11.328 1.123) 11.666 11.818 ( 1.464 9.185 2.117) 9.539 11.990 ( -3.569 17.445 -1.383) 17.860 12.057 ( -4.038 5.823 -1.193) 7.186 12.207 ( 2.110 16.921 -1.922) 17.160 12.346 ( 5.117 15.305 1.577) 16.215 12.444 ( -1.903 -4.643 -0.814) 5.084 12.499 ( 4.442 1.482 1.333) 4.869 12.730 ( -0.107 3.036 0.468) 3.074 12.979 ( 4.428 -7.893 0.699) 9.077 13.075 ( 5.275 0.330 0.562) 5.315 13.305 ( 3.494 -5.048 -0.471) 6.158 14.151 ( 0.502 1.322 -0.060) 1.415 14.308 ( -1.888 -4.240 -0.934) 4.734 14.421 ( -1.870 -1.172 -0.665) 2.305 14.516 ( -2.622 -5.136 -0.542) 5.792 15.665 ( 1.332 0.930 0.821) 1.820 15.724 ( 2.139 -1.629 1.619) 3.139 15.835 ( -1.395 1.689 -0.626) 2.278 15.867 ( -2.002 0.213 -1.001) 2.249 17.835 ( 0.957 1.475 -0.578) 1.851 17.886 ( -1.739 -0.861 0.214) 1.952 17.937 ( 0.150 0.902 0.518) 1.051 17.976 ( -0.332 -0.864 0.052) 0.927 19.834 ( 1.553 -0.655 -0.364) 1.724 19.858 ( 0.227 -1.241 0.652) 1.421 19.911 ( -1.651 -1.142 -0.795) 2.159 19.960 ( -2.563 -3.181 0.477) 4.113 20.706 ( -1.216 1.801 -0.116) 2.176 20.720 ( -1.570 1.314 0.141) 2.052 20.963 ( 1.627 1.786 -0.257) 2.429 20.999 ( 1.452 -0.343 0.239) 1.511 22.099 ( -0.169 6.603 0.177) 6.608 22.114 ( 0.003 5.786 -0.410) 5.801 22.141 ( 0.341 4.887 0.535) 4.928 22.227 ( 0.479 0.490 -0.284) 0.742 24.379 ( 0.560 1.960 -0.047) 2.039 24.405 ( 0.172 0.444 -0.130) 0.493 24.417 ( -0.419 1.893 0.472) 1.995 24.470 ( -1.845 -0.486 -0.323) 1.935 30.169 ( -0.140 1.300 0.179) 1.320 30.189 ( 0.189 1.452 -0.237) 1.484 30.236 ( -0.156 -1.099 -0.004) 1.110 30.271 ( 0.325 -1.801 0.029) 1.830 34.204 ( -0.977 1.476 -0.916) 1.993 34.327 ( -0.934 -4.016 0.716) 4.185 34.474 ( 3.156 2.138 1.231) 4.006 34.657 ( -2.383 -6.557 -1.140) 7.069 36.600 ( -0.449 -1.510 -0.589) 1.682 36.691 ( -0.195 -5.971 0.347) 5.985 36.731 ( 0.569 -2.584 -0.578) 2.708 36.870 ( 1.525 -9.432 0.985) 9.605 40.714 ( 0.286 0.192 -0.013) 0.345 40.846 ( 0.604 -6.542 -0.925) 6.635 41.041 ( 5.433 -4.235 6.216) 9.278 41.063 ( -0.168 -4.188 0.052) 4.192 41.351 ( 1.302 1.840 1.579) 2.752 41.420 ( -7.272 -2.579 -1.874) 7.940 41.490 ( -4.909 -8.399 -8.836) 13.142 41.958 ( 5.613 -22.791 3.815) 23.779 ======================= Grid point 52 (32/126) ======================= q-point: (-0.50 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.775 ( 0.000 2.741 0.000) 2.741 4.805 ( 0.000 18.387 0.000) 18.387 4.907 ( 0.000 -4.157 -0.000) 4.157 5.148 ( 0.000 6.536 0.000) 6.536 5.422 ( 0.000 17.314 0.000) 17.314 5.461 ( 0.000 11.447 -0.000) 11.447 5.544 ( 0.000 5.180 0.000) 5.180 5.633 ( 0.000 9.158 0.000) 9.158 5.722 ( 0.000 17.615 0.000) 17.615 5.891 ( 0.000 1.357 0.000) 1.357 6.029 ( 0.000 -6.801 0.000) 6.801 6.225 ( 0.000 -2.416 0.000) 2.416 6.589 ( 0.000 4.882 -0.000) 4.882 6.723 ( -0.000 9.711 -0.000) 9.711 6.730 ( 0.000 2.885 0.000) 2.885 6.884 ( -0.000 -8.276 -0.000) 8.276 6.891 ( 0.000 5.441 0.000) 5.441 7.115 ( -0.000 -2.034 -0.000) 2.034 7.267 ( 0.000 -10.009 0.000) 10.009 7.342 ( 0.000 -4.044 0.000) 4.044 7.524 ( 0.000 -0.461 0.000) 0.461 7.576 ( 0.000 -2.685 0.000) 2.685 7.686 ( 0.000 4.603 0.000) 4.603 7.817 ( -0.000 -0.568 0.000) 0.568 8.165 ( 0.000 -1.734 0.000) 1.734 8.374 ( 0.000 -13.615 0.000) 13.615 8.556 ( 0.000 1.535 0.000) 1.535 8.592 ( 0.000 0.325 0.000) 0.325 8.601 ( -0.000 2.192 -0.000) 2.192 8.702 ( 0.000 -2.711 -0.000) 2.711 8.968 ( 0.000 -0.090 0.000) 0.090 9.099 ( -0.000 -2.883 0.000) 2.883 9.364 ( 0.000 -3.733 0.000) 3.733 9.401 ( -0.000 -3.268 0.000) 3.268 9.648 ( 0.000 5.033 0.000) 5.033 9.659 ( 0.000 1.018 0.000) 1.018 9.777 ( 0.000 6.225 -0.000) 6.225 10.111 ( 0.000 -6.353 0.000) 6.353 10.494 ( 0.000 6.868 0.000) 6.868 10.586 ( 0.000 7.998 0.000) 7.998 10.684 ( 0.000 9.573 0.000) 9.573 10.724 ( -0.000 6.817 0.000) 6.817 10.762 ( 0.000 14.583 -0.000) 14.583 10.878 ( 0.000 3.810 0.000) 3.810 10.917 ( -0.000 -3.101 -0.000) 3.101 11.249 ( 0.000 -2.119 0.000) 2.119 11.473 ( 0.000 8.689 0.000) 8.689 11.696 ( -0.000 -1.360 0.000) 1.360 11.771 ( -0.000 8.969 0.000) 8.969 11.836 ( 0.000 10.019 -0.000) 10.019 11.931 ( 0.000 12.811 0.000) 12.811 12.005 ( 0.000 9.467 0.000) 9.467 12.246 ( 0.000 22.164 -0.000) 22.164 12.405 ( 0.000 16.802 -0.000) 16.802 12.421 ( 0.000 -5.901 0.000) 5.901 12.555 ( 0.000 -5.018 0.000) 5.018 12.721 ( 0.000 9.365 0.000) 9.365 13.025 ( 0.000 -7.173 -0.000) 7.173 13.140 ( 0.000 0.084 0.000) 0.084 13.313 ( 0.000 0.264 -0.000) 0.264 14.176 ( 0.000 -0.846 0.000) 0.846 14.281 ( 0.000 -5.400 0.000) 5.400 14.413 ( 0.000 -3.448 0.000) 3.448 14.469 ( -0.000 -5.377 0.000) 5.377 15.682 ( 0.000 1.161 0.000) 1.161 15.753 ( 0.000 -1.402 0.000) 1.402 15.822 ( 0.000 0.888 -0.000) 0.888 15.837 ( -0.000 0.224 0.000) 0.224 17.853 ( 0.000 0.524 0.000) 0.524 17.859 ( 0.000 0.381 0.000) 0.381 17.941 ( 0.000 0.639 0.000) 0.639 17.971 ( 0.000 -0.825 0.000) 0.825 19.853 ( 0.000 -0.160 0.000) 0.160 19.867 ( 0.000 -0.787 0.000) 0.787 19.887 ( -0.000 -1.662 -0.000) 1.662 19.931 ( 0.000 -3.463 0.000) 3.463 20.694 ( 0.000 1.841 0.000) 1.841 20.705 ( 0.000 1.470 0.000) 1.470 20.978 ( 0.000 1.749 0.000) 1.749 21.013 ( 0.000 -0.346 0.000) 0.346 22.098 ( 0.000 6.640 0.000) 6.640 22.113 ( 0.000 5.789 -0.000) 5.789 22.146 ( 0.000 4.715 0.000) 4.715 22.231 ( 0.000 0.487 -0.000) 0.487 24.383 ( 0.000 1.934 -0.000) 1.934 24.410 ( 0.000 1.111 0.000) 1.111 24.417 ( 0.000 1.115 0.000) 1.115 24.445 ( 0.000 -0.391 0.000) 0.391 30.169 ( 0.000 1.242 -0.000) 1.242 30.190 ( 0.000 1.369 0.000) 1.369 30.235 ( 0.000 -0.898 0.000) 0.898 30.274 ( 0.000 -1.769 0.000) 1.769 34.193 ( 0.000 1.499 0.000) 1.499 34.318 ( 0.000 -3.690 0.000) 3.690 34.514 ( 0.000 0.143 0.000) 0.143 34.624 ( 0.000 -4.380 0.000) 4.380 36.594 ( 0.000 -1.342 -0.000) 1.342 36.689 ( 0.000 -6.036 -0.000) 6.036 36.736 ( 0.000 -2.601 0.000) 2.601 36.888 ( 0.000 -10.146 0.000) 10.146 40.723 ( 0.000 -1.630 0.000) 1.630 40.808 ( 0.000 -5.570 -0.000) 5.570 41.124 ( 0.000 -1.604 -0.000) 1.604 41.172 ( 0.000 -4.994 0.000) 4.994 41.255 ( -0.000 -4.314 -0.000) 4.314 41.367 ( 0.000 -10.293 0.000) 10.293 41.423 ( 0.000 4.993 0.000) 4.993 42.019 ( 0.000 -23.456 0.000) 23.456 ======================= Grid point 56 (33/126) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 70 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.744 ( 0.000 -2.251 0.000) 2.251 4.744 ( 0.000 2.252 0.000) 2.252 5.386 ( 0.000 -9.069 0.000) 9.069 5.386 ( 0.000 9.069 0.000) 9.069 5.476 ( 0.000 -4.532 0.000) 4.532 5.476 ( 0.000 4.532 0.000) 4.532 5.764 ( 0.000 -4.781 0.000) 4.781 5.764 ( 0.000 4.781 0.000) 4.781 5.820 ( 0.000 -3.264 0.000) 3.264 5.820 ( 0.000 3.264 0.000) 3.264 6.075 ( 0.000 -5.857 0.000) 5.857 6.075 ( 0.000 5.857 0.000) 5.857 6.722 ( 0.000 -4.552 0.000) 4.552 6.722 ( 0.000 4.552 0.000) 4.552 6.834 ( 0.000 -12.401 0.000) 12.401 6.834 ( 0.000 12.401 0.000) 12.401 6.932 ( 0.000 -0.824 0.000) 0.824 6.932 ( 0.000 0.824 0.000) 0.824 7.154 ( 0.000 -0.689 0.000) 0.689 7.154 ( 0.000 0.689 0.000) 0.689 7.608 ( 0.000 -0.943 0.000) 0.943 7.608 ( 0.000 0.943 0.000) 0.943 7.849 ( 0.000 -5.234 0.000) 5.234 7.849 ( 0.000 5.234 0.000) 5.234 8.077 ( 0.000 -2.714 0.000) 2.714 8.077 ( 0.000 2.714 0.000) 2.714 8.602 ( 0.000 -2.222 0.000) 2.222 8.602 ( 0.000 2.222 0.000) 2.222 8.899 ( 0.000 -5.067 0.000) 5.067 8.899 ( 0.000 5.067 0.000) 5.067 9.080 ( 0.000 -3.044 0.000) 3.044 9.080 ( 0.000 3.044 0.000) 3.044 9.365 ( 0.000 -3.364 0.000) 3.364 9.365 ( 0.000 3.364 0.000) 3.364 9.521 ( 0.000 -4.198 0.000) 4.198 9.521 ( 0.000 4.198 0.000) 4.198 9.951 ( 0.000 -5.478 0.000) 5.478 9.951 ( 0.000 5.478 0.000) 5.478 10.448 ( 0.000 -1.295 0.000) 1.295 10.448 ( 0.000 1.295 0.000) 1.295 10.685 ( 0.000 -2.602 0.000) 2.602 10.685 ( 0.000 2.602 0.000) 2.602 11.095 ( 0.000 -13.092 0.000) 13.092 11.095 ( 0.000 13.092 0.000) 13.092 11.346 ( 0.000 -4.360 0.000) 4.360 11.346 ( 0.000 4.360 0.000) 4.360 11.548 ( 0.000 -8.593 0.000) 8.593 11.548 ( 0.000 8.593 0.000) 8.593 11.800 ( 0.000 -1.497 0.000) 1.497 11.800 ( 0.000 1.497 0.000) 1.497 12.298 ( 0.000 -7.801 0.000) 7.801 12.298 ( 0.000 7.801 0.000) 7.801 12.354 ( 0.000 -14.978 0.000) 14.978 12.354 ( 0.000 14.978 0.000) 14.978 12.454 ( 0.000 -11.620 0.000) 11.620 12.454 ( 0.000 11.620 0.000) 11.620 12.746 ( 0.000 -15.061 0.000) 15.061 12.746 ( 0.000 15.061 0.000) 15.061 12.837 ( 0.000 -6.248 0.000) 6.248 12.837 ( 0.000 6.248 0.000) 6.248 14.328 ( 0.000 -1.882 0.000) 1.882 14.328 ( 0.000 1.882 0.000) 1.882 14.494 ( 0.000 -0.687 0.000) 0.687 14.494 ( 0.000 0.687 0.000) 0.687 15.639 ( 0.000 -0.618 0.000) 0.618 15.639 ( 0.000 0.618 0.000) 0.618 15.915 ( 0.000 -1.038 0.000) 1.038 15.915 ( 0.000 1.038 0.000) 1.038 17.871 ( 0.000 -2.281 0.000) 2.281 17.871 ( 0.000 2.281 0.000) 2.281 17.962 ( 0.000 -0.634 0.000) 0.634 17.962 ( 0.000 0.634 0.000) 0.634 19.815 ( 0.000 -1.276 0.000) 1.276 19.815 ( 0.000 1.276 0.000) 1.276 19.968 ( 0.000 -1.597 0.000) 1.597 19.968 ( 0.000 1.597 0.000) 1.597 20.779 ( 0.000 -0.789 0.000) 0.789 20.779 ( 0.000 0.789 0.000) 0.789 20.930 ( 0.000 -0.930 0.000) 0.930 20.930 ( 0.000 0.930 0.000) 0.930 22.176 ( 0.000 -0.254 0.000) 0.254 22.176 ( 0.000 0.254 0.000) 0.254 22.197 ( 0.000 -2.457 0.000) 2.457 22.197 ( 0.000 2.457 0.000) 2.457 24.397 ( 0.000 -1.098 0.000) 1.098 24.397 ( 0.000 1.098 0.000) 1.098 24.483 ( 0.000 -2.230 0.000) 2.230 24.483 ( 0.000 2.230 0.000) 2.230 30.203 ( 0.000 -0.171 0.000) 0.171 30.203 ( 0.000 0.171 0.000) 0.171 30.225 ( 0.000 -0.158 0.000) 0.158 30.225 ( 0.000 0.158 0.000) 0.158 34.277 ( 0.000 -0.891 0.000) 0.891 34.277 ( 0.000 0.891 0.000) 0.891 34.529 ( 0.000 -8.099 0.000) 8.099 34.529 ( 0.000 8.099 0.000) 8.099 36.606 ( 0.000 -1.485 0.000) 1.485 36.606 ( 0.000 1.485 0.000) 1.485 36.727 ( 0.000 -2.666 0.000) 2.666 36.727 ( 0.000 2.666 0.000) 2.666 40.663 ( 0.000 -0.007 0.000) 0.007 40.663 ( 0.000 0.007 0.000) 0.007 41.226 ( 0.000 -3.897 0.000) 3.897 41.226 ( 0.000 3.897 0.000) 3.897 41.236 ( 0.000 -4.325 0.000) 4.325 41.236 ( 0.000 4.325 0.000) 4.325 41.568 ( 0.000 -0.725 0.000) 0.725 41.568 ( 0.000 0.725 0.000) 0.725 ======================= Grid point 58 (34/126) ======================= q-point: ( 0.17 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.756 ( 1.295 -2.218 0.312) 2.587 4.756 ( 1.295 2.218 0.312) 2.587 5.354 ( -5.221 -9.969 -3.971) 11.934 5.354 ( -5.221 9.969 -3.971) 11.934 5.463 ( 1.090 -3.928 4.716) 6.234 5.463 ( 1.090 3.928 4.716) 6.234 5.712 ( -2.648 -1.949 -3.567) 4.851 5.712 ( -2.648 1.949 -3.567) 4.851 5.890 ( 3.933 -10.844 3.651) 12.100 5.890 ( 3.933 10.844 3.651) 12.100 6.077 ( -0.600 -2.635 0.831) 2.828 6.077 ( -0.600 2.635 0.831) 2.828 6.687 ( -0.684 -6.140 -1.720) 6.413 6.687 ( -0.684 6.140 -1.720) 6.413 6.881 ( 1.055 -8.176 0.860) 8.289 6.881 ( 1.055 8.176 0.860) 8.289 6.927 ( -0.643 -4.983 1.327) 5.197 6.927 ( -0.643 4.983 1.327) 5.197 7.152 ( 1.225 -1.576 3.036) 3.633 7.152 ( 1.225 1.576 3.036) 3.633 7.572 ( -2.472 -3.441 -5.315) 6.797 7.572 ( -2.472 3.441 -5.315) 6.797 7.847 ( 1.211 -5.597 -5.915) 8.232 7.847 ( 1.211 5.597 -5.915) 8.232 8.129 ( 3.674 -4.879 3.086) 6.843 8.129 ( 3.674 4.879 3.086) 6.843 8.594 ( -1.268 -1.707 1.072) 2.381 8.594 ( -1.268 1.707 1.072) 2.381 8.828 ( -5.686 -5.222 -3.704) 8.563 8.828 ( -5.686 5.222 -3.704) 8.563 9.035 ( -4.224 -3.007 3.283) 6.136 9.035 ( -4.224 3.007 3.283) 6.137 9.391 ( -0.283 -3.146 1.932) 3.702 9.391 ( -0.283 3.146 1.932) 3.702 9.549 ( 3.538 -3.803 3.158) 6.079 9.549 ( 3.538 3.803 3.158) 6.079 9.975 ( 1.366 -6.496 -0.004) 6.638 9.975 ( 1.366 6.496 -0.004) 6.638 10.483 ( 5.304 -2.738 -3.812) 7.083 10.483 ( 5.304 2.738 -3.812) 7.083 10.670 ( -2.425 -3.938 3.246) 5.650 10.670 ( -2.425 3.938 3.245) 5.650 11.045 ( -2.718 -10.805 -3.567) 11.699 11.045 ( -2.718 10.805 -3.567) 11.699 11.281 ( -6.191 -5.222 -1.949) 8.331 11.281 ( -6.191 5.223 -1.949) 8.331 11.577 ( 1.618 -7.337 2.264) 7.847 11.577 ( 1.618 7.337 2.264) 7.847 11.854 ( 4.080 -3.619 1.580) 5.678 11.854 ( 4.080 3.619 1.580) 5.678 12.228 ( -5.261 -8.855 -0.147) 10.301 12.228 ( -5.261 8.855 -0.147) 10.301 12.360 ( 0.377 -5.947 0.245) 5.964 12.360 ( 0.377 5.947 0.245) 5.964 12.537 ( 5.944 -14.944 0.578) 16.093 12.537 ( 5.944 14.944 0.578) 16.093 12.672 ( -1.137 -10.524 -1.012) 10.634 12.672 ( -1.137 10.524 -1.012) 10.634 12.998 ( 11.264 -5.390 0.050) 12.487 12.998 ( 11.264 5.390 0.050) 12.487 14.282 ( -4.076 -3.885 -0.225) 5.636 14.282 ( -4.076 3.885 -0.225) 5.636 14.484 ( -1.412 -1.287 -0.711) 2.038 14.484 ( -1.412 1.287 -0.711) 2.038 15.654 ( 1.362 -0.930 1.077) 1.970 15.654 ( 1.362 0.930 1.077) 1.970 15.899 ( -1.568 -1.015 -0.641) 1.975 15.899 ( -1.568 1.015 -0.641) 1.975 17.868 ( -0.193 -2.046 -0.310) 2.078 17.868 ( -0.193 2.046 -0.310) 2.078 17.961 ( -0.240 -0.949 0.425) 1.067 17.961 ( -0.240 0.949 0.425) 1.067 19.820 ( 0.582 -1.113 -0.084) 1.258 19.820 ( 0.582 1.113 -0.084) 1.258 19.952 ( -1.725 -1.525 0.059) 2.303 19.952 ( -1.725 1.525 0.059) 2.303 20.758 ( -1.826 -0.590 0.006) 1.919 20.758 ( -1.826 0.590 0.006) 1.919 20.953 ( 2.052 -0.862 0.005) 2.226 20.953 ( 2.052 0.862 0.005) 2.226 22.174 ( -0.215 -0.224 0.166) 0.352 22.174 ( -0.215 0.224 0.166) 0.352 22.201 ( 0.471 -2.320 -0.159) 2.373 22.201 ( 0.471 2.320 -0.159) 2.373 24.398 ( 0.166 -0.921 0.059) 0.937 24.398 ( 0.166 0.921 0.059) 0.937 24.473 ( -0.957 -2.014 -0.063) 2.231 24.473 ( -0.957 2.014 -0.063) 2.231 30.199 ( -0.286 -0.917 0.005) 0.960 30.199 ( -0.286 0.917 0.005) 0.960 30.230 ( 0.445 -1.120 -0.016) 1.205 30.230 ( 0.445 1.120 -0.016) 1.205 34.269 ( -0.860 -2.283 0.022) 2.439 34.269 ( -0.860 2.283 0.022) 2.439 34.534 ( 0.527 -7.066 -0.048) 7.085 34.534 ( 0.527 7.066 -0.048) 7.085 36.609 ( 0.126 -1.874 0.080) 1.880 36.609 ( 0.126 1.874 0.080) 1.880 36.729 ( 0.302 -2.877 -0.056) 2.893 36.729 ( 0.302 2.877 -0.056) 2.893 40.705 ( 3.326 -1.389 2.362) 4.309 40.705 ( 3.326 1.389 2.362) 4.309 41.050 ( -6.672 -6.049 -4.873) 10.240 41.050 ( -6.672 6.049 -4.873) 10.240 41.409 ( 5.811 -10.765 4.547) 13.051 41.409 ( 5.811 10.765 4.547) 13.051 41.533 ( -2.083 -3.761 -2.016) 4.748 41.533 ( -2.083 3.761 -2.016) 4.748 ======================= Grid point 60 (35/126) ======================= q-point: ( 0.33 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.794 ( 2.654 -2.435 0.212) 3.608 4.794 ( 2.654 2.435 0.212) 3.608 5.202 ( -8.112 -9.131 -2.062) 12.387 5.202 ( -8.112 9.131 -2.062) 12.387 5.545 ( 4.407 -3.247 2.733) 6.118 5.545 ( 4.407 3.247 2.733) 6.118 5.663 ( -1.392 -4.955 -0.214) 5.152 5.663 ( -1.392 4.955 -0.214) 5.152 5.939 ( -0.021 -8.025 -2.112) 8.298 5.939 ( -0.021 8.025 -2.112) 8.298 6.062 ( -0.904 -6.811 2.583) 7.340 6.062 ( -0.904 6.811 2.583) 7.340 6.700 ( 0.809 -5.458 1.344) 5.679 6.700 ( 0.809 5.458 1.344) 5.679 6.849 ( -1.780 -2.452 0.523) 3.075 6.849 ( -1.780 2.452 0.523) 3.075 6.950 ( 2.695 -6.641 -0.312) 7.174 6.950 ( 2.695 6.641 -0.312) 7.174 7.225 ( 2.087 -6.990 1.132) 7.382 7.225 ( 2.087 6.990 1.132) 7.382 7.506 ( -0.673 -5.158 -0.892) 5.277 7.506 ( -0.673 5.158 -0.892) 5.277 7.823 ( -0.775 -5.869 -7.698) 9.711 7.823 ( -0.775 5.869 -7.698) 9.711 8.185 ( 0.361 -5.088 1.893) 5.441 8.185 ( 0.361 5.088 1.893) 5.441 8.570 ( -1.467 -3.696 2.766) 4.844 8.570 ( -1.467 3.696 2.766) 4.844 8.712 ( -4.436 -2.207 -3.827) 6.261 8.712 ( -4.436 2.207 -3.827) 6.261 9.003 ( -0.497 -3.437 2.232) 4.128 9.003 ( -0.497 3.437 2.232) 4.128 9.369 ( -2.084 -1.982 1.571) 3.277 9.369 ( -2.084 1.982 1.571) 3.277 9.639 ( 3.574 -1.459 1.962) 4.330 9.639 ( 3.574 1.459 1.962) 4.330 9.971 ( -1.761 -8.251 0.953) 8.490 9.971 ( -1.761 8.251 0.953) 8.490 10.583 ( 5.058 -4.893 -6.222) 9.394 10.583 ( 5.058 4.894 -6.222) 9.394 10.671 ( 3.283 -4.196 6.786) 8.627 10.671 ( 3.283 4.196 6.786) 8.627 10.987 ( -3.329 -3.510 -3.302) 5.857 10.987 ( -3.329 3.510 -3.302) 5.857 11.143 ( -6.179 -9.204 -2.073) 11.278 11.143 ( -6.179 9.204 -2.073) 11.278 11.609 ( 0.856 -6.162 1.518) 6.404 11.609 ( 0.856 6.162 1.518) 6.404 11.904 ( 0.117 -2.736 1.890) 3.327 11.904 ( 0.117 2.736 1.890) 3.327 12.156 ( -2.447 -0.910 -0.320) 2.631 12.156 ( -2.447 0.910 -0.320) 2.631 12.349 ( -0.458 -1.921 -2.061) 2.854 12.349 ( -0.458 1.921 -2.061) 2.854 12.643 ( 4.942 -9.883 1.056) 11.100 12.643 ( 4.942 9.883 1.056) 11.100 12.713 ( 3.743 -15.201 0.716) 15.671 12.713 ( 3.743 15.201 0.716) 15.671 13.177 ( 7.583 -7.466 -0.041) 10.641 13.177 ( 7.583 7.466 -0.041) 10.641 14.214 ( -2.502 -4.527 -0.525) 5.198 14.214 ( -2.502 4.527 -0.525) 5.198 14.433 ( -3.431 -2.533 -0.629) 4.311 14.433 ( -3.431 2.533 -0.629) 4.311 15.691 ( 1.868 -1.544 1.211) 2.709 15.691 ( 1.868 1.544 1.211) 2.710 15.860 ( -2.002 -0.829 -0.781) 2.304 15.860 ( -2.002 0.829 -0.781) 2.304 17.863 ( -0.184 -1.279 -0.290) 1.324 17.863 ( -0.184 1.279 -0.290) 1.324 17.958 ( -0.270 -0.996 0.403) 1.108 17.958 ( -0.270 0.996 0.403) 1.108 19.837 ( 1.342 -0.761 -0.124) 1.548 19.837 ( 1.342 0.761 -0.124) 1.548 19.912 ( -2.483 -1.338 0.101) 2.822 19.912 ( -2.483 1.338 0.101) 2.822 20.728 ( -1.277 -0.383 0.002) 1.333 20.728 ( -1.277 0.383 0.002) 1.333 20.988 ( 1.502 -0.828 0.007) 1.715 20.988 ( 1.502 0.828 0.007) 1.715 22.172 ( -0.123 -0.215 0.120) 0.275 22.172 ( -0.123 0.215 0.120) 0.275 22.209 ( 0.379 -2.281 -0.113) 2.315 22.209 ( 0.379 2.281 -0.113) 2.315 24.405 ( 0.535 -0.570 0.106) 0.789 24.405 ( 0.535 0.570 0.106) 0.789 24.451 ( -1.324 -1.404 -0.109) 1.933 24.451 ( -1.324 1.404 -0.109) 1.933 30.195 ( -0.187 -1.030 -0.007) 1.047 30.195 ( -0.187 1.030 -0.007) 1.047 30.237 ( 0.344 -1.388 -0.005) 1.429 30.237 ( 0.344 1.388 -0.005) 1.430 34.251 ( -0.870 -3.181 -0.036) 3.298 34.251 ( -0.870 3.181 -0.036) 3.298 34.545 ( 0.570 -4.626 0.031) 4.661 34.545 ( 0.570 4.626 0.031) 4.661 36.608 ( -0.229 -2.266 -0.221) 2.289 36.608 ( -0.229 2.266 -0.221) 2.289 36.739 ( 0.643 -3.456 0.236) 3.523 36.739 ( 0.643 3.456 0.236) 3.523 40.747 ( -0.428 -3.261 -0.658) 3.354 40.747 ( -0.428 3.261 -0.658) 3.354 41.008 ( 3.527 -0.837 3.205) 4.839 41.008 ( 3.527 0.837 3.205) 4.839 41.367 ( -6.792 -2.054 -5.453) 8.949 41.367 ( -6.792 2.054 -5.453) 8.949 41.583 ( 4.058 -14.168 2.913) 15.023 41.583 ( 4.058 14.168 2.913) 15.023 ======================= Grid point 62 (36/126) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 63 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.830 ( 0.000 -3.204 0.000) 3.204 4.830 ( 0.000 3.204 -0.000) 3.204 5.107 ( 0.000 -9.944 0.000) 9.944 5.107 ( 0.000 9.944 0.000) 9.944 5.594 ( 0.000 -1.918 0.000) 1.918 5.594 ( 0.000 1.918 0.000) 1.918 5.662 ( 0.000 -6.705 0.000) 6.705 5.662 ( 0.000 6.705 0.000) 6.705 5.912 ( 0.000 -0.966 0.000) 0.966 5.912 ( 0.000 0.966 0.000) 0.966 6.067 ( -0.000 -12.197 0.000) 12.197 6.067 ( 0.000 12.197 0.000) 12.197 6.703 ( 0.000 -6.846 0.000) 6.846 6.703 ( 0.000 6.846 0.000) 6.846 6.845 ( 0.000 -2.904 0.000) 2.904 6.845 ( 0.000 2.904 0.000) 2.904 7.001 ( 0.000 -8.406 -0.000) 8.406 7.001 ( 0.000 8.406 -0.000) 8.406 7.202 ( 0.000 -7.009 -0.000) 7.009 7.202 ( 0.000 7.009 0.000) 7.009 7.543 ( 0.000 -1.281 0.000) 1.281 7.543 ( 0.000 1.281 0.000) 1.281 7.773 ( 0.000 -3.591 -0.000) 3.591 7.773 ( 0.000 3.591 0.000) 3.591 8.181 ( 0.000 -4.596 0.000) 4.596 8.181 ( 0.000 4.596 0.000) 4.596 8.579 ( 0.000 -1.296 0.000) 1.296 8.579 ( 0.000 1.296 0.000) 1.296 8.649 ( -0.000 -2.179 -0.000) 2.179 8.649 ( -0.000 2.179 -0.000) 2.179 9.012 ( 0.000 -4.360 0.000) 4.360 9.012 ( 0.000 4.360 0.000) 4.360 9.351 ( -0.000 -1.533 0.000) 1.533 9.351 ( 0.000 1.534 0.000) 1.534 9.677 ( 0.000 -0.325 0.000) 0.325 9.677 ( 0.000 0.325 -0.000) 0.325 9.950 ( 0.000 -9.093 0.000) 9.093 9.950 ( 0.000 9.093 0.000) 9.093 10.597 ( 0.000 -3.245 0.000) 3.245 10.597 ( 0.000 3.245 0.000) 3.245 10.812 ( 0.000 -0.324 0.000) 0.324 10.812 ( 0.000 0.324 0.000) 0.324 10.871 ( -0.000 -0.988 -0.000) 0.988 10.871 ( -0.000 0.988 -0.000) 0.988 11.089 ( 0.000 -13.248 0.000) 13.248 11.089 ( 0.000 13.248 0.000) 13.248 11.620 ( 0.000 -5.621 0.000) 5.621 11.620 ( 0.000 5.621 0.000) 5.621 11.902 ( 0.000 -2.075 0.000) 2.075 11.902 ( 0.000 2.075 0.000) 2.075 12.132 ( 0.000 -4.533 0.000) 4.533 12.132 ( 0.000 4.533 0.000) 4.533 12.340 ( 0.000 -4.104 0.000) 4.104 12.340 ( 0.000 4.104 0.000) 4.104 12.694 ( 0.000 -10.589 0.000) 10.589 12.694 ( 0.000 10.589 0.000) 10.589 12.757 ( -0.000 -18.007 0.000) 18.007 12.757 ( 0.000 18.007 0.000) 18.007 13.248 ( 0.000 -6.894 0.000) 6.894 13.248 ( 0.000 6.894 -0.000) 6.894 14.193 ( 0.000 -2.749 0.000) 2.749 14.193 ( 0.000 2.749 0.000) 2.749 14.391 ( 0.000 -1.682 0.000) 1.682 14.391 ( 0.000 1.682 0.000) 1.682 15.716 ( 0.000 -1.990 0.000) 1.990 15.716 ( 0.000 1.990 0.000) 1.990 15.835 ( -0.000 -0.375 -0.000) 0.375 15.835 ( -0.000 0.375 0.000) 0.375 17.860 ( 0.000 -0.165 -0.000) 0.165 17.860 ( 0.000 0.165 0.000) 0.165 17.956 ( 0.000 -0.738 0.000) 0.738 17.956 ( 0.000 0.738 0.000) 0.738 19.863 ( 0.000 -0.723 0.000) 0.723 19.863 ( 0.000 0.723 -0.000) 0.723 19.875 ( -0.000 -1.923 0.000) 1.923 19.875 ( -0.000 1.923 0.000) 1.923 20.716 ( 0.000 -0.315 0.000) 0.315 20.716 ( 0.000 0.315 0.000) 0.315 21.002 ( 0.000 -0.819 0.000) 0.819 21.002 ( 0.000 0.819 0.000) 0.819 22.171 ( 0.000 -0.176 0.000) 0.176 22.171 ( 0.000 0.176 0.000) 0.176 22.212 ( 0.000 -2.289 0.000) 2.289 22.212 ( 0.000 2.289 0.000) 2.289 24.414 ( 0.000 -0.846 -0.000) 0.846 24.414 ( 0.000 0.846 0.000) 0.846 24.434 ( -0.000 -0.613 -0.000) 0.613 24.434 ( -0.000 0.613 0.000) 0.613 30.193 ( 0.000 -1.017 -0.000) 1.017 30.193 ( 0.000 1.017 0.000) 1.017 30.241 ( 0.000 -1.432 0.000) 1.432 30.241 ( 0.000 1.432 0.000) 1.432 34.243 ( 0.000 -3.347 0.000) 3.347 34.243 ( 0.000 3.347 0.000) 3.347 34.551 ( 0.000 -2.935 0.000) 2.935 34.551 ( 0.000 2.935 0.000) 2.935 36.604 ( 0.000 -2.359 0.000) 2.359 36.604 ( 0.000 2.359 -0.000) 2.359 36.747 ( 0.000 -3.815 0.000) 3.815 36.747 ( 0.000 3.815 0.000) 3.815 40.729 ( 0.000 -2.186 0.000) 2.186 40.729 ( 0.000 2.186 0.000) 2.186 41.113 ( -0.000 -0.941 -0.000) 0.941 41.113 ( 0.000 0.941 0.000) 0.941 41.237 ( -0.000 -2.705 -0.000) 2.705 41.237 ( 0.000 2.705 0.000) 2.705 41.630 ( 0.000 -15.128 0.000) 15.128 41.630 ( 0.000 15.128 0.000) 15.128 ======================= Grid point 119 (37/126) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.733 ( 1.602 0.000 34.571) 34.608 1.012 ( 7.249 0.000 46.191) 46.756 1.994 ( 21.524 0.000 73.960) 77.028 2.421 ( -1.301 0.000 -9.032) 9.125 3.158 ( -0.074 0.000 -32.867) 32.867 3.497 ( -7.028 0.000 22.209) 23.294 3.954 ( -20.630 0.000 -14.703) 25.334 4.077 ( 9.665 0.000 1.408) 9.767 4.208 ( -0.304 0.000 -8.219) 8.224 4.404 ( 5.158 0.000 2.629) 5.789 4.603 ( -8.680 0.000 2.077) 8.925 4.835 ( -3.139 0.000 6.968) 7.642 5.129 ( -2.059 0.000 3.936) 4.442 5.183 ( 1.140 0.000 -8.802) 8.876 5.194 ( 3.602 0.000 12.688) 13.190 5.562 ( -2.349 0.000 -2.677) 3.561 5.566 ( -2.690 0.000 7.570) 8.034 5.805 ( -7.975 0.000 -12.611) 14.921 5.912 ( -0.261 0.000 2.783) 2.795 6.096 ( -10.306 0.000 -8.355) 13.268 6.687 ( 2.961 0.000 -9.388) 9.844 6.716 ( 25.953 0.000 -6.758) 26.818 6.789 ( -2.887 0.000 0.752) 2.984 7.235 ( -2.577 0.000 -20.737) 20.897 7.574 ( -0.923 0.000 -0.529) 1.064 7.844 ( 1.510 0.000 -5.533) 5.736 7.899 ( -3.504 0.000 -2.753) 4.456 7.950 ( 7.154 0.000 -10.237) 12.489 8.100 ( 6.243 0.000 8.026) 10.168 8.148 ( -6.068 0.000 -0.816) 6.122 8.368 ( 6.050 0.000 -5.050) 7.881 8.414 ( -7.676 0.000 5.992) 9.738 8.469 ( -3.654 0.000 9.048) 9.757 8.709 ( 2.312 0.000 14.884) 15.063 9.037 ( -16.282 0.000 0.789) 16.301 9.141 ( 15.106 0.000 7.229) 16.747 9.204 ( -7.619 0.000 -2.318) 7.963 9.504 ( 16.886 0.000 -6.384) 18.052 9.660 ( -27.443 0.000 -8.799) 28.820 9.776 ( -1.005 0.000 8.406) 8.466 9.904 ( 17.194 0.000 -12.989) 21.549 10.185 ( -6.530 0.000 -0.452) 6.545 10.309 ( 6.965 0.000 -0.695) 7.000 10.383 ( -1.064 0.000 5.430) 5.533 10.486 ( -4.380 0.000 6.750) 8.047 10.538 ( -7.153 0.000 -0.450) 7.167 10.755 ( -1.461 0.000 -0.269) 1.486 10.810 ( 3.826 0.000 -5.001) 6.297 10.941 ( 5.341 0.000 -2.049) 5.720 10.958 ( 12.297 0.000 -4.785) 13.195 11.426 ( -12.069 0.000 16.450) 20.402 11.806 ( -3.763 0.000 1.300) 3.982 12.130 ( 4.930 0.000 2.965) 5.753 12.167 ( 12.620 0.000 -10.308) 16.295 12.242 ( 1.925 0.000 -10.033) 10.216 12.290 ( -2.617 0.000 -5.492) 6.083 12.515 ( -3.173 0.000 4.328) 5.367 12.617 ( 5.047 0.000 2.575) 5.666 13.454 ( -39.779 0.000 27.853) 48.561 14.032 ( 32.519 0.000 1.617) 32.559 14.241 ( -13.644 0.000 11.150) 17.620 14.561 ( 1.252 0.000 -4.805) 4.965 14.744 ( -1.204 0.000 6.851) 6.956 15.232 ( 76.361 0.000 -16.667) 78.159 15.589 ( 1.717 0.000 -8.677) 8.845 15.691 ( -14.099 0.000 -13.734) 19.683 16.114 ( 14.800 0.000 3.428) 15.192 16.134 ( 1.037 0.000 1.777) 2.057 17.590 ( -18.210 0.000 7.549) 19.712 17.947 ( 6.458 0.000 -7.650) 10.012 18.212 ( 0.834 0.000 3.100) 3.210 18.226 ( -1.588 0.000 1.496) 2.181 19.288 ( -24.471 0.000 -0.044) 24.471 19.297 ( 4.865 0.000 -0.642) 4.908 19.599 ( -2.525 0.000 4.678) 5.316 19.776 ( 1.806 0.000 -2.335) 2.951 20.116 ( -0.003 0.000 0.339) 0.339 20.136 ( -0.608 0.000 -0.323) 0.689 20.152 ( 0.657 0.000 0.149) 0.674 20.157 ( -0.777 0.000 -0.006) 0.777 20.478 ( 1.373 0.000 1.083) 1.749 20.542 ( -0.243 0.000 -1.224) 1.248 20.572 ( -0.966 0.000 0.805) 1.258 20.635 ( -1.379 0.000 -1.595) 2.109 24.388 ( -4.408 0.000 0.894) 4.497 24.448 ( 11.571 0.000 -1.885) 11.723 24.541 ( -13.914 0.000 2.394) 14.118 24.620 ( 6.819 0.000 -1.071) 6.903 30.122 ( -3.703 0.000 3.945) 5.411 30.193 ( -6.710 0.000 4.619) 8.147 30.314 ( 1.848 0.000 -3.577) 4.026 30.423 ( -0.048 0.000 -3.727) 3.728 34.858 ( -93.264 0.000 6.545) 93.493 35.350 ( 6.765 0.000 11.886) 13.676 35.395 ( 27.509 0.000 -16.807) 32.237 35.838 ( -21.329 0.000 -2.523) 21.478 37.731 ( 6.365 0.000 6.910) 9.394 37.924 ( -1.824 0.000 -0.965) 2.064 37.952 ( 1.585 0.000 1.614) 2.262 38.248 ( -20.539 0.000 -7.968) 22.030 40.995 ( 4.246 0.000 14.295) 14.912 41.681 ( -1.778 0.000 -11.413) 11.550 42.482 ( -3.377 0.000 8.677) 9.311 43.195 ( 8.597 0.000 -22.188) 23.796 44.135 ( 36.985 0.000 9.668) 38.228 44.354 ( -7.111 0.000 -1.806) 7.337 45.395 ( 66.515 0.000 8.295) 67.030 45.732 ( -8.205 0.000 -4.876) 9.545 ======================= Grid point 120 (38/126) ======================= q-point: ( 0.17 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.178 ( 24.709 0.000 27.691) 37.113 1.441 ( 23.590 0.000 33.139) 40.677 2.408 ( 9.300 0.000 -19.814) 21.888 2.856 ( -9.956 0.000 -47.583) 48.614 3.175 ( 53.331 0.000 78.115) 94.584 3.430 ( -29.224 0.000 -5.922) 29.818 3.460 ( -7.599 0.000 18.210) 19.732 4.110 ( -11.298 0.000 9.223) 14.584 4.138 ( 0.024 0.000 -9.879) 9.879 4.415 ( -11.771 0.000 1.298) 11.843 4.566 ( 10.759 0.000 -3.719) 11.384 4.773 ( -2.565 0.000 -2.264) 3.421 4.889 ( -19.697 0.000 -5.642) 20.489 5.096 ( -2.036 0.000 -0.257) 2.052 5.290 ( -5.390 0.000 16.866) 17.707 5.549 ( 5.713 0.000 12.167) 13.442 5.621 ( 7.532 0.000 -18.942) 20.385 5.800 ( 11.884 0.000 1.169) 11.941 5.930 ( 2.482 0.000 -0.500) 2.532 6.030 ( -2.897 0.000 12.031) 12.375 6.698 ( -8.965 0.000 2.002) 9.186 6.742 ( -14.176 0.000 -33.654) 36.518 6.802 ( 3.409 0.000 -8.869) 9.501 7.154 ( 8.403 0.000 -9.885) 12.974 7.556 ( 1.973 0.000 -5.865) 6.188 7.746 ( -19.900 0.000 -8.553) 21.660 7.796 ( -11.053 0.000 -8.092) 13.699 7.893 ( 4.473 0.000 -1.674) 4.776 8.034 ( -6.153 0.000 -1.860) 6.428 8.145 ( -5.397 0.000 4.605) 7.094 8.256 ( -5.898 0.000 2.074) 6.252 8.357 ( -17.207 0.000 2.494) 17.386 8.579 ( 11.972 0.000 4.423) 12.763 8.717 ( -9.747 0.000 2.622) 10.094 8.718 ( -5.424 0.000 9.789) 11.191 9.188 ( 8.483 0.000 15.161) 17.372 9.285 ( 0.019 0.000 -2.226) 2.226 9.314 ( -10.379 0.000 -6.826) 12.423 9.677 ( 5.643 0.000 -0.923) 5.718 9.769 ( -6.054 0.000 -11.444) 12.947 10.032 ( 11.235 0.000 12.815) 17.043 10.237 ( 3.036 0.000 -8.241) 8.782 10.363 ( 1.858 0.000 7.777) 7.995 10.493 ( 4.219 0.000 -2.629) 4.971 10.509 ( 2.779 0.000 -2.519) 3.751 10.545 ( 13.167 0.000 2.209) 13.351 10.776 ( 4.528 0.000 10.112) 11.080 10.996 ( 15.739 0.000 -0.871) 15.763 11.225 ( 8.286 0.000 -8.449) 11.834 11.242 ( 26.249 0.000 -18.252) 31.971 11.427 ( 11.644 0.000 17.955) 21.400 11.827 ( 2.931 0.000 1.410) 3.252 12.057 ( -24.943 0.000 -2.928) 25.114 12.083 ( -8.416 0.000 4.694) 9.636 12.263 ( 4.145 0.000 -12.638) 13.301 12.292 ( 5.019 0.000 -8.381) 9.769 12.429 ( -4.932 0.000 1.795) 5.248 12.724 ( 5.178 0.000 1.790) 5.478 13.019 ( -10.237 0.000 6.793) 12.286 14.070 ( -11.059 0.000 13.061) 17.114 14.379 ( 5.004 0.000 21.325) 21.905 14.493 ( -8.261 0.000 0.075) 8.262 14.684 ( -4.987 0.000 -0.447) 5.007 15.396 ( -12.656 0.000 -6.161) 14.076 15.430 ( -8.300 0.000 -10.268) 13.203 15.751 ( -28.753 0.000 0.642) 28.761 16.072 ( 16.123 0.000 -17.258) 23.617 16.353 ( 11.186 0.000 -2.154) 11.391 17.604 ( 15.183 0.000 -5.729) 16.228 17.989 ( 1.097 0.000 -4.309) 4.447 18.168 ( -4.836 0.000 0.483) 4.860 18.198 ( -4.218 0.000 3.626) 5.562 19.158 ( 6.413 0.000 -2.792) 6.995 19.347 ( -1.132 0.000 3.706) 3.875 19.590 ( -0.333 0.000 3.550) 3.566 19.785 ( 0.191 0.000 -1.505) 1.518 20.115 ( -0.227 0.000 0.361) 0.426 20.127 ( -0.133 0.000 -0.442) 0.461 20.153 ( 0.056 0.000 0.315) 0.320 20.166 ( 0.564 0.000 0.344) 0.661 20.481 ( -4.111 0.000 -0.686) 4.168 20.506 ( 0.857 0.000 0.761) 1.146 20.576 ( 1.133 0.000 0.612) 1.288 20.620 ( -0.121 0.000 0.716) 0.726 24.338 ( -0.678 0.000 -1.945) 2.060 24.366 ( -6.467 0.000 3.416) 7.314 24.676 ( 14.274 0.000 -3.925) 14.804 24.744 ( 3.609 0.000 5.013) 6.177 30.068 ( -1.975 0.000 4.625) 5.029 30.196 ( 0.515 0.000 6.436) 6.457 30.337 ( 2.072 0.000 -2.772) 3.461 30.407 ( 0.387 0.000 -3.676) 3.696 34.288 ( 4.499 0.000 5.532) 7.131 35.456 ( -17.584 0.000 -4.266) 18.094 35.577 ( 8.966 0.000 21.646) 23.430 35.839 ( 23.831 0.000 -3.369) 24.068 37.878 ( -2.345 0.000 -3.872) 4.527 37.905 ( 7.650 0.000 6.679) 10.155 38.012 ( -5.895 0.000 -0.967) 5.974 38.038 ( 5.985 0.000 6.297) 8.688 41.226 ( 13.325 0.000 17.619) 22.090 41.662 ( 6.315 0.000 -16.269) 17.452 42.479 ( -1.289 0.000 8.585) 8.681 43.219 ( 4.173 0.000 -21.210) 21.616 43.635 ( -57.006 0.000 -16.610) 59.377 43.893 ( -28.353 0.000 12.001) 30.788 45.875 ( 20.122 0.000 -9.141) 22.101 46.208 ( 11.209 0.000 -3.236) 11.667 ======================= Grid point 121 (39/126) ======================= q-point: ( 0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( 21.483 0.000 14.545) 25.943 2.129 ( 34.467 0.000 22.041) 40.912 2.536 ( 13.540 0.000 -16.999) 21.733 2.617 ( 9.618 0.000 -25.627) 27.373 2.905 ( -25.217 0.000 -0.339) 25.220 3.390 ( -7.113 0.000 13.593) 15.342 3.667 ( -32.450 0.000 17.779) 37.001 4.106 ( -8.151 0.000 14.592) 16.714 4.122 ( 1.751 0.000 -7.039) 7.254 4.521 ( 21.980 0.000 25.713) 33.827 4.577 ( -11.918 0.000 0.027) 11.918 4.761 ( 14.484 0.000 -11.255) 18.343 4.910 ( 29.278 0.000 19.038) 34.923 5.054 ( -2.598 0.000 -0.602) 2.667 5.256 ( -2.793 0.000 10.446) 10.813 5.567 ( -10.437 0.000 -10.600) 14.876 5.668 ( -14.394 0.000 1.868) 14.515 5.901 ( -12.172 0.000 -12.672) 17.571 6.004 ( 7.732 0.000 -5.956) 9.760 6.119 ( 4.392 0.000 19.399) 19.890 6.376 ( 1.957 0.000 -35.889) 35.942 6.400 ( -18.064 0.000 13.444) 22.518 6.583 ( -8.778 0.000 -11.293) 14.303 7.223 ( 2.995 0.000 -3.676) 4.741 7.359 ( -2.961 0.000 -2.146) 3.657 7.615 ( 7.948 0.000 -11.322) 13.833 7.617 ( -11.119 0.000 -4.309) 11.925 7.992 ( 8.580 0.000 -5.971) 10.453 7.995 ( 1.109 0.000 3.595) 3.762 8.037 ( -8.171 0.000 4.938) 9.548 8.134 ( -7.499 0.000 -1.808) 7.714 8.260 ( 0.946 0.000 5.403) 5.485 8.428 ( -16.575 0.000 -8.149) 18.470 8.701 ( -3.493 0.000 0.546) 3.535 8.722 ( 3.270 0.000 -0.586) 3.322 9.063 ( -13.657 0.000 -11.357) 17.762 9.188 ( 0.158 0.000 -0.414) 0.443 9.558 ( 10.347 0.000 6.589) 12.267 9.699 ( 0.201 0.000 -5.646) 5.650 9.830 ( 8.291 0.000 13.175) 15.567 10.004 ( -8.428 0.000 -4.237) 9.433 10.238 ( 1.428 0.000 -5.012) 5.211 10.497 ( 4.521 0.000 8.353) 9.498 10.562 ( 6.452 0.000 -6.775) 9.356 10.571 ( 3.711 0.000 2.648) 4.559 10.727 ( 6.771 0.000 -4.603) 8.187 10.892 ( -8.853 0.000 25.900) 27.372 11.187 ( -14.942 0.000 -1.270) 14.996 11.325 ( 17.182 0.000 0.701) 17.197 11.574 ( 18.863 0.000 -21.400) 28.526 11.741 ( 11.373 0.000 -7.841) 13.814 11.779 ( 13.216 0.000 6.341) 14.658 11.880 ( -4.281 0.000 6.670) 7.926 11.955 ( -0.565 0.000 2.568) 2.629 12.270 ( 2.659 0.000 -11.516) 11.819 12.362 ( -1.012 0.000 -3.967) 4.094 12.416 ( 10.317 0.000 4.339) 11.192 12.818 ( 4.752 0.000 0.494) 4.777 13.017 ( 1.398 0.000 7.425) 7.555 13.950 ( -7.727 0.000 7.255) 10.599 14.291 ( -11.981 0.000 1.679) 12.098 14.379 ( -18.771 0.000 19.666) 27.186 14.610 ( -1.040 0.000 -6.854) 6.933 15.059 ( -20.449 0.000 -1.003) 20.473 15.223 ( -4.713 0.000 4.118) 6.258 15.489 ( -1.601 0.000 2.313) 2.813 16.185 ( 5.444 0.000 -16.145) 17.038 16.490 ( 6.191 0.000 -7.866) 10.010 17.818 ( 9.844 0.000 -3.503) 10.449 17.967 ( -0.760 0.000 -2.402) 2.519 18.073 ( -4.809 0.000 -1.103) 4.934 18.101 ( -7.812 0.000 3.072) 8.394 19.306 ( -4.432 0.000 3.878) 5.889 19.308 ( 11.529 0.000 -10.107) 15.332 19.603 ( -0.454 0.000 3.522) 3.551 19.774 ( -0.626 0.000 -0.793) 1.011 20.112 ( -0.256 0.000 0.329) 0.417 20.127 ( 0.329 0.000 -0.601) 0.685 20.157 ( 0.122 0.000 0.502) 0.517 20.172 ( -0.144 0.000 0.425) 0.449 20.425 ( -1.616 0.000 -0.442) 1.675 20.512 ( -0.008 0.000 -1.258) 1.258 20.607 ( 1.551 0.000 0.686) 1.696 20.619 ( -0.525 0.000 1.210) 1.319 24.315 ( -2.283 0.000 3.898) 4.518 24.345 ( 2.638 0.000 -3.015) 4.006 24.784 ( -2.612 0.000 9.124) 9.490 24.895 ( 11.370 0.000 -4.647) 12.283 30.073 ( -0.250 0.000 4.417) 4.424 30.233 ( 0.247 0.000 6.062) 6.067 30.350 ( 0.823 0.000 -3.532) 3.626 30.410 ( 1.438 0.000 -1.983) 2.450 34.521 ( 17.296 0.000 -9.648) 19.805 35.162 ( -12.163 0.000 -5.393) 13.305 35.883 ( 10.930 0.000 34.231) 35.933 36.189 ( 12.964 0.000 9.167) 15.878 37.796 ( -3.135 0.000 -8.310) 8.881 37.968 ( -0.448 0.000 1.457) 1.525 38.018 ( 3.119 0.000 0.122) 3.121 38.174 ( 1.755 0.000 9.361) 9.524 41.604 ( 15.411 0.000 14.055) 20.857 41.737 ( 11.311 0.000 -23.143) 25.759 42.494 ( -15.710 0.000 -6.027) 16.827 42.551 ( -27.433 0.000 -8.058) 28.592 43.037 ( -18.878 0.000 -6.361) 19.920 43.577 ( -5.830 0.000 -7.564) 9.550 46.182 ( -10.657 0.000 11.628) 15.772 46.184 ( 16.450 0.000 -7.649) 18.141 ======================= Grid point 122 (40/126) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( -6.472 0.000 8.573) 10.742 2.473 ( -1.220 0.000 3.090) 3.322 2.499 ( -12.655 0.000 3.702) 13.185 2.751 ( 12.054 0.000 -7.596) 14.247 3.177 ( 42.232 0.000 9.994) 43.399 3.192 ( -16.951 0.000 5.760) 17.903 3.507 ( 16.095 0.000 25.692) 30.317 3.934 ( -13.014 0.000 10.998) 17.039 4.112 ( 0.272 0.000 -6.318) 6.324 4.471 ( -0.988 0.000 0.465) 1.092 4.541 ( -50.526 0.000 -13.735) 52.360 4.777 ( -13.661 0.000 2.791) 13.943 4.915 ( 4.342 0.000 -15.052) 15.666 4.990 ( -5.080 0.000 -1.104) 5.199 5.228 ( -3.700 0.000 6.137) 7.166 5.275 ( -5.310 0.000 -11.606) 12.763 5.669 ( -13.123 0.000 0.827) 13.149 5.848 ( 23.445 0.000 8.195) 24.836 5.979 ( -4.934 0.000 0.793) 4.998 6.201 ( 8.911 0.000 12.224) 15.127 6.210 ( 1.255 0.000 5.481) 5.623 6.645 ( 30.425 0.000 -14.124) 33.543 6.932 ( 26.598 0.000 23.705) 35.628 7.274 ( 5.976 0.000 -9.233) 10.998 7.349 ( -5.655 0.000 -3.748) 6.784 7.527 ( 9.414 0.000 0.491) 9.427 7.687 ( 3.711 0.000 -6.366) 7.368 7.833 ( -16.130 0.000 -3.163) 16.438 7.909 ( -8.871 0.000 -1.009) 8.928 8.065 ( -0.035 0.000 -0.802) 0.803 8.152 ( -7.493 0.000 -6.960) 10.227 8.170 ( 15.864 0.000 -15.132) 21.923 8.359 ( 5.058 0.000 5.105) 7.186 8.617 ( -11.951 0.000 -18.727) 22.215 8.637 ( -1.746 0.000 0.264) 1.766 8.824 ( -5.777 0.000 -2.990) 6.505 9.255 ( 4.053 0.000 2.129) 4.579 9.487 ( -16.948 0.000 5.577) 17.842 9.704 ( 2.643 0.000 -0.615) 2.714 9.843 ( 2.550 0.000 -18.732) 18.905 10.076 ( 3.523 0.000 13.744) 14.188 10.247 ( 1.555 0.000 -2.177) 2.675 10.471 ( -16.330 0.000 0.219) 16.331 10.613 ( 1.473 0.000 7.995) 8.129 10.644 ( 5.630 0.000 -8.390) 10.103 10.769 ( 0.873 0.000 -5.089) 5.163 10.815 ( -4.549 0.000 26.341) 26.731 10.986 ( -3.690 0.000 -0.963) 3.814 11.472 ( -6.591 0.000 2.820) 7.169 11.670 ( 3.069 0.000 -10.174) 10.627 11.838 ( 6.174 0.000 -4.684) 7.750 11.885 ( -0.676 0.000 1.923) 2.039 12.055 ( 10.863 0.000 1.122) 10.921 12.108 ( 10.097 0.000 1.858) 10.266 12.209 ( -5.832 0.000 -9.095) 10.805 12.276 ( -3.943 0.000 1.187) 4.118 12.695 ( 8.295 0.000 -1.615) 8.451 12.902 ( 4.930 0.000 -2.400) 5.483 13.114 ( 6.867 0.000 24.161) 25.118 13.765 ( -19.935 0.000 -5.770) 20.753 14.067 ( -12.003 0.000 15.844) 19.877 14.186 ( 1.221 0.000 5.141) 5.284 14.623 ( 6.506 0.000 -7.259) 9.748 14.793 ( -9.162 0.000 -9.313) 13.064 15.255 ( 3.248 0.000 10.900) 11.374 15.566 ( 4.228 0.000 10.483) 11.304 16.144 ( -0.677 0.000 -17.319) 17.332 16.487 ( -1.531 0.000 -12.746) 12.838 17.892 ( -2.043 0.000 1.610) 2.601 17.960 ( -4.988 0.000 -0.988) 5.085 17.976 ( 0.090 0.000 0.389) 0.399 18.047 ( 4.191 0.000 -1.543) 4.466 19.246 ( -3.167 0.000 1.498) 3.504 19.461 ( 10.525 0.000 -10.063) 14.562 19.609 ( -0.545 0.000 3.852) 3.890 19.762 ( -0.244 0.000 -0.367) 0.441 20.109 ( -0.201 0.000 0.269) 0.336 20.131 ( 0.440 0.000 -0.641) 0.778 20.161 ( 0.062 0.000 0.698) 0.700 20.168 ( -0.407 0.000 0.362) 0.545 20.419 ( 1.108 0.000 -0.289) 1.145 20.495 ( -0.825 0.000 -2.549) 2.679 20.613 ( -0.901 0.000 1.666) 1.894 20.628 ( 0.249 0.000 0.527) 0.583 24.288 ( -2.546 0.000 2.399) 3.498 24.398 ( 4.331 0.000 -2.255) 4.883 24.743 ( -6.369 0.000 8.968) 10.999 25.019 ( 3.849 0.000 -3.220) 5.019 30.094 ( 0.079 0.000 4.906) 4.907 30.261 ( -0.196 0.000 6.131) 6.134 30.339 ( 0.131 0.000 -4.252) 4.254 30.430 ( 1.302 0.000 -1.290) 1.833 34.768 ( 14.737 0.000 -8.977) 17.256 34.974 ( -4.611 0.000 -9.360) 10.434 36.316 ( 16.444 0.000 49.926) 52.564 36.395 ( 3.438 0.000 15.560) 15.935 37.701 ( -2.428 0.000 -10.015) 10.305 37.979 ( 0.146 0.000 2.831) 2.835 38.008 ( -4.977 0.000 -4.142) 6.476 38.129 ( -7.071 0.000 -0.069) 7.071 41.411 ( -24.756 0.000 -14.966) 28.928 41.823 ( 11.565 0.000 -33.025) 34.991 42.428 ( 18.447 0.000 4.240) 18.928 42.590 ( -25.562 0.000 -0.899) 25.578 42.621 ( 11.440 0.000 18.097) 21.409 43.501 ( 1.582 0.000 -20.571) 20.632 46.002 ( -15.154 0.000 12.567) 19.687 46.365 ( 6.064 0.000 -3.880) 7.200 ======================= Grid point 123 (41/126) ======================= q-point: (-0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( -37.538 0.000 12.166) 39.460 1.928 ( -44.477 0.000 -2.172) 44.530 2.622 ( -30.360 0.000 21.704) 37.320 2.818 ( 24.321 0.000 -0.084) 24.321 2.929 ( -25.986 0.000 -21.204) 33.539 3.517 ( -10.511 0.000 0.073) 10.511 3.787 ( -8.879 0.000 14.282) 16.817 4.051 ( 14.788 0.000 -2.693) 15.031 4.132 ( 32.667 0.000 11.673) 34.690 4.228 ( 28.845 0.000 23.345) 37.108 4.434 ( -1.511 0.000 -15.756) 15.828 4.796 ( -12.017 0.000 -2.523) 12.279 4.812 ( 1.188 0.000 8.554) 8.636 4.900 ( 3.348 0.000 9.879) 10.431 5.183 ( -3.044 0.000 3.460) 4.609 5.350 ( -13.473 0.000 -3.299) 13.871 5.385 ( 13.455 0.000 -4.267) 14.115 5.926 ( -1.462 0.000 0.339) 1.500 5.927 ( -1.824 0.000 5.427) 5.725 6.211 ( -2.187 0.000 -1.735) 2.791 6.675 ( 14.295 0.000 6.266) 15.607 7.129 ( 22.105 0.000 -15.157) 26.803 7.219 ( -7.286 0.000 4.100) 8.361 7.287 ( 1.592 0.000 -23.241) 23.295 7.361 ( 12.086 0.000 -3.884) 12.695 7.444 ( -17.298 0.000 -14.894) 22.826 7.718 ( 5.462 0.000 -5.643) 7.853 7.759 ( 11.951 0.000 1.524) 12.048 8.008 ( 8.680 0.000 11.388) 14.319 8.055 ( -4.264 0.000 3.482) 5.505 8.127 ( 18.344 0.000 6.582) 19.489 8.350 ( 2.053 0.000 -10.999) 11.189 8.414 ( 0.123 0.000 -2.549) 2.552 8.447 ( 15.544 0.000 -19.740) 25.125 8.658 ( -9.417 0.000 -6.017) 11.175 8.698 ( 5.904 0.000 16.624) 17.641 9.266 ( -8.890 0.000 11.309) 14.385 9.300 ( 1.505 0.000 -4.298) 4.554 9.754 ( -6.256 0.000 -13.862) 15.209 9.811 ( 8.310 0.000 3.408) 8.981 10.052 ( -11.161 0.000 1.756) 11.298 10.245 ( -4.050 0.000 6.047) 7.278 10.285 ( 3.174 0.000 1.196) 3.392 10.638 ( -1.667 0.000 3.317) 3.713 10.660 ( -0.924 0.000 -4.340) 4.437 10.724 ( -3.891 0.000 -3.141) 5.001 10.852 ( -3.558 0.000 11.565) 12.100 10.984 ( -1.140 0.000 8.941) 9.014 11.203 ( -19.985 0.000 3.193) 20.238 11.671 ( -2.373 0.000 -8.068) 8.410 11.800 ( -9.688 0.000 5.833) 11.308 11.871 ( -11.020 0.000 -12.246) 16.475 12.003 ( -8.422 0.000 1.405) 8.539 12.035 ( 3.958 0.000 -3.551) 5.317 12.251 ( 5.403 0.000 -3.180) 6.270 12.336 ( 4.761 0.000 -3.631) 5.987 12.618 ( -9.139 0.000 3.340) 9.730 12.973 ( 6.094 0.000 -8.298) 10.295 13.265 ( -26.848 0.000 -12.555) 29.639 13.527 ( 18.280 0.000 29.343) 34.571 14.101 ( 3.166 0.000 18.116) 18.391 14.377 ( 12.842 0.000 10.304) 16.465 14.614 ( -5.183 0.000 -12.898) 13.901 14.683 ( -0.929 0.000 -2.607) 2.768 15.440 ( 12.302 0.000 10.928) 16.455 15.661 ( 1.395 0.000 2.859) 3.181 16.048 ( -0.973 0.000 -10.537) 10.582 16.320 ( -9.032 0.000 -16.302) 18.637 17.840 ( -3.222 0.000 1.767) 3.675 17.861 ( -1.549 0.000 -6.186) 6.377 18.049 ( 5.180 0.000 1.222) 5.323 18.141 ( 4.759 0.000 1.227) 4.915 19.213 ( -0.485 0.000 -0.998) 1.110 19.590 ( 8.381 0.000 -8.660) 12.052 19.619 ( -0.609 0.000 4.194) 4.238 19.764 ( 0.690 0.000 -1.054) 1.260 20.109 ( 0.008 0.000 0.185) 0.185 20.136 ( 0.411 0.000 -0.583) 0.713 20.161 ( -0.521 0.000 0.300) 0.601 20.167 ( 0.162 0.000 0.929) 0.943 20.456 ( 2.780 0.000 -0.086) 2.781 20.468 ( -0.663 0.000 -2.223) 2.320 20.604 ( -0.824 0.000 2.029) 2.190 20.621 ( -1.239 0.000 0.621) 1.386 24.260 ( -0.699 0.000 1.007) 1.225 24.467 ( 3.244 0.000 -0.184) 3.249 24.650 ( -6.897 0.000 5.211) 8.645 24.990 ( -6.194 0.000 -0.572) 6.220 30.116 ( -0.299 0.000 4.966) 4.975 30.286 ( -0.128 0.000 5.580) 5.581 30.320 ( 0.163 0.000 -4.505) 4.508 30.441 ( 0.708 0.000 -1.858) 1.988 34.923 ( 5.695 0.000 -15.313) 16.337 34.973 ( 11.381 0.000 -3.926) 12.039 36.434 ( -7.588 0.000 12.819) 14.896 36.921 ( 20.716 0.000 33.943) 39.765 37.688 ( 7.771 0.000 17.321) 18.984 37.788 ( -10.909 0.000 -9.659) 14.570 37.995 ( 0.086 0.000 5.527) 5.528 38.031 ( -3.976 0.000 -1.803) 4.366 41.040 ( -11.713 0.000 -1.664) 11.830 41.792 ( 2.787 0.000 -41.155) 41.250 42.166 ( -19.854 0.000 -1.468) 19.908 42.531 ( -2.146 0.000 8.829) 9.086 43.259 ( 39.829 0.000 11.238) 41.384 43.398 ( -1.284 0.000 -24.919) 24.952 45.744 ( -19.299 0.000 8.228) 20.980 46.350 ( -7.381 0.000 0.603) 7.405 ======================= Grid point 124 (42/126) ======================= q-point: (-0.17 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.942 ( -34.000 0.000 21.267) 40.104 1.042 ( -42.964 0.000 13.447) 45.020 1.972 ( -42.515 0.000 54.608) 69.206 2.567 ( -8.031 0.000 -15.258) 17.243 3.149 ( 13.563 0.000 -14.237) 19.663 3.517 ( -5.063 0.000 17.962) 18.662 3.848 ( 11.904 0.000 -0.460) 11.913 4.098 ( 8.818 0.000 -12.863) 15.595 4.279 ( -6.000 0.000 -13.207) 14.506 4.509 ( -12.526 0.000 -1.468) 12.612 4.647 ( 3.526 0.000 12.482) 12.970 4.846 ( -2.504 0.000 9.719) 10.037 4.896 ( 25.681 0.000 0.860) 25.695 5.091 ( 3.097 0.000 22.349) 22.562 5.146 ( -3.979 0.000 7.496) 8.486 5.364 ( 15.302 0.000 6.217) 16.517 5.622 ( 8.332 0.000 2.508) 8.701 5.906 ( -0.738 0.000 0.965) 1.215 5.928 ( -3.716 0.000 0.411) 3.738 6.218 ( 11.283 0.000 6.988) 13.272 6.681 ( -25.982 0.000 -53.201) 59.207 6.746 ( -0.712 0.000 -5.846) 5.889 6.953 ( -14.266 0.000 -6.464) 15.662 7.238 ( 5.002 0.000 -14.777) 15.600 7.537 ( 7.384 0.000 0.157) 7.386 7.720 ( 21.049 0.000 -1.660) 21.115 7.855 ( 7.695 0.000 -7.972) 11.080 7.915 ( 2.696 0.000 -0.698) 2.785 8.020 ( -1.129 0.000 4.844) 4.974 8.131 ( 7.726 0.000 5.108) 9.262 8.345 ( 1.841 0.000 -18.403) 18.495 8.372 ( -1.144 0.000 2.447) 2.702 8.495 ( 5.800 0.000 6.482) 8.698 8.520 ( 6.425 0.000 14.287) 15.666 8.809 ( 20.355 0.000 -7.023) 21.533 9.054 ( 12.718 0.000 19.794) 23.527 9.243 ( 0.792 0.000 6.586) 6.633 9.377 ( 19.310 0.000 -2.164) 19.431 9.500 ( -11.994 0.000 -9.879) 15.539 9.867 ( -9.292 0.000 3.420) 9.902 9.971 ( 5.133 0.000 -2.850) 5.871 10.288 ( 4.797 0.000 3.323) 5.836 10.329 ( -1.243 0.000 -4.631) 4.795 10.515 ( -21.052 0.000 -2.343) 21.182 10.592 ( -4.594 0.000 6.071) 7.614 10.592 ( -5.665 0.000 4.163) 7.031 10.804 ( -5.577 0.000 5.552) 7.869 10.937 ( -5.876 0.000 4.358) 7.315 10.951 ( -6.285 0.000 3.971) 7.435 11.201 ( -30.523 0.000 -13.768) 33.485 11.611 ( -14.469 0.000 10.304) 17.763 11.889 ( 11.364 0.000 1.007) 11.409 11.981 ( 8.129 0.000 -3.989) 9.055 12.049 ( -6.832 0.000 -11.809) 13.643 12.291 ( 1.577 0.000 -10.940) 11.053 12.344 ( -0.238 0.000 -6.801) 6.805 12.535 ( -3.284 0.000 7.026) 7.755 12.671 ( -19.413 0.000 -12.493) 23.085 13.234 ( 28.489 0.000 3.069) 28.654 13.821 ( -9.984 0.000 37.305) 38.618 14.337 ( 14.142 0.000 25.704) 29.338 14.450 ( -9.790 0.000 -2.080) 10.009 14.575 ( -3.847 0.000 -5.511) 6.721 14.635 ( 8.444 0.000 10.132) 13.189 15.642 ( -0.274 0.000 -10.123) 10.126 15.770 ( 17.088 0.000 7.489) 18.657 16.035 ( -12.638 0.000 -17.235) 21.372 16.050 ( 3.018 0.000 2.532) 3.940 17.788 ( -4.967 0.000 2.287) 5.469 17.864 ( 5.834 0.000 -9.951) 11.535 18.149 ( 4.425 0.000 2.220) 4.950 18.211 ( 2.033 0.000 1.919) 2.796 19.226 ( 3.036 0.000 -2.401) 3.871 19.619 ( -1.796 0.000 4.626) 4.962 19.642 ( -1.701 0.000 -11.180) 11.309 19.759 ( 0.232 0.000 -3.323) 3.331 20.112 ( 0.240 0.000 0.221) 0.327 20.141 ( 0.439 0.000 -0.584) 0.731 20.151 ( -0.704 0.000 0.341) 0.782 20.172 ( -0.262 0.000 0.205) 0.333 20.458 ( 0.482 0.000 -0.568) 0.745 20.510 ( 3.092 0.000 -0.385) 3.116 20.595 ( -1.796 0.000 0.928) 2.022 20.618 ( 1.785 0.000 1.801) 2.536 24.298 ( 5.126 0.000 -0.052) 5.126 24.470 ( -4.574 0.000 3.600) 5.821 24.583 ( -0.227 0.000 -3.294) 3.302 24.801 ( -14.184 0.000 1.566) 14.270 30.128 ( -0.898 0.000 4.875) 4.958 30.294 ( -1.924 0.000 1.503) 2.442 30.308 ( 0.862 0.000 -4.330) 4.415 30.438 ( 0.180 0.000 -2.864) 2.870 35.056 ( 18.396 0.000 -19.780) 27.012 35.152 ( 9.064 0.000 2.807) 9.488 36.220 ( -19.075 0.000 2.408) 19.226 36.724 ( -44.197 0.000 -55.956) 71.305 37.654 ( -0.469 0.000 -1.081) 1.179 37.950 ( -0.576 0.000 1.370) 1.486 37.962 ( -2.603 0.000 -0.458) 2.643 38.495 ( 26.715 0.000 20.657) 33.770 40.931 ( -3.064 0.000 8.715) 9.238 41.801 ( 6.985 0.000 3.408) 7.772 41.965 ( 31.857 0.000 39.092) 50.429 42.512 ( -4.158 0.000 9.309) 10.196 43.269 ( 1.543 0.000 -22.312) 22.365 44.001 ( 35.332 0.000 3.508) 35.505 45.365 ( -26.000 0.000 7.808) 27.147 46.092 ( -21.537 0.000 2.220) 21.651 ======================= Grid point 125 (43/126) ======================= q-point: ( 0.00 0.06 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( 13.529 29.370 35.401) 47.946 1.460 ( 0.740 41.290 29.041) 50.485 2.255 ( 11.420 29.075 61.773) 69.222 2.733 ( -0.950 28.236 -10.914) 30.286 3.311 ( -1.568 14.756 -33.642) 36.769 3.748 ( -6.398 22.372 16.917) 28.769 4.122 ( -18.313 15.442 -11.007) 26.362 4.229 ( 9.752 13.693 1.124) 16.848 4.464 ( 0.536 22.945 -8.161) 24.359 4.600 ( 5.421 19.098 2.875) 20.060 4.770 ( -9.260 15.509 5.221) 18.803 4.869 ( -1.477 6.090 6.799) 9.246 5.135 ( -0.710 1.207 0.028) 1.400 5.338 ( 2.663 9.650 1.653) 10.147 5.375 ( -4.607 13.704 6.062) 15.678 5.585 ( -3.349 3.102 7.274) 8.588 5.700 ( 1.630 13.816 -9.651) 16.931 5.909 ( -11.398 8.731 -16.192) 21.641 6.014 ( 0.857 9.500 2.242) 9.798 6.218 ( -4.265 12.590 -4.118) 13.916 6.685 ( 2.841 0.918 -6.490) 7.143 6.719 ( 22.351 -0.063 -9.362) 24.233 6.790 ( 0.602 0.336 -1.324) 1.493 7.246 ( -4.539 0.783 -22.235) 22.707 7.555 ( -4.384 -3.338 -5.402) 7.716 7.777 ( 9.463 -5.977 -6.480) 12.933 7.848 ( 6.438 -0.784 0.426) 6.499 7.986 ( -7.704 5.102 -3.896) 10.028 8.181 ( 2.817 2.199 10.211) 10.818 8.311 ( -0.321 13.307 2.040) 13.466 8.361 ( 1.999 0.264 7.128) 7.408 8.441 ( -6.759 4.686 6.017) 10.191 8.546 ( 1.914 8.792 -3.926) 9.816 8.777 ( 1.529 5.004 7.040) 8.772 9.071 ( -11.451 4.289 -1.563) 12.327 9.163 ( 15.273 2.063 4.294) 15.999 9.208 ( -9.368 0.679 0.592) 9.411 9.443 ( 7.624 -4.027 -8.534) 12.131 9.637 ( -17.289 -2.455 -6.483) 18.627 9.734 ( -1.430 -3.702 7.556) 8.535 9.903 ( 17.063 -0.550 -12.273) 21.026 10.044 ( -2.647 -7.213 1.429) 7.815 10.325 ( 6.100 0.242 -0.800) 6.157 10.409 ( -12.029 -6.630 6.279) 15.102 10.485 ( 5.402 5.546 1.962) 7.987 10.635 ( -2.859 8.731 6.025) 10.986 10.834 ( -0.254 -1.131 -0.193) 1.175 10.917 ( -0.386 7.576 -2.847) 8.102 10.963 ( 1.639 6.786 -2.908) 7.562 11.025 ( 9.108 8.921 -4.557) 13.539 11.421 ( -7.655 -0.026 11.559) 13.864 11.721 ( 0.923 -6.780 -0.807) 6.890 12.046 ( 9.158 -2.842 -3.386) 10.169 12.184 ( -3.684 2.096 2.385) 4.864 12.225 ( 9.624 -0.377 -3.978) 10.420 12.400 ( -2.272 5.727 -5.145) 8.027 12.636 ( 2.373 6.260 1.452) 6.851 12.729 ( -3.958 11.532 -1.462) 12.279 13.294 ( -33.721 -13.879 24.083) 43.701 13.757 ( 31.179 -22.370 7.606) 39.121 14.197 ( -8.078 -2.445 10.952) 13.826 14.524 ( -3.383 -5.551 -2.141) 6.844 14.686 ( 19.650 -13.702 15.394) 28.475 14.711 ( 2.400 -7.984 8.395) 11.832 15.550 ( -0.765 -3.384 -6.995) 7.808 15.675 ( -11.721 -1.532 -13.120) 17.660 15.978 ( 2.349 -7.843 1.944) 8.415 16.144 ( 12.937 0.447 -2.327) 13.152 17.555 ( -5.932 1.055 7.189) 9.380 17.966 ( 7.837 -1.540 -10.686) 13.341 18.305 ( -3.642 3.946 3.785) 6.570 18.390 ( 1.590 3.377 -0.592) 3.780 19.262 ( -3.123 7.786 3.884) 9.244 19.535 ( 6.147 2.446 -6.423) 9.221 19.690 ( -2.083 4.830 3.753) 6.462 19.947 ( 0.321 13.975 -7.935) 16.074 20.236 ( -1.148 8.705 1.052) 8.843 20.263 ( 0.448 11.694 1.797) 11.840 20.269 ( 1.263 10.411 -0.182) 10.489 20.435 ( -0.359 4.732 -4.129) 6.290 20.510 ( 0.163 3.696 -0.412) 3.722 20.553 ( 1.284 1.425 -0.634) 2.020 20.565 ( -1.182 0.021 1.457) 1.876 21.015 ( -5.517 39.462 -40.892) 57.095 24.360 ( -3.411 -2.583 1.008) 4.396 24.441 ( 8.512 -1.044 -3.185) 9.148 24.536 ( -11.731 -0.628 0.885) 11.781 24.612 ( 5.621 -0.923 -1.293) 5.841 30.115 ( -3.952 -0.477 4.209) 5.793 30.174 ( -3.137 -1.066 6.328) 7.143 30.325 ( 1.333 0.503 -4.502) 4.723 30.417 ( -0.011 -0.592 -3.727) 3.774 34.582 ( -47.336 -14.937 19.756) 53.424 35.215 ( 8.183 -10.331 -0.142) 13.180 35.452 ( 15.714 -1.756 -7.190) 17.370 35.994 ( -26.801 7.465 -17.604) 32.923 37.613 ( 2.250 -9.136 6.569) 11.475 37.832 ( 2.894 -8.797 -1.022) 9.317 37.970 ( 2.401 0.406 1.346) 2.783 38.133 ( -13.427 -9.493 2.671) 16.659 40.975 ( 4.062 -1.990 13.878) 14.597 41.638 ( -1.637 -4.306 -10.797) 11.739 42.390 ( -1.379 -9.031 9.503) 13.182 43.059 ( 7.284 -15.791 -17.219) 24.472 43.568 ( 97.056 -55.895 49.754) 122.554 44.181 ( -11.058 -16.647 -3.193) 20.238 44.389 ( -35.558 -31.767 39.767) 62.089 45.468 ( -1.753 -25.356 -9.787) 27.235 ======================= Grid point 126 (44/126) ======================= q-point: ( 0.17 0.06 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( 11.408 25.535 30.868) 41.653 1.770 ( 20.393 37.362 22.765) 48.270 2.680 ( 5.151 23.602 -22.738) 33.176 3.015 ( -5.715 15.430 -42.808) 45.861 3.278 ( 43.217 11.907 68.534) 81.892 3.556 ( -19.414 15.888 2.737) 25.235 3.792 ( -11.672 26.479 10.977) 30.949 4.264 ( -12.899 12.799 9.922) 20.704 4.427 ( 2.443 26.021 -9.877) 27.939 4.593 ( -9.989 17.831 0.122) 20.438 4.760 ( 8.377 17.098 -1.600) 19.107 4.805 ( -3.390 6.372 -4.717) 8.622 4.900 ( -16.009 1.968 -1.805) 16.230 5.317 ( -6.781 15.774 3.572) 17.538 5.414 ( -2.603 11.463 13.905) 18.208 5.562 ( 7.238 3.134 10.000) 12.736 5.677 ( 5.878 5.495 -18.232) 19.928 5.912 ( 10.433 10.249 2.993) 14.928 6.036 ( -0.101 11.064 0.982) 11.108 6.191 ( -0.066 15.120 3.304) 15.477 6.705 ( -7.592 1.510 -5.017) 9.224 6.784 ( -13.291 3.608 -26.621) 29.973 6.807 ( 2.975 0.832 -8.856) 9.380 7.080 ( 7.227 -5.933 -10.412) 13.995 7.479 ( -0.756 -5.299 -9.045) 10.510 7.767 ( -9.201 -1.638 -12.285) 15.436 7.819 ( -5.401 3.237 2.672) 6.841 7.931 ( -0.124 3.406 -0.841) 3.510 8.124 ( -9.258 11.193 2.547) 14.747 8.272 ( -13.773 3.769 -0.492) 14.288 8.365 ( -7.461 7.662 6.320) 12.422 8.383 ( -3.879 10.528 1.217) 11.285 8.600 ( 5.991 2.141 6.196) 8.881 8.699 ( -4.725 2.360 -3.110) 6.129 8.814 ( -5.614 5.618 6.184) 10.066 9.182 ( 7.766 -0.859 13.890) 15.937 9.281 ( -6.099 0.270 -7.507) 9.676 9.351 ( -2.582 3.814 -2.745) 5.362 9.610 ( 3.441 -5.739 -1.320) 6.820 9.773 ( -3.829 0.582 -8.762) 9.580 9.978 ( 16.471 -6.676 10.691) 20.740 10.173 ( 2.020 -4.528 -2.297) 5.464 10.279 ( -2.461 -3.032 -4.286) 5.798 10.511 ( 3.734 2.940 6.145) 7.769 10.581 ( 10.746 4.156 -0.528) 11.534 10.748 ( 6.439 11.769 1.865) 13.545 10.816 ( 4.894 3.702 1.767) 6.386 11.027 ( 10.264 3.442 1.240) 10.897 11.136 ( 4.816 -3.043 -3.662) 6.773 11.253 ( 27.207 -1.731 -7.120) 28.177 11.470 ( 9.001 3.484 5.330) 11.025 11.765 ( 2.159 -5.267 -3.100) 6.481 12.065 ( -12.173 -1.104 1.217) 12.283 12.134 ( -0.074 -3.006 -3.875) 4.905 12.185 ( -17.033 9.934 3.147) 19.968 12.352 ( -0.645 -5.452 -0.191) 5.493 12.482 ( 1.616 6.891 -10.249) 12.456 12.804 ( -1.620 6.308 2.246) 6.890 12.977 ( -2.399 -1.900 7.039) 7.675 14.018 ( -8.724 -13.667 17.713) 24.014 14.193 ( 0.650 -10.381 13.397) 16.961 14.422 ( -7.110 -6.375 1.653) 9.692 14.656 ( -2.884 -2.687 -0.012) 3.942 15.058 ( 3.370 -24.955 5.293) 25.732 15.396 ( -9.166 -0.322 -4.996) 10.444 15.560 ( -0.763 -2.398 -4.755) 5.380 15.980 ( 3.763 -4.798 -6.727) 9.079 16.353 ( 9.083 -4.615 -4.683) 11.213 17.571 ( 5.432 0.677 2.498) 6.017 18.045 ( 5.854 -0.345 -9.458) 11.128 18.215 ( -7.634 1.249 3.271) 8.399 18.341 ( -6.903 6.290 1.365) 9.439 19.234 ( -0.208 8.510 1.024) 8.574 19.558 ( -2.846 4.530 -5.733) 7.841 19.648 ( -1.981 6.003 4.174) 7.575 19.867 ( -3.809 14.541 -6.109) 16.226 20.222 ( -0.609 8.711 0.532) 8.748 20.257 ( -0.708 10.124 0.379) 10.156 20.295 ( -0.244 11.364 2.283) 11.594 20.402 ( 0.626 8.996 -6.234) 10.963 20.509 ( -1.530 3.844 -1.183) 4.303 20.559 ( 0.824 2.091 -1.500) 2.702 20.577 ( 1.299 4.649 3.033) 5.701 20.738 ( -5.182 21.874 -11.150) 25.093 24.320 ( -0.536 -1.546 -0.894) 1.865 24.369 ( -6.343 0.086 2.399) 6.782 24.614 ( 10.875 -4.937 -2.280) 12.159 24.727 ( 4.972 -2.228 2.433) 5.967 30.072 ( -1.903 0.416 4.499) 4.903 30.192 ( 0.448 -0.316 6.262) 6.286 30.337 ( 1.695 -0.097 -3.154) 3.582 30.402 ( 0.463 -0.480 -3.661) 3.721 34.280 ( 2.974 -0.749 6.284) 6.992 35.411 ( -4.776 -8.619 10.603) 14.475 35.454 ( -1.150 -7.156 -3.164) 7.908 35.851 ( 14.416 -0.625 -1.053) 14.468 37.651 ( -1.113 -13.586 4.786) 14.447 37.864 ( -0.004 -5.787 -3.996) 7.032 37.951 ( -1.182 -5.360 1.657) 5.734 38.150 ( 9.089 3.792 5.661) 11.360 41.197 ( 12.813 -2.832 17.105) 21.559 41.622 ( 6.237 -3.970 -15.575) 17.241 42.401 ( -1.005 -7.605 7.865) 10.986 43.088 ( 4.347 -12.777 -20.536) 24.573 43.434 ( -53.437 -18.412 -19.352) 59.741 43.782 ( -29.942 -10.936 14.954) 35.210 45.173 ( 39.469 -74.983 31.769) 90.497 45.680 ( 21.527 -21.332 -9.404) 31.732 ======================= Grid point 127 (45/126) ======================= q-point: ( 0.33 0.06 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( 19.428 28.094 18.792) 38.986 2.259 ( 26.806 14.287 5.309) 30.836 2.653 ( 9.814 14.526 -12.266) 21.396 2.930 ( 4.847 24.931 -13.352) 28.693 3.090 ( -16.593 17.676 -3.198) 24.453 3.656 ( -9.991 23.814 5.967) 26.506 3.785 ( -31.325 11.234 22.234) 40.022 4.249 ( 0.868 13.568 14.397) 19.802 4.430 ( -2.378 25.452 -3.817) 25.846 4.524 ( -4.661 -0.997 7.862) 9.194 4.644 ( 8.137 11.473 11.697) 18.293 4.942 ( 12.294 16.506 -11.396) 23.525 5.002 ( 25.416 9.347 16.460) 31.690 5.220 ( -2.155 14.763 3.257) 15.271 5.385 ( -4.514 12.356 7.938) 15.364 5.610 ( -11.597 4.474 -7.197) 14.363 5.756 ( -6.591 9.525 -4.104) 12.289 5.961 ( -7.220 7.492 -7.793) 12.999 6.097 ( 7.690 7.116 7.419) 12.838 6.265 ( -4.693 10.780 3.320) 12.217 6.442 ( 8.041 7.897 -33.037) 34.906 6.487 ( -15.810 10.623 10.550) 21.774 6.598 ( -6.934 2.244 -8.346) 11.081 7.108 ( 0.571 -6.431 -5.342) 8.380 7.438 ( 2.858 3.987 -3.957) 6.302 7.607 ( 7.458 -1.091 -12.821) 14.872 7.752 ( -8.164 11.506 -0.872) 14.135 7.930 ( 0.343 -3.044 -2.481) 3.942 8.019 ( -4.212 2.985 4.882) 7.106 8.101 ( -2.397 4.215 1.868) 5.196 8.274 ( -7.262 11.775 -2.321) 14.027 8.345 ( 0.321 8.225 5.424) 9.858 8.437 ( -14.584 1.446 -6.763) 16.141 8.710 ( -0.367 3.276 -1.865) 3.788 8.837 ( 1.940 9.104 -0.115) 9.309 9.064 ( -11.649 0.409 -12.154) 16.840 9.219 ( -0.673 2.611 -0.770) 2.804 9.533 ( 8.034 -2.387 5.417) 9.980 9.639 ( 1.847 -4.835 1.263) 5.327 9.819 ( 5.955 -0.825 3.264) 6.841 10.037 ( -7.239 2.733 2.229) 8.053 10.242 ( 3.993 -4.617 -0.699) 6.145 10.301 ( 6.388 -8.248 -5.024) 11.579 10.559 ( 0.609 4.457 8.252) 9.398 10.747 ( 6.528 4.393 -1.471) 8.005 10.803 ( 3.231 9.787 -1.164) 10.372 10.945 ( -4.983 3.280 14.984) 16.128 11.134 ( -1.581 -3.211 -4.840) 6.019 11.333 ( 12.358 0.117 4.224) 13.061 11.599 ( 11.241 1.810 -16.438) 19.996 11.686 ( 5.529 -5.525 3.269) 8.472 11.739 ( 13.103 -1.867 -8.739) 15.860 11.858 ( 0.932 -2.883 7.065) 7.687 12.061 ( -2.761 2.415 6.492) 7.457 12.130 ( -0.594 -0.571 -7.681) 7.725 12.373 ( 7.505 -3.659 3.610) 9.096 12.515 ( 1.463 7.253 -7.772) 10.731 12.770 ( 0.338 -3.856 2.685) 4.711 13.046 ( 0.588 2.676 6.703) 7.241 13.854 ( -14.836 -16.900 3.825) 22.811 14.129 ( -8.859 -4.166 12.584) 15.943 14.316 ( -7.961 -4.166 8.318) 12.244 14.654 ( 1.499 1.273 -4.330) 4.756 14.965 ( -10.490 -7.159 -0.130) 12.700 15.260 ( -4.607 3.061 3.468) 6.528 15.509 ( -0.994 1.849 1.723) 2.716 16.067 ( 7.646 -8.343 -12.708) 17.016 16.424 ( 2.624 -7.001 -7.903) 10.879 17.724 ( 9.494 -2.502 0.264) 9.821 18.053 ( -7.346 -0.114 0.938) 7.406 18.117 ( 2.821 3.597 -5.994) 7.538 18.188 ( -10.047 6.207 3.015) 12.189 19.272 ( 3.845 4.145 -0.893) 5.724 19.441 ( -5.883 6.174 -1.450) 8.650 19.660 ( 0.852 2.691 1.042) 3.009 19.785 ( -3.038 9.215 -2.181) 9.945 20.222 ( 0.404 9.022 -0.024) 9.031 20.246 ( -0.554 9.879 -0.157) 9.896 20.289 ( -1.157 9.409 2.458) 9.793 20.405 ( 2.032 6.346 -4.617) 8.107 20.469 ( -1.308 9.553 -0.546) 9.658 20.565 ( 0.163 3.626 -1.685) 4.001 20.612 ( 0.590 5.233 2.364) 5.772 20.680 ( 0.062 11.561 -1.819) 11.703 24.310 ( -2.328 -0.457 3.787) 4.469 24.336 ( 2.560 -0.890 -2.656) 3.795 24.731 ( -0.531 -4.846 6.916) 8.462 24.844 ( 8.801 -4.858 -3.467) 10.634 30.076 ( -0.333 0.291 4.349) 4.372 30.228 ( 0.146 -0.545 5.926) 5.953 30.344 ( 0.731 -0.561 -3.562) 3.680 30.406 ( 1.441 -0.398 -2.105) 2.582 34.481 ( 15.280 -3.520 -6.328) 16.909 35.132 ( -12.364 -3.294 -5.243) 13.828 35.719 ( 11.158 -14.284 25.008) 30.886 36.099 ( 8.581 -9.694 10.647) 16.762 37.631 ( -2.297 -15.087 0.381) 15.266 37.798 ( -2.514 -5.705 -5.151) 8.087 38.008 ( 3.725 -4.882 0.714) 6.182 38.316 ( 3.525 6.111 6.584) 9.650 41.562 ( 14.654 -4.134 13.475) 20.333 41.696 ( 11.034 -3.948 -22.424) 25.301 42.394 ( -35.254 -13.793 -20.028) 42.828 42.435 ( -3.433 -6.324 4.807) 8.654 42.946 ( -15.940 -8.942 -7.946) 19.929 43.430 ( -9.741 -13.643 -2.935) 17.018 45.631 ( 3.850 -47.648 20.245) 51.913 45.985 ( 15.507 -20.093 -8.083) 26.637 ======================= Grid point 128 (46/126) ======================= q-point: (-0.50 0.06 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.290 ( -13.739 24.176 8.091) 28.961 2.617 ( -5.497 15.655 8.302) 18.553 2.763 ( -4.042 20.530 -3.107) 21.153 2.889 ( 25.200 11.487 -2.087) 27.773 3.291 ( 0.327 12.222 16.055) 20.181 3.375 ( 14.034 17.520 -5.145) 23.030 3.671 ( 8.634 15.880 19.314) 26.453 4.112 ( -11.839 14.956 4.693) 19.643 4.332 ( -10.639 8.592 -2.106) 13.836 4.431 ( -8.936 14.702 -2.020) 17.323 4.721 ( -18.112 11.389 2.930) 21.595 4.930 ( -11.796 14.748 -1.051) 18.915 5.047 ( 1.519 11.813 -11.996) 16.904 5.179 ( -10.492 17.911 -4.619) 21.266 5.367 ( 1.521 10.678 -8.497) 13.731 5.398 ( -5.930 16.131 7.760) 18.857 5.730 ( -17.571 5.036 -8.695) 20.242 5.889 ( 26.353 5.664 12.377) 29.661 6.109 ( -1.158 11.668 0.764) 11.750 6.268 ( -1.053 6.279 4.242) 7.650 6.296 ( 6.923 9.113 5.693) 12.782 6.757 ( 26.806 11.005 -4.157) 29.274 6.943 ( 24.366 1.599 15.560) 28.955 7.118 ( 4.561 -6.687 -5.938) 10.039 7.539 ( -3.623 6.432 -2.600) 7.827 7.607 ( 8.308 10.970 -3.124) 14.112 7.728 ( 7.794 2.871 -7.198) 10.991 7.841 ( -8.900 -1.530 3.148) 9.564 7.885 ( -10.706 2.015 -11.528) 15.861 8.129 ( -4.282 3.970 -2.983) 6.557 8.158 ( 5.317 2.133 -4.924) 7.554 8.257 ( 0.911 8.551 -6.412) 10.727 8.402 ( 1.671 3.284 3.205) 4.883 8.643 ( -4.031 4.488 -11.069) 12.606 8.724 ( -8.631 6.815 -7.036) 13.055 8.889 ( -3.219 7.071 -1.776) 7.970 9.283 ( 4.225 2.701 1.669) 5.285 9.464 ( -14.601 -2.315 6.869) 16.301 9.671 ( 0.571 -3.191 -0.934) 3.374 9.787 ( 2.227 -3.736 -15.993) 16.574 10.098 ( 0.407 0.155 8.777) 8.787 10.244 ( -2.686 -3.721 -2.560) 5.255 10.380 ( 3.949 -1.608 2.944) 5.181 10.590 ( -1.766 2.397 2.403) 3.827 10.777 ( -3.431 6.030 8.505) 10.976 10.866 ( -4.585 3.835 8.869) 10.695 10.874 ( 3.692 8.790 -2.522) 9.861 11.016 ( -3.494 3.825 -0.145) 5.183 11.441 ( -7.086 -2.485 3.906) 8.464 11.646 ( 3.491 -2.428 -7.316) 8.462 11.812 ( 2.474 -5.188 -0.565) 5.775 11.874 ( 7.715 -2.806 -5.271) 9.756 12.010 ( -4.558 -4.054 0.799) 6.152 12.048 ( 1.053 -5.103 0.452) 5.230 12.133 ( 9.993 1.637 -1.310) 10.210 12.425 ( -4.722 6.743 -5.909) 10.133 12.629 ( 10.439 -4.968 1.802) 11.700 12.880 ( 9.029 -3.399 3.734) 10.344 13.036 ( -2.701 -5.271 16.433) 17.468 13.555 ( -15.909 -17.822 -5.951) 24.620 14.092 ( -4.067 3.814 14.247) 15.299 14.240 ( -1.952 2.284 7.907) 8.459 14.632 ( 0.890 0.619 -8.314) 8.384 14.780 ( -6.614 -0.880 -7.465) 10.013 15.285 ( 3.399 2.970 9.977) 10.951 15.569 ( 3.698 0.543 7.398) 8.288 16.081 ( 1.146 -5.317 -14.639) 15.617 16.385 ( -2.015 -8.946 -11.267) 14.527 17.885 ( -0.167 -0.374 0.564) 0.697 17.915 ( 1.497 -1.530 0.327) 2.165 18.024 ( -8.332 3.758 1.893) 9.334 18.182 ( 5.199 6.896 -3.164) 9.197 19.315 ( -1.329 6.839 0.237) 6.971 19.380 ( 1.986 -3.002 -2.299) 4.271 19.672 ( -0.485 4.512 1.040) 4.655 19.757 ( 1.659 6.254 -1.380) 6.616 20.232 ( 0.541 9.206 -0.086) 9.222 20.236 ( -0.404 9.823 -0.317) 9.836 20.283 ( -0.824 9.007 2.073) 9.280 20.423 ( 1.857 1.839 -2.099) 3.352 20.471 ( 1.618 13.466 -1.725) 13.673 20.547 ( -0.704 4.318 -2.079) 4.844 20.616 ( -0.837 2.733 1.710) 3.331 20.698 ( 2.491 14.244 -0.912) 14.489 24.283 ( -2.412 -0.454 2.366) 3.409 24.388 ( 4.154 -0.942 -1.943) 4.682 24.702 ( -5.646 -3.775 7.734) 10.293 24.950 ( 3.541 -6.541 -3.012) 8.025 30.095 ( -0.021 0.084 4.760) 4.761 30.251 ( -0.536 -0.921 5.815) 5.912 30.335 ( 0.339 -0.430 -4.004) 4.041 30.425 ( 1.264 -0.522 -1.448) 1.992 34.713 ( 12.917 -5.031 -6.370) 15.256 34.948 ( -3.815 -2.940 -9.096) 10.292 36.067 ( 9.313 -21.702 39.798) 46.278 36.242 ( 2.173 -14.878 12.593) 19.613 37.580 ( -2.139 -12.038 -2.353) 12.451 37.739 ( -1.758 -7.623 -5.599) 9.620 38.060 ( 1.280 -2.678 2.273) 3.739 38.294 ( -6.774 7.684 -0.765) 10.272 41.365 ( -23.299 -4.375 -14.358) 27.715 41.778 ( 10.851 -4.397 -32.087) 34.157 42.366 ( 17.887 -6.085 4.478) 19.417 42.473 ( -2.456 -10.208 9.387) 14.084 42.569 ( -10.383 -5.901 7.015) 13.851 43.314 ( -1.015 -17.001 -17.281) 24.264 45.630 ( -11.845 -34.250 17.323) 40.168 46.143 ( 5.004 -21.446 -5.671) 22.741 ======================= Grid point 129 (47/126) ======================= q-point: (-0.33 0.06 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( -38.610 18.111 4.556) 42.889 2.092 ( -43.289 15.043 6.645) 46.307 2.904 ( -17.809 26.405 13.131) 34.450 3.014 ( 8.221 20.547 -0.539) 22.137 3.260 ( -5.082 27.659 -14.603) 31.688 3.691 ( -8.346 16.035 0.762) 18.093 3.964 ( -6.223 15.073 9.088) 18.668 4.101 ( 42.193 2.027 20.074) 46.769 4.212 ( 8.092 10.148 -7.058) 14.775 4.381 ( 17.645 12.896 10.966) 24.452 4.637 ( 0.908 19.249 -1.184) 19.307 4.902 ( -2.472 11.865 2.559) 12.387 4.968 ( -7.067 14.535 0.347) 16.165 5.018 ( -1.459 11.809 6.941) 13.775 5.335 ( -4.058 13.645 6.226) 15.538 5.406 ( -9.452 7.594 -3.251) 12.553 5.554 ( 14.144 15.438 -4.606) 21.438 6.009 ( -0.931 8.709 -0.315) 8.765 6.091 ( -1.459 13.677 5.195) 14.703 6.282 ( -2.598 7.734 -3.130) 8.738 6.666 ( 15.990 -0.616 4.349) 16.583 7.128 ( 9.954 -0.483 -14.838) 17.874 7.164 ( -0.697 -4.590 -7.783) 9.063 7.238 ( 6.285 0.474 6.607) 9.132 7.427 ( -4.596 3.033 -34.152) 34.593 7.481 ( -11.336 4.384 -3.682) 12.700 7.800 ( 3.090 7.379 -3.339) 8.669 7.887 ( 16.638 9.489 0.119) 19.154 8.038 ( 14.176 1.171 13.146) 19.369 8.082 ( 2.910 4.569 2.765) 6.082 8.201 ( 8.871 5.403 1.085) 10.443 8.312 ( 0.697 1.328 -0.903) 1.751 8.465 ( 15.163 1.453 -15.192) 21.513 8.539 ( 1.139 8.892 -8.436) 12.310 8.703 ( -4.764 4.581 1.564) 6.791 8.752 ( -2.710 6.401 8.217) 10.763 9.281 ( -5.440 1.606 8.520) 10.236 9.334 ( 0.753 3.365 -3.698) 5.056 9.677 ( -2.557 -6.703 -8.702) 11.278 9.794 ( 4.737 -1.586 0.375) 5.010 9.984 ( -11.334 -6.021 1.922) 12.976 10.202 ( -0.066 0.319 -1.116) 1.163 10.463 ( 0.587 10.481 7.559) 12.936 10.562 ( 1.059 -1.925 -0.878) 2.366 10.761 ( -6.149 3.013 -2.390) 7.253 10.787 ( -4.773 5.256 4.796) 8.568 10.896 ( -4.633 4.771 6.110) 9.031 10.994 ( -1.893 1.844 4.374) 5.110 11.220 ( -14.936 2.464 3.424) 15.520 11.636 ( -14.989 -6.623 -3.579) 16.773 11.708 ( -2.653 -10.790 -7.526) 13.420 11.765 ( -9.193 -2.459 -0.808) 9.550 11.967 ( -3.041 -2.048 -1.031) 3.809 12.103 ( 7.235 5.231 -1.000) 8.984 12.211 ( -0.764 -3.747 -0.770) 3.901 12.427 ( 4.088 5.148 -3.759) 7.572 12.603 ( -9.461 -0.733 -1.296) 9.577 12.967 ( 7.376 0.259 -5.900) 9.449 13.227 ( -15.440 -3.320 -6.732) 17.168 13.352 ( 15.142 -15.867 26.072) 34.070 14.115 ( 1.344 1.325 14.823) 14.942 14.345 ( 4.354 -2.780 11.105) 12.248 14.569 ( -4.190 -2.702 -3.105) 5.873 14.698 ( 0.616 0.918 -10.702) 10.759 15.459 ( 9.678 1.583 11.691) 15.259 15.642 ( 1.473 -1.098 -0.158) 1.844 16.020 ( -0.367 -2.571 -8.247) 8.646 16.242 ( -7.002 -6.962 -14.923) 17.894 17.770 ( -6.522 -1.590 1.537) 6.886 17.897 ( -3.331 0.693 -2.498) 4.221 18.102 ( 10.777 2.750 -0.463) 11.132 18.264 ( 4.261 7.461 0.411) 8.602 19.280 ( -0.939 6.843 -0.827) 6.957 19.425 ( 2.301 -4.706 -0.758) 5.293 19.668 ( 0.154 3.687 0.875) 3.793 19.822 ( 5.736 7.659 -2.319) 9.846 20.229 ( -0.055 9.670 -0.183) 9.672 20.243 ( 0.506 9.371 -0.011) 9.385 20.275 ( -0.927 9.525 1.660) 9.713 20.460 ( 2.965 1.169 -1.408) 3.485 20.470 ( -0.613 6.868 -2.749) 7.423 20.545 ( 0.818 4.011 -1.401) 4.327 20.605 ( -1.241 1.132 1.748) 2.424 20.783 ( 9.472 28.252 -3.807) 30.040 24.259 ( -0.412 -0.130 0.945) 1.039 24.453 ( 2.641 -1.400 0.242) 2.999 24.619 ( -5.856 -2.934 3.928) 7.637 24.926 ( -5.363 -6.028 -0.573) 8.088 30.115 ( -0.346 -0.122 4.854) 4.867 30.259 ( -1.398 -2.001 4.505) 5.124 30.326 ( 0.750 0.155 -3.320) 3.407 30.435 ( 0.695 -0.627 -1.956) 2.169 34.837 ( 5.348 -6.574 -9.602) 12.807 34.970 ( 10.210 -2.136 -6.359) 12.217 36.113 ( -17.040 -32.632 16.901) 40.508 36.535 ( 14.092 -23.534 25.243) 37.278 37.582 ( 2.810 -9.553 6.001) 11.626 37.662 ( -3.113 -6.121 -7.888) 10.458 38.071 ( -3.927 1.675 4.239) 6.016 38.169 ( -1.608 5.709 3.941) 7.121 41.016 ( -11.138 -2.331 -1.396) 11.465 41.739 ( 2.119 -5.002 -37.321) 37.714 42.108 ( -18.916 -5.548 -0.769) 19.728 42.467 ( -2.240 -6.236 7.781) 10.221 43.113 ( 23.240 -14.231 -0.078) 27.251 43.226 ( 12.859 -14.240 -8.567) 21.012 45.389 ( -23.567 -30.701 16.566) 42.099 46.095 ( -8.605 -24.396 -2.920) 26.033 ======================= Grid point 130 (48/126) ======================= q-point: (-0.17 0.06 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( -24.077 22.448 14.043) 35.789 1.522 ( -24.806 29.887 26.471) 47.003 2.388 ( -39.283 39.281 41.297) 69.221 2.865 ( -6.256 27.133 -16.329) 32.280 3.368 ( 9.139 19.981 -17.430) 28.046 3.730 ( 0.073 19.371 13.135) 23.404 4.025 ( 9.921 16.562 1.009) 19.333 4.235 ( 8.535 11.521 -14.936) 20.704 4.527 ( -5.733 21.382 -3.908) 22.479 4.654 ( -4.786 14.288 -3.120) 15.388 4.777 ( 9.700 11.573 8.622) 17.388 4.852 ( -1.549 4.277 11.828) 12.672 5.020 ( 8.929 7.225 2.223) 11.699 5.166 ( 12.904 8.016 22.725) 27.335 5.321 ( 0.741 16.175 6.057) 17.288 5.442 ( 9.892 8.831 6.617) 14.820 5.757 ( 4.737 12.061 -2.208) 13.145 5.977 ( -1.844 8.639 -0.396) 8.843 6.111 ( -2.856 14.451 -2.668) 14.970 6.255 ( 10.328 3.777 5.881) 12.470 6.726 ( -23.746 4.562 -49.535) 55.122 6.759 ( -1.114 1.545 -7.300) 7.544 6.919 ( -13.734 -2.276 -6.664) 15.434 7.249 ( 5.129 0.834 -12.726) 13.746 7.501 ( 20.122 -11.184 -2.392) 23.145 7.608 ( 4.483 4.732 -1.144) 6.618 7.845 ( 0.090 -1.153 -3.648) 3.827 8.043 ( -0.323 4.993 2.236) 5.480 8.121 ( 4.960 9.168 -2.067) 10.627 8.215 ( 7.414 4.793 2.920) 9.298 8.325 ( 0.135 4.555 2.139) 5.034 8.484 ( 5.549 3.897 -4.123) 7.936 8.517 ( -0.147 6.826 5.849) 8.990 8.625 ( 7.917 8.669 4.401) 12.538 8.817 ( 19.813 1.009 -5.160) 20.499 9.039 ( 15.229 0.108 14.918) 21.318 9.278 ( 0.535 3.268 4.476) 5.568 9.378 ( 11.456 0.616 -5.725) 12.822 9.498 ( -6.461 -0.290 -4.608) 7.941 9.814 ( -8.983 -4.790 4.115) 10.981 9.911 ( 4.906 -4.866 -2.891) 7.491 10.237 ( 1.235 -2.102 -0.947) 2.616 10.428 ( -18.493 -0.438 -8.035) 20.168 10.438 ( -10.020 0.898 4.211) 10.906 10.588 ( -5.343 -0.400 6.053) 8.084 10.725 ( -5.308 6.691 5.478) 10.147 10.844 ( -0.193 3.879 4.014) 5.586 10.941 ( -5.119 2.641 2.021) 6.104 11.009 ( -9.038 6.602 1.825) 11.340 11.194 ( -19.367 -0.007 -8.057) 20.976 11.572 ( -12.399 -3.020 6.466) 14.306 11.778 ( 4.886 -8.734 -8.316) 13.012 11.934 ( -2.302 -2.600 0.166) 3.477 12.096 ( 0.926 -1.702 -5.136) 5.489 12.224 ( -1.188 4.713 4.036) 6.318 12.439 ( 0.692 5.292 -4.299) 6.853 12.502 ( 3.738 2.183 -3.541) 5.593 12.921 ( -12.051 13.300 -6.125) 18.964 13.191 ( 21.317 -2.220 -1.403) 21.478 13.611 ( -8.837 -19.276 32.818) 39.073 14.261 ( -0.011 -6.214 18.634) 19.643 14.340 ( 0.948 -4.657 5.482) 7.255 14.581 ( 0.694 -2.248 -0.831) 2.496 14.662 ( 1.246 0.837 1.019) 1.814 15.583 ( -0.174 -4.201 -4.369) 6.063 15.765 ( 13.261 -0.416 5.664) 14.426 15.958 ( -8.400 -5.573 -10.463) 14.529 16.059 ( -0.568 -0.083 -7.732) 7.753 17.660 ( -7.889 -2.514 6.135) 10.305 17.886 ( 5.065 -0.315 -9.302) 10.596 18.277 ( 7.283 4.613 0.142) 8.622 18.329 ( 2.423 5.324 1.871) 6.141 19.278 ( -0.086 7.086 1.495) 7.242 19.461 ( 3.551 -0.889 -3.156) 4.833 19.684 ( 0.655 2.531 1.641) 3.087 19.916 ( 5.639 9.992 -4.904) 12.478 20.234 ( 0.830 10.525 0.171) 10.559 20.248 ( -0.289 8.762 0.799) 8.803 20.267 ( -0.425 10.226 0.737) 10.261 20.447 ( -0.015 3.207 -2.903) 4.326 20.510 ( 2.135 1.068 0.316) 2.408 20.537 ( -0.399 2.796 -2.104) 3.522 20.586 ( -1.703 0.352 1.604) 2.366 21.009 ( 19.071 40.290 -21.995) 49.707 24.302 ( 5.401 0.036 -0.560) 5.430 24.444 ( -4.603 -2.408 3.442) 6.231 24.569 ( 0.566 -1.255 -3.648) 3.899 24.764 ( -11.954 -3.594 1.103) 12.531 30.126 ( -0.857 -0.154 4.744) 4.824 30.236 ( -3.475 -3.324 3.274) 5.817 30.327 ( 0.944 0.378 -3.937) 4.066 30.432 ( 0.211 -0.643 -2.894) 2.972 34.921 ( 8.455 -10.589 -10.428) 17.098 35.155 ( 10.282 -3.276 2.125) 10.998 35.678 ( -36.165 -37.952 0.055) 52.424 36.597 ( -16.491 -13.290 -18.309) 27.996 37.569 ( -0.872 -6.932 -1.250) 7.098 37.742 ( 6.265 -13.191 6.391) 15.940 37.986 ( -3.485 0.908 -1.126) 3.773 38.303 ( -0.723 -12.157 20.794) 24.098 40.913 ( -2.956 -1.797 8.558) 9.231 41.733 ( 8.842 -6.104 3.978) 11.457 41.876 ( 8.881 -6.586 17.625) 20.806 42.462 ( -1.168 -5.719 9.096) 10.808 43.067 ( 1.958 -14.952 -19.036) 24.285 43.881 ( 33.539 -11.968 4.307) 35.870 44.937 ( -35.639 -29.130 22.753) 51.346 45.800 ( -21.419 -27.481 -3.620) 35.030 ======================= Grid point 131 (49/126) ======================= q-point: ( 0.00 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( 13.804 35.692 30.214) 48.759 2.109 ( 1.281 26.961 44.776) 52.283 3.143 ( 1.208 49.563 6.720) 50.031 3.414 ( -2.557 38.172 3.224) 38.394 3.709 ( -3.232 23.499 -36.934) 43.895 4.249 ( -6.560 23.948 8.520) 26.251 4.491 ( -8.351 19.084 -2.513) 20.983 4.566 ( 4.628 19.640 4.337) 20.639 4.951 ( -1.753 6.245 16.714) 17.928 5.051 ( 5.995 32.208 -3.257) 32.922 5.123 ( 0.988 29.502 -1.145) 29.541 5.178 ( -3.156 14.017 -1.955) 14.500 5.290 ( -5.528 16.800 3.550) 18.039 5.511 ( 4.639 9.386 4.103) 11.245 5.655 ( -12.998 15.804 -1.966) 20.557 5.813 ( -1.646 20.584 12.040) 23.903 6.032 ( 0.604 16.960 0.293) 16.974 6.125 ( -8.044 12.660 -25.353) 29.458 6.273 ( 7.026 16.151 1.287) 17.660 6.564 ( 2.909 18.499 2.098) 18.843 6.737 ( 9.687 6.439 -13.432) 17.769 6.765 ( 4.675 6.110 -5.625) 9.530 6.832 ( 3.617 5.150 -4.447) 7.706 7.264 ( -5.354 0.995 -19.860) 20.593 7.448 ( -9.431 -6.036 -7.951) 13.732 7.684 ( 14.999 -1.834 -8.733) 17.453 7.912 ( 8.218 5.533 6.396) 11.792 8.031 ( -15.882 -2.156 6.209) 17.188 8.155 ( 3.697 -0.845 13.960) 14.465 8.462 ( 3.770 7.769 6.029) 10.532 8.575 ( -0.177 13.924 4.081) 14.511 8.665 ( 2.323 14.170 2.754) 14.621 8.759 ( 2.468 10.598 -3.743) 11.508 8.920 ( -0.475 10.835 -2.475) 11.124 9.167 ( -9.270 3.252 -2.431) 10.120 9.187 ( -3.566 0.563 -10.847) 11.432 9.290 ( -0.031 8.724 9.191) 12.672 9.439 ( 7.557 5.175 -9.542) 13.226 9.572 ( -10.118 -3.537 -5.901) 12.236 9.668 ( -0.436 -1.348 7.761) 7.889 9.863 ( 19.685 -3.458 -4.875) 20.572 9.953 ( -4.178 -1.701 -3.314) 5.598 10.259 ( -2.376 -6.455 3.126) 7.555 10.304 ( -3.190 -3.500 3.640) 5.972 10.580 ( 5.410 3.175 4.583) 7.768 10.752 ( -2.217 0.419 10.569) 10.807 10.824 ( -0.213 4.497 -5.847) 7.380 10.966 ( 0.756 0.677 -3.330) 3.481 11.216 ( -4.224 6.697 3.049) 8.484 11.258 ( 2.219 17.387 -0.621) 17.539 11.438 ( -1.138 1.412 4.820) 5.150 11.632 ( 3.904 -0.978 -5.094) 6.492 11.977 ( 9.782 -4.662 -4.113) 11.591 12.160 ( 3.581 -1.279 -3.572) 5.217 12.289 ( -5.930 3.508 5.066) 8.552 12.511 ( 0.746 1.018 -5.651) 5.791 12.748 ( -4.664 6.306 6.570) 10.231 12.879 ( -10.677 -2.553 8.990) 14.190 13.078 ( -8.949 0.646 8.097) 12.086 13.466 ( 12.594 -4.836 -2.473) 13.715 14.147 ( -0.812 -2.615 8.045) 8.498 14.350 ( -3.430 -8.530 5.992) 10.974 14.539 ( 7.089 -4.961 5.017) 10.002 14.611 ( -1.395 -4.818 3.312) 6.011 15.480 ( -1.544 -2.884 -2.878) 4.357 15.642 ( -7.551 -1.264 -10.840) 13.271 15.864 ( 2.232 -3.676 1.794) 4.659 16.119 ( 8.121 -2.724 -4.339) 9.602 17.597 ( -3.280 2.554 5.541) 6.927 17.935 ( 6.732 -1.386 -9.202) 11.485 18.289 ( -5.500 -4.473 5.554) 9.006 18.395 ( 1.979 -2.270 -0.327) 3.029 19.475 ( -1.960 11.950 2.270) 12.321 19.624 ( 3.121 7.843 -3.842) 9.274 19.874 ( -0.609 12.083 6.868) 13.912 20.176 ( 1.947 8.413 -5.287) 10.126 20.374 ( -0.771 3.091 2.036) 3.781 20.408 ( -0.106 1.982 0.049) 1.985 20.467 ( -0.273 3.382 0.009) 3.393 20.510 ( 0.939 3.319 -1.284) 3.681 20.617 ( 1.034 13.981 0.359) 14.024 20.653 ( -0.691 11.993 -0.536) 12.025 20.733 ( 2.555 16.255 6.326) 17.629 21.589 ( -3.041 17.381 -35.474) 39.620 24.297 ( -1.758 -3.306 1.329) 3.973 24.403 ( 4.057 -2.480 -2.896) 5.567 24.515 ( -7.816 -1.449 -0.501) 7.965 24.581 ( 3.950 -2.035 -1.503) 4.691 30.110 ( -2.969 0.046 4.125) 5.083 30.160 ( -1.100 -0.379 6.075) 6.185 30.327 ( 1.203 -0.227 -4.384) 4.552 30.400 ( 0.113 -1.111 -3.645) 3.812 34.377 ( -20.208 -6.445 15.816) 26.458 34.979 ( 8.444 -12.364 -3.252) 15.321 35.324 ( 7.019 -10.096 0.131) 12.297 35.993 ( -14.824 -7.090 -21.662) 27.189 37.419 ( -0.326 -9.737 5.534) 11.205 37.629 ( 3.748 -10.733 -0.970) 11.410 37.911 ( -8.782 -12.131 9.091) 17.519 37.923 ( 4.990 -5.462 0.129) 7.399 40.919 ( 3.523 -3.426 12.719) 13.636 41.514 ( -1.208 -7.766 -9.183) 12.087 42.132 ( 8.112 -15.974 14.494) 23.044 42.487 ( 24.633 -28.333 26.116) 45.734 42.923 ( 25.305 -18.780 -3.393) 31.694 43.726 ( -18.369 -27.342 -7.630) 33.811 43.932 ( -29.989 -21.963 21.386) 42.885 44.827 ( 8.780 -36.065 -13.330) 39.439 ======================= Grid point 132 (50/126) ======================= q-point: ( 0.17 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( 4.573 30.530 28.152) 41.780 2.531 ( 16.284 32.073 29.192) 46.325 3.195 ( -6.363 26.068 -31.367) 41.279 3.426 ( 5.440 24.272 -23.017) 33.890 3.742 ( 16.884 32.589 29.188) 46.894 4.003 ( -12.269 26.736 10.525) 31.243 4.371 ( -7.590 26.806 8.521) 29.134 4.543 ( -15.981 14.908 8.753) 23.542 4.878 ( -20.426 5.405 -2.940) 21.333 4.965 ( 3.238 15.688 4.632) 16.675 5.082 ( -0.307 30.312 -2.266) 30.398 5.194 ( -4.265 31.824 -6.077) 32.678 5.247 ( 8.024 26.505 -2.350) 27.792 5.537 ( -0.735 6.605 8.928) 11.130 5.681 ( 6.091 15.555 15.297) 22.651 5.816 ( 1.756 18.877 -0.078) 18.959 5.847 ( -3.245 13.542 -7.047) 15.607 6.178 ( 4.977 15.511 -2.535) 16.486 6.373 ( 0.192 21.680 -0.253) 21.683 6.566 ( 2.068 19.249 -4.419) 19.858 6.769 ( -5.024 4.783 -14.598) 16.163 6.860 ( 0.984 5.197 -9.050) 10.482 6.910 ( -7.208 9.254 -7.647) 14.002 6.985 ( 11.579 0.182 -14.024) 18.187 7.377 ( 2.176 -4.695 -7.643) 9.230 7.730 ( -3.427 -1.479 -13.080) 13.602 7.871 ( -3.196 2.988 7.394) 8.592 8.067 ( -1.201 9.431 1.655) 9.650 8.235 ( -11.078 -3.030 7.833) 13.902 8.373 ( -7.071 9.057 5.820) 12.881 8.578 ( -2.055 13.500 3.387) 14.069 8.666 ( -10.918 9.460 -5.635) 15.506 8.758 ( -1.879 17.111 -3.512) 17.569 8.811 ( 2.435 9.182 -1.104) 9.563 8.923 ( -0.286 5.307 3.577) 6.407 9.156 ( 5.056 -0.994 10.746) 11.917 9.340 ( -8.271 6.318 -8.356) 13.348 9.471 ( 0.219 0.502 3.043) 3.092 9.491 ( 1.951 2.669 -7.259) 7.977 9.783 ( -0.682 -1.378 -4.773) 5.014 9.847 ( 10.572 -2.253 5.728) 12.233 10.084 ( 5.400 -4.704 -3.602) 8.017 10.225 ( -1.731 -2.479 1.964) 3.605 10.512 ( 14.676 -3.854 5.534) 16.151 10.669 ( 3.907 3.560 -1.213) 5.423 10.869 ( 10.143 3.850 -1.316) 10.929 10.900 ( 4.216 1.298 0.465) 4.436 11.087 ( 8.736 1.103 7.192) 11.369 11.132 ( 2.146 0.261 -2.758) 3.505 11.323 ( 8.557 10.775 -0.477) 13.768 11.512 ( 5.344 -0.564 1.140) 5.493 11.678 ( 2.117 -1.671 -6.287) 6.841 12.019 ( -8.511 -2.561 -0.712) 8.917 12.117 ( -5.992 -0.346 -0.894) 6.068 12.255 ( 1.128 -2.997 -2.148) 3.855 12.375 ( -18.664 3.041 8.208) 20.615 12.513 ( 2.409 1.919 -3.180) 4.427 12.923 ( -7.504 3.867 3.141) 9.007 13.038 ( 6.196 7.796 3.864) 10.682 13.569 ( -4.414 -18.359 6.872) 20.094 14.171 ( -1.631 1.795 10.551) 10.826 14.275 ( -4.281 -7.323 2.272) 8.782 14.585 ( 1.003 -4.003 -0.576) 4.167 14.761 ( 8.409 -8.703 4.728) 12.992 15.404 ( -4.793 1.250 -2.157) 5.403 15.547 ( 0.659 0.161 -4.657) 4.707 15.884 ( 1.460 -4.284 -3.334) 5.621 16.230 ( 5.390 -6.524 -4.876) 9.767 17.608 ( 2.545 2.380 3.226) 4.748 18.020 ( 6.782 -1.737 -8.052) 10.670 18.185 ( -7.960 -3.787 4.303) 9.809 18.371 ( -5.039 -2.055 1.615) 5.677 19.451 ( -1.314 12.071 0.982) 12.182 19.644 ( 0.624 7.671 -2.714) 8.161 19.846 ( -5.320 11.756 6.524) 14.459 20.125 ( -4.547 9.030 -5.191) 11.365 20.359 ( -1.188 2.695 1.175) 3.171 20.414 ( 0.274 2.010 0.117) 2.032 20.455 ( -0.991 4.317 0.396) 4.447 20.517 ( 0.276 4.266 -1.053) 4.403 20.617 ( -0.136 10.669 -0.527) 10.683 20.635 ( -0.990 13.889 -0.841) 13.949 20.839 ( 3.597 18.004 7.627) 19.881 21.309 ( -7.223 24.740 -26.065) 36.656 24.284 ( 0.316 -1.889 0.013) 1.916 24.366 ( -5.820 -0.377 2.003) 6.167 24.512 ( 7.164 -4.841 -3.189) 9.215 24.659 ( 3.540 -4.177 1.118) 5.588 30.084 ( -1.717 0.741 4.164) 4.564 30.184 ( 0.231 -0.491 5.777) 5.803 30.330 ( 1.059 -0.596 -3.540) 3.743 30.389 ( 0.679 -0.855 -3.554) 3.718 34.261 ( 1.028 -1.176 6.596) 6.778 35.146 ( 7.635 -14.528 6.949) 17.822 35.292 ( -9.934 -10.803 -2.782) 14.938 35.777 ( 1.289 -6.918 -7.761) 10.476 37.399 ( -3.696 -11.386 4.065) 12.642 37.698 ( 3.706 -10.368 -3.121) 11.445 37.802 ( -3.387 -9.160 2.447) 10.068 38.130 ( 12.393 -5.630 4.591) 14.365 41.117 ( 11.365 -4.985 15.644) 19.969 41.508 ( 6.038 -7.139 -13.650) 16.545 42.190 ( -0.818 -12.843 5.434) 13.969 42.727 ( 2.439 -22.229 -16.868) 28.011 42.986 ( -40.803 -24.209 -19.195) 51.180 43.463 ( -29.354 -21.078 26.938) 45.073 43.851 ( 43.285 -51.203 26.926) 72.252 45.131 ( 22.674 -32.390 -9.778) 40.729 ======================= Grid point 133 (51/126) ======================= q-point: ( 0.33 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( 22.011 19.997 12.468) 32.246 2.819 ( 5.745 32.737 -4.937) 33.602 3.072 ( 9.594 25.178 5.978) 27.599 3.469 ( -14.095 26.314 1.346) 29.881 3.543 ( 2.176 24.758 -11.572) 27.415 4.044 ( -29.715 15.776 9.458) 34.947 4.238 ( -10.834 27.019 6.845) 29.904 4.525 ( 3.846 7.333 20.205) 21.836 4.531 ( -5.284 11.770 -1.251) 12.963 4.975 ( -6.930 21.777 5.921) 23.608 5.060 ( 0.202 27.771 3.990) 28.057 5.281 ( 6.468 19.490 8.203) 22.113 5.377 ( 6.985 23.478 -9.910) 26.424 5.569 ( 11.032 20.397 5.842) 23.914 5.740 ( -4.346 19.893 0.768) 20.377 5.782 ( -4.083 16.194 -1.072) 16.735 6.040 ( 10.059 14.602 3.979) 18.172 6.146 ( -4.736 11.584 -3.378) 12.962 6.328 ( 1.317 16.518 -4.304) 17.121 6.477 ( -9.568 13.116 -2.236) 16.388 6.616 ( -10.465 9.741 -13.628) 19.751 6.741 ( 5.335 13.980 -0.385) 14.969 6.919 ( 5.587 26.718 -3.331) 27.498 7.038 ( 1.864 2.110 -9.813) 10.209 7.500 ( 13.468 1.272 -6.702) 15.097 7.584 ( 0.269 0.229 -11.868) 11.873 7.861 ( -0.469 -0.718 0.115) 0.865 7.973 ( -1.914 5.236 5.181) 7.611 8.184 ( -12.110 13.109 3.006) 18.097 8.188 ( -3.418 5.712 2.951) 7.281 8.444 ( -11.937 3.975 -9.321) 15.658 8.545 ( -3.758 12.953 2.412) 13.701 8.635 ( -7.312 16.709 -1.899) 18.338 8.819 ( 0.735 6.827 0.016) 6.867 9.068 ( 3.524 10.169 -5.842) 12.245 9.109 ( -6.955 7.788 -5.811) 11.950 9.266 ( 2.150 1.430 -2.887) 3.873 9.460 ( -2.792 -4.440 3.787) 6.469 9.580 ( 7.819 0.721 6.234) 10.027 9.805 ( 2.486 -0.350 -3.838) 4.586 10.051 ( 2.325 -5.987 4.459) 7.819 10.090 ( 1.001 0.140 4.680) 4.788 10.236 ( 4.420 -2.361 -5.837) 7.693 10.683 ( 1.039 6.663 10.393) 12.389 10.789 ( 10.804 -2.700 -8.526) 14.025 10.984 ( 0.755 1.458 5.121) 5.378 11.000 ( -0.575 8.301 4.208) 9.324 11.096 ( 7.265 -1.079 -3.735) 8.240 11.341 ( 8.900 1.182 3.349) 9.582 11.558 ( 2.407 -6.786 4.826) 8.668 11.591 ( 3.228 -5.278 -3.631) 7.174 11.673 ( 1.261 -2.186 -9.272) 9.609 11.816 ( 6.325 0.372 2.055) 6.660 12.035 ( -3.070 -0.324 -1.271) 3.339 12.210 ( -7.901 0.334 0.928) 7.962 12.298 ( 5.239 -2.393 1.058) 5.856 12.586 ( 6.205 0.099 -0.109) 6.207 12.773 ( -9.218 5.851 0.561) 10.933 13.097 ( -3.427 1.407 6.384) 7.381 13.402 ( -13.586 -20.767 0.407) 24.819 14.188 ( -1.621 6.026 11.338) 12.942 14.231 ( -2.227 -3.645 5.603) 7.046 14.644 ( 5.037 -1.803 -5.314) 7.541 14.831 ( -1.495 -5.700 0.101) 5.894 15.340 ( -2.067 4.930 2.894) 6.079 15.555 ( 0.664 2.529 1.189) 2.873 15.920 ( 5.488 -6.010 -8.159) 11.524 16.250 ( -0.122 -9.063 -6.594) 11.209 17.716 ( 8.009 0.758 0.964) 8.102 18.020 ( -7.990 -2.629 2.520) 8.780 18.137 ( 6.128 -1.710 -6.201) 8.884 18.241 ( -10.028 -0.539 3.326) 10.579 19.444 ( 0.306 11.708 0.332) 11.716 19.603 ( -4.229 10.764 -1.178) 11.625 19.798 ( -1.437 10.126 3.841) 10.925 20.001 ( -5.580 8.940 -3.622) 11.143 20.352 ( 0.063 2.105 0.423) 2.148 20.408 ( -1.080 2.800 0.267) 3.013 20.447 ( 0.167 5.642 0.338) 5.655 20.515 ( 0.115 4.217 -0.825) 4.299 20.611 ( -0.564 14.518 -1.728) 14.631 20.619 ( 0.547 8.629 -1.588) 8.791 20.916 ( 1.233 19.224 5.829) 20.126 21.145 ( -1.572 25.497 -11.434) 27.987 24.299 ( -1.417 -0.653 3.003) 3.384 24.314 ( 1.338 -0.993 -1.361) 2.152 24.614 ( 2.534 -6.226 2.451) 7.155 24.717 ( 3.836 -7.182 -1.332) 8.251 30.085 ( -0.527 0.602 4.080) 4.158 30.213 ( -0.110 -0.894 5.532) 5.605 30.328 ( 0.560 -1.023 -3.553) 3.740 30.394 ( 1.385 -0.799 -2.385) 2.871 34.399 ( 10.813 -4.225 -1.012) 11.653 35.018 ( -12.312 -8.200 -1.642) 14.883 35.391 ( 10.351 -16.790 11.246) 22.705 35.818 ( 0.826 -16.853 5.393) 17.714 37.355 ( -2.430 -11.920 2.213) 12.365 37.663 ( -2.368 -8.127 -6.303) 10.554 37.856 ( 4.434 -9.938 3.610) 11.466 38.325 ( 5.319 -5.180 3.454) 8.188 41.445 ( 12.677 -7.341 11.884) 18.863 41.584 ( 10.268 -7.063 -20.356) 23.868 42.045 ( -22.924 -19.230 -15.766) 33.821 42.265 ( -6.353 -10.573 0.228) 12.337 42.689 ( -9.416 -16.088 -10.545) 21.417 43.086 ( -17.078 -19.304 6.005) 26.464 44.549 ( 17.635 -54.903 27.914) 64.067 45.433 ( 14.678 -33.541 -9.471) 37.817 ======================= Grid point 134 (52/126) ======================= q-point: (-0.50 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( -29.395 23.890 8.984) 38.930 3.012 ( 15.986 20.218 -6.011) 26.466 3.121 ( 13.203 18.951 13.208) 26.607 3.265 ( -7.035 22.118 0.422) 23.214 3.625 ( 7.784 21.051 12.060) 25.479 3.838 ( 13.142 24.935 -8.053) 29.314 4.095 ( -4.925 22.887 7.708) 24.647 4.340 ( -2.981 11.515 -14.330) 18.624 4.556 ( -12.966 15.166 16.794) 26.081 4.937 ( -4.329 21.908 5.801) 23.073 4.997 ( -15.023 20.716 4.442) 25.973 5.292 ( -1.211 17.516 2.020) 17.674 5.355 ( 2.488 20.502 -1.399) 20.699 5.653 ( -8.209 24.340 -12.774) 28.688 5.723 ( -1.879 22.409 1.720) 22.554 5.785 ( -7.528 16.791 -2.965) 18.639 5.904 ( -7.659 20.876 -7.426) 23.444 6.134 ( 16.874 17.888 8.431) 25.996 6.362 ( 0.845 12.161 -4.943) 13.154 6.507 ( 1.335 18.942 7.591) 20.451 6.547 ( 4.500 14.526 1.566) 15.287 6.958 ( 12.487 7.011 12.501) 19.010 7.060 ( 8.804 1.799 2.129) 9.234 7.152 ( 18.655 21.795 -13.003) 31.498 7.619 ( 7.519 0.873 -0.121) 7.570 7.717 ( 2.604 3.236 -11.125) 11.875 7.825 ( -2.337 1.451 1.343) 3.061 7.955 ( 2.545 15.829 -2.784) 16.272 7.964 ( -5.080 5.942 -10.184) 12.839 8.160 ( -2.955 1.037 2.036) 3.736 8.288 ( 1.433 8.247 -5.746) 10.153 8.476 ( -8.174 5.930 -7.090) 12.339 8.497 ( -2.149 13.132 1.951) 13.449 8.785 ( -2.995 8.967 -6.088) 11.244 8.893 ( -5.100 9.823 -1.962) 11.240 9.127 ( -0.624 16.034 -2.997) 16.324 9.357 ( 4.157 3.826 -1.798) 5.928 9.398 ( -5.884 -3.290 10.263) 12.280 9.608 ( -5.501 -1.792 -3.500) 6.762 9.740 ( 1.834 -0.602 -13.185) 13.326 10.011 ( -6.008 -5.146 3.758) 8.758 10.226 ( 3.659 -0.176 -7.511) 8.357 10.341 ( 8.581 -1.670 13.939) 16.453 10.717 ( -2.975 8.285 10.474) 13.682 10.871 ( 0.570 0.179 -6.132) 6.161 10.926 ( -6.589 3.441 9.370) 11.961 11.048 ( 3.327 8.223 -1.264) 8.960 11.131 ( -1.134 5.417 -1.418) 5.713 11.412 ( -6.092 0.594 4.876) 7.826 11.526 ( -4.043 -13.790 -3.487) 14.787 11.589 ( 0.797 -8.949 5.936) 10.768 11.779 ( 11.046 -6.210 -7.139) 14.544 11.947 ( -7.708 -3.920 -0.341) 8.654 12.048 ( 6.288 3.768 0.023) 7.330 12.145 ( 6.085 -0.972 -2.405) 6.615 12.378 ( 0.367 -9.522 -5.835) 11.173 12.668 ( 2.932 7.358 2.155) 8.209 12.749 ( 5.992 -6.563 13.781) 16.398 13.009 ( -6.452 2.040 1.974) 7.049 13.175 ( -6.810 -17.453 -5.298) 19.469 14.189 ( -3.736 4.363 8.683) 10.411 14.266 ( 0.536 1.708 11.141) 11.284 14.638 ( -2.648 -0.173 -7.948) 8.379 14.769 ( -2.397 -0.244 -4.738) 5.315 15.370 ( 2.899 5.368 8.147) 10.178 15.595 ( 2.384 2.037 2.703) 4.139 15.968 ( 3.415 -5.401 -9.933) 11.811 16.182 ( -2.936 -10.229 -8.215) 13.444 17.871 ( -2.460 -1.168 0.557) 2.779 17.897 ( 4.813 -0.821 0.273) 4.890 18.069 ( -9.146 0.511 2.658) 9.538 18.234 ( 6.118 -1.531 -2.932) 6.955 19.461 ( 1.023 11.166 1.037) 11.260 19.524 ( -2.690 12.591 -1.242) 12.935 19.810 ( -0.341 9.363 2.398) 9.671 19.930 ( 0.501 7.646 -2.349) 8.015 20.363 ( 0.682 2.080 0.358) 2.218 20.391 ( -0.526 3.040 0.443) 3.117 20.455 ( 0.350 7.828 -0.306) 7.842 20.515 ( -0.007 1.519 -0.020) 1.519 20.602 ( 0.578 12.343 -2.656) 12.639 20.620 ( 0.298 10.346 -1.317) 10.434 20.901 ( -5.103 20.178 3.483) 21.103 21.171 ( 8.983 24.684 -6.085) 26.964 24.274 ( -2.108 -0.367 2.190) 3.062 24.363 ( 3.575 -1.533 -1.122) 4.049 24.608 ( -4.010 -5.081 4.698) 7.997 24.780 ( 2.846 -9.651 -2.371) 10.337 30.098 ( -0.250 0.275 4.323) 4.339 30.228 ( -1.072 -1.320 5.247) 5.516 30.321 ( 0.665 -0.887 -3.607) 3.773 30.409 ( 1.160 -1.037 -1.844) 2.413 34.590 ( 9.916 -6.704 -1.863) 12.114 34.845 ( -4.084 -7.299 -5.605) 10.068 35.587 ( -2.175 -23.161 22.362) 32.269 35.860 ( 4.967 -21.320 5.049) 22.465 37.341 ( -0.086 -10.798 2.572) 11.100 37.596 ( -1.395 -7.872 -8.050) 11.346 37.945 ( 2.492 -8.780 7.366) 11.729 38.324 ( -5.304 -4.627 -2.667) 7.527 41.246 ( -19.665 -7.179 -12.474) 24.369 41.654 ( 9.068 -7.736 -29.352) 31.680 42.185 ( 25.974 -12.255 9.409) 30.222 42.220 ( -5.084 -13.631 8.181) 16.690 42.392 ( -14.487 -11.243 1.973) 18.444 42.900 ( -4.730 -22.496 -10.877) 25.431 44.779 ( -4.101 -46.868 24.483) 53.036 45.551 ( 2.782 -36.033 -9.180) 37.288 ======================= Grid point 135 (53/126) ======================= q-point: (-0.33 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( -36.382 24.498 -5.380) 44.190 2.481 ( -36.219 22.726 19.592) 47.033 3.530 ( 15.243 30.927 0.423) 34.482 3.568 ( -1.567 31.709 4.996) 32.139 3.860 ( 10.889 28.297 -11.408) 32.395 4.085 ( -3.894 20.143 9.979) 22.815 4.176 ( 28.061 9.851 14.039) 32.887 4.281 ( 7.308 14.357 -15.131) 22.101 4.497 ( 6.715 15.974 6.476) 18.499 4.756 ( -5.989 25.963 6.623) 27.456 4.961 ( 2.515 13.912 17.401) 22.420 5.236 ( -8.402 9.669 -1.678) 12.919 5.350 ( -3.789 20.055 -0.401) 20.414 5.452 ( -4.470 37.395 -8.010) 38.504 5.637 ( -0.123 18.835 12.195) 22.438 5.769 ( -2.135 24.510 -0.724) 24.613 5.928 ( 9.364 20.029 -0.781) 22.124 6.232 ( -0.985 13.955 -2.268) 14.172 6.452 ( -5.532 21.193 5.421) 22.564 6.514 ( 4.925 13.160 -3.659) 14.520 6.697 ( 10.110 6.736 -0.312) 12.152 7.102 ( 4.419 -0.653 -9.301) 10.318 7.111 ( -2.460 -0.002 -8.209) 8.569 7.355 ( -0.463 10.890 3.291) 11.386 7.505 ( -13.167 6.250 -38.229) 40.913 7.605 ( -4.068 6.676 1.149) 7.902 7.922 ( 1.513 3.846 0.932) 4.237 8.014 ( 17.774 2.342 3.809) 18.328 8.102 ( 4.231 4.847 -2.019) 6.743 8.242 ( 10.966 10.946 1.684) 15.586 8.273 ( 5.056 4.551 4.711) 8.275 8.465 ( 9.715 6.111 -0.183) 11.479 8.529 ( 8.695 11.001 -2.374) 14.222 8.720 ( 1.187 8.770 -7.254) 11.443 8.870 ( -2.143 12.326 2.915) 12.846 8.983 ( -9.227 15.937 3.239) 18.698 9.329 ( 0.845 2.590 2.752) 3.873 9.437 ( 1.314 6.493 -4.675) 8.109 9.549 ( -0.555 -3.953 -4.120) 5.737 9.747 ( 2.346 -3.065 -1.670) 4.206 9.875 ( -9.557 -3.061 2.494) 10.341 10.200 ( 0.043 -0.888 -6.576) 6.636 10.542 ( 4.408 -0.277 10.340) 11.243 10.661 ( -8.285 7.379 9.333) 14.498 10.739 ( -13.374 -5.159 -8.129) 16.479 10.874 ( -4.390 3.759 10.277) 11.791 11.039 ( -5.417 7.554 -2.356) 9.590 11.058 ( -5.094 3.354 0.544) 6.123 11.341 ( -0.338 6.957 -0.989) 7.035 11.363 ( -12.367 -10.738 1.732) 16.470 11.604 ( -1.552 -4.667 -0.358) 4.931 11.704 ( -8.303 -4.137 -4.173) 10.172 11.896 ( -1.423 -4.792 -0.886) 5.077 12.099 ( -7.090 -4.799 -1.680) 8.725 12.236 ( 11.783 5.729 2.264) 13.296 12.455 ( 9.040 -3.323 -4.299) 10.547 12.618 ( -6.813 2.145 -5.847) 9.231 12.978 ( 6.903 -14.652 19.297) 25.194 13.014 ( 8.216 1.422 -0.726) 8.370 13.159 ( 4.052 -3.219 -2.174) 5.613 14.159 ( -2.502 3.110 8.968) 9.816 14.286 ( -5.349 -2.565 9.877) 11.521 14.541 ( -3.159 -0.172 -2.011) 3.749 14.713 ( -1.029 0.639 -7.440) 7.538 15.493 ( 3.641 1.835 10.247) 11.029 15.642 ( 3.334 1.279 -1.826) 4.011 15.953 ( -0.665 -3.928 -5.505) 6.795 16.082 ( -2.766 -8.121 -11.638) 14.459 17.764 ( -6.065 0.162 1.284) 6.201 17.903 ( -4.729 -0.091 0.339) 4.742 18.118 ( 11.000 -1.230 -2.055) 11.258 18.316 ( 3.000 -2.165 1.098) 3.859 19.483 ( 0.571 12.871 2.256) 13.080 19.512 ( 2.216 11.282 -2.761) 11.825 19.801 ( -0.912 9.330 2.933) 9.822 19.996 ( 6.736 7.506 -2.969) 10.513 20.364 ( -0.317 2.437 0.348) 2.482 20.407 ( 1.273 2.752 1.016) 3.198 20.455 ( 0.149 9.570 -0.859) 9.610 20.512 ( -0.344 -1.471 -0.006) 1.511 20.598 ( 0.190 9.778 -2.708) 10.148 20.624 ( 0.992 13.911 -1.246) 14.001 20.812 ( -5.587 17.977 2.983) 19.060 21.375 ( 16.347 24.654 -8.740) 30.845 24.256 ( -0.104 -0.130 0.782) 0.800 24.411 ( 0.704 -2.678 1.429) 3.116 24.549 ( -2.806 -3.554 0.731) 4.587 24.772 ( -3.245 -8.672 -0.357) 9.266 30.113 ( -0.446 -0.033 4.455) 4.478 30.219 ( -2.403 -1.807 4.482) 5.397 30.321 ( 1.087 -0.570 -3.239) 3.464 30.416 ( 0.672 -1.192 -2.201) 2.592 34.688 ( 3.018 -7.894 -5.600) 10.139 34.861 ( 6.268 -8.857 0.683) 10.872 35.445 ( -18.680 -27.383 11.121) 34.964 36.088 ( 12.365 -22.424 8.985) 27.137 37.377 ( 1.967 -10.002 4.145) 11.004 37.535 ( -0.823 -7.228 -8.413) 11.122 38.011 ( -1.039 -7.788 12.961) 15.156 38.159 ( -9.054 -5.888 -4.696) 11.777 40.951 ( -9.636 -3.945 -0.616) 10.430 41.605 ( 1.472 -8.068 -29.771) 30.880 41.952 ( -16.906 -9.757 0.335) 19.523 42.289 ( -2.705 -11.245 5.665) 12.878 42.759 ( 4.783 -19.057 -10.296) 22.182 42.890 ( 30.252 -18.936 9.015) 36.811 44.673 ( -19.141 -38.422 24.312) 49.332 45.437 ( -10.787 -39.262 -9.853) 41.892 ======================= Grid point 136 (54/126) ======================= q-point: (-0.17 0.12 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( -10.050 34.942 12.685) 38.508 2.114 ( -18.639 29.736 33.128) 48.261 3.347 ( -24.045 50.580 18.334) 58.929 3.505 ( -4.311 33.048 -12.742) 35.681 3.862 ( 1.586 27.538 -23.805) 36.435 4.170 ( 9.368 21.587 2.882) 23.707 4.431 ( 10.568 20.245 1.434) 22.882 4.547 ( 0.993 19.976 0.178) 20.002 4.829 ( 5.604 7.921 5.722) 11.264 4.906 ( 24.189 10.921 6.499) 27.324 5.094 ( -1.754 16.870 12.246) 20.920 5.166 ( 3.641 8.395 7.635) 11.917 5.255 ( -3.839 32.885 -0.963) 33.122 5.455 ( 5.081 20.900 6.878) 22.581 5.694 ( 0.457 20.206 6.387) 21.196 5.788 ( 1.411 24.414 8.284) 25.820 6.013 ( -1.910 11.234 -2.498) 11.665 6.229 ( 1.907 16.288 -5.341) 17.247 6.407 ( 0.324 12.853 4.401) 13.590 6.461 ( -3.307 19.331 -7.629) 21.044 6.821 ( 2.140 4.805 -7.240) 8.949 6.858 ( -13.336 7.179 -26.654) 30.656 6.920 ( -14.516 4.942 -22.177) 26.962 7.245 ( 4.159 -1.345 -5.707) 7.189 7.397 ( 14.153 3.293 -4.116) 15.102 7.705 ( -2.259 3.783 -3.493) 5.623 7.829 ( -1.496 0.429 -3.056) 3.429 8.052 ( -0.237 -3.466 9.257) 9.887 8.264 ( -6.871 1.285 1.830) 7.225 8.309 ( 6.792 7.831 1.340) 10.452 8.530 ( 10.200 12.103 1.528) 15.901 8.582 ( 2.839 9.492 2.724) 10.275 8.746 ( 0.608 12.096 -0.118) 12.112 8.838 ( 6.969 12.125 1.535) 14.069 8.901 ( 20.960 9.760 -2.437) 23.249 9.108 ( 16.348 7.337 7.109) 19.278 9.366 ( 0.969 4.681 0.368) 4.794 9.411 ( -0.737 2.479 -8.906) 9.273 9.507 ( 2.512 2.673 -0.810) 3.756 9.711 ( -8.682 -4.247 6.026) 11.390 9.819 ( 4.034 -3.382 -3.201) 6.161 10.179 ( -9.108 -3.888 -5.075) 11.128 10.303 ( -16.117 -7.845 -4.343) 18.444 10.492 ( -11.273 0.109 2.953) 11.654 10.595 ( -7.686 1.173 6.446) 10.099 10.825 ( -7.361 2.332 11.425) 13.789 10.908 ( -5.535 5.124 -4.300) 8.683 10.989 ( -2.778 0.930 2.843) 4.082 11.209 ( -2.521 5.198 -0.917) 5.849 11.307 ( -3.380 15.769 -1.998) 16.250 11.511 ( -7.708 -2.853 2.224) 8.515 11.630 ( 1.117 -5.743 -6.582) 8.806 11.853 ( 1.042 -4.189 -0.200) 4.321 12.073 ( 4.569 -0.110 0.142) 4.573 12.367 ( -2.635 6.480 5.339) 8.800 12.506 ( 3.266 1.310 -8.748) 9.430 12.598 ( 7.507 4.814 -2.163) 9.177 13.085 ( -1.572 2.545 1.299) 3.261 13.147 ( -4.757 -16.961 19.820) 26.517 13.257 ( 10.185 3.800 -3.188) 11.329 14.164 ( -5.623 -3.437 7.369) 9.886 14.250 ( 4.082 -4.036 9.018) 10.690 14.521 ( -0.851 -3.202 1.063) 3.479 14.648 ( -3.602 -1.802 -1.029) 4.156 15.516 ( -1.817 -2.112 -0.185) 2.792 15.759 ( 6.927 -0.141 4.477) 8.249 15.848 ( -7.493 -4.803 -9.866) 13.287 16.033 ( 3.350 -2.497 -7.257) 8.374 17.663 ( -6.500 1.466 5.518) 8.652 17.876 ( 3.382 -0.593 -7.114) 7.899 18.286 ( 6.767 -3.511 -0.159) 7.626 18.348 ( -0.013 -2.160 2.929) 3.639 19.492 ( -1.104 12.142 3.012) 12.558 19.568 ( 4.968 10.371 -4.257) 12.262 19.826 ( 1.558 11.035 5.100) 12.256 20.110 ( 7.051 7.940 -4.423) 11.503 20.366 ( 0.187 2.338 1.156) 2.615 20.419 ( -0.594 3.253 0.630) 3.366 20.461 ( 0.813 7.008 -0.201) 7.057 20.505 ( 0.105 0.069 -1.110) 1.117 20.594 ( 0.907 11.506 -1.589) 11.651 20.642 ( 1.447 13.801 -0.669) 13.893 20.738 ( -4.116 15.315 3.787) 16.304 21.613 ( 14.703 19.110 -21.975) 32.623 24.288 ( 2.925 -1.462 -0.141) 3.273 24.386 ( -2.791 -2.957 2.137) 4.593 24.539 ( 1.737 -1.633 -3.807) 4.492 24.669 ( -7.689 -5.438 0.747) 9.448 30.122 ( -0.773 -0.145 4.336) 4.407 30.185 ( -3.641 -1.688 4.869) 6.310 30.326 ( 1.167 -0.398 -3.996) 4.182 30.413 ( 0.255 -1.218 -2.957) 3.208 34.674 ( -8.250 -12.860 3.303) 15.632 34.928 ( -4.985 -15.971 10.249) 19.620 35.209 ( 1.178 -10.969 -9.133) 14.322 36.241 ( 0.126 -20.497 -7.673) 21.887 37.404 ( -0.487 -9.091 0.467) 9.116 37.541 ( 4.560 -8.147 0.556) 9.353 37.949 ( -5.890 -5.172 -4.452) 9.014 38.043 ( -9.247 -13.974 17.009) 23.876 40.863 ( -2.663 -3.015 8.065) 9.013 41.583 ( 5.168 -8.579 -2.082) 10.229 41.725 ( -1.293 -8.549 5.141) 10.059 42.279 ( -1.294 -11.987 7.220) 14.053 42.757 ( 6.754 -15.875 -15.769) 23.373 43.540 ( 29.655 -21.148 6.064) 36.925 44.354 ( -27.816 -29.665 24.911) 47.689 45.084 ( -20.383 -41.374 -13.455) 48.045 ======================= Grid point 137 (55/126) ======================= q-point: ( 0.00 0.19 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.613 ( 8.427 29.144 40.374) 50.502 2.766 ( 0.128 39.160 21.792) 44.815 3.903 ( -0.815 27.962 -22.953) 36.186 4.185 ( -9.967 23.938 -33.278) 42.188 4.286 ( 1.635 40.906 13.608) 43.141 4.645 ( -1.668 16.054 2.042) 16.269 4.845 ( -1.611 15.812 3.351) 16.244 4.952 ( -2.258 14.350 8.723) 16.944 5.140 ( -2.234 16.203 15.240) 22.355 5.350 ( -5.595 7.242 -1.051) 9.212 5.467 ( 4.898 8.989 2.307) 10.494 5.653 ( 3.270 20.228 8.584) 22.216 5.754 ( 4.466 16.378 9.994) 19.700 5.842 ( -3.293 31.558 -11.693) 33.815 6.114 ( -9.491 24.786 -6.228) 27.262 6.205 ( 5.011 14.922 10.956) 19.178 6.299 ( 13.450 7.639 -20.347) 25.558 6.416 ( -14.043 19.711 2.813) 24.365 6.691 ( 0.828 22.775 2.341) 22.910 6.840 ( 5.645 15.803 -1.516) 16.849 6.954 ( 1.253 11.867 -2.715) 12.238 7.022 ( 1.065 16.778 -6.840) 18.150 7.090 ( 5.583 17.712 -7.694) 20.101 7.322 ( 2.415 7.629 -9.877) 12.712 7.349 ( -15.725 -2.378 -11.498) 19.625 7.717 ( 9.548 4.777 -16.548) 19.693 7.933 ( -6.117 -5.718 16.089) 18.137 8.065 ( 8.731 9.808 11.269) 17.304 8.201 ( -0.044 5.622 8.305) 10.029 8.639 ( 5.467 8.788 2.642) 10.682 8.819 ( 2.344 8.065 -3.570) 9.126 8.864 ( -4.496 3.864 -7.738) 9.748 8.971 ( -1.700 13.118 5.936) 14.499 9.170 ( 2.198 10.452 3.015) 11.098 9.212 ( -9.338 3.067 -4.283) 10.721 9.325 ( -8.602 12.988 -8.423) 17.710 9.428 ( -5.582 1.505 -3.637) 6.831 9.573 ( 3.167 7.700 -1.418) 8.446 9.625 ( 10.367 11.590 -1.309) 15.605 9.740 ( 7.491 5.501 1.681) 9.445 9.839 ( 9.298 6.093 -0.014) 11.116 9.970 ( -0.956 4.294 -3.055) 5.356 10.157 ( 0.883 -2.678 4.489) 5.301 10.231 ( -10.794 -2.140 4.329) 11.825 10.613 ( 5.535 0.530 3.770) 6.718 10.735 ( -2.473 -1.187 -0.018) 2.743 10.940 ( -1.961 5.847 1.853) 6.440 10.983 ( -0.273 1.523 -1.077) 1.885 11.273 ( -4.930 -0.401 5.490) 7.390 11.407 ( 2.142 -1.428 -1.905) 3.203 11.533 ( -1.081 3.026 0.093) 3.214 11.660 ( 4.539 1.442 -2.640) 5.445 11.941 ( 7.277 3.941 -2.369) 8.608 12.153 ( 1.500 -0.682 -5.137) 5.395 12.323 ( -8.902 0.535 4.654) 10.059 12.383 ( -1.834 -6.768 4.116) 8.131 12.843 ( -1.406 1.416 3.629) 4.141 12.904 ( -5.244 6.997 2.713) 9.155 13.183 ( 2.448 4.936 3.010) 6.278 13.481 ( 2.175 3.158 -6.517) 7.562 14.106 ( 3.200 -0.965 4.743) 5.803 14.217 ( -4.190 -4.348 4.168) 7.338 14.440 ( 2.577 -4.012 2.922) 5.593 14.525 ( -0.310 -3.586 0.878) 3.704 15.453 ( -1.743 0.460 0.609) 1.903 15.636 ( -4.308 0.711 -7.946) 9.066 15.817 ( 0.354 -1.326 1.779) 2.247 16.046 ( 5.519 -4.297 -3.386) 7.771 17.648 ( -2.467 2.485 4.441) 5.655 17.911 ( 5.426 -1.038 -7.037) 8.946 18.181 ( -4.712 -5.523 4.945) 8.783 18.305 ( 1.672 -6.013 -1.178) 6.352 19.700 ( -1.499 9.591 1.634) 9.844 19.820 ( 2.230 9.904 -3.685) 10.800 20.087 ( -1.508 6.776 5.452) 8.827 20.252 ( 1.294 -0.169 -2.267) 2.616 20.421 ( -0.396 3.815 2.331) 4.488 20.441 ( -0.100 2.429 0.407) 2.465 20.482 ( -1.392 1.235 0.715) 1.993 20.641 ( 2.426 8.721 -3.351) 9.652 20.962 ( -1.307 18.374 -0.202) 18.421 20.975 ( 0.785 17.944 -0.219) 17.962 21.105 ( 2.610 19.112 8.693) 21.157 21.822 ( -1.452 7.922 -20.408) 21.939 24.241 ( -0.656 -2.011 1.646) 2.680 24.354 ( 1.812 -2.207 -2.261) 3.642 24.482 ( -4.858 -1.716 -0.277) 5.160 24.539 ( 2.646 -1.885 -1.734) 3.682 30.115 ( -1.839 0.404 3.634) 4.093 30.156 ( -0.793 -0.022 5.166) 5.227 30.317 ( 0.986 -0.686 -3.901) 4.081 30.374 ( 0.337 -1.434 -3.415) 3.719 34.287 ( -10.002 -3.101 10.278) 14.673 34.740 ( 7.014 -11.084 -3.314) 13.529 35.084 ( 1.576 -12.939 3.902) 13.606 35.762 ( -4.895 -14.526 -19.304) 24.650 37.225 ( -1.080 -9.707 4.274) 10.661 37.406 ( 1.049 -11.455 -1.389) 11.587 37.647 ( -3.052 -13.749 9.188) 16.816 37.763 ( 3.008 -10.309 -0.823) 10.770 40.844 ( 2.694 -3.813 10.883) 11.842 41.335 ( -0.549 -9.775 -7.113) 12.102 41.802 ( 14.901 -15.847 15.667) 26.807 42.039 ( 5.834 -18.557 10.859) 22.279 42.544 ( 12.002 -19.218 -10.580) 25.006 43.137 ( -21.069 -30.127 -11.749) 38.595 43.453 ( -22.510 -25.417 17.208) 38.064 44.083 ( 15.638 -37.167 -10.198) 41.593 ======================= Grid point 138 (56/126) ======================= q-point: ( 0.17 0.19 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.817 ( -0.826 32.410 24.668) 40.738 3.089 ( 17.803 27.037 33.656) 46.698 3.733 ( -12.757 27.767 -31.321) 43.758 3.915 ( 5.676 22.284 -21.850) 31.721 4.352 ( -14.421 24.354 6.260) 28.988 4.563 ( 3.975 25.293 12.386) 28.442 4.739 ( -14.748 12.188 8.221) 20.824 4.873 ( -13.837 13.926 4.204) 20.077 5.054 ( -12.281 15.870 0.121) 20.067 5.306 ( 8.270 18.303 5.834) 20.915 5.558 ( -1.689 11.833 2.370) 12.185 5.593 ( -0.315 12.581 6.547) 14.186 5.789 ( -1.088 18.421 1.750) 18.536 5.987 ( 4.927 38.206 -9.700) 39.725 6.009 ( 4.452 18.707 14.774) 24.250 6.147 ( -0.368 19.420 -14.235) 24.081 6.264 ( -4.221 19.391 8.305) 21.513 6.499 ( 1.461 15.072 -3.356) 15.510 6.795 ( 7.231 12.743 1.260) 14.706 6.862 ( 3.718 12.549 -21.732) 25.369 6.960 ( -4.339 17.780 -2.061) 18.418 7.014 ( -4.718 10.978 -4.529) 12.778 7.073 ( 5.350 16.258 1.465) 17.178 7.281 ( 10.226 1.956 -5.086) 11.587 7.343 ( 9.592 18.835 -9.243) 23.069 7.739 ( 1.701 3.564 -17.378) 17.821 7.931 ( 0.451 1.434 12.020) 12.114 8.196 ( -11.925 2.721 4.233) 12.943 8.305 ( 0.360 13.302 6.362) 14.750 8.479 ( -2.121 2.171 0.671) 3.108 8.787 ( -0.286 4.244 -9.176) 10.114 8.840 ( -4.317 7.519 -8.947) 12.459 8.987 ( -2.416 11.809 12.110) 17.086 9.082 ( -2.211 8.036 6.741) 10.719 9.175 ( 0.217 18.749 -1.657) 18.824 9.207 ( -0.405 9.701 2.394) 10.000 9.357 ( -0.542 -3.080 -2.157) 3.799 9.541 ( -7.627 11.217 -4.966) 14.445 9.743 ( -4.402 13.115 -4.993) 14.708 9.764 ( 5.046 5.055 -2.569) 7.590 9.896 ( 3.618 4.796 -0.728) 6.051 10.010 ( 7.302 -0.685 -1.611) 7.509 10.202 ( 1.555 1.007 5.617) 5.915 10.374 ( 15.128 -7.823 3.829) 17.456 10.697 ( 4.399 -1.286 -3.071) 5.517 10.900 ( 7.270 0.239 6.341) 9.650 10.963 ( 5.932 4.345 -4.498) 8.619 11.021 ( 11.832 -2.968 3.753) 12.763 11.189 ( -6.180 0.907 4.599) 7.757 11.427 ( -0.296 -1.567 0.699) 1.742 11.507 ( -1.529 -0.266 -0.943) 1.815 11.681 ( -0.721 0.022 -2.555) 2.655 12.022 ( -5.664 3.320 -3.140) 7.277 12.092 ( 1.629 -1.262 -2.374) 3.144 12.197 ( -6.486 -2.653 1.163) 7.104 12.374 ( -3.412 3.079 8.286) 9.475 12.619 ( -9.310 3.932 -3.440) 10.676 12.952 ( -1.223 0.449 5.800) 5.945 13.209 ( -2.320 7.136 2.929) 8.055 13.373 ( -10.274 -3.080 -4.596) 11.669 14.159 ( -1.169 -3.532 1.386) 3.970 14.214 ( 4.260 2.204 7.686) 9.060 14.518 ( 4.425 -2.283 0.015) 4.979 14.624 ( 8.145 -5.295 0.950) 9.761 15.448 ( 0.105 3.054 0.815) 3.162 15.565 ( 0.420 1.750 -3.982) 4.370 15.820 ( 0.116 -2.145 -1.204) 2.463 16.104 ( 2.278 -5.990 -3.706) 7.403 17.655 ( 1.635 2.251 2.677) 3.861 17.984 ( 5.764 -1.703 -6.111) 8.571 18.092 ( -6.932 -4.876 4.098) 9.414 18.289 ( -3.419 -5.470 0.473) 6.468 19.687 ( -0.394 10.404 0.528) 10.425 19.839 ( 1.286 9.900 -2.345) 10.255 20.046 ( -5.107 6.082 4.653) 9.205 20.219 ( -4.041 1.091 -1.922) 4.606 20.409 ( -1.001 3.727 0.912) 3.965 20.430 ( -1.774 1.748 1.821) 3.085 20.471 ( 0.029 0.813 0.017) 0.814 20.665 ( 1.338 9.137 -2.401) 9.541 20.929 ( -0.839 18.146 -1.055) 18.196 20.988 ( -0.030 18.579 -0.041) 18.579 21.209 ( 2.995 17.931 9.285) 20.413 21.680 ( -2.600 13.491 -18.594) 23.120 24.251 ( 1.083 -1.191 0.796) 1.796 24.354 ( -2.880 -0.912 1.766) 3.499 24.433 ( 2.469 -2.774 -3.836) 5.339 24.576 ( 1.326 -3.676 0.358) 3.924 30.101 ( -1.414 0.934 3.668) 4.040 30.174 ( -0.094 -0.449 5.039) 5.060 30.313 ( 0.502 -1.008 -3.546) 3.720 30.369 ( 0.891 -1.110 -3.300) 3.594 34.235 ( 0.122 -1.319 5.634) 5.788 34.867 ( 6.223 -12.809 3.130) 14.580 35.043 ( -6.896 -13.051 1.467) 14.833 35.582 ( -4.559 -12.023 -12.266) 17.770 37.186 ( -4.122 -10.108 3.071) 11.340 37.465 ( 4.975 -12.467 -1.147) 13.472 37.592 ( -3.778 -11.566 2.328) 12.388 37.943 ( 12.093 -12.429 2.859) 17.575 41.005 ( 9.205 -5.900 13.328) 17.240 41.344 ( 5.814 -8.936 -10.863) 15.220 41.907 ( -2.175 -14.802 1.270) 15.014 42.256 ( 1.060 -23.047 -9.439) 24.927 42.504 ( -24.434 -23.460 -11.118) 35.651 42.898 ( 7.901 -31.524 30.533) 44.592 43.139 ( -7.351 -25.288 0.845) 26.348 44.424 ( 20.884 -36.999 -7.386) 43.123 ======================= Grid point 139 (57/126) ======================= q-point: ( 0.33 0.19 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.974 ( 11.411 26.434 7.855) 29.844 3.443 ( 2.384 29.951 -5.467) 30.539 3.579 ( 11.247 24.058 18.236) 32.215 3.939 ( -21.210 20.353 8.159) 30.507 3.996 ( 3.391 19.167 -14.272) 24.136 4.362 ( -28.769 15.238 4.118) 32.815 4.568 ( -10.673 11.300 -0.233) 15.546 4.725 ( -0.286 13.782 6.612) 15.288 4.968 ( 1.145 23.128 1.041) 23.180 5.280 ( -12.578 12.240 3.883) 17.975 5.551 ( -6.695 15.436 3.076) 17.104 5.666 ( 10.967 15.894 0.581) 19.319 5.842 ( -2.555 25.315 7.672) 26.575 5.998 ( 3.118 21.863 -1.662) 22.146 6.145 ( -0.517 16.597 4.562) 17.220 6.192 ( 5.653 6.434 -2.623) 8.957 6.271 ( 4.619 26.874 0.422) 27.271 6.512 ( 4.841 21.017 -3.887) 21.915 6.701 ( 2.660 20.270 -6.926) 21.585 6.828 ( -7.356 20.512 2.617) 21.948 6.910 ( -5.529 18.746 -0.595) 19.553 7.068 ( 13.388 13.490 -8.686) 20.897 7.182 ( 4.037 18.533 -0.876) 18.988 7.442 ( 9.637 6.564 -0.980) 11.701 7.581 ( 10.178 16.896 -18.623) 27.127 7.653 ( 3.567 11.026 -5.116) 12.667 7.910 ( -3.244 7.821 -2.442) 8.812 8.028 ( 1.546 0.713 9.465) 9.617 8.312 ( -2.825 8.553 4.551) 10.092 8.459 ( -8.489 10.510 -0.989) 13.546 8.589 ( -11.200 10.100 -9.569) 17.861 8.770 ( -2.350 8.091 -1.928) 8.643 8.962 ( -10.173 15.361 -7.135) 19.757 9.004 ( -0.238 12.436 4.489) 13.223 9.175 ( -4.650 3.849 1.264) 6.168 9.268 ( 6.432 1.383 1.702) 6.796 9.366 ( -5.953 5.804 -1.544) 8.456 9.461 ( 7.319 11.299 2.044) 13.617 9.662 ( -0.541 4.477 -2.113) 4.980 9.839 ( 2.677 5.604 -3.252) 7.010 9.998 ( 3.535 1.935 2.840) 4.930 10.122 ( 7.242 4.144 -4.000) 9.253 10.239 ( 0.145 3.635 3.880) 5.319 10.611 ( 11.778 -12.045 -3.455) 17.197 10.804 ( 6.566 2.341 4.300) 8.191 10.943 ( -0.921 -2.969 6.885) 7.554 11.067 ( 0.287 -2.960 -0.069) 2.974 11.135 ( 3.940 4.301 1.752) 6.091 11.357 ( 9.566 -1.686 6.904) 11.917 11.448 ( 3.710 -5.316 -3.381) 7.311 11.454 ( -2.779 -4.264 2.283) 5.578 11.626 ( -4.154 -2.431 -1.358) 5.001 11.865 ( -0.610 2.906 -3.959) 4.949 12.029 ( -8.853 -1.574 1.349) 9.092 12.171 ( 1.612 0.324 -2.942) 3.371 12.303 ( -5.148 1.572 0.367) 5.395 12.586 ( 3.217 0.593 3.149) 4.541 12.901 ( -5.939 2.935 2.913) 7.236 13.071 ( -10.920 0.217 -2.385) 11.180 13.183 ( -8.151 -2.140 -0.182) 8.430 14.186 ( 1.900 -0.742 4.079) 4.560 14.310 ( 1.834 5.321 8.364) 10.081 14.607 ( 5.547 -1.234 -4.654) 7.345 14.737 ( 3.662 -3.878 -0.267) 5.341 15.454 ( 0.287 6.311 2.324) 6.731 15.603 ( 2.993 2.061 0.810) 3.723 15.827 ( 2.737 -3.263 -4.599) 6.268 16.085 ( -2.141 -7.187 -4.655) 8.826 17.734 ( 6.110 0.869 0.678) 6.209 17.961 ( -7.312 -3.011 2.645) 8.338 18.080 ( 5.703 -3.275 -4.241) 7.826 18.192 ( -7.541 -3.717 2.038) 8.651 19.696 ( 1.423 11.937 -0.131) 12.022 19.833 ( -1.654 10.586 -0.725) 10.739 19.982 ( -2.518 6.191 2.545) 7.152 20.106 ( -6.498 2.199 -1.399) 7.002 20.398 ( -1.347 2.213 1.931) 3.231 20.416 ( 0.431 0.120 -0.603) 0.751 20.474 ( -0.087 2.748 1.538) 3.150 20.665 ( -0.010 9.514 -2.169) 9.758 20.924 ( 0.686 18.263 -1.633) 18.348 20.972 ( -0.909 19.007 -1.667) 19.102 21.292 ( 1.731 17.434 7.158) 18.925 21.579 ( -0.671 17.494 -10.878) 20.612 24.282 ( 1.724 -0.822 0.375) 1.946 24.308 ( -2.044 0.404 1.645) 2.655 24.494 ( 4.128 -5.526 -1.374) 7.033 24.583 ( -0.606 -5.642 0.387) 5.688 30.099 ( -0.694 0.877 3.571) 3.742 30.194 ( -0.392 -0.908 4.915) 5.014 30.305 ( 0.432 -1.222 -3.373) 3.614 30.375 ( 1.198 -1.148 -2.610) 3.093 34.321 ( 6.544 -3.526 1.972) 7.690 34.820 ( -10.905 -10.591 4.329) 15.806 35.078 ( 9.463 -14.142 0.682) 17.029 35.476 ( -4.694 -16.430 -1.682) 17.170 37.140 ( -1.987 -9.874 2.367) 10.346 37.473 ( -1.627 -10.582 -5.539) 12.054 37.621 ( 3.974 -13.032 5.435) 14.668 38.128 ( 5.798 -13.792 0.692) 14.977 41.277 ( 9.971 -9.091 9.500) 16.502 41.422 ( 9.167 -8.754 -17.181) 21.351 41.668 ( -15.668 -17.609 -12.293) 26.583 42.026 ( -4.709 -12.823 -0.358) 13.665 42.332 ( -4.630 -18.700 -9.816) 21.621 42.685 ( -20.237 -20.333 10.248) 30.463 43.532 ( 18.743 -45.498 25.169) 55.271 44.690 ( 12.061 -39.327 -9.304) 42.174 ======================= Grid point 140 (58/126) ======================= q-point: (-0.50 0.19 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.230 ( -15.686 19.969 7.699) 26.534 3.412 ( 7.875 20.949 -8.824) 24.056 3.572 ( -20.283 23.698 11.904) 33.387 3.698 ( 9.775 22.358 6.106) 25.154 4.082 ( 15.094 21.849 9.583) 28.232 4.277 ( 13.820 16.841 -3.848) 22.123 4.447 ( -4.574 16.788 -0.868) 17.421 4.712 ( 0.378 18.952 -1.941) 19.055 4.878 ( -11.373 18.891 -0.629) 22.059 5.173 ( -2.523 7.770 8.276) 11.629 5.465 ( -4.582 16.307 10.266) 19.807 5.689 ( -12.145 21.022 -4.499) 24.692 5.798 ( -2.270 21.304 -6.009) 22.251 5.933 ( -4.780 9.663 -5.423) 12.068 6.082 ( 3.522 20.712 2.267) 21.131 6.283 ( 1.731 19.928 0.035) 20.003 6.457 ( 7.792 15.035 6.254) 18.052 6.502 ( -2.181 29.075 -4.252) 29.465 6.675 ( -2.906 19.493 -1.971) 19.807 6.837 ( 1.051 16.518 6.481) 17.775 6.997 ( 7.553 26.818 1.783) 27.918 7.178 ( 1.036 11.196 8.145) 13.884 7.217 ( 6.313 16.086 -18.019) 24.966 7.572 ( 7.730 10.457 -6.610) 14.588 7.646 ( 12.404 8.244 7.249) 16.565 7.877 ( 5.185 13.420 -0.382) 14.392 7.915 ( 3.042 9.811 -6.468) 12.139 8.095 ( 0.828 7.858 -2.504) 8.289 8.133 ( -10.128 1.493 -5.854) 11.794 8.341 ( 0.457 15.603 -0.646) 15.623 8.466 ( -0.152 9.201 -2.622) 9.568 8.621 ( -10.658 12.001 -10.772) 19.330 8.803 ( -1.076 16.287 1.280) 16.372 8.976 ( -6.306 9.487 -1.089) 11.443 9.114 ( 0.859 11.445 3.293) 11.940 9.293 ( -0.245 -2.187 -2.891) 3.633 9.408 ( 3.920 2.850 2.766) 5.581 9.537 ( -0.583 16.199 -1.549) 16.283 9.613 ( -4.082 1.765 -1.268) 4.625 9.801 ( -0.507 7.447 -10.671) 13.023 9.987 ( -3.597 3.950 2.731) 6.000 10.226 ( 1.390 2.257 -7.940) 8.371 10.349 ( 9.969 3.008 14.197) 17.606 10.756 ( 1.089 -10.181 -4.073) 11.019 10.880 ( -5.026 7.043 13.690) 16.195 10.949 ( -0.124 -3.255 2.697) 4.229 11.030 ( -0.832 -13.882 1.796) 14.022 11.212 ( -0.093 3.640 -0.363) 3.660 11.327 ( -8.156 -1.066 2.172) 8.508 11.409 ( -1.024 -2.916 -1.047) 3.264 11.515 ( 1.750 0.829 6.932) 7.198 11.645 ( 6.428 -4.964 -1.620) 8.281 11.846 ( -7.470 -5.440 -3.702) 9.955 12.049 ( 12.869 -5.809 -4.065) 14.693 12.159 ( -4.814 -1.684 -0.308) 5.109 12.228 ( 2.277 2.133 -1.623) 3.518 12.684 ( 4.442 1.020 5.512) 7.152 12.795 ( -7.099 1.774 1.795) 7.534 12.941 ( 0.606 -2.667 -3.156) 4.176 13.084 ( -0.794 4.342 -1.437) 4.642 14.227 ( -0.738 0.713 5.846) 5.936 14.346 ( -2.529 4.740 8.260) 9.853 14.627 ( -1.247 -0.677 -5.242) 5.430 14.764 ( 0.337 -0.430 -2.424) 2.485 15.491 ( 1.587 6.334 6.084) 8.924 15.648 ( 1.763 3.083 0.464) 3.582 15.873 ( 4.179 -4.052 -6.448) 8.687 15.999 ( -4.119 -7.742 -5.145) 10.167 17.842 ( -4.020 -1.485 0.687) 4.340 17.875 ( 6.285 -1.315 -0.108) 6.422 18.053 ( -7.589 -1.714 2.180) 8.080 18.166 ( 4.799 -4.215 -1.625) 6.591 19.733 ( 2.182 13.592 0.727) 13.786 19.780 ( -2.695 11.481 -1.107) 11.845 19.987 ( -0.354 6.418 0.934) 6.495 20.016 ( -0.171 1.361 -0.538) 1.473 20.382 ( -1.002 0.041 1.279) 1.625 20.433 ( 1.321 0.614 -0.451) 1.525 20.483 ( -0.054 4.005 2.598) 4.774 20.650 ( -0.356 9.542 -2.615) 9.901 20.925 ( -0.090 18.695 -1.321) 18.742 20.956 ( 0.674 18.510 -2.701) 18.718 21.295 ( -5.114 18.003 4.958) 19.361 21.597 ( 7.656 17.469 -6.476) 20.143 24.273 ( -1.798 0.423 1.716) 2.521 24.332 ( 2.456 -1.368 -0.216) 2.819 24.515 ( -2.106 -3.929 1.464) 4.693 24.592 ( 2.078 -8.480 -1.361) 8.836 30.106 ( -0.472 0.562 3.634) 3.708 30.202 ( -1.270 -1.173 4.688) 4.996 30.300 ( 0.847 -1.122 -3.243) 3.535 30.384 ( 0.998 -1.425 -2.258) 2.850 34.459 ( 6.901 -6.153 1.595) 9.383 34.673 ( -5.581 -9.103 0.176) 10.679 35.193 ( -4.230 -16.103 7.194) 18.137 35.442 ( 6.262 -19.458 -0.696) 20.453 37.140 ( 0.527 -9.459 3.374) 10.057 37.416 ( -1.120 -9.916 -7.414) 12.432 37.717 ( 2.326 -13.472 9.274) 16.520 38.132 ( -4.211 -13.734 -4.388) 15.021 41.092 ( -15.189 -7.843 -9.530) 19.572 41.479 ( 6.887 -9.422 -25.173) 27.747 41.882 ( 23.557 -16.293 15.761) 32.692 41.957 ( -5.970 -13.318 2.448) 14.799 42.136 ( -10.790 -13.860 -0.594) 17.574 42.454 ( -6.238 -21.451 -6.168) 23.175 43.849 ( 2.694 -44.285 26.979) 51.926 44.757 ( 0.377 -41.774 -11.613) 43.360 ======================= Grid point 141 (59/126) ======================= q-point: (-0.33 0.19 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.745 ( -25.452 30.963 -5.544) 40.463 2.976 ( -28.074 26.019 21.073) 43.695 4.055 ( 20.264 17.911 7.095) 27.960 4.104 ( 29.335 23.604 -0.217) 37.653 4.357 ( 4.965 20.791 -8.350) 22.949 4.405 ( 13.975 12.224 3.071) 18.819 4.487 ( 4.943 22.940 9.368) 25.267 4.676 ( 3.408 21.276 -18.204) 28.208 4.801 ( 0.465 15.130 10.103) 18.199 5.212 ( 3.438 8.333 12.262) 15.219 5.361 ( -12.039 30.549 6.793) 33.531 5.420 ( -11.200 11.489 -2.265) 16.204 5.710 ( 1.103 13.896 -1.810) 14.057 5.987 ( 4.179 14.562 1.032) 15.184 6.147 ( 1.837 26.846 5.382) 27.442 6.306 ( 0.714 21.926 1.239) 21.972 6.333 ( -9.913 24.118 -4.824) 26.518 6.605 ( -0.902 20.748 4.000) 21.150 6.657 ( 7.196 10.668 -1.905) 13.008 6.942 ( 1.364 19.352 2.543) 19.566 7.023 ( -2.708 24.693 4.020) 25.164 7.096 ( -7.326 2.964 -5.654) 9.717 7.261 ( 7.414 13.274 -16.063) 22.118 7.587 ( -18.723 9.781 -16.230) 26.639 7.701 ( 8.121 7.851 -1.693) 11.422 7.751 ( -10.556 12.048 -7.400) 17.645 7.971 ( -1.140 4.827 6.711) 8.345 8.091 ( -9.543 6.251 -14.625) 18.549 8.260 ( 23.959 9.285 11.653) 28.215 8.274 ( 0.931 0.010 4.669) 4.761 8.457 ( 1.323 8.488 -6.356) 10.686 8.692 ( 15.939 17.390 -1.901) 23.666 8.852 ( 3.508 18.920 6.286) 20.243 8.911 ( 3.808 11.185 -3.430) 12.303 9.143 ( -0.636 12.218 1.258) 12.299 9.318 ( -7.457 13.400 -0.921) 15.363 9.329 ( 5.413 -0.625 0.321) 5.458 9.539 ( -1.019 2.953 -4.354) 5.358 9.598 ( 2.113 6.700 3.139) 7.695 9.748 ( -0.653 6.659 -8.989) 11.205 9.914 ( -5.988 8.027 2.868) 10.417 10.202 ( 0.078 2.017 -4.251) 4.705 10.485 ( -11.433 -7.170 3.245) 13.880 10.600 ( -5.148 -4.206 -1.121) 6.742 10.743 ( -12.451 -0.699 6.980) 14.291 10.951 ( -2.848 4.436 7.722) 9.350 11.020 ( -3.330 -6.488 4.020) 8.327 11.156 ( -7.865 2.572 0.043) 8.274 11.254 ( 0.892 1.876 0.637) 2.173 11.434 ( 3.809 -4.496 -2.674) 6.471 11.544 ( -2.628 -0.663 2.799) 3.896 11.596 ( -5.912 -6.095 -3.066) 9.028 11.838 ( 3.201 1.784 -1.387) 3.918 12.035 ( -2.219 -1.130 1.877) 3.119 12.248 ( 9.360 -8.424 -3.500) 13.070 12.393 ( 13.061 4.130 0.048) 13.698 12.655 ( -6.845 -0.234 -3.173) 7.549 12.799 ( 5.689 -0.414 8.111) 9.916 13.032 ( 6.033 -1.688 0.237) 6.269 13.181 ( 11.920 5.312 -1.766) 13.169 14.211 ( -3.623 0.488 5.597) 6.685 14.275 ( -8.702 2.679 4.970) 10.373 14.547 ( -4.731 0.406 -0.318) 4.759 14.723 ( -3.606 0.244 -3.684) 5.161 15.540 ( -1.017 2.953 6.181) 6.926 15.687 ( 3.255 2.892 0.557) 4.390 15.870 ( -2.608 -4.099 -4.326) 6.505 15.937 ( 1.818 -6.055 -7.829) 10.063 17.765 ( -3.876 0.054 0.474) 3.905 17.894 ( -4.605 -0.666 1.952) 5.045 18.069 ( 8.454 -3.175 -2.452) 9.358 18.231 ( 2.273 -5.151 1.149) 5.747 19.737 ( -1.078 11.339 -0.185) 11.392 19.775 ( 1.412 12.104 -0.425) 12.194 19.985 ( 1.480 7.043 2.630) 7.662 20.088 ( 6.133 2.162 -1.731) 6.729 20.378 ( 0.155 0.159 0.604) 0.644 20.451 ( 0.518 -0.290 0.450) 0.745 20.493 ( -0.300 4.660 2.752) 5.420 20.632 ( 0.094 9.538 -3.394) 10.125 20.915 ( 0.213 18.723 -1.684) 18.800 20.967 ( 1.319 18.386 -1.855) 18.527 21.194 ( -7.208 18.678 4.139) 20.444 21.748 ( 10.878 13.424 -7.342) 18.773 24.256 ( -0.493 0.263 0.519) 0.763 24.353 ( -1.130 -2.767 1.891) 3.537 24.490 ( 0.462 -2.218 -1.743) 2.858 24.604 ( -0.890 -7.505 0.240) 7.561 30.115 ( -0.528 0.251 3.732) 3.777 30.190 ( -2.291 -1.065 4.312) 4.997 30.306 ( 1.276 -0.949 -3.124) 3.505 30.388 ( 0.641 -1.591 -2.455) 2.995 34.535 ( 0.970 -7.017 -2.789) 7.613 34.645 ( -0.952 -11.070 9.780) 14.802 35.046 ( -8.242 -14.397 -2.034) 16.714 35.649 ( 12.752 -20.588 0.658) 24.226 37.183 ( 1.781 -9.451 4.224) 10.504 37.368 ( 0.038 -9.295 -7.746) 12.100 37.779 ( -1.957 -14.444 13.870) 20.121 37.967 ( -9.683 -12.619 -7.267) 17.487 40.866 ( -7.622 -4.312 0.379) 8.765 41.426 ( 1.098 -9.545 -22.915) 24.847 41.729 ( -14.884 -12.181 0.961) 19.257 42.031 ( -3.185 -13.969 3.876) 14.843 42.381 ( 3.260 -18.378 -9.797) 21.080 42.485 ( 30.467 -20.827 12.288) 38.897 43.896 ( -10.418 -38.167 25.735) 47.197 44.591 ( -11.875 -43.520 -14.752) 47.462 ======================= Grid point 142 (60/126) ======================= q-point: (-0.17 0.19 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.442 ( -7.315 38.166 15.020) 41.662 2.740 ( -10.628 33.025 24.418) 42.425 4.072 ( -5.089 23.664 -15.528) 28.757 4.275 ( -3.850 37.928 1.706) 38.161 4.417 ( -1.153 25.997 -15.147) 30.110 4.557 ( 6.964 17.269 1.852) 18.713 4.791 ( 9.794 16.470 0.778) 19.178 4.865 ( 6.055 10.971 1.553) 12.627 5.022 ( 29.382 8.017 6.013) 31.044 5.198 ( -6.147 17.665 20.070) 27.434 5.326 ( 4.979 14.124 -3.117) 15.297 5.479 ( 8.920 16.237 19.191) 26.674 5.734 ( 0.681 16.434 1.044) 16.482 6.000 ( -1.562 21.155 -6.519) 22.192 6.086 ( -8.826 16.618 -7.873) 20.397 6.211 ( -0.609 22.700 7.109) 23.795 6.319 ( -1.993 17.603 1.321) 17.765 6.611 ( -1.254 21.064 4.148) 21.505 6.728 ( -4.901 15.207 0.614) 15.989 6.850 ( -2.452 18.624 -10.140) 21.347 6.977 ( -1.819 13.613 -0.950) 13.767 7.034 ( 0.085 13.187 -1.753) 13.304 7.129 ( -11.726 12.155 -21.146) 27.063 7.324 ( 4.818 10.878 -16.157) 20.064 7.568 ( -3.156 10.788 -7.342) 13.425 7.779 ( -11.713 6.196 -13.814) 19.142 7.891 ( 6.440 3.996 13.168) 15.194 7.962 ( -4.829 -1.429 10.407) 11.561 8.246 ( -4.503 -1.592 0.666) 4.822 8.484 ( 6.734 9.443 -1.404) 11.683 8.730 ( 13.622 9.768 1.746) 16.853 8.850 ( 4.924 11.774 -1.844) 12.894 8.961 ( 3.558 13.080 5.543) 14.645 9.099 ( 4.659 10.897 -0.539) 11.864 9.181 ( 14.640 15.423 2.421) 21.402 9.306 ( 3.728 7.487 2.573) 8.751 9.448 ( 1.745 4.569 -4.487) 6.637 9.466 ( 4.138 6.191 -1.336) 7.566 9.620 ( 0.400 7.068 -5.374) 8.888 9.715 ( -2.865 3.657 0.198) 4.650 9.831 ( -2.398 7.868 -0.449) 8.237 10.057 ( -18.894 -6.697 -5.223) 20.715 10.213 ( -2.767 0.792 -1.323) 3.167 10.465 ( -13.674 -1.251 2.613) 13.977 10.613 ( -6.734 0.555 7.307) 9.952 10.870 ( -9.901 2.580 3.497) 10.813 10.981 ( -2.822 0.361 5.455) 6.152 11.013 ( -4.563 2.583 -1.484) 5.450 11.280 ( 1.158 1.231 1.568) 2.306 11.434 ( -4.370 -2.595 0.377) 5.096 11.525 ( 4.086 -5.565 -3.530) 7.754 11.574 ( 3.520 4.047 -3.144) 6.217 11.866 ( 1.777 7.881 -0.131) 8.080 12.085 ( 5.045 1.390 0.924) 5.313 12.366 ( 3.726 -10.595 -0.032) 11.231 12.468 ( -7.768 0.945 2.260) 8.145 12.676 ( 12.379 3.662 -4.610) 13.708 12.953 ( 3.129 -0.264 12.065) 12.467 13.120 ( 3.777 1.190 -0.479) 3.989 13.388 ( 10.030 5.359 -3.870) 12.013 14.112 ( -6.347 -1.845 1.646) 6.812 14.208 ( -0.782 0.400 6.888) 6.944 14.473 ( -4.336 -1.276 2.118) 4.991 14.604 ( -7.117 -2.182 -1.432) 7.581 15.503 ( -3.754 0.804 1.599) 4.158 15.745 ( -1.638 -1.580 -1.163) 2.556 15.792 ( -0.227 -0.280 -2.400) 2.427 15.966 ( 4.661 -3.973 -5.336) 8.123 17.696 ( -4.803 1.686 4.271) 6.645 17.865 ( 2.214 -0.515 -4.769) 5.283 18.190 ( 3.503 -5.296 1.063) 6.438 18.263 ( 1.682 -5.504 0.577) 5.785 19.720 ( -1.378 9.943 1.453) 10.143 19.796 ( 2.052 10.202 -3.070) 10.850 20.049 ( 2.456 8.551 5.151) 10.280 20.195 ( 6.022 0.898 -2.564) 6.607 20.395 ( 1.371 1.678 0.790) 2.306 20.451 ( -0.833 0.683 1.051) 1.505 20.495 ( -0.719 3.469 1.956) 4.047 20.626 ( 1.069 9.086 -3.778) 9.898 20.930 ( 2.313 18.847 -1.102) 19.021 20.981 ( 0.807 18.358 -0.836) 18.395 21.098 ( -5.218 18.787 5.493) 20.258 21.865 ( 6.120 8.065 -13.623) 16.973 24.253 ( -0.794 -1.616 0.864) 1.997 24.336 ( -0.034 -1.877 0.376) 1.914 24.508 ( 2.282 -1.349 -3.453) 4.353 24.562 ( -3.851 -4.823 0.944) 6.244 30.121 ( -0.706 0.061 3.686) 3.753 30.165 ( -2.547 -0.420 4.660) 5.327 30.314 ( 1.308 -0.755 -3.620) 3.923 30.384 ( 0.306 -1.612 -2.961) 3.385 34.461 ( -11.489 -7.852 8.578) 16.347 34.660 ( 1.531 -10.957 1.994) 11.242 35.005 ( 5.000 -10.610 -4.630) 12.610 35.824 ( 6.632 -20.328 -9.002) 23.200 37.216 ( -0.020 -9.486 1.957) 9.686 37.372 ( 3.287 -9.121 -2.221) 9.946 37.720 ( -10.407 -15.968 7.657) 20.540 37.805 ( -4.529 -10.708 1.265) 11.695 40.799 ( -2.244 -3.222 7.208) 8.208 41.393 ( 1.580 -10.164 -5.573) 11.699 41.534 ( -1.838 -10.256 2.563) 10.730 42.006 ( -1.973 -14.629 4.843) 15.535 42.429 ( 7.973 -16.717 -13.197) 22.742 43.066 ( 24.706 -25.216 7.109) 36.011 43.738 ( -18.804 -31.297 22.775) 43.033 44.222 ( -17.510 -42.941 -18.520) 49.935 ======================= Grid point 143 (61/126) ======================= q-point: ( 0.00 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.218 ( 1.063 31.215 29.184) 42.746 3.577 ( 3.274 40.705 15.640) 43.729 4.328 ( -0.463 14.766 -16.562) 22.193 4.670 ( -9.957 25.056 -30.901) 41.010 4.873 ( 0.104 13.931 3.556) 14.378 4.918 ( -4.155 14.624 7.388) 16.903 5.103 ( -3.248 10.197 2.603) 11.013 5.193 ( 1.430 13.154 6.067) 14.556 5.469 ( -2.938 5.229 -0.913) 6.067 5.530 ( 2.843 16.639 8.265) 18.795 5.604 ( 6.546 5.916 -0.580) 8.842 5.949 ( -4.594 9.509 9.952) 14.511 6.094 ( -0.866 13.869 4.136) 14.499 6.233 ( 5.352 9.589 -8.874) 14.119 6.311 ( 17.019 3.802 2.450) 17.610 6.534 ( 2.307 13.621 -9.224) 16.611 6.671 ( -5.613 23.907 -3.187) 24.763 6.801 ( -10.274 18.092 8.749) 22.570 7.018 ( -3.124 12.592 -1.606) 13.073 7.154 ( 3.806 5.063 1.333) 6.473 7.214 ( -4.321 5.536 -0.770) 7.065 7.307 ( 0.791 15.998 4.681) 16.687 7.316 ( 2.153 13.150 -1.467) 13.406 7.541 ( -9.969 19.713 -8.001) 23.494 7.694 ( 6.756 24.619 -15.345) 29.786 7.816 ( 1.262 1.207 4.956) 5.255 7.879 ( -0.744 6.767 -4.245) 8.023 8.266 ( 3.944 8.555 4.299) 10.355 8.428 ( 8.958 16.237 7.483) 19.996 8.780 ( -6.329 2.714 -4.194) 8.062 8.818 ( 1.414 -0.021 -10.972) 11.063 9.027 ( -0.656 11.553 -6.240) 13.147 9.175 ( -7.168 -2.064 3.545) 8.259 9.239 ( -2.563 0.742 -1.836) 3.238 9.328 ( 1.750 12.247 6.981) 14.205 9.480 ( -3.739 3.570 -1.519) 5.388 9.614 ( 9.301 7.057 -3.196) 12.105 9.698 ( -4.171 7.201 -8.598) 11.966 9.854 ( 10.670 8.161 8.599) 15.950 9.894 ( 10.982 12.752 0.796) 16.848 10.044 ( -6.149 12.449 -0.596) 13.898 10.196 ( -2.625 14.260 4.760) 15.261 10.211 ( -3.414 10.122 5.097) 11.835 10.382 ( -3.411 20.190 -1.395) 20.523 10.630 ( 5.063 2.528 -1.920) 5.976 10.713 ( -5.087 -0.022 -5.730) 7.663 11.042 ( -0.970 4.629 1.513) 4.966 11.061 ( 0.329 5.809 6.574) 8.779 11.212 ( -4.223 -4.036 4.609) 7.440 11.395 ( 1.855 0.996 -5.124) 5.540 11.452 ( 0.431 -7.051 3.040) 7.691 11.642 ( 2.590 -2.765 -0.664) 3.847 12.007 ( 1.578 -1.074 -0.497) 1.973 12.119 ( 0.595 -0.781 -4.097) 4.213 12.344 ( -7.445 2.125 6.289) 9.974 12.446 ( 4.980 10.450 0.762) 11.601 12.889 ( -0.799 2.629 -1.555) 3.157 12.971 ( -4.394 -0.705 -2.196) 4.963 13.230 ( 3.870 -0.595 5.061) 6.399 13.497 ( -0.078 -2.754 -4.649) 5.404 14.120 ( 5.709 2.290 2.825) 6.769 14.185 ( -5.431 1.128 1.990) 5.894 14.406 ( -1.394 0.641 0.837) 1.748 14.479 ( 1.621 -0.791 -0.341) 1.835 15.495 ( -1.433 3.378 2.594) 4.494 15.669 ( -2.156 2.474 -5.333) 6.261 15.801 ( -0.487 -0.465 1.039) 1.238 15.956 ( 3.628 -4.297 -1.355) 5.785 17.697 ( -1.933 2.388 3.519) 4.671 17.895 ( 4.192 -0.505 -5.043) 6.577 18.082 ( -3.858 -4.168 3.537) 6.691 18.179 ( 1.514 -6.159 -1.129) 6.442 19.832 ( -1.293 3.412 1.651) 4.005 19.953 ( 2.550 2.528 -3.660) 5.127 20.126 ( -2.135 -1.466 2.991) 3.956 20.219 ( 1.035 -2.441 -1.341) 2.971 20.511 ( 0.796 5.316 -0.087) 5.376 20.514 ( 0.473 4.974 -0.259) 5.003 20.601 ( -3.198 8.875 4.514) 10.458 20.802 ( 2.101 6.565 -3.181) 7.592 21.329 ( -2.006 17.877 -0.536) 17.997 21.336 ( 1.477 17.575 -0.282) 17.639 21.470 ( 1.543 16.933 7.598) 18.624 21.954 ( -0.471 5.784 -11.302) 12.705 24.224 ( -0.257 0.415 1.674) 1.743 24.323 ( 1.008 -0.691 -1.748) 2.133 24.451 ( -2.569 -1.257 0.430) 2.892 24.511 ( 1.349 -0.877 -1.885) 2.479 30.126 ( -0.984 0.618 3.060) 3.273 30.159 ( -0.879 0.247 4.098) 4.199 30.301 ( 0.667 -0.953 -3.327) 3.525 30.343 ( 0.584 -1.605 -2.985) 3.439 34.243 ( -5.918 -1.384 6.182) 8.669 34.543 ( 5.502 -8.427 -2.371) 10.340 34.832 ( -0.547 -11.703 5.691) 13.025 35.450 ( -0.737 -15.860 -15.745) 22.360 37.031 ( -1.260 -9.520 2.993) 10.059 37.173 ( -0.690 -11.552 -1.364) 11.653 37.369 ( -0.433 -13.706 7.422) 15.592 37.524 ( 2.215 -13.073 -1.405) 13.334 40.774 ( 1.688 -2.962 8.435) 9.098 41.133 ( 0.217 -10.061 -4.981) 11.228 41.507 ( 13.293 -13.557 12.312) 22.629 41.702 ( -0.216 -15.151 4.173) 15.716 42.164 ( 5.925 -18.145 -11.228) 22.146 42.550 ( -18.798 -27.865 -12.783) 35.962 42.933 ( -16.749 -25.834 14.031) 33.835 43.356 ( 16.796 -34.839 -5.313) 39.040 ======================= Grid point 144 (62/126) ======================= q-point: ( 0.17 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.423 ( 3.661 28.031 24.782) 37.594 3.712 ( 5.566 34.803 21.542) 41.308 4.264 ( -4.861 18.123 -24.532) 30.885 4.323 ( -4.022 24.731 -18.466) 31.125 4.731 ( -20.733 14.721 7.847) 26.611 4.904 ( -2.212 8.129 6.235) 10.481 4.986 ( -5.045 15.565 -1.975) 16.481 5.093 ( -19.022 9.836 3.955) 21.777 5.376 ( -3.131 12.478 2.051) 13.028 5.642 ( 9.085 9.875 -6.558) 14.935 5.742 ( -1.592 4.004 5.373) 6.887 5.769 ( -5.131 13.379 7.546) 16.195 6.093 ( 2.535 11.780 -1.089) 12.098 6.310 ( 0.018 11.234 5.966) 12.720 6.509 ( -2.446 8.346 0.051) 8.697 6.564 ( 1.966 15.892 -10.438) 19.115 6.732 ( 12.757 30.841 -0.206) 33.376 6.752 ( 0.005 13.061 4.042) 13.672 6.954 ( 4.571 6.197 -5.825) 9.655 7.184 ( -1.082 16.814 -5.152) 17.618 7.230 ( 0.719 9.157 4.881) 10.402 7.282 ( 3.742 3.451 -3.019) 5.918 7.370 ( -1.756 18.120 6.056) 19.185 7.431 ( 3.582 17.084 0.731) 17.471 7.863 ( 6.125 9.141 -4.858) 12.028 7.873 ( 14.447 26.103 -13.499) 32.746 7.909 ( 4.843 0.100 4.295) 6.474 8.376 ( -9.386 12.382 -2.124) 15.682 8.450 ( -0.595 -3.185 -5.994) 6.814 8.624 ( 7.486 15.264 3.184) 17.296 8.842 ( -3.148 4.029 -6.054) 7.924 8.992 ( -0.758 8.901 -8.422) 12.277 9.080 ( -3.588 -0.293 12.189) 12.709 9.255 ( 1.798 1.864 0.767) 2.701 9.355 ( -1.280 12.887 5.408) 14.034 9.446 ( 1.772 7.227 -1.589) 7.609 9.572 ( -5.376 15.881 -5.478) 17.639 9.672 ( -4.285 2.092 -2.652) 5.456 9.892 ( -5.178 8.218 -3.437) 10.303 10.010 ( 4.378 7.769 2.849) 9.362 10.063 ( -7.252 12.255 -1.550) 14.324 10.154 ( 13.477 12.600 2.402) 18.606 10.253 ( 6.048 9.228 5.160) 12.180 10.411 ( 0.154 13.592 -1.101) 13.638 10.648 ( 3.473 -0.586 -2.956) 4.598 10.875 ( 17.945 -2.271 0.991) 18.116 11.026 ( -1.224 5.207 1.806) 5.645 11.074 ( -2.957 4.110 5.956) 7.817 11.152 ( -2.741 -2.139 3.377) 4.847 11.399 ( -1.106 -2.610 -1.213) 3.084 11.446 ( -1.026 -1.719 1.261) 2.366 11.653 ( -0.858 -1.825 -0.933) 2.222 12.033 ( -3.005 -1.295 -1.087) 3.448 12.071 ( 0.055 -2.385 -3.720) 4.419 12.245 ( -6.294 5.588 3.204) 9.006 12.517 ( -1.288 9.705 4.211) 10.658 12.648 ( -11.840 0.284 -4.829) 12.790 12.969 ( -1.396 0.551 1.860) 2.390 13.234 ( -4.523 -3.338 2.844) 6.300 13.407 ( -8.461 3.712 -4.865) 10.442 14.124 ( 0.824 -0.367 0.367) 0.974 14.265 ( 6.720 2.940 4.563) 8.639 14.477 ( 6.529 -2.412 2.283) 7.325 14.566 ( 7.002 -0.106 -2.386) 7.398 15.522 ( 2.818 4.116 2.630) 5.640 15.619 ( -0.673 3.561 -3.398) 4.968 15.793 ( -0.518 -0.633 -0.217) 0.846 15.991 ( 0.786 -5.229 -1.855) 5.603 17.699 ( 0.923 2.145 2.064) 3.116 17.954 ( 4.710 -1.272 -4.565) 6.682 18.006 ( -5.884 -3.396 3.185) 7.503 18.173 ( -2.008 -5.639 0.205) 5.990 19.830 ( 0.542 3.619 0.692) 3.724 19.976 ( 1.583 2.863 -2.662) 4.217 20.079 ( -4.124 -1.391 2.454) 4.996 20.201 ( -2.522 -2.149 -0.917) 3.438 20.484 ( -1.998 4.465 -0.279) 4.899 20.498 ( -3.162 5.194 0.379) 6.093 20.595 ( 0.593 9.343 3.303) 9.927 20.831 ( 2.016 6.730 -2.338) 7.405 21.299 ( -0.667 18.180 -1.022) 18.221 21.352 ( 0.213 17.418 0.120) 17.419 21.544 ( 2.005 15.373 7.836) 17.371 21.895 ( 0.188 8.604 -11.163) 14.095 24.242 ( 1.328 0.411 1.228) 1.855 24.335 ( 0.709 -0.610 -0.093) 0.940 24.403 ( -1.823 -0.432 -1.575) 2.448 24.519 ( -0.118 -2.015 -0.440) 2.066 30.121 ( -1.007 1.033 3.038) 3.363 30.167 ( -0.409 -0.213 4.126) 4.151 30.291 ( 0.150 -1.122 -3.228) 3.420 30.344 ( 0.962 -1.347 -2.884) 3.325 34.210 ( -0.324 -1.086 3.941) 4.101 34.644 ( 5.363 -9.264 1.456) 10.803 34.795 ( -5.335 -11.189 3.753) 12.952 35.318 ( -5.185 -13.709 -12.321) 19.147 36.990 ( -3.558 -9.327 2.126) 10.207 37.212 ( 4.283 -12.452 0.040) 13.168 37.348 ( -3.129 -12.518 1.999) 13.058 37.656 ( 9.734 -15.553 1.129) 18.383 40.890 ( 6.621 -5.410 10.165) 13.283 41.161 ( 5.680 -9.067 -7.613) 13.131 41.614 ( -5.305 -13.945 -3.246) 15.269 41.839 ( 4.600 -18.205 -0.801) 18.795 42.054 ( -14.069 -21.159 -4.207) 25.755 42.327 ( 7.499 -25.228 8.253) 27.583 42.657 ( -16.637 -23.196 4.315) 28.870 43.678 ( 17.501 -36.699 -4.530) 40.910 ======================= Grid point 145 (63/126) ======================= q-point: ( 0.33 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.537 ( 3.551 28.704 9.279) 30.375 4.020 ( 7.827 25.712 12.549) 29.662 4.054 ( 4.534 25.638 -1.323) 26.069 4.270 ( -17.731 11.776 -3.200) 21.524 4.355 ( -5.012 19.319 1.079) 19.988 4.646 ( -26.168 13.328 1.021) 29.384 4.850 ( -2.416 15.612 0.764) 15.816 4.983 ( 0.370 11.196 0.743) 11.227 5.307 ( -3.748 11.364 1.098) 12.017 5.530 ( -11.418 11.718 0.439) 16.367 5.749 ( -6.951 7.771 3.174) 10.898 5.879 ( 15.121 5.937 -8.946) 18.545 6.261 ( 9.240 12.407 4.851) 16.212 6.302 ( -9.439 8.655 -2.888) 13.128 6.374 ( -3.488 9.191 8.367) 12.910 6.477 ( -1.254 19.463 -10.889) 22.337 6.725 ( -2.660 18.801 4.009) 19.407 6.961 ( 6.363 20.538 0.302) 21.504 7.062 ( 9.168 11.277 -4.659) 15.262 7.126 ( -3.752 5.440 -0.845) 6.662 7.299 ( -3.927 18.544 -1.148) 18.990 7.352 ( 15.394 20.125 -3.659) 25.600 7.489 ( 11.564 1.386 9.420) 14.980 7.586 ( 6.270 18.306 8.147) 20.995 7.817 ( -4.701 14.285 -14.195) 20.680 8.002 ( 1.908 -1.541 11.038) 11.307 8.127 ( 12.449 22.853 -12.566) 28.899 8.171 ( 3.437 14.233 -7.559) 16.478 8.522 ( -4.235 9.494 4.868) 11.479 8.672 ( -0.037 8.916 -9.168) 12.789 8.714 ( -4.541 5.646 -5.180) 8.907 8.952 ( 1.819 14.106 -4.170) 14.822 9.174 ( 4.354 2.253 6.076) 7.807 9.203 ( -5.988 3.491 2.936) 7.527 9.317 ( -5.485 3.697 -2.369) 7.026 9.371 ( -5.240 21.187 2.177) 21.933 9.549 ( -2.718 12.805 -0.259) 13.093 9.611 ( -0.031 -1.429 -1.664) 2.194 9.783 ( 0.564 11.715 -2.790) 12.056 10.037 ( 1.983 8.906 -3.205) 9.671 10.095 ( 3.882 7.071 0.383) 8.076 10.330 ( 4.168 13.454 -4.742) 14.862 10.362 ( 2.294 6.930 3.098) 7.930 10.431 ( 6.861 1.039 5.099) 8.611 10.744 ( 5.173 -2.286 0.059) 5.656 10.958 ( -8.046 -5.500 -1.387) 9.844 11.014 ( -2.830 6.593 14.272) 15.974 11.164 ( 2.143 -0.115 1.814) 2.810 11.255 ( 15.796 -7.032 1.167) 17.330 11.359 ( -1.160 -2.395 3.298) 4.238 11.442 ( 0.427 2.983 -2.182) 3.721 11.630 ( -0.303 2.057 -1.486) 2.555 11.907 ( -6.200 2.165 -4.109) 7.747 11.969 ( -10.761 -2.945 0.123) 11.157 12.200 ( -3.533 -0.972 4.070) 5.476 12.356 ( -4.676 4.434 -4.980) 8.144 12.652 ( 4.794 6.259 0.612) 7.908 12.910 ( -6.043 0.683 2.980) 6.772 13.153 ( -3.777 1.111 -4.526) 5.999 13.190 ( -10.636 4.920 -0.563) 11.733 14.191 ( 3.885 0.779 3.051) 5.001 14.383 ( 3.591 1.936 3.642) 5.469 14.596 ( 4.461 -0.809 -0.014) 4.534 14.672 ( 5.547 -2.291 -1.499) 6.186 15.585 ( 1.544 6.393 2.025) 6.882 15.636 ( 3.883 1.307 0.125) 4.100 15.787 ( 0.715 -0.880 -2.186) 2.463 15.963 ( -2.775 -5.057 -2.557) 6.310 17.752 ( 4.200 0.925 0.379) 4.317 17.909 ( -5.845 -1.964 1.930) 6.461 18.021 ( 4.388 -2.471 -2.760) 5.743 18.111 ( -5.114 -4.082 1.352) 6.681 19.863 ( 3.018 3.947 -0.249) 4.975 19.975 ( -2.109 2.866 0.751) 3.636 20.026 ( -0.963 -0.755 -0.416) 1.292 20.122 ( -5.327 -0.424 -0.765) 5.399 20.444 ( -2.543 4.457 0.890) 5.208 20.454 ( -0.929 3.811 -0.570) 3.964 20.627 ( 0.981 9.884 3.167) 10.425 20.844 ( 0.551 7.492 -2.211) 7.831 21.296 ( 0.756 18.234 -1.429) 18.306 21.343 ( -0.942 17.586 -0.776) 17.628 21.607 ( 0.960 14.077 6.561) 15.560 21.861 ( 1.132 11.100 -7.894) 13.668 24.276 ( 1.915 0.344 0.275) 1.965 24.327 ( -2.037 1.409 1.983) 3.173 24.402 ( 2.718 -3.337 -2.346) 4.902 24.500 ( -1.845 -2.740 0.171) 3.308 30.119 ( -0.729 1.058 2.874) 3.149 30.179 ( -0.551 -0.576 4.148) 4.224 30.281 ( 0.345 -1.155 -3.001) 3.234 30.349 ( 0.954 -1.390 -2.589) 3.090 34.258 ( 3.556 -2.707 2.732) 5.238 34.628 ( -8.634 -8.011 6.133) 13.279 34.824 ( 8.640 -11.247 -2.653) 14.428 35.171 ( -6.513 -13.858 -5.308) 16.206 36.952 ( -1.448 -8.801 2.075) 9.158 37.248 ( -0.516 -11.644 -4.042) 12.337 37.349 ( 2.408 -13.711 5.292) 14.893 37.803 ( 5.071 -17.808 -1.091) 18.549 41.090 ( 6.853 -9.239 6.456) 13.191 41.242 ( 7.528 -8.959 -13.381) 17.776 41.357 ( -10.032 -13.009 -7.488) 18.054 41.767 ( -3.210 -12.477 -0.794) 12.908 41.962 ( -2.359 -17.694 -7.124) 19.219 42.279 ( -18.716 -19.864 9.788) 28.994 42.724 ( 14.820 -35.231 19.155) 42.752 43.894 ( 9.059 -39.207 -8.013) 41.030 ======================= Grid point 146 (64/126) ======================= q-point: (-0.50 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.643 ( -7.580 21.297 8.100) 24.014 3.853 ( -6.512 22.952 -7.485) 25.005 4.061 ( -16.719 25.134 6.740) 30.930 4.181 ( 12.909 25.228 6.828) 29.150 4.442 ( 12.903 13.881 3.502) 19.273 4.544 ( 10.001 12.155 9.470) 18.370 4.821 ( 0.865 18.431 -7.812) 20.037 5.023 ( 3.412 12.642 4.896) 13.980 5.254 ( -3.307 11.948 -3.730) 12.946 5.315 ( -11.215 12.209 4.551) 17.192 5.695 ( -0.325 8.082 7.212) 10.837 5.977 ( -14.239 10.441 -14.341) 22.747 6.051 ( 5.600 4.327 -9.439) 11.798 6.223 ( -4.437 14.603 -13.722) 20.525 6.454 ( 0.252 12.401 18.023) 21.879 6.601 ( 8.009 13.747 4.449) 16.521 6.713 ( 1.214 15.322 3.117) 15.683 6.939 ( -7.324 11.514 -5.175) 14.594 7.107 ( 4.225 20.291 3.717) 21.057 7.220 ( -3.202 17.862 2.439) 18.310 7.240 ( 7.511 2.888 -5.733) 9.880 7.526 ( -2.898 15.109 2.169) 15.536 7.587 ( 5.257 18.622 -14.332) 24.080 7.671 ( 3.202 3.706 5.830) 7.614 7.890 ( 4.334 16.534 14.008) 22.099 8.054 ( 3.856 -0.536 7.414) 8.375 8.218 ( -1.060 13.222 -6.378) 14.718 8.258 ( 2.994 19.817 -12.436) 23.586 8.362 ( 0.201 15.592 0.176) 15.594 8.563 ( -7.379 7.296 -14.543) 17.865 8.646 ( -3.443 8.725 0.601) 9.400 9.025 ( 6.067 24.442 -7.731) 26.344 9.113 ( -1.812 8.528 2.471) 9.061 9.189 ( 0.630 12.476 1.584) 12.592 9.295 ( -0.858 3.327 -3.860) 5.168 9.317 ( -2.872 13.001 2.912) 13.629 9.487 ( 0.898 5.087 3.157) 6.054 9.583 ( -2.287 -0.416 -2.625) 3.507 9.833 ( 1.801 10.496 -2.811) 11.015 10.020 ( -2.206 11.134 -5.268) 12.513 10.152 ( 2.669 9.539 3.672) 10.564 10.345 ( -3.678 8.406 -1.098) 9.241 10.446 ( 8.101 -0.951 2.020) 8.403 10.595 ( 5.334 4.650 4.767) 8.532 10.750 ( -11.610 -10.118 -1.941) 15.522 10.788 ( 0.528 -4.974 1.085) 5.118 11.063 ( -1.706 7.742 16.604) 18.399 11.192 ( -0.098 -1.222 4.846) 4.999 11.303 ( -2.994 -4.556 -1.187) 5.579 11.432 ( -2.026 1.847 1.920) 3.347 11.489 ( 5.598 1.440 -3.233) 6.623 11.601 ( -3.586 -1.572 -4.331) 5.839 11.803 ( -1.872 1.690 -0.135) 2.526 11.932 ( 8.700 -4.209 -2.207) 9.914 12.088 ( -6.108 -1.772 5.416) 8.354 12.369 ( 5.639 6.890 -6.975) 11.310 12.748 ( 3.727 2.821 0.513) 4.702 12.794 ( -5.923 3.004 1.557) 6.821 13.009 ( -4.319 5.314 -2.119) 7.168 13.167 ( 4.228 3.589 -2.162) 5.953 14.245 ( -0.638 1.042 4.910) 5.060 14.416 ( -1.594 1.912 2.360) 3.430 14.615 ( -1.751 -0.639 -0.957) 2.095 14.743 ( 2.195 -1.868 -0.744) 2.977 15.612 ( 0.180 5.431 4.070) 6.789 15.706 ( 2.855 2.258 0.220) 3.647 15.807 ( 2.932 -2.205 -3.914) 5.364 15.877 ( -4.629 -4.305 -2.944) 6.973 17.820 ( -3.169 -0.562 0.497) 3.257 17.850 ( 4.874 -1.047 -0.311) 4.995 18.013 ( -5.432 -2.146 1.606) 6.057 18.087 ( 3.355 -3.545 -0.881) 4.960 19.923 ( -1.074 2.465 0.182) 2.695 19.934 ( 2.325 4.921 0.147) 5.445 20.012 ( -2.614 -1.145 0.117) 2.856 20.056 ( 1.304 1.141 -1.266) 2.146 20.417 ( -0.797 4.379 0.696) 4.505 20.449 ( 0.514 2.947 -0.374) 3.015 20.654 ( 0.094 10.158 3.783) 10.840 20.834 ( -0.223 7.948 -2.727) 8.406 21.303 ( 0.151 18.345 -0.990) 18.372 21.324 ( 0.201 17.759 -1.876) 17.859 21.614 ( -3.727 13.914 5.088) 15.276 21.880 ( 4.660 11.173 -5.384) 13.249 24.293 ( -1.340 1.471 0.937) 2.199 24.314 ( 0.778 -0.261 0.240) 0.855 24.446 ( 1.913 -3.802 -0.399) 4.275 24.466 ( -0.811 -2.941 -0.339) 3.070 30.120 ( -0.605 0.824 2.789) 2.971 30.183 ( -1.093 -0.644 4.091) 4.283 30.278 ( 0.867 -1.092 -2.821) 3.147 30.353 ( 0.792 -1.593 -2.443) 3.022 34.348 ( 4.187 -4.848 3.521) 7.310 34.512 ( -5.411 -6.427 2.230) 8.693 34.919 ( -3.281 -11.775 0.043) 12.224 35.097 ( 6.046 -14.680 -3.345) 16.225 36.959 ( 0.668 -8.616 3.218) 9.222 37.206 ( -0.812 -10.726 -6.085) 12.359 37.426 ( 1.561 -15.014 8.733) 17.440 37.806 ( -3.063 -17.967 -5.045) 18.912 40.943 ( -10.748 -6.731 -6.310) 14.165 41.287 ( 4.698 -9.422 -20.115) 22.704 41.564 ( 18.940 -14.928 14.373) 28.074 41.689 ( -7.568 -13.064 1.807) 15.206 41.851 ( -6.140 -14.086 -1.664) 15.456 42.047 ( -5.547 -18.987 -4.099) 20.201 43.033 ( 6.191 -36.787 25.243) 45.042 43.918 ( -1.395 -40.905 -11.946) 42.637 ======================= Grid point 147 (65/126) ======================= q-point: (-0.33 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.415 ( -11.907 35.013 -2.233) 37.050 3.511 ( -21.057 27.129 16.040) 37.903 4.363 ( 24.484 15.232 5.276) 29.314 4.538 ( 19.313 17.597 7.248) 27.114 4.573 ( 7.535 10.390 -4.995) 13.772 4.790 ( 12.359 17.783 -5.050) 22.237 4.885 ( 7.187 14.623 4.597) 16.930 5.077 ( 1.704 17.880 -20.381) 27.166 5.131 ( -5.946 18.109 15.792) 24.752 5.302 ( 4.104 3.594 9.490) 10.946 5.654 ( -8.487 10.452 0.346) 13.468 5.847 ( 4.076 14.507 3.530) 15.477 5.938 ( -6.592 10.675 -9.782) 15.909 6.188 ( 3.826 6.611 -9.929) 12.527 6.494 ( -6.196 10.180 8.387) 14.572 6.634 ( -2.431 9.121 0.244) 9.442 6.798 ( 1.311 15.678 -2.798) 15.979 6.813 ( 1.349 17.548 4.244) 18.105 7.134 ( -1.582 17.547 -0.298) 17.621 7.233 ( -3.119 14.576 4.528) 15.578 7.263 ( 0.220 9.496 -3.646) 10.174 7.483 ( -2.909 18.489 2.744) 18.917 7.565 ( -3.913 13.829 -3.524) 14.797 7.712 ( -1.231 -1.824 -1.233) 2.523 7.780 ( -10.147 8.924 1.086) 13.556 8.032 ( -6.084 17.485 -7.168) 19.852 8.194 ( -1.724 -0.661 1.767) 2.556 8.250 ( -8.716 12.338 -11.168) 18.786 8.317 ( -2.399 19.526 -1.740) 19.749 8.589 ( 14.707 12.669 -6.859) 20.587 8.633 ( 6.315 14.747 5.659) 17.011 8.999 ( -2.369 10.785 -3.606) 11.616 9.184 ( 7.083 11.681 -3.834) 14.188 9.243 ( 1.118 6.357 3.962) 7.573 9.304 ( 3.633 5.860 -2.059) 7.195 9.312 ( 1.008 14.688 4.007) 15.258 9.528 ( 0.934 0.489 0.865) 1.364 9.575 ( 4.566 10.806 -2.007) 11.901 9.815 ( -2.370 11.143 -0.276) 11.396 9.922 ( -4.729 6.261 -6.113) 9.946 10.202 ( -3.239 17.254 2.162) 17.688 10.226 ( -7.272 1.240 1.364) 7.502 10.414 ( -7.360 6.381 -2.506) 10.058 10.625 ( -1.841 -1.603 -1.856) 3.067 10.686 ( -0.287 3.894 3.109) 4.991 10.859 ( 5.588 -6.476 6.403) 10.684 11.066 ( -4.598 2.928 11.984) 13.166 11.150 ( -9.359 1.529 -0.328) 9.489 11.252 ( -1.828 -1.625 2.375) 3.410 11.370 ( -1.513 -3.394 2.673) 4.578 11.485 ( -4.224 -0.463 -5.194) 6.711 11.536 ( 1.635 1.503 -1.817) 2.869 11.891 ( 8.323 1.054 -0.538) 8.406 12.008 ( 1.244 -3.880 1.225) 4.255 12.178 ( 10.210 3.727 -1.044) 10.919 12.491 ( 11.867 3.809 -4.142) 13.134 12.634 ( -8.830 0.211 1.433) 8.948 12.875 ( 6.457 5.334 0.497) 8.390 13.013 ( 4.123 0.303 1.108) 4.280 13.289 ( 9.999 4.500 -3.169) 11.414 14.204 ( -5.982 -0.386 3.310) 6.847 14.353 ( -5.871 3.892 2.130) 7.359 14.545 ( -5.286 -0.875 0.994) 5.450 14.721 ( -4.406 -0.502 -1.546) 4.696 15.610 ( -3.288 3.688 3.917) 6.306 15.741 ( 0.357 1.797 1.684) 2.489 15.805 ( -0.599 -1.561 -3.108) 3.529 15.839 ( 2.694 -3.828 -4.894) 6.772 17.770 ( -2.181 0.551 0.132) 2.254 17.881 ( -3.027 -0.601 2.117) 3.743 18.005 ( 5.465 -3.006 -2.233) 6.625 18.132 ( 1.510 -4.459 0.887) 4.791 19.896 ( -1.126 3.625 -1.126) 3.959 19.920 ( -2.231 2.420 1.260) 3.524 20.058 ( 4.929 0.607 0.444) 4.986 20.104 ( 4.028 -0.431 -1.238) 4.236 20.424 ( 1.286 4.991 0.372) 5.168 20.466 ( 1.415 3.192 -0.005) 3.492 20.660 ( -1.512 9.739 4.134) 10.687 20.815 ( -0.245 7.827 -3.309) 8.501 21.294 ( 0.160 18.421 -1.311) 18.468 21.335 ( 1.295 17.939 -1.190) 18.025 21.539 ( -6.123 15.502 4.355) 17.227 21.954 ( 5.177 7.936 -5.309) 10.862 24.269 ( -1.605 1.003 0.355) 1.925 24.314 ( -0.876 -0.833 0.985) 1.560 24.458 ( 1.756 -1.181 -2.220) 3.067 24.485 ( 0.794 -4.025 0.921) 4.204 30.123 ( -0.578 0.558 2.834) 2.945 30.177 ( -1.666 -0.321 3.909) 4.262 30.285 ( 1.325 -1.035 -2.776) 3.246 30.354 ( 0.558 -1.747 -2.541) 3.133 34.412 ( 1.264 -5.340 -1.041) 5.585 34.462 ( -3.618 -6.639 9.804) 12.381 34.798 ( -4.190 -10.990 -4.567) 12.617 35.279 ( 12.088 -16.066 -3.225) 20.362 36.998 ( 1.482 -8.888 3.877) 9.809 37.170 ( 0.360 -10.171 -6.434) 12.041 37.465 ( -3.025 -16.068 11.157) 19.794 37.674 ( -7.026 -15.951 -6.399) 18.567 40.787 ( -5.432 -3.362 1.183) 6.497 41.231 ( 0.310 -9.672 -17.300) 19.822 41.477 ( -13.048 -12.547 0.864) 18.122 41.746 ( -2.949 -13.949 2.949) 14.559 42.027 ( 4.876 -16.794 -6.428) 18.631 42.074 ( 25.128 -19.559 9.730) 33.297 43.166 ( -3.964 -34.103 23.594) 41.659 43.734 ( -11.493 -41.069 -15.990) 45.546 ======================= Grid point 148 (66/126) ======================= q-point: (-0.17 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.195 ( -11.382 36.165 17.936) 41.942 3.447 ( 1.968 37.231 11.432) 38.997 4.434 ( -2.936 12.860 -10.728) 17.003 4.797 ( 8.548 13.023 0.035) 15.578 4.890 ( 0.311 16.597 -3.325) 16.929 4.907 ( 2.018 24.757 -6.985) 25.802 5.065 ( 8.193 9.189 0.797) 12.337 5.081 ( 12.620 10.340 -2.362) 16.486 5.215 ( 16.134 11.877 5.390) 20.746 5.408 ( 2.349 9.336 5.033) 10.863 5.654 ( -2.331 11.097 12.247) 16.690 5.779 ( 6.294 12.693 -0.505) 14.176 6.028 ( 5.103 13.061 6.786) 15.578 6.195 ( 1.300 5.800 -8.091) 10.040 6.315 ( -8.298 6.290 -6.789) 12.430 6.587 ( -3.992 10.081 0.375) 10.849 6.779 ( -2.892 27.231 0.295) 27.385 6.922 ( 2.880 11.109 3.796) 12.088 7.067 ( -7.450 17.160 6.581) 19.831 7.117 ( -4.663 9.607 -1.077) 10.733 7.259 ( -0.532 4.808 -1.290) 5.006 7.375 ( -7.929 14.033 -3.085) 16.410 7.386 ( -10.768 16.620 3.361) 20.086 7.631 ( 3.125 19.883 -15.263) 25.259 7.789 ( -1.213 -4.448 9.836) 10.863 7.858 ( -10.845 20.334 -14.642) 27.304 7.960 ( -5.663 7.334 -8.205) 12.376 8.249 ( -2.679 10.880 3.963) 11.885 8.276 ( 3.088 16.644 3.572) 17.301 8.664 ( 7.265 8.047 -6.475) 12.628 8.961 ( -0.908 1.652 -3.223) 3.733 8.965 ( 12.580 13.377 0.402) 18.367 9.226 ( 1.610 3.136 2.212) 4.162 9.248 ( -2.011 1.140 2.300) 3.261 9.337 ( -2.813 5.827 -2.862) 7.075 9.413 ( 8.171 8.377 -0.208) 11.704 9.592 ( 6.743 10.010 4.355) 12.831 9.667 ( -1.731 3.437 -4.376) 5.828 9.736 ( 1.630 6.348 5.349) 8.460 9.835 ( -3.459 13.024 -8.616) 15.994 10.065 ( -0.853 11.947 -1.433) 12.063 10.170 ( -3.941 19.877 3.715) 20.601 10.334 ( -4.998 10.609 2.363) 11.963 10.506 ( -7.789 4.480 -0.539) 9.001 10.653 ( -4.430 6.538 0.187) 7.899 10.896 ( -10.740 -0.360 -2.885) 11.126 11.001 ( 2.305 1.338 5.237) 5.876 11.050 ( -2.072 2.642 6.209) 7.059 11.242 ( -1.682 -2.939 4.625) 5.732 11.400 ( 1.612 -3.796 -1.295) 4.323 11.414 ( 0.024 -0.919 -2.604) 2.761 11.582 ( 3.761 -0.228 -0.582) 3.812 11.991 ( 2.004 0.946 -1.903) 2.921 12.065 ( 4.733 -3.169 1.764) 5.963 12.332 ( 7.325 8.677 -0.965) 11.397 12.477 ( -8.720 -0.080 2.092) 8.968 12.738 ( 14.270 2.568 -3.229) 14.854 12.994 ( 4.644 2.420 2.982) 6.026 13.111 ( 5.518 -2.397 0.860) 6.078 13.454 ( 7.792 1.321 -2.893) 8.416 14.094 ( -4.654 0.127 0.489) 4.681 14.260 ( -5.269 4.083 3.738) 7.642 14.461 ( -4.233 -0.406 2.308) 4.838 14.577 ( -9.390 -0.142 -2.096) 9.622 15.543 ( -4.705 2.858 2.676) 6.121 15.726 ( -1.519 -0.008 -2.791) 3.177 15.803 ( -0.012 0.683 -0.255) 0.729 15.886 ( 4.543 -3.535 -2.284) 6.193 17.730 ( -3.190 1.722 3.164) 4.812 17.859 ( 1.478 -0.022 -2.981) 3.327 18.090 ( 2.836 -4.519 0.432) 5.352 18.151 ( 0.815 -5.274 0.274) 5.343 19.859 ( -2.428 3.526 1.750) 4.625 19.924 ( 2.137 2.249 -2.918) 4.259 20.122 ( 1.206 -0.487 2.676) 2.975 20.179 ( 4.152 -1.967 -1.918) 4.979 20.465 ( 2.883 5.449 0.156) 6.166 20.497 ( 1.778 4.522 0.201) 4.863 20.638 ( -2.902 9.001 4.168) 10.335 20.798 ( 0.252 7.210 -3.525) 8.030 21.307 ( 1.759 18.175 -1.045) 18.289 21.350 ( 0.490 17.941 -0.636) 17.959 21.460 ( -4.254 16.877 5.573) 18.276 21.991 ( 1.952 5.223 -8.040) 9.784 24.238 ( -1.885 0.308 1.201) 2.257 24.313 ( 0.627 -0.379 -0.574) 0.931 24.477 ( 0.093 -2.438 -0.502) 2.491 24.495 ( 0.898 -1.072 -1.081) 1.768 30.126 ( -0.609 0.388 2.947) 3.034 30.164 ( -1.654 0.193 3.953) 4.290 30.297 ( 1.329 -0.946 -3.063) 3.470 30.350 ( 0.327 -1.783 -2.801) 3.336 34.352 ( -8.345 -3.366 6.632) 11.178 34.474 ( 2.441 -7.751 0.542) 8.144 34.786 ( 3.031 -10.781 -0.989) 11.242 35.444 ( 8.094 -17.310 -9.547) 21.361 37.028 ( 0.023 -9.220 1.975) 9.429 37.175 ( 2.299 -10.282 -2.595) 10.851 37.397 ( -7.750 -15.696 7.576) 19.074 37.558 ( -3.532 -13.619 -1.282) 14.128 40.742 ( -1.743 -2.247 5.996) 6.636 41.183 ( -0.893 -10.579 -5.923) 12.157 41.323 ( -0.726 -10.493 2.044) 10.715 41.713 ( -2.120 -14.104 2.890) 14.552 42.098 ( 6.998 -15.899 -10.915) 20.516 42.555 ( 19.538 -25.091 6.926) 32.546 43.116 ( -12.161 -30.219 19.018) 37.719 43.398 ( -13.688 -38.656 -17.821) 44.713 ======================= Grid point 149 (67/126) ======================= q-point: ( 0.00 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.853 ( -1.145 31.471 17.212) 35.889 4.369 ( 3.967 37.114 11.293) 38.996 4.546 ( -1.273 8.177 -10.399) 13.290 4.974 ( -2.700 1.066 6.296) 6.933 5.136 ( -7.921 18.736 -21.157) 29.349 5.189 ( -4.705 11.202 12.479) 17.417 5.351 ( 1.414 13.994 -3.961) 14.613 5.450 ( 0.962 12.551 -1.442) 12.670 5.554 ( -3.545 3.917 -0.376) 5.296 5.692 ( 10.188 3.029 2.877) 11.011 5.753 ( 1.001 5.653 -6.134) 8.401 6.080 ( -3.973 4.829 3.598) 7.215 6.246 ( 3.238 2.598 -4.359) 6.020 6.359 ( 6.904 5.380 -0.387) 8.761 6.438 ( 8.832 8.007 5.909) 13.306 6.732 ( 2.543 7.374 -0.758) 7.837 6.888 ( -13.732 1.415 3.742) 14.303 7.142 ( -0.970 -1.498 -2.921) 3.423 7.213 ( -1.229 6.045 8.021) 10.119 7.258 ( 4.630 6.541 -0.812) 8.055 7.337 ( -0.772 19.775 -0.906) 19.811 7.460 ( -1.126 2.135 1.142) 2.670 7.650 ( 0.807 12.999 2.661) 13.293 7.744 ( -3.966 5.173 -2.390) 6.943 8.006 ( -4.717 12.645 5.962) 14.754 8.064 ( -3.884 15.224 -1.898) 15.826 8.191 ( 4.760 12.396 -14.526) 19.680 8.423 ( 5.071 10.855 -2.881) 12.323 8.706 ( 4.575 5.601 -3.227) 7.919 8.742 ( -9.146 1.745 -0.142) 9.312 8.960 ( 7.031 9.540 -0.841) 11.881 9.124 ( -4.949 -0.998 -1.030) 5.152 9.223 ( -2.677 -0.095 2.086) 3.395 9.276 ( 1.868 9.018 -5.435) 10.694 9.472 ( 6.273 3.789 3.524) 8.132 9.510 ( -1.905 2.806 -0.449) 3.421 9.614 ( 3.418 -3.375 -4.357) 6.484 9.900 ( 1.660 10.618 -8.474) 13.686 10.016 ( 0.588 5.987 9.458) 11.209 10.187 ( 6.301 14.472 -0.354) 15.788 10.289 ( -11.145 9.368 6.510) 15.948 10.451 ( -1.305 11.303 9.711) 14.959 10.534 ( 0.133 17.515 0.869) 17.537 10.721 ( -0.992 6.878 -9.081) 11.435 10.794 ( 2.565 15.266 -2.121) 15.625 10.928 ( -3.350 22.655 -5.744) 23.611 11.131 ( 3.685 6.041 3.980) 8.119 11.182 ( -0.925 8.160 1.005) 8.274 11.253 ( -3.745 8.305 6.458) 11.167 11.354 ( -2.118 0.618 4.039) 4.602 11.444 ( 4.045 2.345 -3.248) 5.693 11.616 ( 0.653 2.718 -0.410) 2.825 11.974 ( 1.310 -0.899 0.790) 1.775 12.101 ( 0.710 -0.623 -4.664) 4.759 12.386 ( -4.365 1.556 7.204) 8.565 12.662 ( 6.250 8.899 -3.292) 11.362 12.903 ( -7.635 -4.375 -1.647) 8.952 12.939 ( 0.029 1.659 -2.845) 3.294 13.153 ( 4.993 -6.895 4.644) 9.697 13.372 ( -0.194 -8.945 -3.975) 9.790 14.183 ( 4.075 3.528 2.115) 5.790 14.241 ( -4.324 3.604 0.562) 5.658 14.444 ( -4.306 2.376 -0.611) 4.956 14.486 ( 3.837 1.013 -0.916) 4.073 15.573 ( -0.896 4.008 3.615) 5.471 15.725 ( -0.647 2.519 -2.622) 3.694 15.792 ( 0.018 -0.377 -0.078) 0.386 15.889 ( 1.184 -1.955 -0.037) 2.286 17.744 ( -1.492 2.362 2.686) 3.876 17.890 ( 2.935 0.048 -3.465) 4.541 18.017 ( -2.631 -2.267 1.975) 3.995 18.068 ( 1.158 -4.720 -0.572) 4.894 19.854 ( -1.127 -0.643 1.230) 1.788 19.944 ( 2.305 -2.306 -2.724) 4.249 20.073 ( -1.990 -3.245 2.482) 4.544 20.159 ( 0.944 -3.492 -1.331) 3.855 20.624 ( -0.383 5.353 0.102) 5.368 20.637 ( 1.259 6.269 -0.628) 6.425 20.760 ( -2.483 6.431 3.177) 7.591 20.895 ( 1.539 2.857 -2.131) 3.882 21.664 ( -0.535 15.139 -0.366) 15.153 21.668 ( 0.075 15.240 -0.517) 15.249 21.776 ( 0.849 13.355 5.228) 14.367 22.063 ( -0.061 5.009 -6.000) 7.817 24.256 ( -0.240 2.576 1.323) 2.906 24.327 ( 0.743 1.016 -1.255) 1.778 24.434 ( -1.237 -0.413 0.978) 1.630 24.503 ( 0.584 -0.007 -1.770) 1.864 30.140 ( -0.413 0.848 2.391) 2.570 30.166 ( -0.934 0.463 3.002) 3.178 30.280 ( 0.379 -1.071 -2.654) 2.888 30.310 ( 0.715 -1.674 -2.389) 3.004 34.230 ( -4.361 0.099 2.937) 5.259 34.404 ( 4.485 -5.407 -1.461) 7.175 34.627 ( -0.635 -8.453 6.509) 10.688 35.145 ( 0.123 -14.281 -11.753) 18.496 36.849 ( -1.210 -8.344 1.802) 8.622 36.954 ( -0.770 -10.014 -1.346) 10.133 37.106 ( 0.367 -12.269 5.478) 13.441 37.256 ( 1.549 -13.256 -1.511) 13.431 40.732 ( 0.554 -1.187 5.489) 5.643 40.943 ( 1.051 -8.572 -2.888) 9.106 41.257 ( 10.188 -11.248 10.136) 18.250 41.437 ( -1.269 -11.038 1.649) 11.232 41.833 ( 1.723 -14.476 -10.669) 18.065 42.032 ( -14.661 -23.471 -11.563) 29.993 42.437 ( -11.941 -23.166 10.603) 28.137 42.696 ( 14.930 -30.662 -1.480) 34.135 ======================= Grid point 150 (68/126) ======================= q-point: ( 0.17 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.973 ( 4.064 26.980 16.715) 31.998 4.415 ( -2.310 30.993 9.355) 32.456 4.518 ( 1.355 12.600 -4.486) 13.443 4.832 ( -11.694 21.518 -16.410) 29.480 4.960 ( -6.580 6.252 6.233) 11.011 5.053 ( -11.982 11.347 2.201) 16.648 5.281 ( -14.728 9.202 5.976) 18.366 5.299 ( -4.776 14.957 -4.354) 16.294 5.564 ( -0.595 6.821 -0.047) 6.847 5.759 ( 2.299 3.046 0.249) 3.824 5.794 ( 2.126 2.989 -4.894) 6.116 5.998 ( -2.628 8.272 0.091) 8.680 6.301 ( 6.205 9.195 0.055) 11.093 6.480 ( 5.539 6.126 -3.657) 9.032 6.606 ( -2.036 2.885 4.230) 5.510 6.728 ( 3.811 3.454 -6.490) 8.281 6.857 ( 2.783 0.870 3.340) 4.434 7.120 ( 1.945 4.864 -8.415) 9.912 7.182 ( -0.691 4.917 9.185) 10.441 7.359 ( 1.438 13.500 4.529) 14.312 7.419 ( 6.418 6.107 -2.594) 9.232 7.548 ( 4.949 -0.338 9.744) 10.934 7.570 ( -1.815 19.950 -0.829) 20.049 7.720 ( 3.003 10.149 -1.371) 10.672 7.955 ( -4.804 8.672 15.798) 18.651 8.068 ( 5.761 11.895 -8.482) 15.704 8.239 ( 3.973 -4.339 -16.113) 17.153 8.477 ( 4.403 13.863 -11.224) 18.373 8.622 ( 1.603 10.592 2.821) 11.077 8.825 ( 3.955 5.777 1.101) 7.088 8.996 ( -5.052 7.677 -5.134) 10.527 9.070 ( 1.934 5.769 7.421) 9.597 9.186 ( -1.518 1.624 1.730) 2.817 9.342 ( 7.610 9.669 -7.510) 14.415 9.462 ( -2.684 2.720 -2.105) 4.363 9.556 ( -2.628 -0.346 -3.604) 4.474 9.626 ( 4.436 1.958 2.473) 5.443 9.924 ( 6.181 11.075 -8.570) 15.308 9.998 ( -9.473 7.942 2.475) 12.607 10.192 ( -0.850 5.248 14.027) 15.001 10.276 ( -0.958 7.239 -3.049) 7.913 10.397 ( -2.278 15.382 4.337) 16.143 10.593 ( 2.013 18.800 1.419) 18.961 10.660 ( -0.971 6.417 -4.262) 7.765 10.868 ( -0.425 17.769 0.642) 17.786 10.900 ( 8.978 9.605 -2.082) 13.312 11.098 ( -7.514 3.644 1.142) 8.429 11.197 ( 0.844 10.575 1.283) 10.685 11.232 ( -1.023 9.109 7.085) 11.585 11.346 ( 0.137 1.710 1.408) 2.220 11.515 ( 4.130 6.416 -2.181) 7.936 11.648 ( 2.352 2.576 -0.056) 3.488 11.993 ( -0.446 -1.947 1.058) 2.260 12.062 ( -1.590 2.058 -5.551) 6.130 12.310 ( -7.696 1.000 3.770) 8.628 12.626 ( -16.163 0.317 -1.579) 16.243 12.739 ( 3.296 8.293 -0.690) 8.951 12.946 ( -0.051 -2.909 0.516) 2.954 13.155 ( -1.588 -4.002 -0.491) 4.333 13.426 ( -0.144 -2.416 -2.829) 3.723 14.130 ( -0.335 0.770 0.467) 0.961 14.324 ( 4.500 2.613 2.788) 5.903 14.442 ( 3.828 -0.728 0.432) 3.921 14.580 ( 5.866 0.500 -1.600) 6.101 15.601 ( 1.996 3.530 2.973) 5.029 15.699 ( -0.471 4.131 -1.997) 4.612 15.791 ( -0.283 0.344 0.087) 0.454 15.899 ( 0.062 -3.669 -0.458) 3.698 17.743 ( 0.328 2.171 1.539) 2.681 17.930 ( 2.570 -1.034 -2.487) 3.723 17.962 ( -3.578 -1.124 1.145) 3.921 18.072 ( -0.966 -4.350 0.379) 4.472 19.852 ( 0.562 -0.703 0.415) 0.991 19.970 ( 1.705 -2.421 -2.114) 3.639 20.031 ( -3.689 -2.913 2.215) 5.197 20.145 ( -1.847 -3.325 -0.873) 3.902 20.590 ( -2.420 5.478 -0.197) 5.992 20.621 ( -2.776 6.038 -0.052) 6.646 20.764 ( 1.339 6.924 2.264) 7.407 20.928 ( 2.388 3.000 -1.495) 4.116 21.643 ( -0.493 15.697 -0.853) 15.728 21.677 ( 0.068 14.778 0.143) 14.779 21.822 ( 1.153 12.161 5.355) 13.338 22.042 ( 1.056 6.194 -6.235) 8.852 24.268 ( 0.959 2.153 1.087) 2.596 24.338 ( 1.101 0.893 -0.941) 1.702 24.406 ( -2.105 0.570 0.434) 2.224 24.494 ( -0.829 -0.535 -1.101) 1.478 30.142 ( -0.586 1.103 2.289) 2.608 30.167 ( -0.572 0.145 3.134) 3.189 30.269 ( -0.018 -1.068 -2.650) 2.858 30.315 ( 0.927 -1.516 -2.323) 2.925 34.194 ( -0.898 -0.409 2.101) 2.321 34.495 ( 5.916 -5.738 -0.257) 8.246 34.605 ( -4.909 -7.542 5.918) 10.771 35.050 ( -4.110 -12.652 -10.180) 16.751 36.817 ( -2.556 -7.800 1.356) 8.319 36.977 ( 3.020 -10.658 0.069) 11.078 37.100 ( -2.296 -11.840 1.800) 12.195 37.341 ( 6.746 -15.392 0.005) 16.806 40.795 ( 3.809 -3.916 6.236) 8.290 40.992 ( 5.655 -7.514 -4.337) 10.356 41.364 ( -7.772 -10.598 -5.742) 14.342 41.522 ( 9.350 -13.766 7.590) 18.290 41.667 ( -9.168 -16.867 -2.482) 19.358 41.880 ( 2.467 -19.213 -2.470) 19.527 42.214 ( -15.340 -20.642 3.925) 26.016 42.973 ( 13.901 -33.095 -2.070) 35.955 ======================= Grid point 151 (69/126) ======================= q-point: ( 0.33 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.082 ( -0.041 24.710 10.933) 27.021 4.464 ( 0.067 10.178 -5.680) 11.656 4.517 ( -0.028 24.040 14.032) 27.836 4.590 ( -5.543 25.254 -8.553) 27.233 4.745 ( -7.574 18.224 2.319) 19.871 4.917 ( -14.993 13.231 4.317) 20.457 5.106 ( -1.584 9.829 6.123) 11.688 5.213 ( -2.837 13.018 -5.691) 14.488 5.468 ( -6.937 4.901 0.692) 8.521 5.727 ( -3.037 7.807 4.969) 9.740 5.915 ( -4.227 8.472 -5.394) 10.897 5.950 ( 10.405 3.078 -6.232) 12.513 6.436 ( -1.272 8.483 -9.317) 12.664 6.455 ( -4.375 4.643 0.831) 6.433 6.546 ( 2.768 8.145 5.248) 10.077 6.721 ( 2.855 5.782 -12.962) 14.478 6.979 ( 7.362 -5.240 5.058) 10.356 7.054 ( -2.932 8.620 -3.939) 9.921 7.211 ( -8.096 7.146 -1.053) 10.850 7.374 ( 8.346 0.840 3.609) 9.132 7.503 ( 0.111 9.312 6.663) 11.451 7.596 ( -1.045 9.871 5.799) 11.496 7.745 ( 8.526 15.315 3.919) 17.962 7.841 ( 9.673 1.269 4.957) 10.943 7.948 ( -1.774 3.968 -0.145) 4.349 8.138 ( 2.979 11.603 1.560) 12.080 8.282 ( 12.130 4.489 -5.177) 13.931 8.525 ( 4.286 6.139 -11.993) 14.138 8.676 ( -1.154 8.886 8.114) 12.089 8.807 ( -3.993 8.469 -10.719) 14.232 8.900 ( -2.691 8.516 -0.667) 8.956 9.181 ( 4.548 3.357 7.635) 9.500 9.255 ( 11.084 6.612 0.691) 12.925 9.329 ( -6.935 3.921 -2.833) 8.456 9.421 ( 1.478 14.402 -8.370) 16.723 9.468 ( -2.353 -3.550 -9.997) 10.866 9.719 ( 1.023 0.577 1.242) 1.710 9.845 ( -5.962 12.500 1.625) 13.944 9.983 ( 2.494 13.130 -2.321) 13.565 10.191 ( -4.315 10.340 0.637) 11.223 10.265 ( 2.417 9.140 5.029) 10.708 10.390 ( -0.910 0.228 3.319) 3.449 10.630 ( -2.729 14.746 0.446) 15.003 10.636 ( 1.181 8.453 0.442) 8.547 10.829 ( -3.886 7.542 3.947) 9.357 10.979 ( -1.605 9.640 -4.872) 10.920 11.110 ( 6.868 2.349 5.484) 9.097 11.191 ( 1.465 8.073 0.024) 8.205 11.286 ( 2.189 10.796 8.931) 14.181 11.372 ( 1.331 6.772 1.485) 7.059 11.582 ( 5.243 9.295 -2.692) 11.006 11.662 ( -0.627 1.637 -2.758) 3.268 11.927 ( -7.352 -1.640 -0.926) 7.589 11.993 ( -4.255 6.866 -1.869) 8.291 12.166 ( -7.759 -0.142 3.246) 8.411 12.436 ( -2.014 2.642 -4.425) 5.533 12.783 ( 1.381 4.812 1.283) 5.168 12.935 ( -1.708 1.751 -0.022) 2.446 13.151 ( 2.187 -0.383 -1.710) 2.802 13.286 ( -10.660 3.300 -3.528) 11.703 14.202 ( 4.969 0.034 2.306) 5.478 14.397 ( 2.344 -0.363 1.262) 2.687 14.543 ( 5.896 -3.803 1.187) 7.116 14.649 ( 1.988 -1.051 -0.666) 2.345 15.657 ( 2.593 0.847 0.424) 2.761 15.699 ( 0.724 4.646 1.394) 4.904 15.787 ( 0.425 0.840 -1.351) 1.647 15.881 ( -1.948 -3.049 -0.499) 3.652 17.773 ( 2.583 1.228 0.249) 2.871 17.886 ( -4.120 -0.325 0.897) 4.229 17.980 ( 2.784 -1.722 -1.573) 3.631 18.037 ( -3.022 -3.087 0.912) 4.415 19.880 ( 2.649 -1.086 -0.408) 2.891 19.967 ( -3.638 -2.279 1.951) 4.716 19.989 ( 0.856 -2.634 -1.285) 3.053 20.091 ( -3.402 -2.477 -0.657) 4.259 20.552 ( -1.516 5.617 -0.167) 5.820 20.569 ( -2.405 6.221 0.045) 6.670 20.805 ( 1.586 7.191 2.160) 7.674 20.954 ( 1.095 3.505 -1.489) 3.962 21.640 ( 0.594 15.733 -1.054) 15.779 21.670 ( -0.758 14.820 -0.259) 14.841 21.859 ( 0.135 11.038 4.876) 12.068 22.042 ( 1.769 7.142 -5.018) 8.906 24.296 ( 1.561 1.584 0.495) 2.279 24.359 ( 0.727 1.126 1.125) 1.750 24.369 ( -1.190 0.461 -1.191) 1.746 24.466 ( -1.714 -0.840 -0.592) 1.999 30.141 ( -0.663 1.088 2.046) 2.410 30.173 ( -0.478 0.021 3.313) 3.347 30.259 ( 0.266 -0.991 -2.458) 2.664 30.320 ( 0.758 -1.492 -2.263) 2.814 34.213 ( 1.607 -1.768 2.387) 3.377 34.505 ( -6.726 -4.445 4.812) 9.389 34.630 ( 7.868 -7.921 -1.948) 11.333 34.921 ( -5.713 -10.910 -5.722) 13.580 36.790 ( -0.941 -7.195 1.711) 7.455 37.017 ( 0.605 -10.970 -2.231) 11.211 37.086 ( 0.626 -12.179 3.671) 12.735 37.440 ( 3.676 -17.679 -1.761) 18.143 40.916 ( 3.935 -7.849 3.421) 9.423 41.065 ( 3.220 -8.629 -8.903) 12.810 41.156 ( -3.205 -6.981 -4.346) 8.825 41.542 ( -2.367 -9.529 -0.880) 9.858 41.634 ( -0.885 -14.756 -4.423) 15.430 41.898 ( -15.137 -17.838 7.941) 24.705 42.107 ( 10.417 -26.435 13.012) 31.251 43.141 ( 6.432 -35.272 -6.149) 36.377 ======================= Grid point 152 (70/126) ======================= q-point: (-0.50 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.077 ( -5.860 21.467 8.719) 23.899 4.324 ( -3.085 23.181 -5.346) 23.988 4.568 ( -2.406 23.274 2.337) 23.514 4.660 ( -4.057 16.688 1.785) 17.266 4.700 ( 7.206 18.924 3.000) 20.470 4.801 ( 8.908 14.053 11.727) 20.356 5.152 ( -0.106 12.513 -6.126) 13.933 5.194 ( 6.418 6.372 3.361) 9.648 5.370 ( -4.895 5.062 3.511) 7.868 5.684 ( -6.224 19.090 4.791) 20.643 5.826 ( 0.452 5.800 -1.679) 6.055 6.042 ( -0.219 -0.277 -8.186) 8.193 6.237 ( -4.080 10.687 -10.852) 15.767 6.386 ( -2.502 4.596 -19.793) 20.473 6.630 ( 0.793 6.640 13.247) 14.839 6.824 ( 5.315 8.309 0.869) 9.901 6.972 ( -3.222 -4.098 -4.597) 6.950 6.993 ( -1.779 8.324 -3.172) 9.084 7.266 ( 10.468 -0.007 4.762) 11.501 7.410 ( -5.562 3.047 -1.296) 6.473 7.487 ( 0.991 11.280 1.328) 11.402 7.648 ( -0.899 7.443 11.511) 13.737 7.810 ( -3.737 4.876 9.193) 11.057 7.898 ( -2.806 6.956 -3.156) 8.137 8.033 ( 8.011 3.654 -1.957) 9.020 8.223 ( 1.103 12.380 10.056) 15.988 8.459 ( 4.498 4.370 -6.337) 8.916 8.474 ( -4.006 8.425 -8.096) 12.353 8.682 ( 2.919 7.010 -6.743) 10.155 8.760 ( 3.993 15.271 4.749) 16.484 8.838 ( -3.656 9.591 3.214) 10.756 9.170 ( -7.132 1.979 1.202) 7.499 9.266 ( -0.313 -3.629 2.455) 4.393 9.364 ( -0.430 0.121 -12.396) 12.404 9.389 ( 0.820 13.090 -9.151) 15.993 9.571 ( 17.434 6.767 -6.359) 19.753 9.655 ( -3.650 8.561 -0.986) 9.359 9.785 ( -1.568 16.709 -2.662) 16.992 10.024 ( -2.310 2.068 7.332) 7.961 10.092 ( -5.869 9.767 2.848) 11.745 10.272 ( -3.206 5.420 2.069) 6.628 10.470 ( 7.777 2.442 -1.772) 8.342 10.530 ( -2.899 7.338 2.667) 8.329 10.673 ( -2.939 10.849 5.907) 12.698 10.797 ( 1.648 8.748 -0.090) 8.903 10.960 ( 0.004 11.707 -6.082) 13.192 11.128 ( -3.459 5.783 8.492) 10.840 11.277 ( 1.965 7.240 2.935) 8.055 11.359 ( -2.655 3.286 6.037) 7.368 11.391 ( 1.935 11.814 2.851) 12.306 11.601 ( -2.471 3.827 -5.963) 7.504 11.675 ( 2.856 9.590 -2.474) 10.308 11.820 ( -0.068 -0.418 0.790) 0.896 11.907 ( -2.862 1.550 -1.713) 3.678 12.124 ( 1.751 6.108 5.198) 8.209 12.460 ( 5.937 2.210 -8.285) 10.430 12.769 ( -5.286 0.190 3.128) 6.145 12.911 ( 1.591 6.068 -2.666) 6.816 13.106 ( -6.411 4.066 -1.805) 7.804 13.222 ( 6.587 1.910 -2.486) 7.295 14.260 ( -1.272 0.166 3.936) 4.140 14.423 ( 0.826 -1.156 -0.943) 1.705 14.590 ( -3.027 -2.203 1.793) 4.151 14.685 ( 2.969 -3.949 0.156) 4.943 15.682 ( 0.051 0.652 0.845) 1.069 15.734 ( 1.787 1.483 1.134) 2.584 15.799 ( 1.207 0.890 -1.410) 2.059 15.827 ( -3.073 -0.686 -0.959) 3.291 17.822 ( -1.704 0.643 0.115) 1.825 17.837 ( 2.821 -0.185 -0.299) 2.842 17.973 ( -3.507 -1.711 1.241) 4.095 18.026 ( 2.161 -2.456 -0.615) 3.329 19.914 ( -1.634 -1.857 0.372) 2.502 19.946 ( 3.652 -2.488 -0.882) 4.506 19.983 ( -2.213 -1.647 1.323) 3.059 20.048 ( 0.225 -1.880 -1.239) 2.263 20.537 ( -0.078 6.309 -0.033) 6.309 20.545 ( -0.035 5.684 -0.086) 5.684 20.833 ( 0.193 7.111 2.611) 7.577 20.953 ( -0.220 3.896 -1.918) 4.348 21.646 ( -0.117 15.487 -0.528) 15.496 21.658 ( 0.510 15.293 -1.207) 15.349 21.861 ( -2.471 10.806 4.135) 11.831 22.060 ( 2.494 7.004 -3.788) 8.344 24.320 ( 0.451 1.054 0.269) 1.177 24.332 ( -1.693 2.064 0.179) 2.676 24.393 ( 1.658 -1.003 0.393) 1.977 24.441 ( -0.115 -0.385 -0.846) 0.937 30.138 ( -0.641 0.920 1.929) 2.231 30.178 ( -0.724 0.101 3.361) 3.440 30.257 ( 0.757 -0.962 -2.295) 2.601 30.321 ( 0.576 -1.565 -2.267) 2.815 34.266 ( 2.295 -3.230 3.977) 5.614 34.417 ( -3.833 -3.254 1.140) 5.156 34.711 ( -3.178 -8.904 -1.066) 9.515 34.853 ( 5.528 -9.746 -3.792) 11.829 36.799 ( 0.618 -7.143 2.781) 7.690 36.995 ( -0.484 -10.064 -4.435) 11.009 37.134 ( 0.882 -13.561 6.851) 15.219 37.439 ( -2.049 -17.900 -4.641) 18.605 40.827 ( -6.548 -4.739 -3.481) 8.800 41.108 ( 2.822 -8.282 -14.249) 16.721 41.296 ( 13.762 -11.481 10.367) 20.705 41.448 ( -9.473 -10.583 0.924) 14.234 41.585 ( -3.159 -12.004 -1.741) 12.534 41.698 ( -2.815 -15.506 -3.245) 16.090 42.376 ( 7.404 -28.622 21.430) 36.514 43.139 ( -2.381 -36.219 -10.628) 37.821 ======================= Grid point 153 (71/126) ======================= q-point: (-0.33 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.029 ( -4.713 25.709 9.627) 27.853 4.146 ( -9.991 35.411 0.445) 36.797 4.658 ( 3.057 10.476 2.143) 11.121 4.739 ( 14.379 12.794 1.559) 19.309 4.887 ( 11.574 12.035 1.029) 16.729 5.055 ( 13.434 10.505 4.358) 17.602 5.164 ( 1.877 12.954 1.167) 13.141 5.302 ( 1.226 4.011 4.847) 6.410 5.349 ( 5.267 11.077 -7.877) 14.577 5.618 ( -1.193 21.249 4.332) 21.719 5.821 ( -4.030 7.211 5.020) 9.667 6.012 ( 3.174 3.389 -3.404) 5.757 6.119 ( -3.059 7.095 -12.539) 14.728 6.297 ( 1.668 5.879 -14.954) 16.154 6.663 ( -7.729 7.438 5.085) 11.871 6.734 ( -3.667 3.106 1.275) 4.971 6.986 ( 2.487 5.715 -1.532) 6.418 7.046 ( 4.943 -0.349 2.563) 5.579 7.311 ( -1.995 1.670 -5.601) 6.176 7.453 ( -4.522 8.017 -1.340) 9.301 7.495 ( 7.798 5.008 4.867) 10.468 7.625 ( -6.261 6.824 11.800) 15.000 7.725 ( -9.477 3.518 7.903) 12.832 7.795 ( -7.956 9.215 -0.392) 12.180 8.075 ( -2.289 15.438 -3.009) 15.895 8.177 ( -3.714 2.514 0.479) 4.510 8.378 ( -2.089 8.243 1.720) 8.675 8.525 ( -5.045 13.266 -11.419) 18.216 8.620 ( 4.514 8.941 -4.750) 11.085 8.778 ( -0.436 10.786 -0.033) 10.795 8.985 ( 7.938 11.741 5.646) 15.256 9.089 ( -1.358 -0.315 -1.047) 1.743 9.230 ( -0.917 -5.706 1.345) 5.934 9.303 ( -1.872 4.200 -10.697) 11.643 9.387 ( 1.987 10.936 -7.050) 13.162 9.545 ( -3.366 2.549 0.996) 4.338 9.754 ( 1.126 10.507 0.393) 10.575 9.812 ( -13.413 -3.141 -1.525) 13.860 9.880 ( 11.026 18.682 -1.779) 21.766 10.124 ( 2.324 14.671 0.080) 14.854 10.323 ( 5.167 -3.672 9.228) 11.195 10.438 ( -5.217 9.428 -0.254) 10.778 10.620 ( 0.669 11.380 5.994) 12.880 10.648 ( 3.345 13.503 -5.140) 14.830 10.877 ( 5.001 7.233 4.421) 9.842 10.911 ( -0.977 7.999 -6.831) 10.564 11.062 ( -7.303 6.981 6.561) 12.046 11.258 ( -6.195 5.570 2.560) 8.715 11.310 ( -1.604 7.278 5.984) 9.558 11.424 ( -2.073 13.231 5.552) 14.498 11.520 ( -3.059 4.818 -7.505) 9.429 11.646 ( -2.331 7.341 -1.183) 7.793 11.896 ( 6.556 -0.318 -1.553) 6.745 11.939 ( 4.180 -1.168 0.144) 4.343 12.264 ( 10.608 3.508 1.730) 11.306 12.542 ( 6.777 2.167 -8.614) 11.173 12.666 ( -5.363 1.522 4.874) 7.405 12.967 ( 4.538 3.315 -1.475) 5.810 13.040 ( -1.125 1.916 -0.004) 2.222 13.351 ( 8.351 1.642 -3.383) 9.159 14.196 ( -6.323 -0.592 2.121) 6.696 14.410 ( -2.851 1.535 1.309) 3.493 14.511 ( -4.843 -2.328 0.935) 5.454 14.696 ( -2.638 -2.247 -0.398) 3.488 15.664 ( -3.292 1.194 2.713) 4.429 15.744 ( -1.078 -0.547 -1.003) 1.571 15.785 ( 1.308 -0.606 -1.660) 2.199 15.829 ( 1.407 2.269 -0.024) 2.670 17.789 ( -1.328 1.276 0.111) 1.845 17.874 ( -0.885 -0.020 1.328) 1.596 17.953 ( 2.690 -2.041 -1.477) 3.686 18.056 ( 0.918 -3.134 0.525) 3.308 19.898 ( 0.282 -1.895 -1.194) 2.257 19.925 ( -3.203 -1.297 1.549) 3.787 20.029 ( 3.957 -2.677 0.258) 4.784 20.074 ( 2.658 -2.505 -1.013) 3.790 20.550 ( 1.621 6.465 -0.221) 6.669 20.564 ( 1.983 5.568 0.136) 5.912 20.832 ( -1.760 6.811 2.972) 7.636 20.932 ( -0.945 3.811 -2.343) 4.572 21.639 ( 0.128 15.588 -0.830) 15.610 21.673 ( 1.179 15.333 -0.769) 15.398 21.816 ( -4.114 12.067 3.676) 13.269 22.086 ( 1.908 5.467 -3.522) 6.778 24.297 ( -2.099 1.793 0.701) 2.848 24.322 ( -0.197 1.415 -0.303) 1.460 24.421 ( 1.197 -1.448 0.607) 1.974 24.459 ( 2.137 0.132 -1.174) 2.442 30.136 ( -0.563 0.781 1.996) 2.216 30.177 ( -1.061 0.323 3.226) 3.411 30.265 ( 1.189 -1.013 -2.252) 2.740 30.319 ( 0.387 -1.678 -2.335) 2.901 34.314 ( 1.068 -4.164 2.555) 5.000 34.382 ( -2.372 -1.807 4.438) 5.347 34.600 ( -4.103 -8.641 -3.527) 10.195 35.002 ( 9.900 -11.727 -3.925) 15.841 36.831 ( 1.075 -7.593 3.207) 8.312 36.970 ( 0.309 -9.552 -4.814) 10.701 37.157 ( -2.799 -14.188 7.915) 16.485 37.349 ( -4.262 -15.958 -4.935) 17.238 40.737 ( -3.182 -1.531 1.651) 3.898 41.046 ( -1.082 -8.585 -12.394) 15.116 41.239 ( -11.163 -10.737 -0.028) 15.489 41.489 ( -2.045 -11.253 2.648) 11.740 41.685 ( 15.820 -17.028 6.917) 24.250 41.743 ( 8.979 -13.156 -4.145) 16.459 42.539 ( -0.228 -28.073 19.617) 34.249 42.962 ( -10.251 -35.439 -14.582) 39.669 ======================= Grid point 154 (72/126) ======================= q-point: (-0.17 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.886 ( -10.460 32.602 13.421) 36.775 4.203 ( 8.277 36.659 5.095) 37.926 4.625 ( -2.442 7.115 -6.070) 9.666 4.963 ( 2.420 4.053 6.156) 7.757 5.155 ( 4.758 9.883 10.215) 14.989 5.218 ( 13.706 7.797 -1.817) 15.873 5.251 ( 5.482 7.842 -3.112) 10.062 5.369 ( 5.028 19.577 -16.462) 26.068 5.435 ( 10.367 9.387 2.705) 14.245 5.612 ( -1.608 9.516 -0.344) 9.657 5.864 ( -5.743 9.123 2.542) 11.076 5.933 ( 8.460 6.979 -0.183) 10.968 6.217 ( 7.640 3.098 3.684) 9.030 6.258 ( 0.331 4.317 -6.990) 8.222 6.468 ( -8.893 9.487 -4.439) 13.740 6.722 ( -1.648 4.267 2.328) 5.133 7.056 ( 2.043 0.313 5.226) 5.620 7.116 ( 0.892 1.768 6.317) 6.620 7.224 ( -6.163 2.377 -5.305) 8.472 7.311 ( -7.204 4.520 -4.180) 9.476 7.433 ( -9.974 17.826 4.491) 20.914 7.567 ( -8.815 4.013 0.145) 9.687 7.655 ( -4.404 10.563 3.271) 11.903 7.719 ( 5.065 3.290 4.235) 7.376 8.037 ( -0.911 15.739 1.304) 15.819 8.145 ( -1.975 10.630 0.121) 10.812 8.267 ( -6.180 12.965 -12.149) 18.811 8.407 ( -1.947 12.483 -0.598) 12.648 8.651 ( 1.826 7.379 -7.679) 10.805 8.828 ( 5.213 11.009 -1.644) 12.291 8.947 ( -7.665 -0.842 0.007) 7.711 9.170 ( 1.779 -2.744 1.837) 3.751 9.236 ( 0.152 -1.261 2.339) 2.661 9.265 ( 3.189 9.777 -7.700) 12.847 9.383 ( 0.505 6.359 -0.347) 6.388 9.548 ( 3.854 1.333 -3.156) 5.156 9.588 ( -8.039 -2.765 2.551) 8.876 9.836 ( 5.212 10.964 -0.579) 12.153 10.019 ( 2.770 14.322 5.044) 15.435 10.114 ( -0.041 13.831 -7.214) 15.599 10.376 ( -1.112 16.201 7.458) 17.870 10.432 ( -1.156 -3.509 3.677) 5.212 10.580 ( -4.990 18.867 4.887) 20.118 10.697 ( 3.708 16.540 -4.343) 17.498 10.855 ( -2.602 2.232 -7.784) 8.505 10.969 ( 1.438 12.624 0.714) 12.726 11.038 ( 3.314 8.720 5.056) 10.611 11.185 ( -2.709 10.400 3.811) 11.403 11.288 ( -2.981 8.302 2.956) 9.303 11.382 ( -3.786 4.440 5.521) 8.033 11.445 ( -1.228 4.021 -6.166) 7.463 11.620 ( -0.595 4.536 -0.046) 4.575 11.955 ( 0.848 -2.115 -0.275) 2.295 12.047 ( 6.737 0.421 -1.447) 6.903 12.416 ( 1.038 -0.883 2.404) 2.763 12.565 ( 4.025 7.672 -3.420) 9.314 12.768 ( 12.389 -0.396 0.435) 12.403 13.018 ( -0.301 -0.755 -0.372) 0.894 13.045 ( 2.418 -2.819 -0.213) 3.720 13.437 ( 0.578 -3.198 -2.422) 4.054 14.113 ( -1.138 1.547 0.502) 1.985 14.338 ( -5.438 3.024 2.654) 6.764 14.457 ( -1.165 0.347 0.325) 1.258 14.586 ( -8.112 0.335 -1.572) 8.270 15.603 ( -3.959 2.861 3.179) 5.828 15.734 ( 0.246 -0.138 -0.855) 0.901 15.796 ( 0.581 -0.551 -2.768) 2.881 15.859 ( 1.610 0.951 1.103) 2.171 17.766 ( -1.989 1.871 2.325) 3.586 17.865 ( 1.012 0.651 -2.006) 2.339 18.010 ( 2.892 -3.360 -0.367) 4.449 18.062 ( -0.449 -3.520 0.626) 3.603 19.879 ( -2.274 -0.825 1.504) 2.848 19.916 ( 1.932 -2.015 -2.209) 3.560 20.075 ( 0.580 -3.263 2.063) 3.904 20.126 ( 3.295 -3.203 -1.715) 4.905 20.590 ( 2.660 6.090 -0.289) 6.651 20.610 ( 2.426 5.752 0.174) 6.245 20.800 ( -3.092 6.528 3.095) 7.858 20.903 ( -0.804 3.293 -2.463) 4.190 21.647 ( 1.142 15.453 -0.753) 15.513 21.686 ( 0.242 15.139 -0.711) 15.157 21.766 ( -2.734 13.430 4.441) 14.407 22.088 ( 0.323 4.491 -4.555) 6.405 24.266 ( -1.543 2.390 1.128) 3.060 24.321 ( 0.440 1.160 -0.912) 1.540 24.439 ( 0.180 -1.145 0.979) 1.517 24.490 ( 1.768 0.181 -1.727) 2.478 30.137 ( -0.441 0.729 2.205) 2.364 30.171 ( -1.142 0.524 3.062) 3.310 30.277 ( 1.202 -1.055 -2.395) 2.880 30.314 ( 0.244 -1.751 -2.426) 3.002 34.316 ( -6.045 -0.339 3.528) 7.008 34.347 ( 1.782 -4.841 0.906) 5.238 34.587 ( 2.157 -8.798 1.067) 9.121 35.130 ( 6.552 -13.936 -7.960) 17.335 36.852 ( -0.130 -8.062 1.545) 8.210 36.970 ( 1.121 -9.884 -2.314) 10.213 37.106 ( -4.654 -13.024 5.555) 14.904 37.277 ( -2.118 -13.908 -1.470) 14.145 40.714 ( -1.160 -0.414 4.490) 4.656 40.979 ( -2.256 -9.414 -4.667) 10.747 41.125 ( 0.040 -8.890 1.824) 9.075 41.455 ( -1.912 -11.279 1.553) 11.545 41.805 ( 5.600 -12.913 -8.482) 16.433 42.078 ( 14.873 -22.033 5.892) 27.228 42.540 ( -8.025 -26.962 12.112) 30.627 42.685 ( -9.832 -31.952 -12.110) 35.556 ======================= Grid point 155 (73/126) ======================= q-point: ( 0.00 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.447 ( -1.066 25.804 6.299) 26.583 4.683 ( -1.207 7.198 -4.667) 8.663 4.910 ( 1.489 3.464 5.670) 6.809 5.073 ( -2.725 20.128 8.915) 22.181 5.389 ( -4.407 9.935 -0.584) 10.884 5.409 ( -1.337 8.581 4.039) 9.578 5.554 ( 6.134 4.778 -3.676) 8.601 5.647 ( -0.247 7.415 -0.358) 7.427 5.690 ( -2.636 5.044 -3.575) 6.722 5.731 ( 3.584 1.774 -0.195) 4.004 5.860 ( 0.523 9.962 -10.071) 14.176 6.157 ( -2.023 1.292 -5.024) 5.568 6.302 ( 5.678 5.944 6.119) 10.248 6.450 ( 3.023 4.862 4.051) 7.013 6.630 ( 1.348 9.889 2.639) 10.323 6.860 ( 4.647 4.961 -0.523) 6.818 6.892 ( -8.374 0.303 3.927) 9.254 7.074 ( -0.394 -3.335 -3.745) 5.031 7.208 ( 3.308 -3.773 3.518) 6.128 7.336 ( -4.781 -4.251 -3.455) 7.271 7.367 ( 3.185 2.196 -2.305) 4.503 7.686 ( -4.036 1.944 -0.623) 4.523 7.787 ( 2.105 2.662 -1.175) 3.591 7.873 ( -0.298 6.489 -0.108) 6.497 8.168 ( -3.136 -2.321 -4.001) 5.589 8.277 ( 0.468 10.604 -7.118) 12.780 8.365 ( -9.483 12.871 9.203) 18.447 8.598 ( -0.621 -2.222 1.414) 2.706 8.715 ( 1.280 3.092 -1.425) 3.638 8.840 ( 3.540 4.238 -1.962) 5.860 9.072 ( 1.669 1.272 4.751) 5.194 9.153 ( 1.409 1.147 0.484) 1.881 9.225 ( 0.295 2.304 1.213) 2.620 9.380 ( 0.639 3.044 1.053) 3.283 9.520 ( 3.146 4.712 -0.826) 5.726 9.560 ( 2.974 -1.182 1.048) 3.368 9.742 ( 0.856 11.466 -7.616) 13.791 10.049 ( 0.564 4.158 2.049) 4.670 10.131 ( -2.372 9.312 -4.335) 10.542 10.329 ( -4.557 1.298 -1.186) 4.884 10.428 ( 3.842 2.484 0.649) 4.621 10.603 ( 1.717 3.392 0.372) 3.820 10.767 ( -5.933 9.652 8.537) 14.186 10.946 ( -2.407 11.695 -7.785) 14.254 11.115 ( 9.330 13.232 0.189) 16.191 11.250 ( -6.603 13.440 -1.824) 15.085 11.326 ( -0.877 5.981 3.890) 7.189 11.411 ( -2.286 10.972 5.918) 12.674 11.444 ( -0.558 11.693 2.287) 11.928 11.553 ( 6.365 17.850 -1.145) 18.985 11.611 ( -3.417 14.856 -2.708) 15.482 11.758 ( 0.123 10.612 -0.741) 10.638 12.005 ( 3.679 5.454 1.920) 6.853 12.141 ( 0.929 6.009 -5.274) 8.049 12.412 ( -4.567 1.454 6.997) 8.481 12.729 ( 3.936 -2.154 -5.724) 7.273 12.853 ( -1.929 -0.718 1.205) 2.385 12.935 ( -9.528 -4.792 -0.143) 10.666 12.976 ( 11.801 -8.105 1.512) 14.396 13.165 ( -0.956 -11.064 -4.890) 12.134 14.249 ( 1.608 2.882 1.678) 3.702 14.308 ( -2.238 2.885 0.023) 3.651 14.477 ( -3.306 0.591 -1.251) 3.584 14.501 ( 2.816 0.186 -1.219) 3.074 15.640 ( -0.633 2.374 3.905) 4.613 15.727 ( 1.414 -1.782 1.372) 2.657 15.819 ( -0.372 2.819 -1.062) 3.036 15.884 ( -0.718 1.023 -1.006) 1.604 17.791 ( -1.117 2.302 1.914) 3.195 17.896 ( 1.716 0.496 -2.382) 2.978 17.987 ( -1.005 -0.945 0.684) 1.540 17.991 ( 0.465 -2.957 0.177) 2.999 19.829 ( -0.892 -1.396 0.759) 1.822 19.890 ( 1.688 -2.716 -1.892) 3.716 20.010 ( -1.527 -2.779 1.979) 3.738 20.083 ( 0.809 -3.885 -1.123) 4.125 20.713 ( -0.452 3.426 0.517) 3.494 20.740 ( 0.937 3.723 -0.566) 3.881 20.856 ( -1.723 3.268 1.523) 3.995 20.928 ( 1.171 0.652 -1.236) 1.823 21.929 ( 0.023 11.111 -0.073) 11.111 21.936 ( -0.351 11.193 -0.532) 11.211 22.003 ( 0.536 9.152 2.889) 9.612 22.150 ( -0.031 3.593 -2.940) 4.642 24.316 ( -0.216 3.138 0.782) 3.241 24.360 ( 0.484 2.093 -0.941) 2.345 24.432 ( -0.552 0.231 1.416) 1.537 24.506 ( 0.237 0.144 -1.485) 1.510 30.160 ( -0.037 1.076 1.625) 1.949 30.177 ( -0.875 0.679 1.953) 2.245 30.258 ( 0.173 -1.112 -1.880) 2.191 30.277 ( 0.672 -1.647 -1.688) 2.453 34.244 ( -3.936 1.195 0.388) 4.131 34.324 ( 3.748 -2.650 -0.920) 4.681 34.497 ( 0.247 -4.450 6.563) 7.933 34.883 ( -0.160 -11.697 -7.785) 14.051 36.704 ( -0.933 -5.868 0.961) 6.019 36.780 ( -0.068 -7.107 -1.464) 7.257 36.887 ( -0.007 -9.344 3.860) 10.110 37.007 ( 1.025 -11.135 -1.306) 11.258 40.721 ( -0.467 -0.359 2.469) 2.538 40.802 ( 1.990 -5.127 -0.723) 5.547 41.066 ( 6.189 -7.249 7.388) 12.060 41.268 ( 0.044 -5.520 1.581) 5.742 41.586 ( -7.873 -12.308 -9.437) 17.394 41.624 ( -4.037 -14.666 -8.927) 17.638 42.017 ( -7.370 -18.386 6.754) 20.928 42.134 ( 11.643 -25.046 1.227) 27.648 ======================= Grid point 156 (74/126) ======================= q-point: ( 0.17 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.491 ( 1.666 23.594 6.493) 24.528 4.642 ( -0.684 6.380 -4.355) 7.755 4.955 ( -0.151 -1.012 7.737) 7.804 5.037 ( -4.206 22.303 7.945) 24.047 5.224 ( -12.586 13.381 -1.965) 18.475 5.325 ( -6.897 14.750 -6.051) 17.371 5.465 ( -7.762 9.028 7.478) 14.060 5.579 ( -6.355 10.639 -1.544) 12.488 5.685 ( -4.594 6.873 -2.419) 8.613 5.800 ( 3.680 1.539 0.974) 4.107 5.858 ( 6.145 4.423 -10.404) 12.867 6.143 ( 1.392 5.969 -1.245) 6.254 6.452 ( 7.645 5.683 4.684) 10.615 6.557 ( 7.470 2.466 -1.431) 7.996 6.655 ( -3.319 2.257 3.264) 5.173 6.782 ( -2.765 4.664 1.072) 5.527 6.922 ( 1.336 4.500 -9.228) 10.353 7.086 ( 6.838 -3.962 -1.362) 8.019 7.209 ( -4.006 -2.422 -2.716) 5.413 7.362 ( 7.243 -8.265 9.046) 14.234 7.499 ( 7.104 2.351 10.031) 12.515 7.546 ( -8.017 -1.382 -8.245) 11.583 7.807 ( -1.044 1.274 0.440) 1.705 7.936 ( 9.025 5.931 -5.085) 11.937 8.114 ( -6.418 0.462 -4.501) 7.853 8.188 ( -5.833 10.586 9.278) 15.237 8.305 ( 5.916 11.846 -3.833) 13.784 8.582 ( -0.952 -1.261 -0.942) 1.839 8.741 ( -0.333 0.139 5.134) 5.146 8.916 ( 2.898 1.403 -2.676) 4.187 9.066 ( -2.812 2.016 -0.248) 3.469 9.151 ( -0.450 -2.170 1.397) 2.620 9.276 ( 2.255 8.213 4.944) 9.848 9.429 ( 3.646 2.276 -2.743) 5.098 9.529 ( -0.670 0.906 -3.219) 3.410 9.682 ( 7.884 9.129 2.202) 12.261 9.705 ( -0.446 6.760 -8.924) 11.204 10.020 ( -6.080 0.407 3.643) 7.099 10.151 ( 7.443 9.437 -5.989) 13.429 10.245 ( -1.365 2.692 -1.325) 3.297 10.446 ( -2.337 7.924 2.279) 8.570 10.641 ( 0.269 -1.441 -0.902) 1.721 10.738 ( 0.578 12.457 5.934) 13.810 10.863 ( -3.366 8.140 -0.420) 8.818 11.051 ( -12.183 6.577 -3.730) 14.338 11.285 ( 4.645 12.766 3.768) 14.097 11.312 ( -2.147 14.604 2.893) 15.042 11.388 ( -0.059 13.289 2.074) 13.450 11.463 ( 2.224 14.475 3.719) 15.109 11.576 ( 0.688 13.036 -0.966) 13.090 11.709 ( 7.474 16.482 -0.991) 18.125 11.754 ( 0.837 6.453 -1.765) 6.742 12.022 ( -3.274 6.649 -0.464) 7.426 12.155 ( 4.583 7.127 -5.745) 10.237 12.316 ( -8.680 0.525 4.109) 9.618 12.616 ( -11.145 -0.993 -0.708) 11.211 12.817 ( -1.980 -3.355 3.964) 5.558 12.897 ( 5.750 0.656 -3.644) 6.839 13.073 ( 2.552 -4.521 -2.162) 5.623 13.305 ( 8.975 -9.383 -2.470) 13.217 14.156 ( -4.017 1.933 0.550) 4.491 14.362 ( 1.534 0.944 2.149) 2.804 14.440 ( -0.032 0.151 -1.000) 1.012 14.567 ( 4.018 -1.956 -1.180) 4.622 15.655 ( 0.296 1.826 2.869) 3.413 15.755 ( 0.988 0.150 0.372) 1.066 15.808 ( -0.571 1.946 0.620) 2.121 15.862 ( -0.813 0.251 -1.159) 1.437 17.786 ( -0.102 2.167 1.108) 2.436 17.919 ( 1.599 -0.148 -1.546) 2.229 17.947 ( -2.582 -0.655 0.272) 2.678 18.003 ( -0.118 -2.309 0.465) 2.359 19.826 ( 0.453 -1.374 0.111) 1.451 19.911 ( 1.401 -3.050 -1.282) 3.592 19.975 ( -3.095 -2.347 1.634) 4.214 20.072 ( -1.473 -3.805 -0.727) 4.145 20.684 ( -2.239 3.680 0.112) 4.309 20.719 ( -2.611 3.484 -0.024) 4.354 20.869 ( 2.011 3.691 0.887) 4.296 20.961 ( 2.460 0.613 -0.759) 2.646 21.918 ( -0.330 11.468 -0.530) 11.485 21.938 ( -0.088 11.015 0.063) 11.015 22.029 ( 0.635 8.355 3.051) 8.918 22.145 ( 1.016 4.008 -3.221) 5.241 24.322 ( 0.407 2.894 0.623) 2.988 24.366 ( 0.696 1.702 -0.858) 2.029 24.421 ( -1.317 0.946 1.397) 2.141 24.491 ( -1.125 0.014 -1.336) 1.746 30.165 ( -0.366 1.098 1.397) 1.814 30.174 ( -0.406 0.607 2.199) 2.317 30.249 ( -0.084 -1.016 -1.896) 2.153 30.284 ( 0.855 -1.558 -1.647) 2.423 34.197 ( -1.632 0.687 0.699) 1.904 34.401 ( 5.188 -3.972 -1.529) 6.710 34.499 ( -3.306 -2.949 6.774) 8.094 34.819 ( -2.544 -10.158 -7.183) 12.698 36.684 ( -1.531 -5.272 0.850) 5.556 36.794 ( 1.900 -7.366 -0.611) 7.632 36.883 ( -1.611 -9.460 1.760) 9.756 37.055 ( 4.020 -12.705 -0.451) 13.334 40.734 ( 1.126 -2.088 2.337) 3.330 40.866 ( 5.101 -4.891 -1.847) 7.304 41.193 ( -8.546 -6.779 -6.735) 12.820 41.266 ( 9.096 -11.844 11.814) 19.042 41.409 ( -2.082 -8.041 0.344) 8.313 41.564 ( -1.278 -11.948 -7.412) 14.118 41.841 ( -12.650 -16.257 1.709) 20.670 42.362 ( 10.701 -27.458 -0.031) 29.470 ======================= Grid point 157 (75/126) ======================= q-point: ( 0.33 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.525 ( -2.473 19.679 7.045) 21.048 4.629 ( 1.647 7.058 -2.876) 7.798 4.957 ( -2.811 9.509 6.384) 11.793 4.993 ( -8.907 14.604 -0.807) 17.125 5.056 ( 2.033 13.337 8.719) 16.064 5.181 ( -4.786 21.996 -6.599) 23.458 5.388 ( -4.565 14.443 4.117) 15.696 5.477 ( -5.243 13.928 1.223) 14.932 5.529 ( -8.121 2.666 -1.796) 8.734 5.829 ( 1.352 2.625 0.483) 2.992 5.960 ( 7.468 0.651 -9.522) 12.119 6.154 ( -0.866 11.035 1.154) 11.129 6.513 ( -5.777 2.049 -5.471) 8.216 6.605 ( 0.323 7.543 -0.716) 7.583 6.681 ( 8.100 1.913 -1.497) 8.457 6.747 ( -1.762 2.923 -3.568) 4.938 6.915 ( 4.190 -0.732 -0.510) 4.284 7.091 ( -3.010 -3.001 -6.648) 7.890 7.300 ( 2.599 -2.388 -1.270) 3.752 7.345 ( -1.428 1.630 1.731) 2.773 7.553 ( 7.632 -5.493 6.111) 11.215 7.704 ( 5.402 -4.181 10.981) 12.932 7.758 ( -3.981 3.363 6.866) 8.620 7.903 ( -5.956 -2.936 -1.278) 6.762 8.133 ( 9.698 12.555 -9.399) 18.440 8.237 ( 3.653 2.397 7.157) 8.386 8.449 ( 9.065 6.221 -4.894) 12.034 8.558 ( 1.156 1.038 1.003) 1.849 8.766 ( 0.449 -1.683 9.146) 9.310 8.835 ( -9.721 -4.096 -2.968) 10.958 9.006 ( -3.417 2.150 0.592) 4.080 9.202 ( 3.113 -5.470 -0.073) 6.294 9.316 ( 0.506 5.817 1.916) 6.145 9.427 ( -2.285 7.348 -5.594) 9.513 9.511 ( 2.708 3.331 -3.470) 5.520 9.654 ( -0.259 0.833 -7.898) 7.946 9.768 ( -1.618 5.556 -0.818) 5.845 9.927 ( -1.294 6.707 -0.595) 6.856 10.275 ( 5.282 9.762 -5.632) 12.447 10.311 ( 7.570 4.867 -2.714) 9.400 10.434 ( 2.114 11.046 4.345) 12.057 10.537 ( -9.124 5.638 3.168) 11.183 10.773 ( -8.768 7.192 0.578) 11.356 10.815 ( -3.546 9.106 -0.366) 9.779 10.912 ( 6.028 -0.301 7.542) 9.660 11.199 ( -6.105 12.897 -0.978) 14.302 11.332 ( -2.493 7.390 -0.371) 7.808 11.490 ( 6.589 23.602 3.453) 24.747 11.540 ( 3.500 15.359 8.080) 17.703 11.612 ( 2.568 7.172 -1.333) 7.733 11.759 ( -0.532 15.902 -0.606) 15.922 11.782 ( 2.865 5.725 -2.573) 6.899 11.933 ( -5.711 5.167 -0.831) 7.747 12.139 ( -6.410 7.253 0.562) 9.696 12.269 ( 6.904 9.437 -5.897) 13.096 12.470 ( -4.909 2.172 -0.217) 5.372 12.803 ( -2.605 -2.245 4.649) 5.783 12.975 ( 3.964 1.250 -4.403) 6.056 13.131 ( 5.043 -1.945 -1.350) 5.571 13.307 ( -5.786 -1.408 -3.500) 6.907 14.186 ( 4.972 -1.392 1.956) 5.522 14.372 ( -0.713 -2.012 1.007) 2.361 14.467 ( 3.185 -3.611 0.378) 4.830 14.602 ( -0.203 -3.730 -0.016) 3.736 15.672 ( 0.484 0.786 1.023) 1.378 15.761 ( -0.303 1.449 -0.231) 1.498 15.811 ( 0.836 0.853 0.388) 1.256 15.846 ( -1.148 -0.074 0.577) 1.288 17.801 ( 1.394 1.520 0.271) 2.080 17.892 ( -2.902 0.717 0.170) 2.994 17.948 ( 1.333 -1.484 -0.482) 2.052 17.991 ( -1.177 -1.436 0.159) 1.863 19.848 ( 2.077 -1.669 -0.512) 2.713 19.920 ( -3.082 -2.111 1.687) 4.099 19.931 ( 0.809 -2.858 -0.911) 3.106 20.030 ( -2.595 -3.409 -0.509) 4.314 20.650 ( -1.346 3.907 0.032) 4.133 20.672 ( -2.110 3.850 0.009) 4.391 20.911 ( 1.834 3.633 0.942) 4.177 20.994 ( 1.341 0.800 -0.801) 1.755 21.916 ( 0.347 11.511 -0.609) 11.532 21.931 ( -0.521 11.055 -0.157) 11.069 22.048 ( -0.167 7.673 2.979) 8.233 22.155 ( 1.525 4.184 -2.811) 5.267 24.336 ( 0.830 2.225 0.371) 2.404 24.377 ( 0.869 1.335 -0.752) 1.761 24.402 ( -1.341 1.764 1.308) 2.573 24.458 ( -1.615 -0.071 -0.997) 1.899 30.161 ( -0.613 0.880 1.280) 1.670 30.181 ( -0.154 0.775 2.308) 2.439 30.241 ( 0.180 -0.875 -1.775) 1.987 30.290 ( 0.633 -1.473 -1.678) 2.321 34.191 ( 0.355 -0.299 1.662) 1.726 34.424 ( -3.650 -4.409 0.828) 5.784 34.520 ( 4.936 -2.631 1.387) 5.763 34.736 ( -3.557 -7.574 -4.363) 9.436 36.669 ( -0.523 -4.757 1.365) 4.977 36.820 ( 0.774 -8.385 -1.425) 8.540 36.870 ( -0.094 -9.009 2.386) 9.320 37.113 ( 2.204 -14.526 -1.619) 14.781 40.784 ( 1.893 -5.126 1.280) 5.612 40.907 ( 0.552 -6.932 -4.790) 8.443 41.066 ( 0.689 -2.342 -3.303) 4.107 41.381 ( 0.309 -10.152 -1.851) 10.324 41.403 ( -2.021 -3.849 -0.096) 4.348 41.572 ( -9.249 -14.478 6.861) 18.499 41.660 ( 4.850 -18.074 5.957) 19.639 42.492 ( 4.354 -29.179 -4.060) 29.780 ======================= Grid point 158 (76/126) ======================= q-point: (-0.50 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.487 ( -3.111 18.950 6.750) 20.355 4.686 ( 5.017 9.895 -1.831) 11.245 4.895 ( -1.729 17.271 1.036) 17.388 4.967 ( 0.342 6.290 2.173) 6.664 5.095 ( -4.334 21.507 0.758) 21.953 5.164 ( 2.939 15.987 8.815) 18.491 5.271 ( -3.422 10.724 0.384) 11.263 5.434 ( 0.269 11.426 -1.736) 11.560 5.482 ( 2.043 7.200 1.506) 7.634 5.881 ( 3.331 2.928 2.341) 5.015 5.993 ( 0.640 0.034 -8.839) 8.862 6.123 ( -2.588 15.544 2.151) 15.904 6.348 ( -6.051 0.817 -15.349) 16.519 6.544 ( -1.039 11.285 -12.335) 16.751 6.734 ( -0.543 3.334 9.030) 9.641 6.827 ( 5.617 -5.348 1.044) 7.826 6.959 ( -1.105 3.283 -3.230) 4.736 7.034 ( -1.107 -4.653 -2.961) 5.625 7.256 ( 4.293 2.080 0.760) 4.830 7.422 ( -2.522 -1.443 -2.859) 4.076 7.564 ( -2.698 -1.564 2.855) 4.228 7.777 ( 1.263 -5.122 6.282) 8.203 7.818 ( -0.922 -0.776 10.452) 10.521 7.906 ( 2.312 3.068 11.336) 11.969 8.205 ( 4.227 9.310 -11.997) 15.763 8.355 ( 4.013 0.854 9.212) 10.084 8.455 ( -0.121 -1.328 -9.927) 10.016 8.590 ( -9.029 -2.109 -5.819) 10.946 8.710 ( 3.265 -1.328 8.553) 9.250 8.888 ( 6.121 -1.564 10.536) 12.285 8.954 ( -1.594 1.067 1.087) 2.205 9.162 ( -5.369 -2.605 -0.136) 5.969 9.316 ( -1.459 4.413 -8.129) 9.364 9.373 ( 1.477 8.715 -3.059) 9.354 9.561 ( 1.841 0.216 -7.072) 7.311 9.617 ( -2.172 -2.051 -4.050) 5.033 9.733 ( 3.368 0.651 1.677) 3.818 9.949 ( 2.865 9.932 -6.371) 12.143 10.196 ( -7.285 10.813 0.173) 13.039 10.365 ( -4.071 10.872 0.384) 11.616 10.458 ( -1.773 11.271 -4.201) 12.158 10.538 ( 6.824 6.742 -3.859) 10.339 10.664 ( 1.510 5.444 9.073) 10.688 10.851 ( 2.029 8.463 9.383) 12.798 11.011 ( -0.261 0.111 -1.902) 1.923 11.117 ( -0.426 15.902 0.236) 15.910 11.272 ( -2.717 6.393 0.280) 6.952 11.542 ( -1.522 15.346 0.341) 15.425 11.627 ( 0.555 8.770 6.429) 10.888 11.641 ( -1.629 15.638 2.388) 15.903 11.773 ( 4.304 16.565 2.666) 17.322 11.796 ( -2.107 2.470 -3.869) 5.051 11.876 ( 2.966 8.208 1.249) 8.816 12.039 ( -4.406 12.702 -3.733) 13.953 12.332 ( -0.787 12.994 -0.193) 13.019 12.474 ( 8.077 0.347 -6.489) 10.366 12.748 ( -5.948 -2.457 5.111) 8.218 12.997 ( 1.520 2.173 -5.280) 5.908 13.155 ( -6.205 0.148 -0.999) 6.287 13.247 ( 6.662 0.665 -2.984) 7.331 14.245 ( -1.975 -1.561 3.343) 4.185 14.373 ( 2.225 -3.652 -1.237) 4.452 14.520 ( -1.719 -4.578 2.133) 5.335 14.588 ( 1.781 -5.526 0.229) 5.810 15.678 ( -0.352 0.002 0.713) 0.795 15.753 ( -0.276 0.188 -0.965) 1.021 15.819 ( -1.792 1.030 0.838) 2.230 15.838 ( 1.552 0.975 0.715) 1.967 17.838 ( 2.285 0.698 -0.071) 2.390 17.846 ( -1.779 1.165 -0.075) 2.128 17.946 ( -1.778 -0.916 0.791) 2.151 17.987 ( 1.122 -1.529 -0.613) 1.993 19.874 ( -1.925 -1.752 0.149) 2.607 19.892 ( 2.503 -2.312 -0.560) 3.454 19.940 ( -0.271 -2.375 1.123) 2.641 19.993 ( -0.263 -3.274 -0.949) 3.419 20.640 ( 0.280 3.936 0.151) 3.948 20.649 ( -0.340 4.124 -0.143) 4.140 20.936 ( 0.260 3.400 1.276) 3.641 21.000 ( -0.225 1.042 -1.115) 1.543 21.916 ( -0.338 11.319 -0.149) 11.325 21.928 ( 0.700 11.323 -0.873) 11.378 22.047 ( -1.503 7.610 2.676) 8.206 22.169 ( 1.275 3.961 -2.235) 4.723 24.349 ( 0.166 1.797 0.412) 1.851 24.375 ( -0.744 2.046 -0.397) 2.213 24.397 ( 0.053 0.980 0.682) 1.195 24.440 ( 0.633 0.180 -0.716) 0.973 30.156 ( -0.537 0.883 1.255) 1.626 30.187 ( -0.365 0.773 2.333) 2.484 30.239 ( 0.540 -0.865 -1.672) 1.958 30.291 ( 0.379 -1.440 -1.741) 2.291 34.220 ( 1.306 -1.329 3.220) 3.720 34.364 ( -2.005 -2.532 -0.960) 3.369 34.570 ( -3.156 -4.735 0.538) 5.716 34.699 ( 4.239 -5.918 -3.017) 7.880 36.678 ( 0.451 -4.792 2.207) 5.295 36.811 ( -0.185 -8.058 -2.724) 8.508 36.897 ( 0.503 -9.746 4.426) 10.716 37.108 ( -1.302 -14.660 -3.577) 15.146 40.752 ( -2.611 -2.747 -1.117) 3.951 40.953 ( 2.446 -7.215 -6.400) 9.950 41.113 ( 6.185 -6.613 2.607) 9.422 41.268 ( -11.105 -7.673 -0.803) 13.521 41.395 ( -1.733 -6.011 -0.868) 6.315 41.438 ( 1.975 -9.879 -1.743) 10.225 41.882 ( 7.620 -20.636 16.733) 27.639 42.476 ( -2.838 -29.625 -8.428) 30.931 ======================= Grid point 159 (77/126) ======================= q-point: (-0.33 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.508 ( 1.059 21.401 4.793) 21.957 4.714 ( -1.654 9.644 -0.402) 9.793 4.878 ( -4.530 21.454 3.075) 22.142 4.985 ( 2.266 6.379 3.356) 7.556 5.080 ( 8.455 14.473 -1.395) 16.820 5.270 ( 6.426 8.465 0.384) 10.635 5.327 ( 1.782 7.586 12.027) 14.331 5.473 ( 5.073 9.691 -0.751) 10.965 5.573 ( 7.497 11.290 -3.046) 13.891 5.875 ( -3.948 5.947 -5.261) 8.868 5.983 ( 1.305 -1.399 -5.166) 5.509 6.118 ( 0.362 17.129 7.894) 18.865 6.189 ( -1.424 -0.101 -13.450) 13.526 6.489 ( -0.602 12.393 -9.307) 15.510 6.768 ( -0.261 1.602 6.398) 6.601 6.807 ( -6.747 4.826 -1.857) 8.501 6.970 ( 4.297 -3.808 -0.872) 5.808 7.022 ( -0.583 -1.543 2.013) 2.602 7.290 ( -4.958 -4.158 -7.419) 9.844 7.382 ( 4.569 -2.631 4.405) 6.870 7.526 ( -5.754 -5.637 3.493) 8.780 7.761 ( -0.874 1.517 1.258) 2.156 7.862 ( -1.781 4.783 4.979) 7.130 7.934 ( -5.221 6.887 6.892) 11.054 8.217 ( 3.038 3.615 -0.760) 4.783 8.357 ( -2.959 10.573 -0.965) 11.022 8.423 ( -5.078 -3.167 4.132) 7.273 8.496 ( 4.419 -8.402 -12.392) 15.611 8.796 ( 0.301 3.203 6.323) 7.094 8.906 ( -1.610 -0.184 6.755) 6.946 9.036 ( 3.013 -3.639 3.497) 5.878 9.078 ( -3.759 -0.707 -2.427) 4.530 9.259 ( -0.509 8.117 -5.652) 9.905 9.394 ( 1.509 5.598 -3.703) 6.879 9.525 ( -0.177 1.174 -8.850) 8.929 9.543 ( -4.396 -1.765 3.798) 6.071 9.793 ( -2.603 1.428 2.338) 3.779 9.958 ( 6.103 7.943 -10.930) 14.826 10.192 ( 6.173 12.351 -2.884) 14.106 10.310 ( -1.326 7.187 5.563) 9.185 10.376 ( -4.481 8.747 -1.760) 9.984 10.603 ( 0.839 6.145 -2.282) 6.609 10.764 ( 2.381 5.074 8.443) 10.134 10.923 ( 1.032 6.656 -2.939) 7.348 11.009 ( 4.675 9.468 6.426) 12.361 11.109 ( -0.486 15.222 -3.906) 15.722 11.293 ( 2.961 5.648 7.406) 9.773 11.490 ( -4.727 14.772 2.222) 15.669 11.527 ( -7.638 16.320 -2.133) 18.145 11.679 ( 1.370 5.570 7.457) 9.408 11.726 ( -3.576 12.044 -4.934) 13.498 11.841 ( -3.185 16.155 0.320) 16.469 11.936 ( 1.611 9.075 -2.275) 9.494 12.008 ( 5.695 7.328 -0.779) 9.313 12.322 ( 2.849 2.336 -3.504) 5.084 12.600 ( 7.302 4.026 -5.149) 9.800 12.668 ( -4.828 -1.229 6.778) 8.412 12.998 ( 0.831 -0.242 -3.269) 3.381 13.061 ( -3.824 -0.504 -0.895) 3.959 13.349 ( 4.639 -2.121 -3.027) 5.931 14.176 ( -5.047 -1.176 1.750) 5.469 14.407 ( -0.622 -1.902 1.425) 2.457 14.462 ( -1.631 -2.255 0.044) 2.784 14.626 ( 0.013 -4.605 -0.049) 4.605 15.668 ( -1.250 -0.121 1.911) 2.287 15.726 ( -2.019 -0.833 -1.077) 2.435 15.809 ( 0.508 1.976 0.358) 2.071 15.870 ( 1.476 1.554 0.605) 2.227 17.819 ( -1.054 1.627 0.322) 1.965 17.880 ( 1.265 0.595 0.312) 1.432 17.923 ( 0.217 -0.937 -0.616) 1.142 18.005 ( 0.703 -2.025 0.100) 2.146 19.856 ( -0.044 -1.889 -0.843) 2.069 19.889 ( -2.085 -1.943 0.935) 2.999 19.972 ( 2.790 -2.723 0.566) 3.939 20.012 ( 2.250 -3.417 -0.905) 4.190 20.656 ( 1.306 3.911 0.031) 4.123 20.663 ( 1.947 3.970 0.016) 4.422 20.931 ( -1.629 3.188 1.578) 3.913 20.978 ( -1.430 1.099 -1.441) 2.309 21.912 ( 0.121 11.456 -0.407) 11.464 21.940 ( 0.897 11.122 -0.615) 11.175 22.022 ( -2.379 8.387 2.436) 9.052 22.176 ( 0.474 3.428 -2.012) 4.004 24.339 ( -1.200 2.308 0.585) 2.666 24.361 ( -0.339 2.335 -0.611) 2.438 24.409 ( 0.846 0.025 0.861) 1.207 24.466 ( 2.093 0.393 -0.904) 2.313 30.154 ( -0.403 0.938 1.312) 1.662 30.188 ( -0.681 0.788 2.256) 2.485 30.244 ( 0.888 -1.015 -1.630) 2.116 30.288 ( 0.146 -1.488 -1.803) 2.342 34.252 ( 0.561 -1.997 2.484) 3.237 34.362 ( 1.652 -1.231 1.055) 2.315 34.466 ( -6.144 -3.796 -1.169) 7.316 34.801 ( 6.629 -8.483 -2.854) 11.138 36.700 ( 0.583 -5.336 2.342) 5.856 36.796 ( 0.104 -7.574 -3.074) 8.175 36.911 ( -1.790 -10.069 4.854) 11.320 37.053 ( -2.147 -13.113 -3.417) 13.720 40.723 ( -1.123 -0.038 1.796) 2.119 40.892 ( -2.753 -6.587 -7.889) 10.640 41.060 ( -8.253 -6.764 -1.145) 10.732 41.310 ( 0.436 -6.575 3.525) 7.473 41.380 ( 10.122 -12.613 3.729) 16.597 41.533 ( 7.017 -7.601 -2.870) 10.736 42.044 ( 1.693 -21.158 14.661) 25.797 42.319 ( -8.723 -28.464 -11.805) 32.026 ======================= Grid point 160 (78/126) ======================= q-point: (-0.17 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.483 ( -5.080 25.090 4.620) 26.013 4.711 ( 0.642 7.999 -2.235) 8.330 4.852 ( 1.277 13.942 3.804) 14.508 5.043 ( 1.108 12.700 7.106) 14.595 5.315 ( 14.807 5.867 -1.112) 15.966 5.361 ( 1.272 7.900 8.802) 11.895 5.415 ( 4.848 7.079 -1.055) 8.644 5.591 ( 6.842 7.191 0.630) 9.946 5.660 ( 2.107 8.073 -3.094) 8.899 5.804 ( -0.795 9.486 -6.827) 11.714 5.900 ( -2.051 0.071 -11.804) 11.981 6.168 ( 4.016 1.201 -4.288) 5.996 6.233 ( 0.874 11.463 11.676) 16.386 6.419 ( -2.123 9.883 -2.249) 10.356 6.669 ( -5.487 9.856 -3.672) 11.863 6.789 ( 1.349 2.832 2.311) 3.896 7.000 ( -5.191 -3.759 9.247) 11.251 7.051 ( 4.277 -5.465 -0.812) 6.988 7.198 ( -3.021 -3.145 -1.066) 4.489 7.411 ( -3.265 3.079 -10.324) 11.257 7.421 ( -2.843 -6.208 1.811) 7.064 7.737 ( -2.389 2.016 -0.059) 3.126 7.800 ( -4.233 3.801 2.526) 6.224 7.881 ( -1.528 8.826 3.168) 9.502 8.291 ( -7.877 -3.546 -2.140) 8.900 8.309 ( 1.879 7.989 -5.707) 9.996 8.352 ( 2.862 10.378 9.031) 14.052 8.548 ( 5.228 -2.155 -5.159) 7.654 8.745 ( -3.761 7.350 -2.785) 8.713 8.905 ( -5.537 -5.593 0.636) 7.895 9.008 ( -1.128 4.544 9.444) 10.541 9.111 ( 3.240 -2.603 0.064) 4.157 9.231 ( -0.146 3.064 -2.002) 3.663 9.390 ( -0.242 3.358 -2.248) 4.049 9.473 ( -0.762 1.183 0.828) 1.633 9.540 ( 1.129 2.813 -1.203) 3.261 9.754 ( 0.300 9.966 -4.442) 10.915 10.020 ( 3.289 6.617 -4.386) 8.592 10.222 ( -5.401 9.961 3.963) 12.004 10.342 ( 4.304 8.099 -5.049) 10.469 10.358 ( 3.066 -1.786 -1.309) 3.782 10.588 ( -1.053 3.697 2.405) 4.535 10.809 ( -2.282 5.996 10.187) 12.039 10.968 ( 5.958 10.664 -3.348) 12.666 11.022 ( -0.850 14.360 -8.187) 16.552 11.213 ( 7.250 9.209 7.370) 13.845 11.368 ( -4.564 18.408 1.929) 19.063 11.394 ( 1.363 7.688 7.193) 10.616 11.438 ( -3.505 10.797 -0.073) 11.352 11.608 ( -5.935 15.290 -5.985) 17.459 11.713 ( -5.008 9.989 -2.714) 11.499 11.740 ( -0.164 15.226 4.014) 15.748 11.958 ( 1.121 5.490 -1.484) 5.797 12.104 ( 4.999 5.559 -2.089) 7.763 12.411 ( 3.751 1.036 1.480) 4.163 12.659 ( 3.739 0.336 -0.338) 3.769 12.712 ( 7.843 -3.446 0.208) 8.569 12.960 ( -4.722 -3.633 0.561) 5.984 13.017 ( -0.262 -1.916 -3.346) 3.865 13.320 ( -7.439 -8.457 -2.255) 11.487 14.152 ( 3.143 2.437 0.556) 4.016 14.371 ( -2.826 0.408 1.862) 3.409 14.472 ( 1.266 0.671 -0.850) 1.666 14.572 ( -5.104 -1.883 -1.190) 5.569 15.649 ( -2.133 1.560 3.461) 4.355 15.704 ( 0.319 -1.820 0.097) 1.851 15.822 ( 0.636 2.263 -0.858) 2.502 15.890 ( 0.392 1.640 0.060) 1.687 17.805 ( -1.205 1.966 1.684) 2.855 17.884 ( 0.589 1.202 -1.680) 2.148 17.955 ( 2.342 -2.208 -0.139) 3.222 18.008 ( -0.535 -1.960 0.433) 2.077 19.848 ( -1.409 -1.749 0.805) 2.386 19.871 ( 0.948 -2.070 -1.440) 2.694 20.010 ( 0.599 -3.022 1.787) 3.561 20.055 ( 2.730 -3.665 -1.418) 4.785 20.690 ( 2.110 3.738 0.143) 4.295 20.707 ( 2.507 3.695 -0.037) 4.465 20.896 ( -2.841 3.133 1.677) 4.550 20.941 ( -1.526 0.894 -1.566) 2.363 21.918 ( 0.758 11.374 -0.405) 11.406 21.949 ( 0.084 10.920 -0.660) 10.940 21.994 ( -1.470 9.264 2.757) 9.776 22.167 ( -0.262 3.249 -2.327) 4.004 24.323 ( -0.868 2.863 0.728) 3.079 24.357 ( 0.217 2.354 -0.826) 2.505 24.427 ( 0.423 -0.127 1.228) 1.305 24.496 ( 1.554 0.270 -1.304) 2.047 30.155 ( -0.206 1.000 1.463) 1.784 30.184 ( -0.877 0.774 2.087) 2.392 30.254 ( 0.981 -1.157 -1.664) 2.252 30.280 ( 0.014 -1.572 -1.833) 2.415 34.275 ( 1.796 -2.282 -0.122) 2.906 34.333 ( -5.874 1.496 1.455) 6.234 34.441 ( 2.834 -5.332 2.688) 6.609 34.881 ( 3.868 -10.990 -5.269) 12.787 36.711 ( -0.304 -5.814 1.083) 5.922 36.790 ( 0.329 -7.768 -1.799) 7.981 36.883 ( -2.301 -8.974 3.484) 9.898 37.017 ( -0.873 -11.615 -1.204) 11.710 40.718 ( -0.572 0.168 2.608) 2.675 40.815 ( -2.518 -6.695 -2.616) 7.616 40.988 ( 0.202 -3.850 1.419) 4.108 41.271 ( -1.716 -6.740 0.564) 6.978 41.586 ( 5.426 -9.418 -3.698) 11.481 41.690 ( 10.075 -15.667 3.083) 18.880 42.027 ( -7.226 -24.301 -3.180) 25.551 42.135 ( -5.162 -22.386 1.993) 23.060 ======================= Grid point 161 (79/126) ======================= q-point: ( 0.00 0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.713 ( -0.117 4.677 2.084) 5.121 4.847 ( -0.259 -1.405 2.184) 2.610 5.024 ( -2.343 17.635 0.302) 17.792 5.351 ( -2.337 5.563 -0.455) 6.051 5.494 ( 0.036 1.261 -1.849) 2.239 5.546 ( 5.380 -2.861 -1.296) 6.230 5.610 ( -1.318 8.828 3.700) 9.662 5.700 ( -2.008 -1.475 -4.294) 4.965 5.791 ( -1.387 5.780 5.006) 7.771 5.862 ( 5.052 10.701 1.984) 11.999 6.060 ( 1.067 4.699 -2.648) 5.498 6.136 ( 1.644 -1.300 0.499) 2.155 6.500 ( -1.601 12.010 2.325) 12.338 6.594 ( 1.817 9.833 2.242) 10.248 6.766 ( -3.392 0.906 -0.461) 3.541 6.881 ( 0.000 1.230 4.602) 4.764 6.955 ( 1.388 3.241 -2.819) 4.515 7.028 ( 5.522 -0.807 -0.741) 5.630 7.129 ( -2.446 -5.304 -1.097) 5.943 7.205 ( -1.018 -4.475 1.112) 4.722 7.464 ( -1.482 5.328 -7.492) 9.312 7.567 ( -2.063 -8.443 -9.329) 12.750 7.794 ( -0.310 -2.733 -4.126) 4.959 7.871 ( 1.507 -5.382 -3.560) 6.627 8.152 ( -3.050 1.891 8.872) 9.570 8.361 ( -5.522 -5.342 3.975) 8.650 8.525 ( 0.313 3.010 4.972) 5.820 8.612 ( -0.644 6.328 3.399) 7.212 8.763 ( -2.986 3.780 -2.929) 5.638 8.907 ( 3.611 1.624 -4.713) 6.155 9.080 ( 1.797 0.186 3.221) 3.693 9.140 ( -0.330 -1.938 1.821) 2.680 9.297 ( 2.833 4.406 2.233) 5.694 9.415 ( 0.844 0.288 2.162) 2.338 9.562 ( 4.340 1.148 6.427) 7.840 9.622 ( 0.012 2.404 1.224) 2.698 9.822 ( -0.409 1.640 -2.873) 3.333 10.075 ( 2.014 -5.155 -1.088) 5.640 10.285 ( 0.936 3.198 -8.996) 9.593 10.361 ( -4.562 2.457 -8.126) 9.637 10.546 ( 1.776 12.433 1.323) 12.629 10.680 ( 0.225 4.482 2.915) 5.351 10.924 ( -3.151 6.031 7.362) 10.025 11.106 ( -4.714 3.889 -7.266) 9.494 11.293 ( 3.500 4.737 -1.135) 5.998 11.338 ( 0.866 3.750 0.121) 3.850 11.472 ( -2.577 -0.406 1.875) 3.213 11.604 ( -0.145 0.957 -4.048) 4.163 11.672 ( 1.467 11.425 3.470) 12.030 11.768 ( 3.438 11.084 5.312) 12.763 11.972 ( -2.582 19.473 0.113) 19.643 12.062 ( -0.074 16.025 0.149) 16.026 12.230 ( 2.255 13.310 -0.018) 13.500 12.311 ( 2.653 8.279 -2.147) 8.955 12.476 ( -6.794 6.487 3.967) 10.197 12.681 ( -0.337 -8.583 0.663) 8.615 12.710 ( 5.586 -5.501 -1.928) 8.074 12.746 ( -0.542 -10.584 1.587) 10.716 12.897 ( -0.568 -4.029 -2.937) 5.018 12.950 ( 0.233 -10.488 -5.390) 11.794 14.299 ( 0.150 2.260 1.470) 2.700 14.350 ( -0.811 1.023 0.317) 1.344 14.469 ( -0.410 -0.826 -1.690) 1.925 14.492 ( -0.020 -1.023 -1.671) 1.959 15.669 ( -0.391 0.683 3.427) 3.516 15.693 ( 1.066 -1.287 2.609) 3.098 15.874 ( -0.207 2.372 -0.555) 2.445 15.907 ( -0.851 0.834 -1.178) 1.675 17.836 ( -0.802 2.135 1.197) 2.576 17.902 ( 0.494 -0.437 -1.247) 1.411 17.952 ( 0.589 -0.661 0.367) 0.958 17.973 ( -0.152 -0.629 -0.068) 0.651 19.809 ( -0.563 -0.462 0.384) 0.823 19.842 ( 0.816 -1.962 -0.989) 2.344 19.969 ( -0.764 -1.167 1.001) 1.717 20.011 ( 0.557 -3.058 -0.702) 3.187 20.764 ( -0.390 1.747 0.786) 1.955 20.785 ( 0.320 0.979 0.081) 1.034 20.901 ( -0.713 1.471 0.168) 1.643 20.931 ( 0.747 -0.170 -0.855) 1.148 22.106 ( -0.276 6.456 -0.004) 6.462 22.111 ( 0.155 6.117 -0.283) 6.126 22.140 ( 0.344 4.496 1.164) 4.657 22.200 ( -0.121 1.226 -1.210) 1.727 24.370 ( 0.002 2.073 0.472) 2.126 24.398 ( 0.006 1.177 -0.764) 1.403 24.446 ( -0.105 1.356 1.318) 1.894 24.503 ( 0.063 -0.561 -0.991) 1.141 30.183 ( 0.234 1.226 0.804) 1.485 30.193 ( -0.736 0.866 0.990) 1.507 30.236 ( 0.088 -1.098 -1.061) 1.529 30.245 ( 0.433 -1.500 -0.918) 1.811 34.266 ( -2.293 0.713 -0.197) 2.409 34.292 ( 1.864 -0.822 -0.745) 2.169 34.458 ( 0.803 0.831 4.451) 4.598 34.676 ( -0.420 -8.911 -4.034) 9.791 36.620 ( -0.509 -2.383 0.587) 2.506 36.669 ( 0.674 -4.155 -0.863) 4.297 36.745 ( -0.683 -4.287 1.894) 4.736 36.820 ( 0.529 -7.252 -0.954) 7.333 40.695 ( 1.144 -1.459 1.526) 2.401 40.739 ( 2.232 -2.403 2.041) 3.863 40.998 ( -0.788 0.977 0.321) 1.296 41.220 ( 0.143 -0.370 0.221) 0.454 41.306 ( -6.403 -10.261 -4.485) 12.900 41.489 ( -0.651 -2.893 -4.881) 5.711 41.685 ( 8.995 -16.394 3.336) 18.995 41.724 ( -4.642 -13.401 2.041) 14.328 ======================= Grid point 162 (80/126) ======================= q-point: ( 0.17 0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.726 ( 0.082 4.423 2.007) 4.858 4.859 ( 1.598 2.031 -0.474) 2.627 4.985 ( -3.828 12.901 5.384) 14.494 5.285 ( -3.367 4.816 -2.917) 6.560 5.465 ( -3.517 7.873 -4.248) 9.612 5.512 ( -2.404 4.691 1.177) 5.400 5.622 ( -0.408 2.990 3.805) 4.856 5.691 ( -3.872 2.562 -1.007) 4.751 5.756 ( 0.118 2.732 4.273) 5.073 5.930 ( -0.407 9.130 -4.233) 10.071 6.017 ( -1.762 9.222 -2.002) 9.600 6.197 ( 3.153 -0.788 3.186) 4.551 6.558 ( 5.317 5.830 3.656) 8.696 6.656 ( 2.750 6.691 4.571) 8.557 6.700 ( -2.296 3.252 -3.760) 5.476 6.889 ( -1.580 3.507 1.200) 4.030 6.992 ( 2.458 0.648 -5.078) 5.679 7.026 ( 0.795 -1.104 -3.178) 3.457 7.116 ( -3.105 -4.271 -2.989) 6.068 7.198 ( 4.349 -6.885 2.244) 8.447 7.477 ( -1.360 -3.458 -9.745) 10.429 7.516 ( 4.522 -0.688 7.106) 8.451 7.781 ( 1.330 -2.654 -3.422) 4.530 7.879 ( -0.306 -5.751 -4.090) 7.063 8.170 ( 0.792 2.374 7.401) 7.813 8.295 ( -2.044 -1.610 -0.538) 2.657 8.551 ( -3.306 1.576 4.017) 5.436 8.566 ( -1.392 10.939 4.812) 12.032 8.710 ( -2.060 -1.263 -0.730) 2.524 8.897 ( -3.498 -2.614 -1.577) 4.643 9.077 ( -3.293 -0.662 1.786) 3.804 9.105 ( -1.834 -2.382 0.754) 3.099 9.381 ( 1.681 3.575 3.503) 5.280 9.461 ( 3.711 1.076 0.524) 3.899 9.571 ( 0.721 1.769 -3.495) 3.983 9.673 ( -2.789 -6.311 -0.280) 6.905 9.850 ( 3.876 8.327 5.556) 10.735 10.076 ( -0.619 0.191 -1.669) 1.790 10.270 ( 1.676 2.331 -8.596) 9.062 10.344 ( 8.341 3.371 -8.233) 12.195 10.616 ( 4.570 11.318 1.773) 12.333 10.663 ( -2.173 5.246 1.437) 5.857 10.890 ( -5.041 3.203 8.098) 10.062 10.994 ( -3.360 4.327 -3.793) 6.663 11.166 ( -10.742 4.840 -1.192) 11.842 11.397 ( -3.475 -2.718 0.380) 4.428 11.441 ( 2.096 5.184 0.555) 5.619 11.617 ( 3.403 1.862 -2.603) 4.672 11.729 ( 2.173 11.028 1.998) 11.416 11.869 ( 1.819 15.206 7.617) 17.104 11.975 ( 5.786 16.014 -1.339) 17.080 12.065 ( -1.333 13.719 -2.206) 13.959 12.211 ( -4.688 9.717 -1.445) 10.885 12.338 ( 0.131 10.869 -5.170) 12.036 12.361 ( -3.577 4.268 3.124) 6.386 12.592 ( -2.822 -1.967 4.156) 5.395 12.713 ( 1.924 -4.463 0.969) 4.956 12.878 ( 5.109 -5.093 -1.386) 7.346 12.960 ( 4.727 -6.126 -1.986) 7.989 13.081 ( 14.268 -11.159 -5.105) 18.819 14.211 ( -5.834 3.560 0.714) 6.872 14.354 ( -1.374 -1.800 1.571) 2.756 14.442 ( -2.037 0.243 -1.408) 2.488 14.510 ( 1.814 -3.224 -1.137) 3.870 15.681 ( 0.072 0.973 2.594) 2.772 15.730 ( 1.449 -1.633 2.368) 3.221 15.856 ( -1.553 2.136 -0.286) 2.657 15.881 ( -1.134 0.883 -0.904) 1.698 17.829 ( -0.372 2.071 0.750) 2.234 17.905 ( 0.161 -1.527 -0.415) 1.590 17.944 ( -0.940 0.662 -0.127) 1.157 17.977 ( 0.189 -0.726 -0.076) 0.754 19.808 ( 0.421 -0.309 -0.000) 0.522 19.855 ( 0.939 -2.424 -0.513) 2.650 19.944 ( -2.294 -0.644 0.661) 2.473 20.000 ( -1.407 -3.160 -0.427) 3.486 20.739 ( -2.081 1.893 0.408) 2.843 20.762 ( -2.365 0.955 0.236) 2.561 20.921 ( 2.264 1.788 -0.019) 2.885 20.962 ( 2.378 -0.421 -0.485) 2.464 22.098 ( -0.187 6.520 -0.274) 6.529 22.114 ( -0.132 6.333 0.059) 6.335 22.153 ( 0.387 3.942 1.325) 4.176 22.199 ( 0.698 1.352 -1.434) 2.091 24.374 ( 0.209 2.110 0.379) 2.154 24.396 ( 0.192 1.062 -0.535) 1.204 24.443 ( -0.794 1.284 1.239) 1.953 24.488 ( -1.156 -0.436 -1.036) 1.612 30.184 ( -0.571 0.862 0.698) 1.248 30.192 ( 0.152 1.090 1.070) 1.535 30.229 ( -0.073 -0.883 -1.048) 1.373 30.253 ( 0.757 -1.476 -0.885) 1.880 34.223 ( -1.916 1.873 0.068) 2.680 34.329 ( 1.635 -3.270 -0.432) 3.681 34.482 ( -0.044 0.987 3.765) 3.893 34.645 ( -0.727 -7.137 -3.773) 8.105 36.611 ( -0.776 -1.899 0.516) 2.115 36.680 ( 0.880 -4.399 -0.999) 4.596 36.738 ( -0.771 -4.215 1.438) 4.520 36.842 ( 1.981 -8.300 -0.438) 8.545 40.714 ( -0.228 0.145 0.333) 0.429 40.791 ( 2.794 -2.907 -0.839) 4.119 41.065 ( -2.235 -6.322 -0.616) 6.734 41.076 ( 2.986 -5.974 4.212) 7.896 41.355 ( 2.777 2.121 3.618) 5.030 41.414 ( -3.310 -2.572 -7.021) 8.177 41.571 ( -9.906 -10.334 -1.344) 14.378 41.878 ( 7.997 -20.552 1.728) 22.121 ======================= Grid point 163 (81/126) ======================= q-point: ( 0.33 0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.743 ( 1.658 5.056 0.506) 5.345 4.872 ( -1.473 10.507 -1.224) 10.680 4.958 ( -1.443 1.619 9.898) 10.133 5.206 ( -4.238 5.533 -0.232) 6.973 5.398 ( -0.603 14.825 -1.083) 14.877 5.510 ( -1.501 2.825 -1.941) 3.741 5.569 ( -3.173 5.747 1.310) 6.694 5.611 ( -2.787 10.696 -2.902) 11.428 5.794 ( -0.899 10.104 4.421) 11.066 5.865 ( -0.990 3.774 -2.137) 4.449 5.986 ( -1.027 3.178 -4.805) 5.851 6.249 ( 1.048 -2.599 0.500) 2.847 6.594 ( -2.823 6.208 -3.364) 7.604 6.693 ( 3.215 4.394 0.051) 5.445 6.743 ( 3.059 5.222 6.431) 8.831 6.878 ( -3.324 6.447 -6.096) 9.475 6.899 ( -0.600 -1.818 -0.409) 1.957 7.022 ( -1.730 -1.747 -5.220) 5.770 7.214 ( 10.769 -6.339 2.282) 12.703 7.248 ( 1.051 -10.631 -1.059) 10.735 7.467 ( 3.837 0.197 -0.763) 3.918 7.607 ( -0.771 -5.211 2.170) 5.697 7.809 ( -4.073 -1.350 -0.839) 4.372 7.840 ( 4.999 0.438 7.829) 9.299 8.225 ( 2.049 -2.009 2.867) 4.057 8.301 ( 3.744 -0.774 -5.463) 6.668 8.463 ( -4.615 1.816 -1.725) 5.250 8.634 ( -0.343 -1.842 3.899) 4.326 8.645 ( -2.402 0.952 3.713) 4.523 8.792 ( -5.859 -2.279 3.917) 7.408 9.014 ( -4.062 -0.337 1.831) 4.468 9.105 ( 0.801 -4.235 0.669) 4.361 9.379 ( -1.520 1.816 0.318) 2.390 9.513 ( 0.085 -2.472 -0.639) 2.555 9.575 ( 1.768 2.662 -5.636) 6.479 9.610 ( -0.588 -0.258 -3.810) 3.863 9.848 ( -5.864 6.697 5.976) 10.722 10.075 ( 1.985 1.290 -5.635) 6.112 10.342 ( 5.340 2.876 -3.299) 6.904 10.458 ( 7.048 1.699 -8.619) 11.262 10.637 ( 1.221 8.694 -1.246) 8.867 10.689 ( 2.290 12.644 -0.000) 12.849 10.897 ( 2.872 0.660 7.904) 8.435 10.929 ( -8.110 6.988 4.535) 11.626 10.981 ( -4.657 5.083 1.349) 7.024 11.304 ( -5.064 -2.999 0.972) 5.965 11.466 ( 0.086 6.319 -2.543) 6.812 11.668 ( 2.185 -2.967 -2.086) 4.234 11.762 ( 1.283 11.306 1.355) 11.459 11.915 ( 1.460 14.370 2.738) 14.701 11.954 ( -7.615 9.351 0.779) 12.084 12.059 ( -2.515 9.240 0.912) 9.619 12.189 ( 5.320 20.273 0.291) 20.961 12.282 ( 2.130 2.376 -4.991) 5.923 12.415 ( 3.234 9.885 -0.249) 10.404 12.599 ( -0.151 6.018 3.293) 6.862 12.739 ( -0.476 -1.977 1.939) 2.810 12.960 ( 4.713 -2.948 -3.782) 6.723 13.055 ( 5.957 -5.315 -0.961) 8.041 13.231 ( 4.027 -5.680 -5.364) 8.789 14.173 ( 1.504 0.775 1.622) 2.344 14.313 ( -3.425 -3.929 1.251) 5.360 14.411 ( -0.420 -1.431 -0.145) 1.498 14.508 ( -1.790 -5.087 -0.006) 5.393 15.693 ( 0.130 1.357 1.334) 1.907 15.758 ( 0.512 -1.330 0.562) 1.532 15.830 ( -0.729 1.308 0.434) 1.559 15.858 ( -1.368 0.408 0.485) 1.507 17.833 ( 0.567 1.636 0.379) 1.773 17.894 ( -1.469 -1.000 0.450) 1.833 17.936 ( 0.300 0.674 -0.567) 0.930 17.972 ( -0.528 -0.720 -0.357) 0.962 19.825 ( 1.618 -0.429 -0.329) 1.706 19.872 ( 0.943 -2.421 0.354) 2.622 19.899 ( -2.507 -0.306 -0.022) 2.526 19.962 ( -2.389 -3.098 -0.234) 3.919 20.708 ( -1.310 1.952 0.243) 2.363 20.723 ( -1.717 1.335 0.133) 2.179 20.961 ( 1.784 1.607 0.142) 2.405 20.997 ( 1.468 -0.356 -0.452) 1.577 22.098 ( 0.232 6.599 -0.325) 6.611 22.108 ( -0.432 6.334 -0.039) 6.349 22.163 ( -0.072 3.691 1.375) 3.940 22.210 ( 1.015 1.240 -1.313) 2.072 24.380 ( 0.321 2.002 0.110) 2.031 24.404 ( 0.745 1.012 -0.010) 1.257 24.431 ( -0.984 1.126 0.900) 1.745 24.456 ( -1.612 -0.228 -0.931) 1.875 30.178 ( -0.434 0.865 0.665) 1.174 30.199 ( 0.025 0.727 0.969) 1.212 30.225 ( 0.157 -0.450 -0.847) 0.972 30.261 ( 0.535 -1.384 -0.916) 1.744 34.203 ( -0.432 1.513 0.827) 1.778 34.330 ( -1.140 -4.522 -0.503) 4.691 34.509 ( 1.743 0.933 1.722) 2.622 34.615 ( -1.119 -4.568 -2.222) 5.201 36.604 ( -0.219 -1.642 0.926) 1.898 36.683 ( -0.008 -5.418 -1.004) 5.510 36.741 ( 0.344 -3.371 1.361) 3.652 36.870 ( 1.073 -9.430 -1.006) 9.544 40.716 ( 0.548 -1.596 -0.142) 1.693 40.789 ( -0.352 -4.754 -2.522) 5.393 41.054 ( 2.703 1.117 -0.573) 2.980 41.231 ( 2.717 -5.269 3.385) 6.827 41.309 ( -3.549 -8.799 2.229) 9.746 41.373 ( -5.505 -8.488 -3.306) 10.643 41.433 ( 1.552 2.990 2.882) 4.433 41.977 ( 2.743 -21.921 -1.918) 22.175 ======================= Grid point 164 (82/126) ======================= q-point: (-0.50 0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.788 ( 2.436 6.471 0.568) 6.937 4.822 ( -3.020 8.073 1.209) 8.704 5.004 ( 0.745 1.658 8.307) 8.503 5.164 ( 0.844 5.717 0.694) 5.820 5.414 ( -0.989 13.191 1.854) 13.357 5.458 ( 1.270 11.753 0.030) 11.821 5.490 ( -4.403 8.713 -3.470) 10.361 5.637 ( 3.565 5.438 0.782) 6.549 5.734 ( -4.128 17.727 0.520) 18.209 5.906 ( 3.240 -0.812 -0.095) 3.341 5.949 ( 0.821 -2.235 -7.046) 7.438 6.225 ( -2.213 -5.468 -6.770) 8.980 6.516 ( -3.661 13.959 -2.534) 14.651 6.720 ( -0.205 3.325 0.388) 3.354 6.773 ( -2.506 2.750 -0.668) 3.780 6.835 ( 3.578 7.310 3.933) 9.039 6.905 ( 0.375 -5.123 1.497) 5.350 7.018 ( 0.885 2.164 -4.078) 4.701 7.263 ( 2.196 -4.630 -0.156) 5.127 7.338 ( 0.387 -7.403 -3.546) 8.218 7.488 ( -9.222 -3.747 1.332) 10.043 7.604 ( 9.105 -8.651 4.062) 13.200 7.792 ( 0.943 1.847 1.496) 2.557 7.988 ( 3.978 1.931 12.382) 13.147 8.269 ( 2.253 -8.422 -8.919) 12.472 8.324 ( -0.626 -6.634 1.691) 6.875 8.386 ( -1.327 4.980 -2.297) 5.642 8.507 ( -4.188 -1.343 -0.767) 4.465 8.735 ( 0.576 0.708 6.804) 6.865 8.796 ( 4.773 -5.022 5.730) 8.991 8.948 ( -4.363 0.597 1.054) 4.528 9.107 ( -1.537 -3.888 1.070) 4.316 9.359 ( 0.301 1.283 -2.857) 3.146 9.466 ( -3.300 -4.940 0.568) 5.968 9.590 ( 2.137 5.763 -3.721) 7.186 9.605 ( 0.222 1.682 -5.037) 5.315 9.778 ( -3.040 5.760 3.341) 7.320 10.059 ( -1.307 -1.922 -4.325) 4.910 10.368 ( 2.440 7.639 -6.300) 10.198 10.511 ( 3.479 2.600 -6.458) 7.783 10.652 ( -6.580 8.374 -2.007) 10.838 10.718 ( 4.407 7.986 -3.412) 9.738 10.830 ( -1.373 11.537 6.566) 13.346 10.948 ( 1.043 2.124 5.758) 6.225 11.052 ( 4.318 2.435 7.656) 9.121 11.263 ( 0.435 -1.234 4.445) 4.634 11.423 ( -2.576 7.836 -4.996) 9.644 11.658 ( -0.976 -2.101 -4.833) 5.359 11.787 ( -0.271 6.664 1.890) 6.932 11.840 ( -3.125 8.678 -0.631) 9.245 11.987 ( 2.899 12.035 4.613) 13.210 12.017 ( 0.001 8.212 1.184) 8.297 12.253 ( 1.905 19.071 -0.322) 19.169 12.322 ( 0.571 12.833 -4.277) 13.539 12.441 ( -1.703 4.459 1.920) 5.145 12.615 ( 1.357 4.190 1.222) 4.570 12.706 ( -3.106 2.458 1.392) 4.199 12.995 ( 1.043 -2.613 -4.366) 5.194 13.101 ( -2.013 -3.993 -1.276) 4.650 13.247 ( 3.109 -1.284 -5.274) 6.255 14.212 ( -1.984 -1.160 2.806) 3.627 14.286 ( 2.449 -4.520 0.008) 5.141 14.427 ( 0.023 -3.896 1.382) 4.134 14.473 ( 0.389 -5.472 0.054) 5.486 15.692 ( -0.982 1.302 1.049) 1.939 15.748 ( -1.330 -0.746 -0.656) 1.660 15.835 ( -0.231 0.609 1.109) 1.286 15.850 ( 1.235 0.179 0.857) 1.513 17.853 ( 1.495 0.855 0.307) 1.750 17.868 ( -1.376 0.641 0.381) 1.565 17.937 ( -0.447 0.062 -0.150) 0.476 17.963 ( 0.200 -0.935 -0.742) 1.210 19.853 ( -1.065 -0.207 0.050) 1.086 19.862 ( 1.125 -0.631 -0.355) 1.338 19.895 ( 0.669 -2.003 0.646) 2.209 19.925 ( -0.651 -3.240 -0.551) 3.350 20.698 ( 0.087 1.878 0.285) 1.901 20.706 ( -0.177 1.608 0.007) 1.617 20.981 ( 0.202 1.332 0.346) 1.391 21.007 ( -0.125 -0.144 -0.605) 0.635 22.097 ( -0.286 6.645 -0.038) 6.652 22.105 ( 0.481 6.263 -0.464) 6.298 22.162 ( -0.751 3.807 1.260) 4.080 22.220 ( 0.615 1.016 -1.050) 1.585 24.388 ( 0.292 1.871 0.406) 1.937 24.410 ( -0.327 1.454 -0.387) 1.540 24.417 ( -0.940 0.708 0.439) 1.256 24.441 ( 0.977 -0.207 -0.377) 1.068 30.175 ( -0.283 0.947 0.647) 1.181 30.203 ( -0.034 0.416 0.890) 0.983 30.225 ( 0.170 -0.224 -0.681) 0.737 30.264 ( 0.204 -1.312 -0.965) 1.642 34.213 ( 0.657 0.615 1.797) 2.010 34.304 ( -0.687 -3.350 -1.462) 3.719 34.526 ( -2.080 -0.047 1.187) 2.395 34.606 ( 2.215 -3.550 -1.655) 4.500 36.611 ( 0.294 -1.750 1.486) 2.314 36.678 ( 0.027 -5.097 -1.049) 5.204 36.756 ( 0.256 -4.042 1.882) 4.466 36.865 ( -0.759 -9.311 -2.142) 9.584 40.719 ( 0.317 -0.477 0.476) 0.744 40.822 ( 2.629 -5.575 -0.636) 6.196 41.029 ( -1.612 -1.836 -3.262) 4.075 41.125 ( -9.602 -6.222 -3.347) 11.921 41.310 ( 6.500 -2.355 2.433) 7.329 41.377 ( -1.978 3.093 -0.603) 3.720 41.552 ( 6.770 -11.444 10.865) 17.171 41.956 ( -3.031 -22.066 -5.878) 23.035 ======================= Grid point 165 (83/126) ======================= q-point: (-0.33 0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.773 ( -2.934 3.145 0.100) 4.303 4.823 ( 0.838 3.472 1.898) 4.045 5.050 ( 0.937 10.986 5.682) 12.404 5.258 ( 7.189 6.258 1.482) 9.646 5.364 ( -2.670 5.534 -1.645) 6.361 5.451 ( 1.557 13.584 1.939) 13.810 5.524 ( 2.862 11.056 2.379) 11.666 5.669 ( -0.371 10.804 2.201) 11.032 5.728 ( 2.880 3.492 0.197) 4.530 5.904 ( 0.377 -3.035 -9.880) 10.342 5.984 ( 2.599 3.418 -2.015) 4.743 6.140 ( -0.902 -4.434 -9.278) 10.322 6.468 ( -1.261 16.102 5.039) 16.919 6.708 ( -1.075 7.392 -0.861) 7.519 6.776 ( 0.862 0.752 5.172) 5.297 6.915 ( 2.818 6.187 1.863) 7.049 6.928 ( -1.409 0.191 -9.080) 9.190 6.963 ( -1.401 -3.984 5.545) 6.970 7.208 ( -7.550 -4.120 -5.694) 10.315 7.264 ( -5.022 -10.310 4.638) 12.371 7.461 ( 5.192 1.567 0.690) 5.467 7.756 ( 5.241 -5.316 -0.981) 7.529 7.794 ( -1.709 -3.368 -1.545) 4.080 8.011 ( -6.139 -2.686 1.094) 6.789 8.226 ( -0.365 -4.337 -0.496) 4.380 8.343 ( 2.624 1.630 1.335) 3.365 8.413 ( 2.423 0.088 3.424) 4.195 8.514 ( 2.847 3.571 0.314) 4.578 8.784 ( 1.153 -2.347 7.108) 7.574 8.866 ( -1.471 -1.980 -6.306) 6.771 8.929 ( 4.455 -3.581 7.988) 9.823 9.062 ( -3.518 -2.541 2.597) 5.058 9.358 ( 0.838 2.132 -5.282) 5.757 9.421 ( -2.209 -2.271 1.314) 3.430 9.545 ( -4.236 1.528 -0.715) 4.559 9.618 ( 2.313 3.269 -3.051) 5.035 9.770 ( 0.771 3.021 0.675) 3.190 10.030 ( 1.465 -2.133 -6.117) 6.642 10.412 ( 4.445 8.817 -6.487) 11.814 10.499 ( -3.900 9.889 1.278) 10.707 10.538 ( -2.023 4.999 -4.259) 6.872 10.697 ( -4.213 3.624 -0.025) 5.557 10.872 ( 1.373 6.846 6.577) 9.592 11.033 ( 5.827 3.772 0.220) 6.945 11.160 ( 4.783 5.363 7.752) 10.570 11.336 ( -2.741 5.614 -3.496) 7.159 11.358 ( 4.563 1.548 3.391) 5.892 11.611 ( -0.675 -2.757 -6.917) 7.476 11.761 ( -3.588 9.686 2.362) 10.596 11.814 ( -0.285 8.716 0.704) 8.749 12.033 ( -0.137 12.890 2.602) 13.151 12.090 ( 4.586 6.569 1.257) 8.109 12.243 ( -2.186 17.697 -0.950) 17.857 12.265 ( -2.415 14.773 -3.357) 15.341 12.372 ( -3.792 5.734 -1.568) 7.051 12.622 ( -2.572 -2.108 7.132) 7.869 12.700 ( 1.522 3.075 -1.688) 3.824 12.955 ( -3.620 -5.050 -2.546) 6.715 13.019 ( -4.381 -1.606 -2.836) 5.460 13.256 ( -1.694 -6.917 -4.185) 8.260 14.172 ( -1.328 1.425 1.470) 2.440 14.339 ( 1.415 -4.620 1.318) 5.008 14.428 ( 1.957 -0.917 -0.206) 2.171 14.522 ( 2.247 -5.258 -0.056) 5.719 15.673 ( -1.419 0.641 1.562) 2.206 15.711 ( -2.337 -0.811 0.356) 2.499 15.846 ( 1.160 1.689 0.335) 2.076 15.887 ( 1.879 0.090 0.608) 1.977 17.851 ( -0.716 1.436 0.591) 1.710 17.888 ( 1.920 -0.189 0.405) 1.971 17.920 ( -0.851 0.744 -0.738) 1.350 17.971 ( 0.634 -1.448 -0.353) 1.620 19.832 ( -0.582 -0.406 -0.503) 0.870 19.856 ( -1.622 -1.225 0.443) 2.080 19.926 ( 2.414 -1.730 0.350) 2.990 19.946 ( 2.277 -2.851 -0.523) 3.686 20.712 ( 1.236 1.767 0.346) 2.184 20.718 ( 1.543 1.579 0.027) 2.208 20.971 ( -1.505 1.108 0.508) 1.936 20.987 ( -1.545 0.055 -0.814) 1.748 22.094 ( 0.064 6.627 -0.228) 6.632 22.114 ( 0.581 6.100 -0.274) 6.134 22.149 ( -1.218 4.255 1.092) 4.558 22.220 ( -0.030 0.890 -0.893) 1.261 24.381 ( -0.834 1.700 0.117) 1.898 24.407 ( -0.298 1.312 -0.156) 1.354 24.416 ( 0.833 1.138 0.583) 1.526 24.469 ( 1.818 -0.300 -0.475) 1.903 30.174 ( -0.127 1.064 0.657) 1.257 30.205 ( -0.279 0.598 1.065) 1.253 30.226 ( 0.326 -0.630 -0.843) 1.102 30.260 ( -0.109 -1.301 -1.008) 1.650 34.233 ( 0.570 0.027 1.344) 1.460 34.306 ( 1.561 -3.375 -0.984) 3.847 34.467 ( -3.900 2.717 0.803) 4.821 34.654 ( 2.986 -6.280 -1.339) 7.081 36.622 ( 0.117 -2.222 1.338) 2.597 36.672 ( -0.079 -4.631 -1.347) 4.823 36.762 ( -0.736 -4.524 2.167) 5.070 36.836 ( -0.814 -8.140 -1.881) 8.394 40.724 ( -1.125 0.012 0.744) 1.348 40.785 ( -3.739 -3.984 -4.136) 6.853 40.979 ( -2.143 -1.207 -0.119) 2.462 41.138 ( 9.563 -8.785 5.565) 14.128 41.294 ( -5.096 2.751 -3.102) 6.570 41.445 ( 6.291 -1.033 0.340) 6.385 41.691 ( 1.935 -13.997 8.633) 16.559 41.826 ( -6.622 -20.459 -7.889) 22.905 ======================= Grid point 166 (84/126) ======================= q-point: (-0.17 0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.726 ( -2.045 3.664 0.583) 4.236 4.839 ( -0.183 -1.498 2.948) 3.312 5.064 ( -1.544 18.260 0.563) 18.334 5.345 ( 1.712 6.685 3.729) 7.844 5.413 ( 7.550 3.375 -0.906) 8.319 5.498 ( 0.635 1.490 0.287) 1.645 5.573 ( 3.037 11.381 0.487) 11.789 5.726 ( 4.701 6.073 2.414) 8.050 5.769 ( 0.833 4.171 1.849) 4.638 5.825 ( -3.404 -0.707 -6.693) 7.543 6.018 ( 3.290 4.282 -2.211) 5.835 6.127 ( 1.291 -1.480 -4.186) 4.623 6.511 ( 1.053 14.107 7.405) 15.967 6.627 ( -6.696 9.276 -1.479) 11.536 6.811 ( -1.783 0.726 0.577) 2.010 6.852 ( 2.809 5.278 0.162) 5.981 6.956 ( -2.461 -2.596 -1.290) 3.802 6.970 ( 0.826 1.191 3.225) 3.535 7.144 ( 2.289 -2.339 -0.480) 3.307 7.201 ( -3.063 -11.042 2.504) 11.729 7.537 ( 2.305 4.446 -6.570) 8.261 7.672 ( -5.880 -4.385 -10.603) 12.893 7.809 ( 0.534 -3.924 -0.958) 4.074 7.900 ( -3.604 -5.343 -2.455) 6.897 8.191 ( -4.758 -0.657 6.862) 8.376 8.413 ( -0.283 -3.774 4.036) 5.533 8.486 ( 2.433 2.480 5.024) 6.108 8.562 ( 2.917 6.392 2.102) 7.334 8.803 ( 1.856 0.809 -9.338) 9.555 8.849 ( 1.230 1.198 2.331) 2.895 9.028 ( 0.702 -1.431 7.788) 7.949 9.071 ( 4.168 -1.952 3.939) 6.058 9.313 ( -2.651 4.100 -3.191) 5.833 9.408 ( 0.108 -0.825 -0.127) 0.842 9.487 ( -1.852 1.503 5.312) 5.823 9.640 ( 0.830 1.170 -2.083) 2.530 9.805 ( 2.635 1.346 -1.107) 3.159 10.044 ( 2.713 -4.075 -5.477) 7.346 10.365 ( -4.543 5.233 -5.390) 8.780 10.461 ( -2.531 3.869 -4.733) 6.616 10.524 ( 1.414 12.174 -0.144) 12.257 10.648 ( -0.579 4.017 3.448) 5.325 10.922 ( -0.039 6.132 7.466) 9.661 11.144 ( 6.197 3.463 -1.199) 7.199 11.232 ( -1.095 9.696 -8.380) 12.862 11.298 ( 3.348 2.266 4.334) 5.927 11.464 ( 2.928 -1.728 4.161) 5.373 11.597 ( 3.053 -3.815 -5.160) 7.106 11.690 ( -5.572 14.251 3.784) 15.762 11.782 ( -4.324 9.985 0.502) 10.892 11.995 ( -1.608 17.972 1.568) 18.112 12.109 ( -3.754 14.620 0.557) 15.105 12.219 ( -0.500 13.470 -1.299) 13.542 12.255 ( 2.854 11.941 -1.840) 12.415 12.421 ( 10.429 -2.641 -0.363) 10.764 12.600 ( -3.297 -0.905 5.802) 6.734 12.699 ( -0.620 -0.094 -1.811) 1.916 12.858 ( -5.735 -7.209 -0.277) 9.216 12.942 ( -2.158 -5.131 -3.450) 6.549 13.114 ( -11.124 -11.086 -3.886) 16.179 14.214 ( 5.033 3.750 0.682) 6.313 14.358 ( 0.356 -1.842 1.165) 2.208 14.475 ( 2.322 -0.234 -1.112) 2.585 14.519 ( -2.091 -2.874 -1.136) 3.731 15.665 ( -0.661 0.203 2.928) 3.009 15.681 ( -1.116 -0.609 1.471) 1.945 15.869 ( 1.006 2.202 -0.342) 2.445 15.913 ( 0.669 0.443 -0.215) 0.831 17.844 ( -0.623 1.877 1.122) 2.274 17.903 ( -0.100 -0.194 -1.143) 1.164 17.926 ( 1.757 0.112 0.240) 1.777 17.976 ( 0.040 -1.356 -0.087) 1.359 19.821 ( -0.822 -0.747 0.309) 1.153 19.837 ( -0.044 -1.290 -0.753) 1.495 19.961 ( 0.994 -1.631 1.074) 2.191 19.988 ( 2.333 -2.828 -0.909) 3.777 20.743 ( 1.774 1.732 0.514) 2.532 20.756 ( 2.282 1.277 0.115) 2.618 20.935 ( -2.487 1.065 0.505) 2.752 20.950 ( -1.835 0.112 -0.994) 2.090 22.099 ( 0.535 6.502 -0.267) 6.529 22.120 ( -0.093 6.102 -0.301) 6.110 22.134 ( -0.608 4.553 1.189) 4.745 22.211 ( -0.417 0.997 -0.945) 1.435 24.371 ( -0.358 1.917 0.288) 1.971 24.402 ( -0.057 1.212 -0.561) 1.336 24.435 ( 0.655 1.336 1.106) 1.854 24.495 ( 1.263 -0.505 -0.787) 1.571 30.177 ( 0.075 1.173 0.717) 1.377 30.201 ( -0.664 0.872 1.100) 1.553 30.231 ( 0.663 -1.154 -0.952) 1.636 30.251 ( -0.283 -1.327 -1.031) 1.704 34.252 ( 1.421 -0.115 0.014) 1.426 34.318 ( -1.110 -2.949 -0.537) 3.197 34.428 ( -0.407 3.784 2.659) 4.643 34.685 ( 1.271 -8.585 -2.507) 9.033 36.625 ( -0.330 -2.609 0.676) 2.715 36.665 ( 0.105 -4.541 -0.940) 4.639 36.752 ( -1.053 -3.948 1.557) 4.373 36.823 ( -0.170 -7.345 -0.773) 7.387 40.695 ( -1.253 -2.017 -0.338) 2.398 40.716 ( -1.559 -3.271 0.319) 3.637 41.007 ( 1.903 5.694 1.633) 6.222 41.194 ( -2.707 -0.621 -1.161) 3.010 41.362 ( 9.539 -11.327 5.321) 15.736 41.529 ( 2.287 -1.680 -2.406) 3.721 41.583 ( -7.402 -19.330 -8.287) 22.296 41.776 ( -1.723 -13.796 4.989) 14.771 ======================= Grid point 167 (85/126) ======================= q-point: ( 0.00 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.788 ( -0.277 -3.349 4.036) 5.252 4.788 ( -0.277 3.349 4.036) 5.252 5.313 ( -1.684 -9.402 -6.318) 11.452 5.313 ( -1.684 9.402 -6.318) 11.452 5.501 ( 2.414 -1.911 1.070) 3.259 5.501 ( 2.414 1.911 1.070) 3.259 5.691 ( -1.948 -0.763 -2.907) 3.581 5.691 ( -1.948 0.763 -2.907) 3.581 5.930 ( 2.259 -5.501 7.290) 9.407 5.930 ( 2.259 5.501 7.290) 9.407 6.101 ( 1.226 -3.731 1.813) 4.326 6.101 ( 1.226 3.731 1.813) 4.326 6.683 ( -3.242 -5.831 -0.754) 6.715 6.683 ( -3.242 5.831 -0.754) 6.715 6.837 ( 2.653 -9.574 -0.373) 9.942 6.837 ( 2.653 9.574 -0.373) 9.942 7.002 ( -0.985 -2.219 3.772) 4.486 7.002 ( -0.985 2.219 3.772) 4.486 7.108 ( 1.949 -6.246 -4.257) 7.805 7.108 ( 1.949 6.246 -4.257) 7.805 7.507 ( -3.034 -1.818 -6.118) 7.067 7.507 ( -3.034 1.818 -6.118) 7.067 7.765 ( 1.451 -3.190 -6.915) 7.752 7.765 ( 1.451 3.190 -6.915) 7.752 8.226 ( -4.423 -5.606 11.938) 13.911 8.226 ( -4.423 5.606 11.938) 13.911 8.612 ( 0.858 -3.626 0.580) 3.771 8.612 ( 0.858 3.626 0.580) 3.771 8.880 ( -0.685 -4.695 -4.095) 6.267 8.880 ( -0.685 4.695 -4.095) 6.267 9.096 ( 0.728 -1.754 2.584) 3.207 9.096 ( 0.728 1.754 2.584) 3.207 9.383 ( 2.466 -3.442 2.651) 4.995 9.383 ( 2.466 3.442 2.651) 4.995 9.599 ( -0.011 -2.500 5.046) 5.632 9.599 ( -0.011 2.500 5.046) 5.632 9.924 ( 3.123 -7.585 -1.211) 8.292 9.924 ( 3.123 7.585 -1.211) 8.292 10.350 ( -2.880 -2.540 -9.192) 9.962 10.350 ( -2.880 2.540 -9.192) 9.962 10.718 ( 1.958 -2.722 3.623) 4.936 10.718 ( 1.958 2.722 3.623) 4.937 11.073 ( -4.391 -7.215 -2.089) 8.701 11.073 ( -4.391 7.215 -2.089) 8.701 11.355 ( -1.551 -3.803 0.352) 4.122 11.355 ( -1.551 3.803 0.352) 4.122 11.506 ( 3.897 -6.587 -2.805) 8.151 11.506 ( 3.897 6.587 -2.805) 8.151 11.860 ( 0.383 -3.428 4.897) 5.990 11.860 ( 0.383 3.429 4.897) 5.990 12.290 ( -0.354 -5.805 -0.742) 5.863 12.290 ( -0.354 5.805 -0.742) 5.863 12.387 ( -0.872 -12.536 2.547) 12.822 12.387 ( -0.872 12.536 2.547) 12.822 12.481 ( 2.783 -10.524 1.963) 11.061 12.481 ( 2.783 10.524 1.963) 11.061 12.700 ( -5.146 -12.173 -3.518) 13.676 12.700 ( -5.146 12.173 -3.518) 13.676 12.795 ( 3.885 -4.616 -3.357) 6.904 12.795 ( 3.885 4.616 -3.357) 6.904 14.341 ( -0.284 -1.682 1.182) 2.075 14.341 ( -0.284 1.682 1.182) 2.075 14.469 ( -0.230 -0.897 -2.082) 2.278 14.469 ( -0.230 0.897 -2.082) 2.278 15.677 ( 0.265 -0.423 3.006) 3.047 15.677 ( 0.265 0.423 3.006) 3.048 15.907 ( -0.482 -0.853 -0.711) 1.210 15.907 ( -0.482 0.853 -0.711) 1.210 17.876 ( -0.424 -1.792 0.389) 1.882 17.876 ( -0.424 1.793 0.389) 1.883 17.959 ( 0.501 -0.763 -0.286) 0.957 17.959 ( 0.501 0.763 -0.286) 0.957 19.813 ( -0.032 -0.890 -0.143) 0.902 19.813 ( -0.032 0.890 -0.143) 0.902 19.968 ( 0.051 -1.118 -0.021) 1.119 19.968 ( 0.051 1.118 -0.021) 1.119 20.787 ( -0.168 -0.620 0.683) 0.938 20.787 ( -0.168 0.620 0.683) 0.938 20.922 ( 0.155 -0.716 -0.594) 0.943 20.922 ( 0.155 0.716 -0.594) 0.943 22.178 ( 0.224 -0.567 0.142) 0.626 22.178 ( 0.224 0.567 0.142) 0.626 22.193 ( -0.184 -2.031 -0.271) 2.057 22.193 ( -0.184 2.031 -0.271) 2.057 24.399 ( -0.005 -0.841 0.201) 0.865 24.399 ( -0.005 0.841 0.201) 0.865 24.481 ( -0.013 -1.642 -0.143) 1.648 24.481 ( -0.013 1.642 -0.143) 1.648 30.205 ( -0.034 -0.470 0.222) 0.521 30.205 ( -0.034 0.470 0.222) 0.521 30.221 ( 0.056 -0.402 -0.345) 0.533 30.221 ( 0.056 0.402 -0.345) 0.533 34.278 ( 0.037 -0.635 0.059) 0.639 34.278 ( 0.037 0.635 0.059) 0.639 34.528 ( -0.053 -5.742 -0.121) 5.744 34.528 ( -0.053 5.742 -0.121) 5.744 36.611 ( 0.140 -1.398 0.336) 1.444 36.611 ( 0.140 1.398 0.336) 1.444 36.725 ( -0.144 -2.100 -0.227) 2.117 36.725 ( -0.144 2.100 -0.227) 2.117 40.694 ( 2.336 -1.424 2.602) 3.775 40.694 ( 2.336 1.424 2.602) 3.775 41.087 ( -7.388 -7.200 -6.333) 12.105 41.087 ( -7.388 7.200 -6.333) 12.105 41.363 ( 8.139 -9.697 5.464) 13.788 41.363 ( 8.139 9.697 5.464) 13.788 41.550 ( -3.074 -4.170 -1.687) 5.448 41.550 ( -3.074 4.170 -1.687) 5.448 ======================= Grid point 169 (86/126) ======================= q-point: ( 0.17 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.806 ( 0.192 -3.780 4.059) 5.550 4.806 ( 0.192 3.780 4.059) 5.550 5.248 ( -2.615 -8.925 -5.015) 10.566 5.248 ( -2.615 8.925 -5.015) 10.567 5.543 ( 1.118 -1.257 0.200) 1.694 5.543 ( 1.118 1.257 0.200) 1.694 5.647 ( -0.853 -2.069 -1.367) 2.623 5.647 ( -0.853 2.069 -1.367) 2.623 5.944 ( -2.349 -8.615 2.514) 9.277 5.944 ( -2.349 8.615 2.514) 9.277 6.146 ( 0.566 -4.039 4.057) 5.752 6.146 ( 0.566 4.039 4.057) 5.752 6.668 ( 1.874 -3.506 0.301) 3.987 6.668 ( 1.874 3.506 0.301) 3.987 6.864 ( 0.464 -7.067 -0.900) 7.139 6.864 ( 0.464 7.067 -0.900) 7.139 6.976 ( -2.463 -1.658 0.477) 3.007 6.976 ( -2.463 1.658 0.477) 3.007 7.116 ( 1.664 -1.889 -5.073) 5.663 7.116 ( 1.664 1.889 -5.073) 5.663 7.472 ( 1.428 -2.855 -1.412) 3.491 7.472 ( 1.428 2.855 -1.412) 3.491 7.775 ( 2.016 -3.253 -2.993) 4.858 7.775 ( 2.016 3.253 -2.993) 4.858 8.221 ( -1.270 -3.478 6.496) 7.477 8.221 ( -1.270 3.478 6.496) 7.477 8.616 ( -1.137 -3.190 0.529) 3.427 8.616 ( -1.137 3.190 0.529) 3.427 8.800 ( -6.123 -7.027 0.276) 9.325 8.800 ( -6.123 7.027 0.276) 9.325 9.071 ( -3.050 -0.795 1.359) 3.432 9.071 ( -3.050 0.795 1.359) 3.432 9.448 ( 1.019 -2.891 2.146) 3.742 9.448 ( 1.019 2.891 2.146) 3.742 9.590 ( 0.158 -1.611 -1.012) 1.909 9.590 ( 0.158 1.611 -1.012) 1.909 10.002 ( 1.964 -6.380 3.375) 7.480 10.002 ( 1.964 6.380 3.375) 7.480 10.324 ( 5.916 -2.684 -9.403) 11.429 10.324 ( 5.916 2.684 -9.403) 11.429 10.753 ( -0.148 -1.308 3.164) 3.427 10.753 ( -0.148 1.309 3.164) 3.427 10.983 ( -2.964 -5.596 -0.525) 6.354 10.983 ( -2.964 5.596 -0.525) 6.354 11.271 ( -7.263 -6.664 0.303) 9.861 11.271 ( -7.263 6.664 0.303) 9.861 11.555 ( 2.920 -5.329 -3.317) 6.923 11.555 ( 2.920 5.329 -3.317) 6.923 11.932 ( 3.313 -6.582 4.579) 8.676 11.932 ( 3.313 6.582 4.579) 8.676 12.211 ( -5.757 -7.422 -1.698) 9.545 12.211 ( -5.757 7.422 -1.698) 9.545 12.363 ( -2.022 -6.193 0.600) 6.542 12.363 ( -2.022 6.193 0.600) 6.542 12.580 ( 3.928 -8.785 1.591) 9.754 12.580 ( 3.928 8.785 1.591) 9.754 12.662 ( 3.857 -9.452 1.601) 10.333 12.662 ( 3.857 9.451 1.601) 10.333 12.930 ( 11.221 -3.535 -5.823) 13.127 12.930 ( 11.221 3.535 -5.823) 13.127 14.292 ( -4.578 -4.065 1.024) 6.207 14.292 ( -4.578 4.065 1.024) 6.207 14.458 ( -0.685 -1.606 -1.275) 2.162 14.458 ( -0.685 1.606 -1.275) 2.162 15.702 ( 0.823 -1.169 2.536) 2.911 15.702 ( 0.823 1.170 2.536) 2.911 15.884 ( -1.587 -0.654 -0.492) 1.786 15.884 ( -1.587 0.654 -0.492) 1.786 17.869 ( -0.448 -1.933 0.389) 2.022 17.869 ( -0.448 1.933 0.389) 2.022 17.962 ( 0.003 -0.855 -0.348) 0.923 17.962 ( 0.003 0.855 -0.348) 0.923 19.817 ( 0.570 -1.229 -0.125) 1.361 19.817 ( 0.570 1.229 -0.125) 1.361 19.952 ( -1.672 -1.474 -0.025) 2.229 19.952 ( -1.672 1.474 -0.025) 2.229 20.764 ( -2.126 -0.616 0.463) 2.261 20.764 ( -2.126 0.616 0.463) 2.261 20.948 ( 2.311 -0.957 -0.397) 2.533 20.948 ( 2.311 0.957 -0.397) 2.533 22.178 ( -0.234 -1.140 0.127) 1.171 22.178 ( -0.234 1.140 0.127) 1.171 22.196 ( 0.533 -1.622 -0.251) 1.726 22.196 ( 0.533 1.622 -0.251) 1.726 24.401 ( 0.166 -0.581 0.198) 0.636 24.401 ( 0.166 0.581 0.198) 0.636 24.471 ( -0.972 -1.251 -0.138) 1.590 24.471 ( -0.972 1.251 -0.138) 1.590 30.201 ( -0.380 -0.617 0.104) 0.732 30.201 ( -0.380 0.617 0.104) 0.732 30.227 ( 0.569 -1.017 -0.221) 1.186 30.227 ( 0.569 1.017 -0.221) 1.186 34.269 ( -0.930 -2.683 0.007) 2.840 34.269 ( -0.930 2.683 0.007) 2.840 34.533 ( 0.631 -4.054 -0.041) 4.103 34.533 ( 0.631 4.054 -0.041) 4.103 36.611 ( -0.258 -1.972 0.085) 1.991 36.611 ( -0.258 1.972 0.085) 1.991 36.728 ( 0.651 -2.840 0.005) 2.913 36.728 ( 0.651 2.840 0.005) 2.913 40.740 ( 0.297 -2.178 -0.181) 2.205 40.740 ( 0.297 2.178 -0.181) 2.205 41.005 ( 1.375 -0.696 1.644) 2.254 41.005 ( 1.375 0.696 1.644) 2.254 41.406 ( -5.947 -3.563 -3.977) 7.993 41.406 ( -5.947 3.563 -3.977) 7.993 41.547 ( 4.634 -11.718 2.541) 12.855 41.547 ( 4.634 11.718 2.541) 12.855 ======================= Grid point 171 (87/126) ======================= q-point: ( 0.33 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.837 ( 1.418 -4.485 2.935) 5.544 4.837 ( 1.418 4.485 2.935) 5.544 5.168 ( -4.713 -8.910 0.093) 10.080 5.168 ( -4.713 8.910 0.093) 10.080 5.545 ( 1.672 -0.827 -2.517) 3.133 5.545 ( 1.672 0.827 -2.517) 3.133 5.660 ( 0.857 -5.343 -0.891) 5.484 5.660 ( 0.857 5.343 -0.891) 5.484 5.904 ( -2.039 -4.424 0.082) 4.872 5.904 ( -2.039 4.424 0.082) 4.872 6.128 ( -3.444 -8.062 0.854) 8.808 6.128 ( -3.444 8.062 0.854) 8.808 6.713 ( 0.983 -4.682 0.013) 4.784 6.713 ( 0.983 4.682 0.013) 4.784 6.850 ( -0.942 -3.809 -0.485) 3.954 6.850 ( -0.942 3.809 -0.485) 3.954 6.986 ( 3.564 -8.387 3.399) 9.727 6.986 ( 3.564 8.387 3.399) 9.727 7.111 ( 0.829 -6.881 -5.007) 8.550 7.111 ( 0.829 6.881 -5.007) 8.550 7.509 ( 1.103 -3.853 -1.449) 4.262 7.509 ( 1.103 3.853 -1.449) 4.262 7.818 ( 3.648 -2.501 2.692) 5.178 7.818 ( 3.648 2.501 2.692) 5.178 8.220 ( -1.471 -2.998 2.096) 3.942 8.220 ( -1.471 2.998 2.096) 3.942 8.549 ( -5.009 -4.198 -2.889) 7.146 8.549 ( -5.009 4.198 -2.889) 7.146 8.728 ( -2.444 -3.833 5.290) 6.974 8.728 ( -2.444 3.833 5.290) 6.974 9.033 ( -1.816 -2.565 1.808) 3.626 9.033 ( -1.816 2.565 1.808) 3.626 9.427 ( -2.509 -3.536 0.313) 4.347 9.427 ( -2.509 3.536 0.313) 4.347 9.614 ( 2.739 -1.016 -3.949) 4.912 9.614 ( 2.739 1.016 -3.949) 4.912 9.998 ( -2.993 -7.007 2.050) 7.891 9.998 ( -2.993 7.007 2.050) 7.891 10.419 ( 6.598 -3.831 -7.592) 10.764 10.419 ( 6.598 3.831 -7.592) 10.764 10.778 ( 2.548 -3.949 0.427) 4.719 10.778 ( 2.548 3.949 0.427) 4.719 10.966 ( -0.865 -3.702 4.271) 5.718 10.966 ( -0.865 3.702 4.271) 5.718 11.143 ( -5.706 -11.079 1.696) 12.577 11.143 ( -5.706 11.079 1.696) 12.577 11.581 ( 1.571 -5.066 -3.859) 6.559 11.581 ( 1.571 5.066 -3.859) 6.559 11.953 ( -2.873 -5.831 1.606) 6.695 11.953 ( -2.873 5.831 1.606) 6.696 12.124 ( -1.857 -5.139 -1.968) 5.808 12.124 ( -1.857 5.139 -1.968) 5.808 12.359 ( 0.965 -5.883 3.115) 6.726 12.359 ( 0.965 5.883 3.115) 6.727 12.648 ( 3.134 -9.265 -1.609) 9.912 12.648 ( 3.134 9.265 -1.609) 9.912 12.760 ( 3.565 -13.845 4.454) 14.974 12.760 ( 3.565 13.845 4.454) 14.974 13.095 ( 9.007 -7.432 -6.921) 13.574 13.095 ( 9.007 7.432 -6.921) 13.574 14.226 ( -2.535 -4.146 1.322) 5.036 14.226 ( -2.535 4.146 1.322) 5.036 14.423 ( -2.483 -2.741 -0.073) 3.699 14.423 ( -2.483 2.741 -0.073) 3.699 15.725 ( 0.584 -1.763 1.256) 2.242 15.725 ( 0.584 1.763 1.256) 2.242 15.853 ( -1.524 -0.851 0.324) 1.775 15.853 ( -1.524 0.851 0.324) 1.775 17.865 ( -0.164 -1.588 0.502) 1.674 17.865 ( -0.164 1.588 0.502) 1.674 17.956 ( -0.371 -0.977 -0.580) 1.195 17.956 ( -0.371 0.977 -0.580) 1.195 19.834 ( 1.361 -1.242 -0.081) 1.844 19.834 ( 1.361 1.242 -0.081) 1.844 19.913 ( -2.448 -1.655 -0.043) 2.955 19.913 ( -2.448 1.655 -0.043) 2.955 20.731 ( -1.431 -0.417 0.276) 1.516 20.731 ( -1.431 0.417 0.276) 1.516 20.984 ( 1.620 -0.830 -0.252) 1.838 20.984 ( 1.620 0.830 -0.252) 1.838 22.174 ( -0.206 -0.473 0.067) 0.520 22.174 ( -0.206 0.473 0.067) 0.520 22.205 ( 0.496 -1.356 -0.183) 1.456 22.205 ( 0.496 1.356 -0.183) 1.456 24.408 ( 0.535 -0.668 0.189) 0.877 24.408 ( 0.535 0.668 0.189) 0.877 24.448 ( -1.338 -0.594 -0.127) 1.469 24.448 ( -1.338 0.594 -0.127) 1.469 30.195 ( -0.212 -0.789 0.059) 0.819 30.195 ( -0.212 0.789 0.059) 0.819 30.235 ( 0.406 -1.151 -0.163) 1.232 30.235 ( 0.406 1.151 -0.163) 1.232 34.251 ( -0.853 -3.234 0.018) 3.345 34.251 ( -0.853 3.234 0.018) 3.345 34.545 ( 0.567 -2.583 -0.033) 2.645 34.545 ( 0.567 2.583 -0.033) 2.645 36.607 ( -0.138 -2.010 0.157) 2.021 36.607 ( -0.138 2.010 0.157) 2.021 36.741 ( 0.517 -3.299 -0.091) 3.340 36.741 ( 0.517 3.299 -0.091) 3.340 40.720 ( -0.294 -1.943 -1.277) 2.343 40.720 ( -0.294 1.943 -1.277) 2.344 41.116 ( 4.851 -5.171 5.523) 8.988 41.116 ( 4.851 5.171 5.523) 8.988 41.252 ( -5.710 -2.578 -4.387) 7.648 41.252 ( -5.710 2.578 -4.387) 7.648 41.617 ( 1.503 -13.842 0.152) 13.925 41.617 ( 1.503 13.842 0.152) 13.925 ======================= Grid point 173 (88/126) ======================= q-point: (-0.50 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.859 ( -1.299 -2.398 1.320) 3.030 4.859 ( -1.299 2.398 1.320) 3.030 5.133 ( 1.853 -6.951 3.657) 8.070 5.133 ( 1.853 6.951 3.657) 8.070 5.593 ( 0.109 -1.071 -0.488) 1.182 5.593 ( 0.109 1.071 -0.488) 1.182 5.621 ( -0.829 -6.428 -1.743) 6.712 5.621 ( -0.829 6.428 -1.744) 6.712 5.900 ( 2.054 -3.081 -1.638) 4.049 5.900 ( 2.054 3.081 -1.638) 4.049 6.052 ( -3.459 -11.704 -4.092) 12.873 6.052 ( -3.459 11.704 -4.092) 12.873 6.707 ( -0.833 -5.365 1.618) 5.665 6.707 ( -0.833 5.365 1.618) 5.665 6.834 ( -0.324 -3.590 -0.180) 3.609 6.834 ( -0.324 3.590 -0.180) 3.609 7.047 ( -1.638 -11.414 4.856) 12.512 7.047 ( -1.638 11.414 4.856) 12.512 7.146 ( 3.841 -9.038 -3.709) 10.497 7.146 ( 3.841 9.038 -3.709) 10.497 7.486 ( -0.060 -3.174 -0.517) 3.216 7.486 ( -0.060 3.174 -0.517) 3.216 7.906 ( 2.607 -8.221 -0.280) 8.629 7.906 ( 2.607 8.221 -0.280) 8.629 8.209 ( 0.249 -4.043 4.578) 6.113 8.209 ( 0.249 4.043 4.578) 6.113 8.473 ( -0.618 -2.702 -4.142) 4.984 8.473 ( -0.618 2.702 -4.142) 4.984 8.738 ( 0.270 -0.766 5.857) 5.913 8.738 ( 0.270 0.766 5.857) 5.913 9.008 ( -2.291 -4.905 1.649) 5.659 9.008 ( -2.291 4.905 1.649) 5.659 9.392 ( -1.096 -2.366 -0.320) 2.627 9.392 ( -1.096 2.366 -0.320) 2.627 9.630 ( 0.676 -0.531 -4.319) 4.403 9.630 ( 0.676 0.531 -4.319) 4.403 9.941 ( -3.212 -8.319 1.407) 9.028 9.941 ( -3.212 8.319 1.407) 9.028 10.489 ( 5.633 -4.006 -7.837) 10.450 10.489 ( 5.633 4.006 -7.837) 10.450 10.769 ( -4.202 -2.498 -1.728) 5.185 10.769 ( -4.202 2.498 -1.728) 5.185 10.988 ( 0.959 -0.505 3.907) 4.054 10.988 ( 0.959 0.505 3.907) 4.054 11.138 ( 2.875 -8.792 7.439) 11.870 11.138 ( 2.875 8.792 7.439) 11.870 11.565 ( -1.012 -6.108 -5.590) 8.341 11.565 ( -1.012 6.108 -5.590) 8.341 11.904 ( -1.640 -2.300 0.181) 2.830 11.904 ( -1.640 2.300 0.181) 2.830 12.114 ( 1.004 -3.119 -1.309) 3.528 12.114 ( 1.004 3.119 -1.309) 3.528 12.406 ( 1.178 -6.807 5.537) 8.853 12.406 ( 1.178 6.807 5.537) 8.853 12.655 ( -1.046 -9.877 -4.021) 10.715 12.655 ( -1.046 9.877 -4.021) 10.716 12.801 ( -1.722 -14.832 4.385) 15.562 12.801 ( -1.722 14.832 4.385) 15.562 13.163 ( 1.899 -6.962 -7.057) 10.093 13.163 ( 1.899 6.962 -7.057) 10.093 14.217 ( 0.216 -1.892 1.726) 2.570 14.217 ( 0.216 1.892 1.726) 2.570 14.397 ( 0.349 -1.374 0.416) 1.477 14.397 ( 0.349 1.374 0.416) 1.477 15.723 ( -1.381 -1.579 0.556) 2.171 15.723 ( -1.381 1.579 0.556) 2.171 15.846 ( 0.661 -0.476 0.798) 1.140 15.846 ( 0.661 0.476 0.798) 1.140 17.868 ( 0.147 -0.491 0.664) 0.839 17.868 ( 0.147 0.491 0.664) 0.839 17.947 ( -0.211 -0.712 -0.801) 1.092 17.947 ( -0.211 0.712 -0.801) 1.092 19.863 ( 0.791 -0.832 0.053) 1.149 19.863 ( 0.791 0.832 0.053) 1.149 19.873 ( -0.743 -1.668 -0.165) 1.833 19.873 ( -0.743 1.668 -0.165) 1.833 20.719 ( -0.057 -0.234 0.222) 0.327 20.719 ( -0.057 0.234 0.222) 0.327 20.999 ( 0.049 -0.584 -0.218) 0.625 20.999 ( 0.049 0.584 -0.218) 0.625 22.172 ( -0.116 -0.312 0.052) 0.337 22.172 ( -0.116 0.312 0.052) 0.337 22.210 ( 0.138 -1.695 -0.163) 1.709 22.210 ( 0.138 1.695 -0.163) 1.709 24.417 ( -0.386 -0.846 0.256) 0.964 24.417 ( -0.386 0.846 0.256) 0.964 24.432 ( 0.372 -0.703 -0.192) 0.818 24.432 ( 0.372 0.703 -0.192) 0.818 30.194 ( -0.005 -0.905 0.059) 0.907 30.194 ( -0.005 0.905 0.059) 0.907 30.239 ( 0.041 -1.146 -0.156) 1.157 30.239 ( 0.041 1.146 -0.156) 1.157 34.244 ( 0.036 -2.383 0.069) 2.384 34.244 ( 0.036 2.383 0.069) 2.384 34.550 ( -0.035 -2.093 -0.092) 2.096 34.550 ( -0.035 2.093 -0.092) 2.096 36.610 ( 0.209 -1.642 0.451) 1.715 36.610 ( 0.209 1.642 0.451) 1.715 36.742 ( -0.235 -2.760 -0.390) 2.797 36.742 ( -0.235 2.760 -0.390) 2.797 40.739 ( 1.874 -2.593 0.832) 3.305 40.739 ( 1.874 2.593 0.832) 3.305 41.036 ( -6.368 -2.477 -4.248) 8.046 41.036 ( -6.368 2.477 -4.248) 8.046 41.337 ( 7.270 -4.744 6.365) 10.764 41.337 ( 7.270 4.744 6.365) 10.764 41.597 ( -2.779 -13.273 -2.934) 13.874 41.597 ( -2.779 13.273 -2.934) 13.874 ======================= Grid point 175 (89/126) ======================= q-point: (-0.33 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.816 ( -3.003 -1.816 1.611) 3.861 4.816 ( -3.003 1.816 1.611) 3.861 5.260 ( 8.597 -5.959 3.669) 11.085 5.260 ( 8.597 5.959 3.669) 11.085 5.478 ( -6.226 -6.321 -2.813) 9.307 5.478 ( -6.226 6.321 -2.814) 9.307 5.694 ( 3.844 -5.008 2.382) 6.747 5.694 ( 3.844 5.008 2.382) 6.747 5.890 ( -2.922 -3.493 -5.897) 7.451 5.890 ( -2.922 3.493 -5.897) 7.451 6.027 ( 3.366 -4.663 -1.720) 6.002 6.027 ( 3.366 4.663 -1.720) 6.002 6.712 ( 0.125 -6.657 3.443) 7.496 6.712 ( 0.125 6.657 3.443) 7.496 6.857 ( 2.491 -4.889 1.113) 5.599 6.857 ( 2.491 4.889 1.113) 5.599 6.988 ( -6.245 -9.594 0.999) 11.491 6.988 ( -6.245 9.594 0.999) 11.491 7.122 ( -2.143 -8.977 -2.446) 9.547 7.122 ( -2.143 8.977 -2.446) 9.547 7.562 ( 4.905 -8.863 3.299) 10.654 7.562 ( 4.905 8.863 3.299) 10.654 7.867 ( -2.419 -7.506 -10.821) 13.390 7.867 ( -2.419 7.506 -10.821) 13.390 8.265 ( -0.496 -5.409 11.074) 12.335 8.265 ( -0.496 5.409 11.074) 12.335 8.502 ( 4.974 -4.187 -1.527) 6.679 8.502 ( 4.974 4.187 -1.527) 6.679 8.788 ( 3.688 -3.087 -0.426) 4.828 8.788 ( 3.688 3.087 -0.426) 4.828 8.974 ( -1.996 -5.101 4.578) 7.139 8.974 ( -1.996 5.101 4.578) 7.139 9.385 ( 0.327 -1.286 -0.657) 1.481 9.385 ( 0.327 1.286 -0.657) 1.481 9.589 ( -3.224 -2.667 -1.417) 4.418 9.589 ( -3.224 2.667 -1.417) 4.418 9.920 ( 0.846 -7.848 -2.430) 8.259 9.920 ( 0.846 7.848 -2.430) 8.259 10.536 ( 1.835 -3.560 -6.423) 7.569 10.536 ( 1.835 3.560 -6.423) 7.569 10.673 ( -4.512 -5.941 2.717) 7.940 10.673 ( -4.512 5.941 2.717) 7.940 11.029 ( 2.669 -5.174 1.097) 5.924 11.029 ( 2.669 5.174 1.097) 5.924 11.258 ( 4.847 -5.512 8.323) 11.097 11.258 ( 4.847 5.512 8.323) 11.097 11.503 ( -1.693 -7.172 -8.534) 11.275 11.503 ( -1.693 7.172 -8.534) 11.275 11.899 ( -0.128 -2.064 1.208) 2.395 11.899 ( -0.128 2.064 1.208) 2.395 12.141 ( 2.925 -2.199 -1.259) 3.870 12.141 ( 2.925 2.199 -1.259) 3.870 12.420 ( -2.806 -4.044 4.006) 6.346 12.420 ( -2.806 4.044 4.006) 6.346 12.603 ( -1.582 -10.518 -2.940) 11.035 12.603 ( -1.582 10.518 -2.940) 11.035 12.747 ( -5.642 -13.537 4.477) 15.334 12.747 ( -5.642 13.537 4.477) 15.334 13.100 ( -5.252 -7.711 -6.551) 11.400 13.100 ( -5.252 7.711 -6.551) 11.400 14.239 ( 1.751 -4.768 1.237) 5.228 14.239 ( 1.751 4.768 1.237) 5.228 14.440 ( 3.278 -2.427 -0.089) 4.080 14.440 ( 3.278 2.427 -0.089) 4.080 15.692 ( -2.098 -1.088 1.182) 2.642 15.692 ( -2.098 1.088 1.182) 2.642 15.876 ( 1.849 -1.128 0.423) 2.207 15.876 ( 1.849 1.128 0.423) 2.207 17.875 ( 0.185 -0.957 0.678) 1.187 17.875 ( 0.185 0.957 0.678) 1.187 17.943 ( 0.286 -1.326 -0.756) 1.553 17.943 ( 0.286 1.326 -0.756) 1.553 19.837 ( -1.341 -0.755 -0.083) 1.541 19.837 ( -1.341 0.755 -0.083) 1.541 19.910 ( 2.515 -0.461 -0.041) 2.557 19.910 ( 2.515 0.461 -0.041) 2.557 20.731 ( 1.283 -0.192 0.276) 1.326 20.731 ( 1.283 0.192 0.276) 1.326 20.984 ( -1.495 -0.353 -0.252) 1.557 20.984 ( -1.495 0.353 -0.252) 1.557 22.171 ( 0.011 -0.780 0.044) 0.781 22.171 ( 0.011 0.780 0.044) 0.781 22.208 ( -0.248 -2.066 -0.160) 2.087 22.208 ( -0.248 2.066 -0.160) 2.087 24.405 ( -0.578 -0.702 0.168) 0.924 24.405 ( -0.578 0.702 0.168) 0.924 24.451 ( 1.352 -1.450 -0.105) 1.985 24.451 ( 1.352 1.450 -0.105) 1.985 30.196 ( 0.176 -1.047 0.059) 1.063 30.196 ( 0.176 1.047 0.059) 1.063 30.235 ( -0.307 -1.107 -0.164) 1.161 30.235 ( -0.307 1.107 -0.164) 1.161 34.252 ( 0.807 -1.879 0.018) 2.045 34.252 ( 0.807 1.879 0.018) 2.045 34.544 ( -0.481 -4.717 -0.033) 4.741 34.544 ( -0.481 4.717 -0.033) 4.741 36.613 ( -0.125 -1.261 0.170) 1.279 36.613 ( -0.125 1.261 0.170) 1.279 36.735 ( -0.312 -1.862 -0.104) 1.891 36.735 ( -0.312 1.862 -0.104) 1.891 40.733 ( -3.053 -1.272 -1.550) 3.652 40.733 ( -3.053 1.272 -1.550) 3.652 41.008 ( 4.721 -4.018 2.865) 6.829 41.008 ( 4.721 4.018 2.865) 6.829 41.428 ( -2.582 -7.970 -2.287) 8.684 41.428 ( -2.582 7.970 -2.287) 8.684 41.536 ( 0.533 -5.770 0.983) 5.877 41.536 ( 0.533 5.770 0.983) 5.877 ======================= Grid point 177 (90/126) ======================= q-point: (-0.17 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.786 ( -1.399 -2.867 2.828) 4.263 4.786 ( -1.399 2.867 2.828) 4.263 5.371 ( -2.090 -9.655 -3.605) 10.515 5.371 ( -2.090 9.655 -3.605) 10.515 5.428 ( 5.398 -0.585 1.558) 5.648 5.428 ( 5.398 0.585 1.558) 5.648 5.740 ( -0.419 -4.468 -4.419) 6.298 5.740 ( -0.419 4.468 -4.419) 6.298 5.839 ( 1.487 -1.902 4.696) 5.280 5.839 ( 1.487 1.902 4.696) 5.280 6.080 ( 1.728 -4.087 0.199) 4.442 6.080 ( 1.728 4.087 0.199) 4.442 6.737 ( -0.040 -6.055 2.006) 6.379 6.737 ( -0.040 6.055 2.006) 6.379 6.829 ( -4.478 -10.898 -0.272) 11.785 6.829 ( -4.478 10.898 -0.272) 11.785 6.967 ( 3.542 -6.874 1.111) 7.812 6.967 ( 3.542 6.874 1.111) 7.812 7.094 ( -0.246 -6.460 -0.431) 6.479 7.094 ( -0.246 6.460 -0.431) 6.479 7.595 ( -2.448 -5.893 -2.228) 6.759 7.595 ( -2.448 5.893 -2.228) 6.759 7.786 ( 0.492 -5.026 -11.538) 12.595 7.786 ( 0.492 5.026 -11.538) 12.595 8.263 ( -5.552 -6.893 13.889) 16.470 8.263 ( -5.552 6.893 13.889) 16.470 8.580 ( 2.852 -3.376 0.040) 4.420 8.580 ( 2.852 3.376 0.040) 4.420 8.857 ( 5.495 -1.569 -7.508) 9.436 8.857 ( 5.495 1.569 -7.508) 9.436 9.017 ( 3.197 -1.808 8.069) 8.866 9.017 ( 3.197 1.808 8.069) 8.866 9.378 ( -1.070 -2.196 -0.720) 2.547 9.378 ( -1.070 2.196 -0.720) 2.547 9.554 ( 0.002 -5.370 4.512) 7.014 9.554 ( 0.002 5.370 4.512) 7.014 9.920 ( 0.671 -7.197 -5.010) 8.795 9.920 ( 0.671 7.197 -5.010) 8.795 10.464 ( -5.133 -3.252 -5.098) 7.932 10.464 ( -5.133 3.252 -5.098) 7.932 10.671 ( 1.243 -3.506 3.133) 4.863 10.671 ( 1.243 3.506 3.133) 4.864 11.092 ( 2.689 -8.004 0.783) 8.479 11.092 ( 2.689 8.004 0.783) 8.480 11.349 ( 1.247 -2.444 2.872) 3.972 11.349 ( 1.247 2.444 2.872) 3.972 11.460 ( 2.379 -7.050 -6.670) 9.993 11.460 ( 2.379 7.050 -6.670) 9.993 11.878 ( -3.228 -2.701 3.462) 5.450 11.878 ( -3.228 2.701 3.462) 5.450 12.221 ( 6.141 -5.630 -0.954) 8.386 12.221 ( 6.141 5.630 -0.954) 8.386 12.375 ( -1.809 -3.056 1.898) 4.027 12.375 ( -1.809 3.056 1.898) 4.027 12.544 ( -5.643 -14.529 0.305) 15.590 12.544 ( -5.643 14.530 0.305) 15.590 12.701 ( 0.125 -7.929 2.249) 8.242 12.701 ( 0.125 7.929 2.249) 8.242 12.928 ( -9.655 -6.006 -6.034) 12.872 12.928 ( -9.655 6.006 -6.034) 12.872 14.296 ( 3.563 -4.035 0.874) 5.453 14.296 ( 3.563 4.035 0.874) 5.453 14.478 ( 0.849 -0.982 -1.195) 1.764 14.478 ( 0.849 0.982 -1.195) 1.764 15.670 ( -0.986 -0.451 2.297) 2.540 15.670 ( -0.986 0.451 2.297) 2.540 15.904 ( 1.059 -1.221 -0.217) 1.631 15.904 ( 1.059 1.221 -0.217) 1.631 17.879 ( -0.101 -1.598 0.509) 1.680 17.879 ( -0.101 1.598 0.509) 1.680 17.949 ( 0.625 -1.396 -0.468) 1.600 17.949 ( 0.625 1.396 -0.468) 1.600 19.819 ( -0.601 -0.466 -0.126) 0.771 19.819 ( -0.601 0.466 -0.126) 0.771 19.951 ( 1.762 -0.675 -0.024) 1.887 19.951 ( 1.762 0.675 -0.024) 1.887 20.764 ( 1.886 -0.368 0.463) 1.977 20.764 ( 1.886 0.368 0.463) 1.977 20.948 ( -2.099 -0.306 -0.397) 2.158 20.948 ( -2.099 0.306 -0.396) 2.158 22.173 ( 0.205 -0.789 0.057) 0.817 22.173 ( 0.205 0.789 0.057) 0.817 22.201 ( -0.433 -2.168 -0.181) 2.219 22.201 ( -0.433 2.169 -0.181) 2.219 24.400 ( -0.175 -0.928 0.190) 0.963 24.400 ( -0.175 0.928 0.190) 0.963 24.472 ( 0.947 -1.711 -0.130) 1.960 24.472 ( 0.947 1.711 -0.130) 1.960 30.200 ( 0.304 -1.117 0.101) 1.162 30.200 ( 0.304 1.117 0.101) 1.162 30.227 ( -0.443 -0.992 -0.218) 1.108 30.227 ( -0.443 0.992 -0.218) 1.108 34.268 ( 0.858 -1.704 0.007) 1.908 34.268 ( 0.858 1.704 0.007) 1.908 34.534 ( -0.536 -6.501 -0.041) 6.524 34.534 ( -0.536 6.501 -0.041) 6.524 36.609 ( -0.159 -1.014 0.084) 1.030 36.609 ( -0.159 1.014 0.084) 1.030 36.730 ( -0.271 -1.831 0.006) 1.851 36.730 ( -0.271 1.831 0.006) 1.851 40.677 ( -1.441 -0.568 -0.020) 1.549 40.677 ( -1.441 0.568 -0.020) 1.549 41.169 ( 9.093 -8.708 5.834) 13.876 41.169 ( 9.093 8.708 5.834) 13.876 41.276 ( -8.571 -10.007 -7.227) 15.028 41.276 ( -8.571 10.007 -7.227) 15.028 41.576 ( 0.547 -6.165 1.439) 6.355 41.576 ( 0.547 6.165 1.439) 6.355 ======================= Grid point 221 (91/126) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( -5.163 0.000 -22.987) 23.560 1.391 ( 5.163 0.000 22.987) 23.560 2.308 ( -15.678 0.000 -38.580) 41.644 2.308 ( 15.678 0.000 38.580) 41.644 3.571 ( -12.281 0.000 -32.805) 35.028 3.571 ( 12.281 0.000 32.805) 35.028 4.067 ( -13.711 0.000 -15.789) 20.911 4.067 ( 13.711 0.000 15.789) 20.911 4.216 ( -1.216 0.000 -35.057) 35.078 4.216 ( 1.216 0.000 35.057) 35.078 4.600 ( 13.651 0.000 -6.329) 15.047 4.600 ( -13.651 0.000 6.329) 15.047 5.029 ( 5.636 0.000 -9.185) 10.776 5.029 ( -5.636 0.000 9.185) 10.776 5.407 ( -11.299 0.000 -7.005) 13.294 5.407 ( 11.299 0.000 7.005) 13.294 5.733 ( 2.810 0.000 -1.713) 3.290 5.733 ( -2.810 0.000 1.713) 3.290 6.046 ( 15.115 0.000 -7.292) 16.782 6.046 ( -15.115 0.000 7.292) 16.782 6.555 ( -12.091 0.000 -2.479) 12.343 6.555 ( 12.091 0.000 2.479) 12.343 6.875 ( 0.266 0.000 -9.591) 9.594 6.875 ( -0.266 0.000 9.591) 9.594 7.700 ( 3.242 0.000 -10.957) 11.426 7.700 ( -3.242 0.000 10.957) 11.426 7.853 ( -4.798 0.000 -3.130) 5.729 7.853 ( 4.798 0.000 3.130) 5.729 8.156 ( -6.736 0.000 1.201) 6.842 8.156 ( 6.736 0.000 -1.201) 6.842 8.420 ( -14.579 0.000 -6.082) 15.797 8.420 ( 14.579 0.000 6.082) 15.797 8.677 ( 1.747 0.000 -11.594) 11.725 8.677 ( -1.747 0.000 11.594) 11.725 9.099 ( -14.705 0.000 2.666) 14.945 9.099 ( 14.705 0.000 -2.666) 14.945 9.428 ( -13.506 0.000 -10.109) 16.870 9.428 ( 13.506 0.000 10.109) 16.870 9.585 ( -2.182 0.000 -15.556) 15.708 9.585 ( 2.182 0.000 15.556) 15.708 10.010 ( -3.332 0.000 -11.925) 12.382 10.010 ( 3.332 0.000 11.925) 12.382 10.430 ( -2.051 0.000 -4.383) 4.839 10.430 ( 2.051 0.000 4.383) 4.839 10.517 ( -1.689 0.000 -0.223) 1.704 10.517 ( 1.689 0.000 0.223) 1.704 10.743 ( -0.009 0.000 -0.711) 0.711 10.743 ( 0.009 0.000 0.711) 0.711 10.899 ( -2.049 0.000 -0.801) 2.200 10.899 ( 2.049 0.000 0.801) 2.200 11.773 ( 6.376 0.000 -9.744) 11.645 11.773 ( -6.376 0.000 9.744) 11.645 12.044 ( -5.474 0.000 -2.531) 6.031 12.044 ( 5.474 0.000 2.531) 6.031 12.208 ( -2.031 0.000 -3.356) 3.923 12.208 ( 2.031 0.000 3.356) 3.923 12.604 ( 5.156 0.000 -3.301) 6.122 12.604 ( -5.156 0.000 3.301) 6.122 13.948 ( -53.543 0.000 14.629) 55.505 13.948 ( 53.543 0.000 -14.629) 55.505 14.436 ( 6.826 0.000 -7.040) 9.806 14.436 ( -6.826 0.000 7.040) 9.806 14.925 ( 14.626 0.000 -10.689) 18.115 14.925 ( -14.626 0.000 10.689) 18.115 15.483 ( -6.742 0.000 -2.492) 7.188 15.483 ( 6.742 0.000 2.492) 7.188 16.150 ( -8.340 0.000 -0.335) 8.347 16.150 ( 8.340 0.000 0.335) 8.347 17.771 ( 11.533 0.000 -8.971) 14.611 17.771 ( -11.533 0.000 8.971) 14.611 18.245 ( -1.820 0.000 -0.080) 1.822 18.245 ( 1.820 0.000 0.080) 1.822 19.289 ( -10.481 0.000 0.148) 10.482 19.289 ( 10.481 0.000 -0.148) 10.482 19.702 ( 2.885 0.000 -4.600) 5.430 19.702 ( -2.885 0.000 4.600) 5.430 20.126 ( -0.180 0.000 -0.542) 0.572 20.126 ( 0.180 0.000 0.542) 0.572 20.156 ( -0.520 0.000 -0.129) 0.536 20.156 ( 0.520 0.000 0.129) 0.536 20.509 ( -1.432 0.000 -1.733) 2.248 20.509 ( 1.432 0.000 1.733) 2.248 20.598 ( 0.939 0.000 -1.648) 1.897 20.598 ( -0.939 0.000 1.648) 1.897 24.413 ( -8.362 0.000 1.457) 8.488 24.413 ( 8.362 0.000 -1.457) 8.488 24.588 ( -11.727 0.000 1.954) 11.888 24.588 ( 11.727 0.000 -1.954) 11.888 30.220 ( 3.599 0.000 -4.988) 6.151 30.220 ( -3.599 0.000 4.988) 6.151 30.315 ( 0.869 0.000 -6.187) 6.247 30.315 ( -0.869 0.000 6.187) 6.247 35.069 ( -43.169 0.000 13.431) 45.210 35.069 ( 43.169 0.000 -13.431) 45.210 35.643 ( -15.463 0.000 -14.018) 20.871 35.643 ( 15.463 0.000 14.018) 20.871 37.878 ( -5.024 0.000 -4.408) 6.684 37.878 ( 5.024 0.000 4.408) 6.684 38.048 ( -7.631 0.000 -8.886) 11.713 38.048 ( 7.631 0.000 8.886) 11.713 41.358 ( -4.246 0.000 -18.276) 18.763 41.358 ( 4.246 0.000 18.276) 18.763 42.759 ( 5.934 0.000 -17.761) 18.726 42.759 ( -5.934 0.000 17.761) 18.726 44.286 ( -16.815 0.000 -4.915) 17.519 44.286 ( 16.815 0.000 4.915) 17.519 45.586 ( -22.540 0.000 -8.781) 24.190 45.586 ( 22.540 0.000 8.781) 24.190 ======================= Grid point 223 (92/126) ======================= q-point: ( 0.17 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( 24.006 0.000 -24.011) 33.953 1.788 ( -7.514 0.000 -46.033) 46.643 1.804 ( 22.945 0.000 27.311) 35.671 2.624 ( 3.850 0.000 31.875) 32.107 3.281 ( -6.997 0.000 -23.389) 24.413 3.746 ( -6.942 0.000 14.620) 16.185 3.798 ( -3.541 0.000 -20.889) 21.187 4.149 ( 7.614 0.000 -28.606) 29.602 4.213 ( -4.421 0.000 0.839) 4.500 4.463 ( 3.991 0.000 3.429) 5.262 4.750 ( 0.522 0.000 -3.070) 3.114 4.796 ( -18.710 0.000 11.520) 21.972 4.847 ( 30.585 0.000 57.772) 65.368 5.019 ( 4.080 0.000 -3.701) 5.509 5.313 ( 3.173 0.000 -8.664) 9.227 5.618 ( -5.470 0.000 14.118) 15.141 5.714 ( -6.814 0.000 -14.125) 15.683 5.764 ( 7.833 0.000 4.822) 9.199 5.876 ( -3.800 0.000 1.778) 4.195 6.056 ( -8.642 0.000 -22.564) 24.162 6.432 ( 4.130 0.000 20.373) 20.787 6.516 ( -11.817 0.000 -16.961) 20.672 6.927 ( -4.383 0.000 17.730) 18.264 6.948 ( 11.221 0.000 -6.115) 12.779 7.519 ( -14.854 0.000 -3.958) 15.372 7.594 ( -10.829 0.000 6.523) 12.642 7.752 ( -6.420 0.000 -0.189) 6.423 7.918 ( 1.710 0.000 1.324) 2.163 8.042 ( -2.458 0.000 2.524) 3.523 8.192 ( -2.378 0.000 -0.027) 2.378 8.205 ( -6.184 0.000 -3.464) 7.088 8.526 ( -10.092 0.000 -10.141) 14.307 8.529 ( -15.281 0.000 11.006) 18.832 8.608 ( 2.817 0.000 -5.325) 6.024 8.830 ( -16.479 0.000 -5.769) 17.459 9.261 ( -1.107 0.000 6.367) 6.462 9.285 ( -2.337 0.000 0.608) 2.415 9.374 ( -8.491 0.000 -0.473) 8.504 9.503 ( 4.058 0.000 -12.348) 12.998 9.846 ( 8.527 0.000 10.052) 13.181 10.027 ( 6.559 0.000 -10.550) 12.423 10.188 ( -2.510 0.000 4.635) 5.271 10.406 ( 0.881 0.000 -5.989) 6.053 10.410 ( 16.536 0.000 3.655) 16.935 10.575 ( 3.205 0.000 5.761) 6.593 10.594 ( 3.810 0.000 1.889) 4.253 10.876 ( 12.163 0.000 -5.756) 13.456 10.985 ( 27.419 0.000 7.187) 28.346 11.063 ( 17.063 0.000 -3.709) 17.461 11.074 ( 8.580 0.000 -3.503) 9.268 11.779 ( 1.726 0.000 12.919) 13.033 11.865 ( 5.977 0.000 -2.177) 6.361 11.957 ( 0.558 0.000 -10.887) 10.901 11.962 ( -21.936 0.000 -4.774) 22.450 12.193 ( 6.197 0.000 0.157) 6.199 12.211 ( -2.858 0.000 5.600) 6.287 12.527 ( -3.164 0.000 5.916) 6.709 12.674 ( 5.141 0.000 -5.518) 7.542 13.180 ( -23.644 0.000 6.048) 24.405 14.276 ( -13.905 0.000 3.646) 14.375 14.464 ( -1.506 0.000 -2.431) 2.860 14.587 ( 18.098 0.000 -6.596) 19.262 14.647 ( -14.730 0.000 -4.991) 15.553 14.994 ( 2.855 0.000 -26.168) 26.323 15.405 ( -3.730 0.000 7.965) 8.795 15.683 ( 9.709 0.000 9.377) 13.498 15.899 ( -14.543 0.000 -4.411) 15.197 16.225 ( 3.847 0.000 -9.416) 10.172 17.666 ( -1.643 0.000 8.156) 8.319 17.884 ( 4.006 0.000 -5.531) 6.829 18.176 ( -5.397 0.000 -0.275) 5.405 18.235 ( -2.953 0.000 0.078) 2.954 19.178 ( -2.014 0.000 2.215) 2.994 19.452 ( 2.111 0.000 6.709) 7.033 19.678 ( -1.160 0.000 4.316) 4.469 19.721 ( 1.425 0.000 -4.431) 4.654 20.118 ( -0.271 0.000 -0.368) 0.457 20.126 ( -0.360 0.000 0.675) 0.765 20.156 ( 0.418 0.000 -0.032) 0.420 20.171 ( 0.745 0.000 0.153) 0.760 20.461 ( -2.430 0.000 -0.809) 2.561 20.509 ( -1.401 0.000 -0.159) 1.410 20.605 ( 0.435 0.000 1.732) 1.786 20.615 ( 1.201 0.000 -0.834) 1.462 24.308 ( -3.055 0.000 -0.954) 3.200 24.453 ( -4.326 0.000 4.441) 6.200 24.591 ( 11.469 0.000 -3.939) 12.126 24.808 ( 10.602 0.000 1.172) 10.667 30.192 ( -2.096 0.000 6.299) 6.638 30.248 ( 1.757 0.000 -5.673) 5.939 30.330 ( 2.986 0.000 -2.850) 4.128 30.339 ( -0.050 0.000 6.350) 6.350 34.619 ( -15.728 0.000 20.615) 25.930 35.292 ( -13.633 0.000 -9.090) 16.385 35.956 ( 41.690 0.000 17.229) 45.110 36.035 ( 18.964 0.000 18.748) 26.666 37.742 ( -5.626 0.000 -8.048) 9.819 37.961 ( 3.234 0.000 0.317) 3.250 37.969 ( -0.011 0.000 -1.363) 1.363 38.298 ( 9.453 0.000 15.971) 18.559 41.256 ( 2.404 0.000 -20.162) 20.305 41.589 ( 12.134 0.000 15.418) 19.620 42.741 ( -8.686 0.000 11.692) 14.565 42.791 ( 5.938 0.000 -17.457) 18.440 43.129 ( -72.180 0.000 -30.623) 78.408 44.024 ( -30.518 0.000 1.734) 30.567 45.635 ( 22.069 0.000 -13.574) 25.909 46.133 ( 22.732 0.000 -2.412) 22.860 ======================= Grid point 224 (93/126) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( 24.293 0.000 -1.560) 24.343 1.919 ( 34.654 0.000 -21.657) 40.865 2.500 ( 40.103 0.000 16.016) 43.183 2.731 ( -7.174 0.000 11.588) 13.629 2.967 ( -21.033 0.000 1.283) 21.072 3.673 ( -3.434 0.000 19.970) 20.263 3.803 ( 13.518 0.000 -25.709) 29.046 4.110 ( -13.494 0.000 17.089) 21.775 4.212 ( 13.876 0.000 -25.561) 29.084 4.236 ( -22.521 0.000 3.768) 22.834 4.643 ( -11.334 0.000 -6.727) 13.180 4.761 ( 6.779 0.000 1.733) 6.997 5.034 ( -3.608 0.000 -6.886) 7.774 5.260 ( -35.829 0.000 -15.282) 38.952 5.270 ( -7.426 0.000 -11.204) 13.442 5.424 ( 2.502 0.000 -5.227) 5.795 5.541 ( 16.366 0.000 -25.050) 29.922 5.898 ( 0.296 0.000 9.416) 9.420 5.946 ( 6.989 0.000 53.719) 54.171 5.971 ( 1.860 0.000 -4.434) 4.808 6.264 ( -2.924 0.000 -3.490) 4.553 6.570 ( -0.437 0.000 16.496) 16.502 7.018 ( 5.760 0.000 25.011) 25.666 7.159 ( 8.929 0.000 -0.288) 8.933 7.358 ( 0.301 0.000 1.870) 1.894 7.439 ( -3.143 0.000 -4.830) 5.763 7.557 ( -11.983 0.000 1.641) 12.094 7.898 ( -6.685 0.000 -8.096) 10.500 8.070 ( -6.355 0.000 -2.015) 6.667 8.074 ( -2.880 0.000 6.370) 6.990 8.125 ( -1.661 0.000 0.881) 1.880 8.299 ( -10.660 0.000 1.018) 10.708 8.337 ( -8.792 0.000 -0.163) 8.794 8.496 ( -9.826 0.000 -17.159) 19.773 8.615 ( 1.078 0.000 -3.739) 3.891 8.962 ( -15.097 0.000 -2.781) 15.351 9.321 ( 0.789 0.000 8.733) 8.769 9.423 ( 5.716 0.000 -17.890) 18.781 9.597 ( 7.611 0.000 -2.282) 7.946 9.794 ( -9.806 0.000 2.928) 10.234 10.108 ( 7.180 0.000 -5.441) 9.009 10.236 ( 1.125 0.000 8.928) 8.999 10.425 ( 4.470 0.000 -7.754) 8.950 10.637 ( -1.077 0.000 2.689) 2.897 10.672 ( 4.186 0.000 -1.340) 4.395 10.675 ( 3.950 0.000 4.521) 6.004 11.044 ( 11.627 0.000 -15.231) 19.162 11.094 ( 1.178 0.000 4.367) 4.523 11.315 ( 11.091 0.000 -11.703) 16.124 11.498 ( -16.535 0.000 19.916) 25.885 11.625 ( 24.999 0.000 -0.616) 25.006 11.917 ( 4.871 0.000 6.269) 7.939 11.950 ( 1.799 0.000 -4.905) 5.224 12.007 ( 10.926 0.000 -0.488) 10.937 12.181 ( -3.749 0.000 7.484) 8.371 12.292 ( 3.691 0.000 -2.947) 4.724 12.619 ( 5.836 0.000 15.098) 16.187 12.741 ( 5.068 0.000 -6.512) 8.252 13.177 ( 14.147 0.000 4.953) 14.989 13.965 ( -18.713 0.000 -9.094) 20.805 14.373 ( -6.632 0.000 7.030) 9.664 14.424 ( -4.975 0.000 -10.792) 11.883 14.582 ( -11.072 0.000 1.085) 11.125 14.770 ( -15.355 0.000 -18.410) 23.973 15.441 ( 1.703 0.000 15.734) 15.826 15.684 ( -3.171 0.000 -6.057) 6.837 15.929 ( 8.159 0.000 11.538) 14.131 16.217 ( 1.617 0.000 -16.860) 16.938 17.778 ( 9.639 0.000 1.068) 9.698 17.903 ( 1.827 0.000 -3.548) 3.991 18.064 ( -6.204 0.000 -0.278) 6.210 18.144 ( -7.276 0.000 1.029) 7.349 19.209 ( 4.368 0.000 -1.118) 4.508 19.418 ( -7.232 0.000 7.015) 10.075 19.693 ( -0.411 0.000 4.534) 4.553 19.716 ( 0.441 0.000 -4.344) 4.366 20.115 ( 0.144 0.000 -0.448) 0.471 20.122 ( -0.394 0.000 0.608) 0.724 20.164 ( 0.392 0.000 0.105) 0.406 20.176 ( -0.140 0.000 -0.034) 0.144 20.431 ( -0.835 0.000 1.073) 1.360 20.475 ( -1.646 0.000 -1.774) 2.420 20.621 ( 0.803 0.000 0.260) 0.844 20.629 ( 0.564 0.000 -0.102) 0.573 24.294 ( 2.022 0.000 -2.046) 2.877 24.410 ( -3.855 0.000 4.511) 5.934 24.779 ( 11.233 0.000 -6.308) 12.883 24.936 ( 1.608 0.000 4.914) 5.171 30.199 ( -0.678 0.000 6.626) 6.661 30.241 ( 0.823 0.000 -6.283) 6.336 30.364 ( -0.334 0.000 5.451) 5.461 30.366 ( 1.944 0.000 -2.527) 3.188 34.604 ( 2.824 0.000 12.854) 13.161 35.016 ( -12.678 0.000 -6.476) 14.236 36.478 ( 19.580 0.000 15.165) 24.766 36.578 ( 14.768 0.000 26.966) 30.745 37.646 ( -0.831 0.000 -1.223) 1.479 37.990 ( -0.260 0.000 -2.727) 2.740 37.994 ( 2.139 0.000 1.493) 2.609 38.309 ( -14.497 0.000 -3.459) 14.904 41.241 ( 5.969 0.000 -19.931) 20.805 41.634 ( -24.877 0.000 -13.904) 28.499 42.132 ( 10.670 0.000 -3.537) 11.241 42.773 ( -1.615 0.000 -13.844) 13.937 42.882 ( 0.868 0.000 22.480) 22.497 43.449 ( -28.450 0.000 -6.950) 29.287 45.981 ( 20.473 0.000 -11.588) 23.525 46.325 ( 0.308 0.000 3.310) 3.324 ======================= Grid point 225 (94/126) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 63 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( -5.292 0.000 -17.919) 18.685 2.299 ( 5.292 0.000 17.919) 18.685 2.553 ( 10.624 0.000 -4.812) 11.663 2.553 ( -10.624 0.000 4.812) 11.663 3.404 ( -44.299 0.000 -3.759) 44.458 3.404 ( 44.299 0.000 3.759) 44.458 3.916 ( 3.916 0.000 -8.849) 9.677 3.916 ( -3.916 0.000 8.849) 9.677 4.222 ( -10.833 0.000 -23.885) 26.227 4.222 ( 10.833 0.000 23.885) 26.227 4.534 ( 29.551 0.000 -15.876) 33.545 4.534 ( -29.551 0.000 15.876) 33.545 4.913 ( -4.507 0.000 -4.525) 6.387 4.913 ( 4.507 0.000 4.525) 6.387 5.298 ( -6.921 0.000 -7.103) 9.917 5.298 ( 6.921 0.000 7.103) 9.917 5.790 ( 18.557 0.000 -22.612) 29.251 5.790 ( -18.557 0.000 22.612) 29.251 6.009 ( 5.613 0.000 -6.098) 8.288 6.009 ( -5.613 0.000 6.098) 8.288 6.508 ( -10.950 0.000 -9.740) 14.655 6.508 ( 10.950 0.000 9.740) 14.655 7.175 ( 2.210 0.000 -0.863) 2.372 7.175 ( -2.210 0.000 0.863) 2.372 7.464 ( 2.110 0.000 -14.588) 14.740 7.464 ( -2.110 0.000 14.588) 14.740 7.597 ( -16.076 0.000 -8.287) 18.086 7.597 ( 16.076 0.000 8.287) 18.086 8.035 ( -0.780 0.000 -6.798) 6.843 8.035 ( 0.780 0.000 6.798) 6.843 8.096 ( -0.434 0.000 -8.295) 8.307 8.096 ( 0.434 0.000 8.295) 8.307 8.311 ( 4.657 0.000 -2.638) 5.352 8.311 ( -4.657 0.000 2.638) 5.352 8.747 ( -9.059 0.000 -5.833) 10.774 8.747 ( 9.059 0.000 5.833) 10.774 9.377 ( -0.732 0.000 -12.481) 12.502 9.377 ( 0.732 0.000 12.481) 12.502 9.690 ( 4.249 0.000 -2.837) 5.109 9.690 ( -4.249 0.000 2.837) 5.109 10.223 ( -5.172 0.000 0.659) 5.214 10.223 ( 5.172 0.000 -0.659) 5.214 10.509 ( 8.761 0.000 -4.158) 9.698 10.509 ( -8.761 0.000 4.158) 9.698 10.709 ( 0.638 0.000 -2.683) 2.757 10.709 ( -0.638 0.000 2.683) 2.757 11.148 ( 7.021 0.000 -18.781) 20.050 11.148 ( -7.021 0.000 18.781) 20.050 11.368 ( 6.525 0.000 -20.040) 21.076 11.368 ( -6.525 0.000 20.040) 21.076 11.895 ( 6.751 0.000 -2.301) 7.132 11.895 ( -6.751 0.000 2.301) 7.132 12.090 ( -8.393 0.000 -2.427) 8.737 12.090 ( 8.393 0.000 2.427) 8.737 12.235 ( -7.871 0.000 -5.854) 9.810 12.235 ( 7.871 0.000 5.854) 9.810 12.760 ( -1.004 0.000 -8.104) 8.166 12.760 ( 1.004 0.000 8.104) 8.166 13.553 ( -19.375 0.000 -15.375) 24.734 13.553 ( 19.375 0.000 15.375) 24.734 14.394 ( 9.281 0.000 -12.674) 15.709 14.394 ( -9.281 0.000 12.674) 15.709 14.437 ( -8.312 0.000 -16.976) 18.902 14.437 ( 8.312 0.000 16.976) 18.902 15.577 ( -3.249 0.000 -17.452) 17.752 15.577 ( 3.249 0.000 17.452) 17.752 16.115 ( -3.462 0.000 -19.704) 20.006 16.115 ( 3.462 0.000 19.704) 20.006 17.931 ( -0.442 0.000 -1.789) 1.842 17.931 ( 0.442 0.000 1.789) 1.842 18.003 ( 5.643 0.000 -2.136) 6.034 18.003 ( -5.643 0.000 2.136) 6.034 19.306 ( 7.429 0.000 -4.680) 8.780 19.306 ( -7.429 0.000 4.680) 8.780 19.703 ( 0.522 0.000 -4.421) 4.452 19.703 ( -0.522 0.000 4.421) 4.452 20.118 ( 0.363 0.000 -0.544) 0.654 20.118 ( -0.363 0.000 0.544) 0.654 20.171 ( -0.315 0.000 -0.135) 0.342 20.171 ( 0.315 0.000 0.135) 0.342 20.441 ( -0.927 0.000 -2.163) 2.353 20.441 ( 0.927 0.000 2.163) 2.353 20.632 ( 0.302 0.000 -0.238) 0.385 20.632 ( -0.302 0.000 0.238) 0.385 24.347 ( 4.550 0.000 -2.823) 5.354 24.347 ( -4.550 0.000 2.823) 5.354 24.915 ( 6.598 0.000 -6.830) 9.497 24.915 ( -6.598 0.000 6.830) 9.497 30.222 ( 0.377 0.000 -6.505) 6.516 30.222 ( -0.377 0.000 6.505) 6.516 30.376 ( 0.910 0.000 -4.124) 4.223 30.376 ( -0.910 0.000 4.124) 4.223 34.777 ( -10.099 0.000 -7.315) 12.471 34.777 ( 10.099 0.000 7.315) 12.471 36.753 ( 6.029 0.000 -11.387) 12.885 36.753 ( -6.029 0.000 11.387) 12.885 37.798 ( -13.919 0.000 -17.668) 22.492 37.798 ( 13.919 0.000 17.668) 22.492 38.053 ( -3.753 0.000 -4.775) 6.073 38.053 ( 3.753 0.000 4.775) 6.073 41.302 ( 10.146 0.000 -10.001) 14.246 41.302 ( -10.146 0.000 10.001) 14.246 42.522 ( -21.285 0.000 -4.597) 21.775 42.522 ( 21.285 0.000 4.597) 21.775 43.050 ( -7.667 0.000 -21.687) 23.002 43.050 ( 7.667 0.000 21.687) 23.002 46.235 ( 12.382 0.000 -8.787) 15.184 46.235 ( -12.382 0.000 8.787) 15.184 ======================= Grid point 229 (95/126) ======================= q-point: ( 0.00 0.06 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( -11.910 38.304 -14.356) 42.605 1.864 ( 11.910 38.304 14.356) 42.605 2.476 ( -16.135 16.251 -33.442) 40.532 2.476 ( 16.135 16.251 33.442) 40.532 3.779 ( -13.214 18.461 -34.397) 41.213 3.779 ( 13.214 18.461 34.397) 41.213 4.184 ( -4.466 12.384 -17.454) 21.863 4.184 ( 4.466 12.384 17.454) 21.863 4.450 ( 5.731 21.059 -24.744) 32.994 4.450 ( -5.731 21.059 24.744) 32.994 4.748 ( -12.025 15.428 0.990) 19.586 4.748 ( 12.025 15.428 -0.990) 19.586 5.125 ( 0.915 7.152 -10.391) 12.648 5.125 ( -0.915 7.152 10.391) 12.648 5.524 ( -5.040 11.553 -7.058) 14.446 5.524 ( 5.040 11.553 7.058) 14.446 5.771 ( 3.249 4.336 -4.992) 7.368 5.771 ( -3.249 4.336 4.992) 7.368 6.170 ( 10.802 12.067 -7.550) 17.869 6.170 ( -10.802 12.067 7.550) 17.869 6.566 ( -11.832 1.190 -2.640) 12.181 6.566 ( 11.832 1.190 2.640) 12.181 6.856 ( -2.014 -1.343 -9.806) 10.101 6.856 ( 2.014 -1.343 9.806) 10.101 7.615 ( 6.658 -6.297 -8.167) 12.276 7.615 ( -6.658 -6.297 8.167) 12.276 7.906 ( -6.273 4.802 -3.800) 8.766 7.906 ( 6.273 4.802 3.800) 8.766 8.316 ( 1.146 13.333 -3.286) 13.780 8.316 ( -1.146 13.333 3.286) 13.780 8.472 ( -12.229 4.914 -5.728) 14.370 8.472 ( 12.229 4.914 5.728) 14.370 8.668 ( 0.467 -0.235 -11.352) 11.364 8.668 ( -0.467 -0.235 11.352) 11.364 9.079 ( -10.699 -1.302 2.408) 11.044 9.079 ( 10.699 -1.302 -2.408) 11.044 9.409 ( -11.476 -1.208 -6.464) 13.227 9.409 ( 11.476 -1.208 6.464) 13.227 9.588 ( 0.569 0.275 -14.513) 14.527 9.588 ( -0.569 0.275 14.513) 14.527 9.947 ( -0.707 -4.949 -10.033) 11.210 9.947 ( 0.707 -4.949 10.033) 11.210 10.405 ( -7.309 -1.766 -6.351) 9.842 10.405 ( 7.309 -1.766 6.351) 9.842 10.571 ( 2.105 3.470 -7.035) 8.122 10.571 ( -2.105 3.470 7.035) 8.122 10.893 ( -0.149 3.007 -1.163) 3.227 10.893 ( 0.149 3.007 1.163) 3.227 10.926 ( 7.197 12.604 -2.747) 14.772 10.926 ( -7.197 12.604 2.747) 14.772 11.667 ( 4.531 -7.200 -6.804) 10.893 11.667 ( -4.531 -7.200 6.804) 10.893 12.068 ( -1.101 -0.257 -6.568) 6.664 12.068 ( 1.101 -0.257 6.568) 6.664 12.281 ( -1.914 6.367 -4.717) 8.152 12.281 ( 1.914 6.367 4.717) 8.152 12.693 ( -9.379 8.289 -1.696) 12.631 12.693 ( 9.379 8.289 1.696) 12.631 13.710 ( -43.924 -20.222 12.062) 49.837 13.710 ( 43.924 -20.222 -12.062) 49.837 14.406 ( 0.997 -3.230 -7.870) 8.565 14.406 ( -0.997 -3.230 7.870) 8.565 14.825 ( -11.049 -8.064 3.019) 14.008 14.825 ( 11.049 -8.064 -3.019) 14.008 15.468 ( -4.938 -0.961 -3.166) 5.944 15.468 ( 4.938 -0.961 3.166) 5.944 16.065 ( 4.588 -5.574 -4.263) 8.384 16.065 ( -4.588 -5.574 4.263) 8.384 17.744 ( 7.457 -0.804 -10.151) 12.621 17.744 ( -7.457 -0.804 10.151) 12.621 18.365 ( 1.501 5.244 -1.763) 5.733 18.365 ( -1.501 5.244 1.763) 5.733 19.378 ( 2.754 6.763 -6.804) 9.981 19.378 ( -2.754 6.763 6.804) 9.981 19.794 ( -0.596 9.860 -5.941) 11.527 19.794 ( 0.596 9.860 5.941) 11.527 20.257 ( 1.138 9.839 -0.808) 9.938 20.257 ( -1.138 9.839 0.808) 9.938 20.327 ( -1.943 13.356 -4.432) 14.206 20.327 ( 1.943 13.356 4.432) 14.206 20.527 ( -0.434 1.874 -1.459) 2.415 20.527 ( 0.434 1.874 1.459) 2.415 20.635 ( -0.481 7.051 -6.225) 9.418 20.635 ( 0.481 7.051 6.225) 9.418 24.390 ( -4.854 -2.123 0.472) 5.319 24.390 ( 4.854 -2.123 -0.472) 5.319 24.575 ( -9.453 -1.228 1.266) 9.616 24.575 ( 9.453 -1.228 -1.266) 9.616 30.219 ( 3.188 -0.068 -5.249) 6.141 30.219 ( -3.188 -0.068 5.249) 6.141 30.309 ( 0.820 -0.547 -6.204) 6.282 30.309 ( -0.820 -0.547 6.204) 6.282 34.941 ( 11.846 -10.483 -12.871) 20.393 34.941 ( -11.846 -10.483 12.871) 20.393 35.656 ( -18.216 -0.706 -15.994) 24.251 35.656 ( 18.216 -0.706 15.994) 24.251 37.763 ( -1.147 -9.233 -5.719) 10.922 37.763 ( 1.147 -9.233 5.719) 10.922 38.050 ( -9.740 -1.671 -6.027) 11.575 38.050 ( 9.740 -1.671 6.027) 11.575 41.326 ( -4.038 -3.046 -17.700) 18.409 41.326 ( 4.038 -3.046 17.700) 18.409 42.659 ( 5.272 -9.681 -16.799) 20.093 42.659 ( -5.272 -9.681 16.799) 20.093 44.052 ( -31.874 -23.401 -10.107) 40.813 44.052 ( 31.874 -23.401 10.107) 40.813 45.125 ( -0.855 -36.467 -24.508) 43.946 45.125 ( 0.855 -36.467 24.508) 43.946 ======================= Grid point 231 (96/126) ======================= q-point: ( 0.17 0.06 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 3.307 21.138 -29.879) 36.749 2.066 ( -0.719 26.559 -25.542) 36.855 2.273 ( 23.241 38.010 17.052) 47.704 2.796 ( 5.173 16.150 29.851) 34.331 3.478 ( -9.253 18.225 -19.011) 27.914 3.967 ( -7.275 20.349 5.609) 22.327 3.979 ( -0.525 16.176 -22.549) 27.756 4.313 ( 7.760 16.639 -17.871) 25.621 4.480 ( -4.084 22.536 -1.138) 22.931 4.582 ( -0.328 11.963 3.016) 12.342 4.782 ( -7.031 7.662 0.833) 10.432 4.913 ( 26.940 7.706 54.349) 61.147 4.962 ( -16.170 10.013 11.631) 22.294 5.159 ( 11.554 13.350 -7.954) 19.365 5.435 ( -2.042 12.260 -6.646) 14.094 5.717 ( -3.152 9.136 8.641) 12.964 5.773 ( -2.245 6.978 -1.227) 7.432 5.825 ( 6.257 5.578 -3.567) 9.110 5.995 ( -5.960 10.267 -4.444) 12.676 6.139 ( -5.440 8.910 -13.207) 16.835 6.461 ( 2.754 3.700 14.069) 14.806 6.538 ( -9.789 2.489 -12.320) 15.931 6.899 ( 7.733 -3.251 -3.553) 9.110 6.959 ( -0.884 2.676 16.844) 17.078 7.440 ( -11.833 -6.728 3.136) 13.969 7.548 ( -7.341 -1.461 -3.982) 8.478 7.824 ( -1.621 3.737 -1.253) 4.261 7.978 ( -0.451 6.433 3.521) 7.347 8.177 ( -7.837 11.439 1.133) 13.912 8.261 ( -7.319 5.019 -0.722) 8.904 8.332 ( -4.445 11.694 -3.774) 13.067 8.525 ( -8.353 0.217 -5.762) 10.150 8.563 ( -12.201 4.163 7.258) 14.795 8.645 ( 2.707 4.222 -3.439) 6.081 8.862 ( -13.070 3.464 -5.266) 14.511 9.166 ( 1.889 -6.186 -0.170) 6.470 9.274 ( -7.160 -0.650 2.551) 7.629 9.436 ( -5.629 4.146 0.336) 6.999 9.510 ( 2.960 0.332 -8.707) 9.202 9.801 ( 8.172 -4.090 8.037) 12.170 9.988 ( 7.509 -3.748 -10.439) 13.394 10.158 ( 13.264 -8.703 6.478) 17.135 10.254 ( -3.102 1.854 2.773) 4.555 10.500 ( 6.419 1.994 -3.277) 7.478 10.671 ( 5.314 6.457 5.390) 9.949 10.731 ( 14.431 -2.155 -5.070) 15.447 10.822 ( -2.129 10.336 3.311) 11.060 11.039 ( 9.354 -0.548 -4.060) 10.212 11.084 ( 16.852 5.537 1.995) 17.850 11.105 ( 16.402 2.880 -3.597) 17.037 11.662 ( 0.518 -6.539 5.535) 8.582 11.727 ( 2.681 -7.929 -3.268) 8.986 11.989 ( -2.113 -0.616 -5.767) 6.173 12.061 ( -8.169 3.050 -1.956) 8.937 12.252 ( 3.078 7.513 -0.981) 8.178 12.319 ( 1.302 4.691 4.752) 6.803 12.454 ( -11.553 0.733 2.449) 11.832 12.850 ( 2.652 11.659 2.156) 12.150 13.116 ( -15.235 -4.849 5.319) 16.850 14.120 ( -7.212 -22.114 -10.334) 25.452 14.404 ( 13.217 -9.566 1.722) 16.406 14.440 ( -1.636 -2.037 2.971) 3.957 14.587 ( -11.461 -5.168 -7.133) 14.455 14.889 ( 0.288 -7.104 -15.333) 16.901 15.409 ( -2.241 0.399 7.223) 7.573 15.635 ( 7.827 -2.787 12.950) 15.386 15.880 ( -9.911 -1.197 -3.491) 10.576 16.161 ( 5.421 -5.770 -11.413) 13.891 17.676 ( -1.861 1.041 6.707) 7.038 17.850 ( 7.518 -0.968 -8.038) 11.049 18.265 ( -8.363 2.849 1.399) 8.945 18.354 ( -3.711 7.374 -0.281) 8.260 19.276 ( -4.248 9.452 2.063) 10.566 19.443 ( 1.673 1.698 -2.808) 3.684 19.720 ( -3.367 6.584 -0.122) 7.396 19.816 ( -1.921 8.372 2.704) 9.005 20.234 ( -1.246 9.565 0.392) 9.654 20.256 ( -0.644 10.630 -0.357) 10.655 20.306 ( 1.384 10.930 -2.809) 11.370 20.365 ( -0.681 8.947 4.214) 9.913 20.504 ( -1.426 3.258 0.585) 3.604 20.529 ( 0.476 2.597 -1.175) 2.890 20.628 ( 1.206 3.150 -2.356) 4.115 20.690 ( -0.388 15.607 8.391) 17.724 24.302 ( -2.709 -0.602 -0.522) 2.824 24.447 ( -4.396 -0.554 4.096) 6.034 24.548 ( 10.451 -3.973 -3.164) 11.620 24.768 ( 9.177 -3.695 0.894) 9.933 30.193 ( -2.038 0.062 5.889) 6.232 30.244 ( 1.628 -0.356 -5.486) 5.734 30.321 ( 2.824 -0.813 -3.016) 4.211 30.333 ( 0.013 -0.582 5.969) 5.997 34.588 ( -13.334 -2.920 18.552) 23.032 35.272 ( -13.921 -2.385 -8.364) 16.415 35.577 ( 30.978 -23.557 4.670) 39.196 36.127 ( 21.262 -3.038 22.055) 30.785 37.661 ( -4.722 -8.227 -6.037) 11.244 37.780 ( -2.128 -10.722 -0.928) 10.970 37.964 ( 1.719 -2.914 0.586) 3.434 38.318 ( 11.930 -1.092 9.045) 15.011 41.229 ( 2.380 -2.624 -19.577) 19.895 41.548 ( 11.594 -3.935 14.803) 19.210 42.643 ( -9.948 -12.118 -16.063) 22.447 42.668 ( -1.057 -12.007 9.250) 15.193 42.866 ( -52.675 -18.716 -32.952) 64.890 43.917 ( -29.133 -10.663 1.219) 31.047 45.370 ( 26.181 -23.266 -16.478) 38.707 45.644 ( 26.155 -43.436 11.548) 52.002 ======================= Grid point 232 (97/126) ======================= q-point: ( 0.33 0.06 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( 34.368 10.120 -14.846) 38.781 2.260 ( 23.465 28.332 -6.528) 37.362 2.824 ( 28.067 28.319 10.560) 41.246 2.955 ( -1.873 20.058 15.204) 25.239 3.148 ( -22.556 16.799 3.330) 28.321 3.770 ( -10.038 10.376 11.261) 18.309 4.014 ( 11.380 16.967 -24.362) 31.795 4.265 ( -29.983 7.182 9.861) 32.370 4.374 ( 5.712 19.217 -8.149) 21.641 4.446 ( 2.740 21.170 -6.699) 22.373 4.700 ( -8.499 10.145 -5.554) 14.353 4.901 ( 4.317 11.225 6.306) 13.579 5.152 ( -9.081 8.483 -11.972) 17.256 5.313 ( -11.806 4.105 -15.541) 19.944 5.370 ( -7.392 14.376 -6.394) 17.384 5.512 ( -4.345 10.967 0.976) 11.836 5.696 ( 10.506 12.597 -23.265) 28.466 5.965 ( -2.842 5.866 8.676) 10.851 6.028 ( 8.183 9.777 37.790) 39.883 6.126 ( 2.894 13.371 8.530) 16.121 6.312 ( -1.740 5.777 -4.922) 7.786 6.598 ( 0.382 2.845 12.748) 13.067 7.041 ( 2.122 -7.387 3.330) 8.376 7.057 ( 7.968 3.781 22.206) 23.894 7.369 ( 8.012 -1.799 -5.154) 9.695 7.458 ( 0.538 5.001 2.514) 5.623 7.698 ( -13.512 8.963 -2.856) 16.464 7.923 ( -7.090 4.125 -1.494) 8.337 8.055 ( -9.035 -0.251 -0.618) 9.060 8.149 ( -5.362 4.953 2.697) 7.782 8.201 ( -4.041 6.009 -0.160) 7.243 8.348 ( -10.417 7.144 -2.199) 12.821 8.434 ( -5.617 7.104 2.695) 9.449 8.518 ( -8.039 3.997 -14.782) 17.295 8.699 ( 0.997 8.251 -5.343) 9.880 8.981 ( -11.397 1.960 -2.370) 11.804 9.308 ( 3.591 -1.533 4.447) 5.918 9.433 ( 3.269 1.701 -11.767) 12.330 9.572 ( 5.563 -2.448 -3.227) 6.881 9.776 ( -8.632 -1.674 2.269) 9.081 10.058 ( 6.508 -4.531 -5.931) 9.903 10.233 ( 0.192 -2.549 -0.056) 2.557 10.409 ( 5.592 1.564 10.960) 12.403 10.635 ( 1.949 1.483 -1.116) 2.691 10.772 ( 4.221 7.349 0.951) 8.528 10.773 ( 0.354 6.402 -4.422) 7.789 10.960 ( 11.398 -2.151 -2.228) 11.811 11.131 ( 5.401 -0.804 -1.772) 5.741 11.335 ( 9.845 2.750 -9.646) 14.055 11.488 ( -2.832 -1.878 13.130) 13.562 11.591 ( 15.496 -2.716 -2.835) 15.986 11.786 ( 3.671 -5.344 1.662) 6.693 11.959 ( 4.777 -4.223 -1.940) 6.665 12.043 ( 2.951 0.929 3.080) 4.366 12.211 ( -7.429 5.065 5.041) 10.308 12.377 ( -0.085 4.131 -2.735) 4.955 12.514 ( 13.783 -5.011 7.704) 16.566 12.817 ( -2.118 4.059 2.797) 5.365 13.166 ( 8.565 -0.742 3.723) 9.369 13.766 ( -20.688 -19.270 -11.489) 30.518 14.374 ( -4.122 -1.947 -3.120) 5.524 14.401 ( -4.119 0.670 8.121) 9.131 14.543 ( -2.498 -4.157 -1.587) 5.103 14.724 ( -8.767 -2.199 -17.865) 20.021 15.447 ( 1.081 0.646 13.521) 13.580 15.680 ( -5.082 -0.053 -3.720) 6.298 15.883 ( 7.934 -3.784 10.563) 13.742 16.157 ( 1.030 -5.419 -15.257) 16.223 17.747 ( 6.617 -0.781 2.032) 6.965 17.954 ( 8.218 2.776 -6.214) 10.671 18.092 ( -10.614 0.919 0.647) 10.673 18.246 ( -8.147 6.967 2.085) 10.921 19.265 ( 2.075 6.385 0.351) 6.723 19.415 ( -3.617 1.611 -0.276) 3.969 19.690 ( 0.049 4.185 -0.025) 4.185 19.769 ( -3.702 5.896 1.521) 7.126 20.225 ( -0.004 9.181 0.181) 9.183 20.244 ( -0.650 10.019 -0.103) 10.041 20.323 ( 1.744 9.083 -2.934) 9.703 20.359 ( -1.769 7.954 4.301) 9.214 20.482 ( -0.559 4.494 0.456) 4.551 20.532 ( -0.578 6.064 -0.886) 6.155 20.642 ( 1.352 3.734 -1.770) 4.347 20.681 ( -2.743 13.096 4.391) 14.082 24.290 ( 1.892 -0.384 -1.864) 2.683 24.402 ( -3.802 -0.758 4.321) 5.805 24.724 ( 10.482 -5.134 -5.271) 12.807 24.878 ( 1.306 -5.395 4.104) 6.903 30.198 ( -0.709 -0.101 6.289) 6.330 30.237 ( 0.789 -0.410 -6.095) 6.159 30.355 ( 0.840 -0.899 1.575) 1.998 30.358 ( 0.849 -0.731 1.025) 1.518 34.581 ( 2.817 -2.187 12.007) 12.525 34.988 ( -12.926 -2.819 -6.263) 14.637 36.112 ( 22.778 -27.034 12.545) 37.511 36.499 ( 6.274 -14.473 18.858) 24.585 37.574 ( -1.417 -6.861 -2.179) 7.336 37.723 ( -3.425 -14.063 -2.771) 14.737 38.037 ( 4.885 -0.043 2.446) 5.463 38.397 ( -6.637 1.885 -3.418) 7.699 41.215 ( 5.794 -2.552 -19.409) 20.415 41.571 ( -22.659 -5.935 -12.528) 26.563 42.069 ( 13.172 -6.063 -1.030) 14.537 42.681 ( -2.066 -8.986 -10.574) 14.029 42.747 ( 2.192 -11.666 17.348) 21.020 43.348 ( -29.183 -9.869 -6.188) 31.422 45.733 ( 20.545 -23.136 -14.114) 34.008 45.965 ( 4.734 -33.578 9.765) 35.288 ======================= Grid point 233 (98/126) ======================= q-point: ( 0.50 0.06 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.533 ( -7.956 19.165 -11.632) 23.789 2.533 ( 7.956 19.165 11.632) 23.789 2.763 ( -2.563 20.224 0.714) 20.398 2.763 ( 2.563 20.224 -0.714) 20.398 3.500 ( -34.005 9.656 -4.282) 35.608 3.500 ( 34.005 9.656 4.282) 35.608 3.979 ( -5.332 5.805 -8.085) 11.291 3.979 ( 5.332 5.805 8.085) 11.291 4.471 ( -4.215 23.583 -9.221) 25.670 4.471 ( 4.215 23.583 9.221) 25.670 4.707 ( -4.267 15.476 -1.681) 16.142 4.707 ( 4.267 15.476 1.681) 16.142 5.037 ( -5.699 12.014 -7.095) 15.072 5.037 ( 5.699 12.014 7.095) 15.072 5.402 ( -5.603 10.544 -9.178) 15.060 5.402 ( 5.603 10.544 9.178) 15.060 5.852 ( 13.962 6.792 -21.549) 26.560 5.852 ( -13.962 6.792 21.549) 26.560 6.164 ( 3.923 14.175 -5.687) 15.769 6.164 ( -3.923 14.175 5.687) 15.769 6.508 ( -9.176 0.943 -14.721) 17.372 6.508 ( 9.176 0.943 14.721) 17.372 7.188 ( -7.883 0.682 -13.750) 15.864 7.188 ( 7.883 0.682 13.750) 15.864 7.481 ( 4.573 2.483 -10.894) 12.073 7.481 ( -4.573 2.483 10.894) 12.073 7.670 ( -15.218 6.522 -5.173) 17.346 7.670 ( 15.218 6.522 5.173) 17.346 8.020 ( -6.908 0.229 -10.619) 12.670 8.020 ( 6.908 0.229 10.619) 12.670 8.165 ( 0.456 5.351 -6.974) 8.802 8.165 ( -0.456 5.351 6.974) 8.802 8.401 ( 1.755 8.285 -6.615) 10.746 8.401 ( -1.755 8.285 6.615) 10.746 8.810 ( -7.113 6.563 -6.312) 11.554 8.810 ( 7.113 6.563 6.312) 11.554 9.380 ( -0.256 0.251 -11.231) 11.237 9.380 ( 0.256 0.251 11.231) 11.237 9.659 ( 5.089 -2.806 -4.386) 7.281 9.659 ( -5.089 -2.806 4.386) 7.281 10.175 ( -4.268 -4.690 -2.148) 6.695 10.175 ( 4.268 -4.690 2.148) 6.695 10.535 ( -4.967 4.267 -7.473) 9.936 10.535 ( 4.967 4.267 7.473) 9.936 10.804 ( 0.219 6.898 -3.293) 7.647 10.804 ( -0.219 6.898 3.293) 7.647 11.132 ( 1.857 -0.951 -10.672) 10.874 11.132 ( -1.857 -0.951 10.672) 10.874 11.400 ( 5.363 2.730 -13.715) 14.977 11.400 ( -5.363 2.730 13.715) 14.977 11.839 ( -0.510 -6.597 -2.079) 6.936 11.839 ( 0.510 -6.597 2.079) 6.936 12.048 ( -8.176 -1.759 0.946) 8.417 12.048 ( 8.176 -1.759 -0.946) 8.417 12.254 ( -9.209 -0.103 -9.378) 13.144 12.254 ( 9.209 -0.103 9.378) 13.144 12.765 ( -4.039 1.002 -9.377) 10.259 12.765 ( 4.039 1.002 9.377) 10.259 13.382 ( -13.176 -14.784 -11.993) 23.152 13.382 ( 13.176 -14.784 11.993) 23.152 14.397 ( 7.432 -0.093 -12.768) 14.774 14.397 ( -7.432 -0.093 12.768) 14.774 14.491 ( -4.525 4.433 -15.130) 16.402 14.491 ( 4.525 4.433 15.130) 16.402 15.562 ( -3.396 -0.840 -14.443) 14.861 15.562 ( 3.396 -0.840 14.443) 14.861 16.059 ( -3.527 -4.921 -16.698) 17.762 16.059 ( 3.527 -4.921 16.698) 17.762 17.904 ( -9.340 -0.857 -0.108) 9.380 17.904 ( 9.340 -0.857 0.108) 9.380 18.096 ( 9.196 5.418 -4.360) 11.529 18.096 ( -9.196 5.418 4.360) 11.529 19.333 ( -2.446 3.632 -0.823) 4.455 19.333 ( 2.446 3.632 0.823) 4.455 19.714 ( 0.486 4.289 -2.339) 4.910 19.714 ( -0.486 4.289 2.339) 4.910 20.232 ( -0.568 9.410 -0.087) 9.428 20.232 ( 0.568 9.410 0.087) 9.428 20.342 ( 2.010 8.102 -3.676) 9.121 20.342 ( -2.010 8.102 3.676) 9.121 20.499 ( -0.633 7.349 -2.309) 7.729 20.499 ( 0.633 7.349 2.309) 7.729 20.658 ( 1.524 6.420 -2.266) 6.976 20.658 ( -1.524 6.420 2.266) 6.976 24.341 ( 4.275 -0.595 -2.716) 5.100 24.341 ( -4.275 -0.595 2.716) 5.100 24.854 ( 5.710 -5.700 -6.119) 10.126 24.854 ( -5.710 -5.700 6.119) 10.126 30.218 ( 0.425 -0.300 -6.292) 6.313 30.218 ( -0.425 -0.300 6.292) 6.313 30.367 ( 0.979 -0.817 -4.201) 4.390 30.367 ( -0.979 -0.817 4.201) 4.390 34.749 ( -9.297 -2.703 -7.700) 12.371 34.749 ( 9.297 -2.703 7.700) 12.371 36.480 ( -9.707 -24.795 -3.346) 26.836 36.480 ( 9.707 -24.795 3.346) 26.836 37.620 ( -4.467 -10.444 -6.503) 13.089 37.620 ( 4.467 -10.444 6.503) 13.089 38.181 ( -8.754 5.010 -8.766) 13.363 38.181 ( 8.754 5.010 8.766) 13.363 41.272 ( 9.657 -2.887 -10.184) 14.329 41.272 ( -9.657 -2.887 10.184) 14.329 42.457 ( -19.620 -6.295 -4.044) 20.998 42.457 ( 19.620 -6.295 4.044) 20.998 42.922 ( -9.060 -11.879 -19.464) 24.536 42.922 ( 9.060 -11.879 19.464) 24.536 45.955 ( 9.843 -26.466 -12.472) 30.869 45.955 ( -9.843 -26.466 12.472) 30.869 ======================= Grid point 237 (99/126) ======================= q-point: ( 0.00 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 114 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.641 ( -8.967 36.023 -26.220) 45.449 2.641 ( 8.967 36.023 26.220) 45.449 2.925 ( -10.363 26.709 -28.388) 40.331 2.925 ( 10.363 26.709 28.388) 40.331 4.190 ( -7.133 20.865 -25.215) 33.497 4.190 ( 7.133 20.865 25.215) 33.497 4.588 ( -5.245 25.872 -13.744) 29.762 4.588 ( 5.245 25.872 13.744) 29.762 4.942 ( 2.763 26.630 -10.269) 28.675 4.942 ( -2.763 26.630 10.269) 28.675 5.185 ( -6.876 19.135 -1.838) 20.416 5.185 ( 6.876 19.135 1.838) 20.416 5.302 ( -3.004 17.463 -2.819) 17.942 5.302 ( 3.004 17.463 2.819) 17.942 5.722 ( 10.330 6.158 -7.863) 14.369 5.722 ( -10.330 6.158 7.863) 14.369 6.046 ( -4.469 24.343 -3.995) 25.070 6.046 ( 4.469 24.343 3.995) 25.070 6.471 ( 2.699 13.768 -14.981) 20.524 6.471 ( -2.699 13.768 14.981) 20.524 6.628 ( -5.111 7.786 -1.788) 9.483 6.628 ( 5.111 7.786 1.788) 9.483 6.861 ( -6.979 3.348 -9.668) 12.384 6.861 ( 6.979 3.348 9.668) 12.384 7.495 ( 7.460 -5.287 -8.071) 12.196 7.495 ( -7.460 -5.287 8.071) 12.196 8.033 ( -9.888 7.480 -3.739) 12.950 8.033 ( 9.888 7.480 3.739) 12.950 8.507 ( -6.881 1.970 -14.018) 15.739 8.507 ( 6.881 1.970 14.018) 15.739 8.612 ( 0.807 6.708 -8.587) 10.926 8.612 ( -0.807 6.708 8.587) 10.926 8.770 ( -5.713 14.338 -7.091) 16.985 8.770 ( 5.713 14.338 7.091) 16.985 9.089 ( -2.754 3.465 -2.849) 5.264 9.089 ( 2.754 3.465 2.849) 5.264 9.409 ( -4.788 1.628 -5.403) 7.401 9.409 ( 4.788 1.628 5.403) 7.401 9.603 ( 2.035 1.683 -14.456) 14.696 9.603 ( -2.035 1.683 14.456) 14.696 9.862 ( -0.245 -2.671 -8.497) 8.910 9.862 ( 0.245 -2.671 8.497) 8.910 10.340 ( -6.370 -4.425 -5.330) 9.411 10.340 ( 6.370 -4.425 5.330) 9.411 10.637 ( -0.462 2.098 -6.170) 6.533 10.637 ( 0.462 2.098 6.170) 6.533 10.921 ( 0.638 2.578 -3.601) 4.474 10.921 ( -0.638 2.578 3.601) 4.474 11.247 ( -3.879 14.155 -0.035) 14.677 11.247 ( 3.879 14.155 0.035) 14.677 11.558 ( 1.771 -2.607 -3.837) 4.966 11.558 ( -1.771 -2.607 3.837) 4.966 12.031 ( -3.288 -2.596 -7.575) 8.656 12.031 ( 3.288 -2.596 7.575) 8.656 12.390 ( 2.067 2.998 -4.894) 6.100 12.390 ( -2.067 2.998 4.894) 6.100 12.876 ( -14.295 7.313 -3.886) 16.520 12.876 ( 14.295 7.313 3.886) 16.520 13.336 ( 15.762 -11.966 -9.013) 21.745 13.336 ( -15.762 -11.966 9.013) 21.745 14.312 ( -4.621 -5.580 -6.448) 9.699 14.312 ( 4.621 -5.580 6.448) 9.699 14.659 ( -8.506 -7.983 -1.529) 11.766 14.659 ( 8.506 -7.983 1.529) 11.766 15.461 ( -2.866 0.490 -3.885) 4.853 15.461 ( 2.866 0.490 3.885) 4.853 15.978 ( 5.136 -3.226 -7.824) 9.900 15.978 ( -5.136 -3.226 7.824) 9.900 17.748 ( 5.193 0.783 -8.375) 9.885 17.748 ( -5.193 0.783 8.375) 9.885 18.371 ( 2.419 -3.648 -2.008) 4.816 18.371 ( -2.419 -3.648 2.008) 4.816 19.541 ( 3.380 9.852 -3.840) 11.101 19.541 ( -3.380 9.852 3.840) 11.101 20.034 ( 1.196 11.753 -7.812) 14.163 20.034 ( -1.196 11.753 7.812) 14.163 20.405 ( -0.780 2.865 -0.494) 3.010 20.405 ( 0.780 2.865 0.494) 3.010 20.479 ( 0.524 2.434 -1.354) 2.834 20.479 ( -0.524 2.434 1.354) 2.834 20.635 ( -1.146 12.999 -1.088) 13.095 20.635 ( 1.146 12.999 1.088) 13.095 20.985 ( -5.178 22.032 -19.523) 29.890 20.985 ( 5.178 22.032 19.523) 29.890 24.338 ( 0.349 -2.712 -2.076) 3.433 24.338 ( -0.349 -2.712 2.076) 3.433 24.541 ( -5.395 -2.014 0.483) 5.779 24.541 ( 5.395 -2.014 -0.483) 5.779 30.217 ( 2.537 -0.113 -5.458) 6.020 30.217 ( -2.537 -0.113 5.458) 6.020 30.295 ( 0.804 -0.841 -6.016) 6.128 30.295 ( -0.804 -0.841 6.016) 6.128 34.723 ( 12.953 -10.281 -15.464) 22.641 34.723 ( -12.953 -10.281 15.464) 22.641 35.565 ( -13.859 -8.349 -18.035) 24.229 35.565 ( 13.859 -8.349 18.035) 24.229 37.558 ( -0.617 -10.708 -5.495) 12.052 37.558 ( 0.617 -10.708 5.495) 12.052 37.953 ( -11.464 -7.862 -1.874) 14.027 37.953 ( 11.464 -7.862 1.874) 14.027 41.240 ( -3.438 -5.447 -16.009) 17.257 41.240 ( 3.438 -5.447 16.009) 17.257 42.391 ( 3.481 -16.234 -13.803) 21.592 42.391 ( -3.481 -16.234 13.803) 21.592 43.423 ( -44.092 -35.200 -23.555) 61.139 43.423 ( 44.092 -35.200 23.555) 61.139 44.424 ( 24.649 -32.006 -23.795) 46.885 44.424 ( -24.649 -32.006 23.795) 46.885 ======================= Grid point 239 (100/126) ======================= q-point: ( 0.17 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( -11.440 29.925 -30.108) 43.965 2.706 ( 5.597 33.025 -18.831) 38.426 3.045 ( 17.132 34.230 21.635) 43.969 3.236 ( 7.459 27.228 22.089) 35.846 3.934 ( -13.410 25.240 -6.666) 29.348 4.347 ( 4.279 18.634 -14.679) 24.103 4.462 ( -8.823 26.131 -10.708) 29.586 4.709 ( -0.248 15.105 -3.161) 15.434 4.840 ( -7.728 19.496 2.159) 21.083 4.954 ( -10.506 16.732 -3.053) 19.992 5.162 ( 0.655 27.186 2.269) 27.289 5.188 ( -9.480 16.833 22.925) 29.979 5.199 ( 16.265 21.413 20.504) 33.815 5.487 ( 10.003 17.660 -10.425) 22.817 5.728 ( 3.307 13.257 8.772) 16.237 5.941 ( -0.762 15.588 -7.186) 17.182 5.996 ( 4.688 13.684 -6.859) 16.008 6.097 ( -3.100 23.510 8.008) 25.029 6.181 ( -2.489 7.404 -5.953) 9.821 6.432 ( -1.202 19.316 0.572) 19.362 6.627 ( -6.585 9.145 -12.626) 16.924 6.656 ( 1.445 14.878 7.334) 16.650 6.849 ( 5.111 -0.740 -1.102) 5.281 7.069 ( 4.663 8.824 14.748) 17.808 7.328 ( -8.298 -3.596 0.802) 9.079 7.516 ( 1.510 -1.999 -1.443) 2.891 7.930 ( -1.702 7.309 -2.557) 7.928 8.107 ( -8.084 4.782 1.688) 9.543 8.310 ( -2.731 2.417 -1.705) 4.026 8.437 ( -10.991 5.579 -10.631) 16.277 8.515 ( -10.841 10.241 3.779) 15.385 8.632 ( -1.039 5.448 2.032) 5.907 8.718 ( -1.541 13.660 1.586) 13.838 8.806 ( -2.127 12.958 -0.953) 13.166 8.989 ( -3.725 9.803 -2.909) 10.883 9.116 ( -3.148 3.413 -1.997) 5.054 9.280 ( -9.188 2.231 3.095) 9.949 9.491 ( 2.699 -0.396 -6.995) 7.508 9.541 ( -4.249 4.221 1.921) 6.290 9.707 ( 8.332 -4.379 4.688) 10.515 9.897 ( 8.868 -4.058 -8.383) 12.860 10.017 ( 11.811 -4.657 6.653) 14.333 10.267 ( 0.168 -1.685 -0.717) 1.839 10.502 ( 7.526 -2.377 -1.032) 7.960 10.677 ( 9.559 -0.165 -0.385) 9.568 10.807 ( 9.598 4.886 1.932) 10.942 10.964 ( 3.070 3.419 0.376) 4.611 11.051 ( 9.977 -0.080 -2.465) 10.277 11.193 ( 2.928 5.367 0.633) 6.147 11.296 ( 4.164 15.017 -1.235) 15.632 11.547 ( 0.137 -5.498 0.610) 5.533 11.620 ( 3.820 -2.351 -1.614) 4.767 11.937 ( -1.566 -3.362 -7.970) 8.791 12.077 ( -2.517 -0.204 -0.361) 2.551 12.304 ( -6.015 -0.971 7.768) 9.872 12.442 ( 2.304 6.883 -2.047) 7.542 12.554 ( -14.721 3.970 3.893) 15.736 13.021 ( -14.215 2.698 7.863) 16.468 13.114 ( 8.218 7.992 1.848) 11.612 13.551 ( -0.681 -26.367 -9.863) 28.160 14.263 ( 4.656 -6.329 -2.657) 8.294 14.397 ( -0.498 -3.173 6.628) 7.365 14.489 ( -5.025 -3.136 -5.844) 8.321 14.752 ( 2.558 -6.534 -6.657) 9.673 15.428 ( -0.413 1.681 4.855) 5.154 15.597 ( 6.806 -1.187 10.113) 12.248 15.860 ( -7.278 -0.713 -0.283) 7.318 16.043 ( 4.246 -5.332 -9.931) 12.045 17.701 ( -1.490 1.280 4.630) 5.029 17.848 ( 8.444 0.346 -6.975) 10.957 18.257 ( -9.087 -3.169 2.362) 9.909 18.387 ( -1.933 -3.098 -0.411) 3.674 19.491 ( -3.373 10.960 2.864) 11.819 19.571 ( 1.488 10.394 -4.051) 11.254 19.947 ( -5.905 13.336 -3.028) 14.896 20.014 ( -3.726 9.740 1.485) 10.534 20.378 ( -1.467 1.966 0.249) 2.465 20.426 ( 0.493 4.109 0.829) 4.221 20.473 ( -1.019 3.169 -1.325) 3.583 20.475 ( 0.104 3.670 0.371) 3.690 20.592 ( -1.337 10.928 -1.310) 11.087 20.630 ( -1.600 13.358 0.420) 13.460 20.872 ( 1.709 19.264 -8.920) 21.298 21.159 ( 0.510 23.135 16.593) 28.475 24.284 ( -1.695 -1.113 0.108) 2.031 24.430 ( -2.347 -1.456 1.231) 3.024 24.455 ( 5.752 -4.299 0.292) 7.187 24.675 ( 6.100 -5.162 0.251) 7.995 30.195 ( -1.875 0.148 4.938) 5.284 30.234 ( 1.277 -0.625 -4.991) 5.190 30.302 ( 2.399 -1.039 -3.298) 4.208 30.317 ( 0.011 -1.022 5.317) 5.415 34.513 ( -8.862 -4.344 14.058) 17.177 35.107 ( 22.591 -18.604 -3.179) 29.438 35.207 ( -13.766 -7.431 -9.711) 18.412 35.916 ( 11.034 -16.110 17.696) 26.352 37.451 ( -4.841 -10.953 -0.747) 11.998 37.594 ( -1.820 -8.929 -5.087) 10.436 37.856 ( 1.608 -7.827 3.641) 8.781 38.207 ( 12.809 -9.661 0.887) 16.068 41.155 ( 2.331 -4.616 -17.882) 18.614 41.436 ( 10.088 -7.108 13.011) 17.933 42.193 ( -26.785 -24.592 -25.677) 44.514 42.417 ( -0.646 -14.599 5.680) 15.678 42.565 ( -16.332 -13.981 -14.108) 25.714 43.607 ( -24.432 -19.675 -0.332) 31.371 44.626 ( 25.339 -51.173 31.066) 65.007 44.826 ( 26.325 -31.421 -18.960) 45.163 ======================= Grid point 240 (101/126) ======================= q-point: ( 0.33 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( 27.450 23.035 -13.542) 38.308 2.887 ( 20.750 31.054 -10.950) 38.921 3.409 ( 4.530 24.868 18.867) 31.542 3.477 ( 11.988 30.539 10.390) 34.414 3.582 ( -22.435 25.878 6.801) 34.917 4.058 ( -24.748 16.495 1.301) 29.769 4.322 ( -6.533 11.470 -12.697) 18.315 4.428 ( -22.105 11.152 -0.305) 24.761 4.811 ( 5.984 18.953 -17.054) 26.189 4.905 ( 10.435 24.684 -7.379) 27.796 5.127 ( -5.053 20.905 7.406) 22.746 5.219 ( 1.187 23.487 4.975) 24.037 5.379 ( -6.477 19.086 -3.129) 20.397 5.458 ( -1.748 10.674 -16.468) 19.702 5.765 ( 1.866 19.188 1.455) 19.333 5.887 ( -12.313 26.452 -0.351) 29.180 6.012 ( 7.982 19.536 -10.271) 23.471 6.137 ( -0.528 11.169 -0.428) 11.190 6.287 ( 4.496 16.577 29.075) 33.770 6.482 ( 4.472 20.264 6.491) 21.743 6.518 ( 2.407 13.078 2.472) 13.525 6.712 ( 0.241 9.936 -1.559) 10.061 6.933 ( 7.143 0.087 4.240) 8.307 7.224 ( 8.617 12.118 14.327) 20.648 7.329 ( 5.917 -0.708 -2.369) 6.413 7.582 ( 4.248 6.265 7.966) 10.989 7.823 ( -4.433 3.674 -5.446) 7.925 8.003 ( -6.781 2.213 0.780) 7.176 8.155 ( -17.225 10.727 -3.108) 20.529 8.284 ( -7.186 6.355 2.598) 9.939 8.292 ( -4.366 6.101 -0.602) 7.527 8.531 ( -15.636 7.941 -8.711) 19.581 8.609 ( -3.107 11.590 3.648) 12.542 8.705 ( -4.755 13.422 -10.333) 17.593 8.938 ( 2.556 14.677 -3.782) 15.371 9.045 ( -1.496 4.680 -1.800) 5.232 9.298 ( 4.840 2.596 4.645) 7.193 9.488 ( -1.824 1.724 -5.149) 5.728 9.517 ( 3.836 -0.813 -5.253) 6.555 9.742 ( -6.889 -1.276 0.708) 7.042 9.953 ( 6.252 -4.728 -6.458) 10.155 10.159 ( -1.159 -2.932 0.234) 3.161 10.442 ( 11.096 -1.518 17.364) 20.663 10.652 ( 6.893 0.117 -3.713) 7.830 10.851 ( 8.908 1.686 -4.538) 10.138 10.940 ( 1.355 8.178 0.509) 8.305 11.027 ( 5.510 5.610 0.158) 7.865 11.081 ( 4.324 -1.923 0.213) 4.737 11.375 ( 7.427 -1.591 -1.545) 7.751 11.460 ( 9.342 1.348 -7.061) 11.788 11.541 ( 1.389 -1.300 1.033) 2.165 11.693 ( 4.998 -4.619 3.184) 7.513 11.876 ( -1.935 -3.806 -1.113) 4.412 12.039 ( 2.645 -0.869 3.569) 4.527 12.228 ( -8.253 -2.884 2.723) 9.157 12.388 ( -7.440 -1.831 3.032) 8.240 12.547 ( 10.813 5.616 -0.089) 12.185 12.889 ( -4.826 3.812 7.678) 9.838 13.161 ( -4.111 0.263 -0.157) 4.122 13.301 ( -15.821 -23.089 -9.525) 29.566 14.315 ( 1.570 -2.585 -0.680) 3.099 14.413 ( 1.391 -2.841 2.354) 3.943 14.494 ( 3.775 2.445 0.245) 4.504 14.700 ( -3.212 -0.850 -10.257) 10.781 15.472 ( 1.484 2.023 9.091) 9.431 15.691 ( -5.811 1.036 0.965) 5.981 15.806 ( 6.034 -3.401 5.690) 8.964 16.034 ( 0.130 -6.136 -10.988) 12.586 17.748 ( 5.028 0.376 1.746) 5.335 17.987 ( 10.134 0.374 -6.040) 11.803 18.079 ( -11.158 -2.222 1.622) 11.493 18.302 ( -7.592 -1.471 2.155) 8.028 19.463 ( -0.465 11.965 1.559) 12.075 19.549 ( -1.920 11.663 -3.371) 12.291 19.859 ( -1.804 10.669 -0.706) 10.843 19.938 ( -4.586 9.064 0.546) 10.173 20.365 ( 0.031 2.292 0.427) 2.331 20.417 ( -2.063 4.297 0.750) 4.825 20.460 ( 1.035 4.649 -1.831) 5.103 20.481 ( -0.244 4.965 1.368) 5.156 20.586 ( 0.595 8.360 -1.021) 8.443 20.604 ( -1.210 11.666 0.522) 11.740 20.915 ( 6.096 20.094 -6.179) 21.889 21.141 ( -8.141 23.937 10.724) 27.463 24.280 ( 1.687 -0.529 -1.404) 2.258 24.383 ( -3.647 -1.063 3.655) 5.272 24.594 ( 8.463 -7.089 -3.073) 11.459 24.742 ( 0.351 -7.535 2.331) 7.895 30.196 ( -0.804 -0.080 5.447) 5.506 30.226 ( 0.729 -0.655 -5.554) 5.640 30.330 ( 1.442 -1.455 -0.712) 2.169 30.338 ( 0.186 -1.240 2.618) 2.902 34.520 ( 2.733 -3.729 9.776) 10.814 34.904 ( -13.113 -5.430 -5.635) 15.271 35.544 ( 22.345 -27.061 1.830) 35.141 36.060 ( -3.577 -25.720 11.568) 28.428 37.400 ( -0.969 -9.370 2.261) 9.687 37.508 ( -3.218 -8.887 -6.412) 11.421 37.976 ( 7.278 -6.415 7.573) 12.307 38.316 ( -0.645 -9.428 -7.078) 11.807 41.143 ( 5.297 -4.456 -17.919) 19.210 41.418 ( -17.568 -8.703 -8.328) 21.301 41.902 ( 16.249 -10.228 3.522) 19.521 42.428 ( -1.795 -15.108 1.660) 15.305 42.482 ( 1.006 -14.236 2.709) 14.526 43.070 ( -29.226 -17.144 -5.844) 34.383 45.100 ( 12.758 -44.947 16.213) 49.456 45.144 ( 16.230 -37.907 -12.934) 43.216 ======================= Grid point 241 (102/126) ======================= q-point: ( 0.50 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.914 ( -42.428 18.227 2.151) 46.228 2.914 ( 42.428 18.227 -2.151) 46.228 3.290 ( -10.007 28.841 -1.264) 30.554 3.290 ( 10.007 28.841 1.264) 30.554 3.788 ( -2.559 17.965 -10.667) 21.050 3.788 ( 2.559 17.965 10.667) 21.050 4.162 ( -6.095 12.996 -2.267) 14.532 4.162 ( 6.095 12.996 2.267) 14.532 4.938 ( 5.985 17.083 -15.565) 23.873 4.938 ( -5.985 17.083 15.565) 23.873 5.150 ( 5.879 27.899 -10.030) 30.224 5.150 ( -5.879 27.899 10.030) 30.224 5.360 ( -3.676 18.402 -10.169) 21.344 5.360 ( 3.676 18.402 10.169) 21.344 5.732 ( -1.110 22.574 -3.017) 22.802 5.732 ( 1.110 22.574 3.017) 22.802 6.091 ( 7.144 17.433 -16.536) 25.068 6.091 ( -7.144 17.433 16.536) 25.068 6.464 ( -0.799 11.650 -15.277) 19.229 6.464 ( 0.799 11.650 15.277) 19.229 6.651 ( -0.800 16.881 -10.988) 20.157 6.651 ( 0.800 16.881 10.988) 20.157 7.198 ( -14.117 1.330 -8.512) 16.538 7.198 ( 14.117 1.330 8.512) 16.538 7.590 ( -14.286 8.507 -7.582) 18.274 7.590 ( 14.286 8.507 7.582) 18.274 7.809 ( -15.621 6.298 -2.467) 17.023 7.809 ( 15.621 6.298 2.467) 17.023 8.092 ( -14.871 7.835 -14.037) 21.899 8.092 ( 14.871 7.835 14.037) 21.899 8.275 ( -1.504 5.116 -4.633) 7.064 8.275 ( 1.504 5.116 4.633) 7.064 8.616 ( -0.621 12.654 -7.666) 14.808 8.616 ( 0.621 12.654 7.666) 14.808 9.008 ( -0.760 11.957 -7.719) 14.252 9.008 ( 0.760 11.957 7.719) 14.252 9.399 ( -1.522 2.743 -8.039) 8.630 9.399 ( 1.522 2.743 8.039) 8.630 9.596 ( 4.581 -2.866 -6.132) 8.174 9.596 ( -4.581 -2.866 6.132) 8.174 10.080 ( -1.776 -3.533 -4.130) 5.718 10.080 ( 1.776 -3.533 4.130) 5.718 10.633 ( -2.841 2.971 -12.501) 13.159 10.633 ( 2.841 2.971 12.501) 13.159 10.938 ( 2.358 6.361 -7.729) 10.284 10.938 ( -2.358 6.361 7.729) 10.284 11.129 ( 0.749 0.481 -1.266) 1.547 11.129 ( -0.749 0.481 1.266) 1.547 11.442 ( 0.246 -0.483 -2.993) 3.042 11.442 ( -0.246 -0.483 2.993) 3.042 11.674 ( -0.463 -6.779 -1.936) 7.065 11.674 ( 0.463 -6.779 1.936) 7.065 12.011 ( -6.803 -3.488 -0.365) 7.654 12.011 ( 6.803 -3.488 0.365) 7.654 12.213 ( -9.805 -2.899 -7.205) 12.509 12.213 ( 9.805 -2.899 7.205) 12.509 12.806 ( -6.861 2.089 -7.522) 10.393 12.806 ( 6.861 2.089 7.522) 10.393 13.073 ( -2.056 -12.734 -5.926) 14.195 13.073 ( 2.056 -12.734 5.926) 14.195 14.388 ( 1.958 -0.722 -8.350) 8.607 14.388 ( -1.958 -0.722 8.350) 8.607 14.580 ( -2.685 4.116 -10.336) 11.445 14.580 ( 2.685 4.116 10.336) 11.445 15.567 ( -4.252 1.568 -8.910) 9.997 15.567 ( 4.252 1.568 8.910) 9.997 15.949 ( -3.683 -5.474 -10.944) 12.779 15.949 ( 3.683 -5.474 10.944) 12.779 17.889 ( -9.485 -1.031 0.305) 9.546 17.889 ( 9.485 -1.031 -0.305) 9.546 18.151 ( 9.720 -0.111 -4.427) 10.681 18.151 ( -9.720 -0.111 4.427) 10.681 19.491 ( -2.409 11.869 -1.685) 12.228 19.491 ( 2.409 11.869 1.685) 12.228 19.870 ( 0.071 9.159 -2.960) 9.626 19.870 ( -0.071 9.159 2.960) 9.626 20.382 ( -0.686 3.074 -1.025) 3.312 20.382 ( 0.686 3.074 1.025) 3.312 20.475 ( 0.988 5.602 -2.314) 6.141 20.475 ( -0.988 5.602 2.314) 6.141 20.592 ( 0.533 9.210 -1.095) 9.290 20.592 ( -0.533 9.210 1.095) 9.290 21.020 ( 7.877 22.611 -7.230) 25.011 21.020 ( -7.877 22.611 7.230) 25.011 24.326 ( 3.830 -0.804 -2.374) 4.577 24.326 ( -3.830 -0.804 2.374) 4.577 24.708 ( 3.590 -8.120 -4.181) 9.813 24.708 ( -3.590 -8.120 4.181) 9.813 30.211 ( 0.568 -0.426 -5.720) 5.764 30.211 ( -0.568 -0.426 5.720) 5.764 30.344 ( 1.118 -1.440 -4.364) 4.729 30.344 ( -1.118 -1.440 4.364) 4.729 34.673 ( -7.665 -4.752 -7.968) 12.034 34.673 ( 7.665 -4.752 7.968) 12.034 35.903 ( -10.855 -29.450 -2.510) 31.487 35.903 ( 10.855 -29.450 2.510) 31.487 37.432 ( -1.590 -8.883 -6.351) 11.035 37.432 ( 1.590 -8.883 6.351) 11.035 38.168 ( -7.942 -6.199 -11.686) 15.430 38.168 ( 7.942 -6.199 11.686) 15.430 41.191 ( 8.436 -5.015 -10.343) 14.259 41.191 ( -8.436 -5.015 10.343) 14.259 42.280 ( -15.539 -11.020 -2.771) 19.250 42.280 ( 15.539 -11.020 2.771) 19.250 42.616 ( -10.731 -17.580 -15.374) 25.702 42.616 ( 10.731 -17.580 15.374) 25.702 45.256 ( 4.781 -40.860 -19.072) 45.345 45.256 ( -4.781 -40.860 19.072) 45.345 ======================= Grid point 245 (103/126) ======================= q-point: ( 0.00 0.19 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.327 ( -8.714 33.435 -30.445) 46.051 3.327 ( 8.714 33.435 30.445) 46.051 3.445 ( -7.054 24.019 -34.529) 42.649 3.445 ( 7.054 24.019 34.529) 42.649 4.603 ( -2.493 19.656 -7.453) 21.168 4.603 ( 2.493 19.656 7.453) 21.168 5.045 ( 2.544 16.595 -8.847) 18.977 5.045 ( -2.544 16.595 8.847) 18.977 5.350 ( -1.041 9.402 -2.278) 9.730 5.350 ( 1.041 9.402 2.278) 9.730 5.523 ( -9.636 20.188 -9.248) 24.206 5.523 ( 9.636 20.188 9.248) 24.206 5.825 ( -1.095 27.156 -6.779) 28.011 5.825 ( 1.095 27.156 6.779) 28.011 5.910 ( -14.735 16.120 -5.468) 22.513 5.910 ( 14.735 16.120 5.468) 22.513 6.576 ( -2.596 12.806 -11.384) 17.330 6.576 ( 2.596 12.806 11.384) 17.330 6.635 ( 2.163 19.576 -14.105) 24.225 6.635 ( -2.163 19.576 14.105) 24.225 6.947 ( -2.104 20.207 -0.195) 20.317 6.947 ( 2.104 20.207 0.195) 20.317 7.057 ( -7.319 15.430 -6.112) 18.138 7.057 ( 7.319 15.430 6.112) 18.138 7.415 ( 5.452 -1.753 -10.311) 11.795 7.415 ( -5.452 -1.753 10.311) 11.795 8.175 ( -8.404 5.014 0.437) 9.796 8.175 ( 8.404 5.014 -0.437) 9.796 8.501 ( -7.816 0.096 -19.047) 20.589 8.501 ( 7.816 0.096 19.047) 20.589 8.709 ( -7.895 4.433 -6.587) 11.197 8.709 ( 7.895 4.433 6.587) 11.197 9.116 ( -3.282 15.399 -4.543) 16.387 9.116 ( 3.282 15.399 4.543) 16.387 9.231 ( -2.091 10.478 -1.247) 10.757 9.231 ( 2.091 10.478 1.247) 10.757 9.455 ( 4.214 1.647 -6.424) 7.857 9.455 ( -4.214 1.647 6.424) 7.857 9.721 ( -3.170 12.207 -7.072) 14.459 9.721 ( 3.170 12.207 7.072) 14.459 9.865 ( -2.572 3.559 -7.251) 8.477 9.865 ( 2.572 3.559 7.251) 8.477 10.259 ( -6.419 -2.277 -5.024) 8.463 10.259 ( 6.419 -2.277 5.024) 8.463 10.640 ( -2.905 -1.326 -2.976) 4.365 10.640 ( 2.905 -1.326 2.976) 4.365 11.003 ( 1.745 5.038 -2.154) 5.751 11.003 ( -1.745 5.038 2.154) 5.751 11.362 ( -2.651 -1.646 -2.017) 3.716 11.362 ( 2.651 -1.646 2.017) 3.716 11.595 ( 4.008 2.842 -4.137) 6.423 11.595 ( -4.008 2.842 4.137) 6.423 12.006 ( -3.699 1.121 -7.409) 8.357 12.006 ( 3.699 1.121 7.409) 8.357 12.390 ( -4.956 -1.165 -0.318) 5.101 12.390 ( 4.956 -1.165 0.318) 5.101 12.922 ( -15.317 -0.577 -1.518) 15.403 12.922 ( 15.317 -0.577 1.518) 15.403 13.309 ( 0.609 4.926 -8.656) 9.978 13.309 ( -0.609 4.926 8.656) 9.978 14.211 ( -7.001 -3.758 -4.000) 8.896 14.211 ( 7.001 -3.758 4.000) 8.896 14.518 ( -5.252 -5.610 -2.510) 8.084 14.518 ( 5.252 -5.610 2.510) 8.084 15.491 ( -1.107 2.561 -4.375) 5.189 15.491 ( 1.107 2.561 4.375) 5.189 15.924 ( 4.606 -2.365 -7.197) 8.866 15.924 ( -4.606 -2.365 7.197) 8.866 17.767 ( 3.815 1.045 -6.457) 7.572 17.767 ( -3.815 1.045 6.457) 7.572 18.263 ( 2.163 -6.202 -2.684) 7.096 18.263 ( -2.163 -6.202 2.684) 7.096 19.749 ( 1.884 9.622 -2.862) 10.214 19.749 ( -1.884 9.622 2.862) 10.214 20.188 ( 1.722 2.691 -3.909) 5.048 20.188 ( -1.722 2.691 3.909) 5.048 20.446 ( -1.943 1.868 0.245) 2.707 20.446 ( 1.943 1.868 -0.245) 2.707 20.548 ( 3.062 6.771 -4.901) 8.902 20.548 ( -3.062 6.771 4.901) 8.902 20.967 ( -1.770 18.055 0.026) 18.141 20.967 ( 1.770 18.055 -0.026) 18.141 21.385 ( -3.685 17.288 -18.255) 25.411 21.385 ( 3.685 17.288 18.255) 25.411 24.291 ( 0.465 -1.810 -2.885) 3.438 24.291 ( -0.465 -1.810 2.885) 3.438 24.501 ( -0.683 -1.832 -0.178) 1.963 24.501 ( 0.683 -1.832 0.178) 1.963 30.214 ( 1.901 -0.195 -5.106) 5.451 30.214 ( -1.901 -0.195 5.106) 5.451 30.277 ( 0.941 -0.877 -5.406) 5.557 30.277 ( -0.941 -0.877 5.406) 5.557 34.540 ( 9.222 -7.884 -12.424) 17.365 34.540 ( -9.222 -7.884 12.424) 17.365 35.346 ( -6.597 -12.638 -18.066) 23.013 35.346 ( 6.597 -12.638 18.066) 23.013 37.339 ( -1.750 -11.112 -4.689) 12.187 37.339 ( 1.750 -11.112 4.689) 12.187 37.747 ( -9.714 -12.215 -0.254) 15.608 37.747 ( 9.714 -12.215 0.254) 15.608 41.115 ( -2.498 -6.715 -13.291) 15.099 41.115 ( 2.498 -6.715 13.291) 15.099 42.042 ( -0.584 -17.727 -9.741) 20.235 42.042 ( 0.584 -17.727 9.741) 20.235 42.758 ( -32.836 -30.101 -22.981) 50.123 42.758 ( 32.836 -30.101 22.981) 50.123 43.802 ( 25.419 -30.624 -15.573) 42.737 43.802 ( -25.419 -30.624 15.573) 42.737 ======================= Grid point 247 (104/126) ======================= q-point: ( 0.17 0.19 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.880 ( -13.606 35.332 -23.654) 44.643 3.313 ( 5.796 27.103 -21.122) 34.847 3.637 ( 10.644 27.024 19.437) 34.948 3.794 ( 10.379 25.765 25.998) 38.045 4.429 ( -13.304 23.157 1.278) 26.737 4.696 ( 1.505 15.644 -3.133) 16.026 4.897 ( -17.015 7.633 0.077) 18.649 4.922 ( -16.627 17.746 -7.953) 25.586 5.180 ( -0.868 12.401 -11.720) 17.085 5.257 ( -11.045 13.980 13.263) 22.212 5.480 ( 0.609 8.686 0.608) 8.728 5.709 ( -1.500 30.849 -9.052) 32.185 5.773 ( 4.315 20.245 10.591) 23.252 5.858 ( 5.025 22.861 -12.778) 26.667 5.943 ( 10.565 9.614 5.765) 15.404 6.283 ( 17.733 18.218 0.052) 25.424 6.320 ( -0.102 11.752 0.669) 11.771 6.458 ( -9.143 27.257 7.548) 29.724 6.651 ( -6.272 27.302 6.534) 28.765 6.810 ( 4.009 14.014 -2.880) 14.858 6.907 ( 2.136 12.186 -2.382) 12.599 6.929 ( -2.876 21.435 -0.551) 21.634 7.076 ( 6.897 23.130 -4.150) 24.491 7.248 ( 1.422 4.409 -1.385) 4.835 7.380 ( 5.647 12.908 14.165) 19.978 7.476 ( 8.171 -0.796 -0.626) 8.234 8.094 ( 1.257 5.658 0.058) 5.796 8.140 ( -19.993 1.806 -7.040) 21.273 8.376 ( 9.451 2.742 -6.380) 11.728 8.474 ( -10.681 3.234 -4.833) 12.162 8.653 ( 1.054 1.647 8.143) 8.375 8.775 ( -5.654 11.105 3.281) 12.886 9.057 ( -6.481 16.934 -4.455) 18.671 9.099 ( -4.244 13.857 -3.374) 14.880 9.214 ( -3.964 9.645 -0.836) 10.461 9.283 ( 2.181 11.937 9.897) 15.659 9.446 ( -0.187 4.979 1.447) 5.189 9.460 ( -6.401 8.321 0.359) 10.505 9.572 ( -2.259 -1.970 -8.243) 8.771 9.730 ( 6.022 8.099 1.887) 10.267 9.890 ( 7.140 4.579 -4.879) 9.785 9.974 ( 6.257 1.612 1.329) 6.597 10.231 ( 3.038 -0.192 -3.918) 4.962 10.434 ( 7.906 -3.103 4.658) 9.687 10.659 ( 7.246 -2.026 0.969) 7.586 10.866 ( 14.629 1.417 -1.534) 14.777 11.034 ( 6.975 -0.525 0.407) 7.006 11.064 ( 2.882 5.817 1.695) 6.709 11.263 ( -2.446 0.266 1.051) 2.675 11.447 ( -0.074 -3.500 0.936) 3.623 11.515 ( -2.050 2.127 0.019) 2.954 11.596 ( -0.928 -0.089 -5.223) 5.305 11.925 ( -2.257 3.399 -5.312) 6.698 12.093 ( 1.194 1.826 1.242) 2.511 12.248 ( -8.612 -4.169 5.717) 11.146 12.507 ( 5.050 0.796 0.772) 5.171 12.600 ( -17.036 1.847 2.799) 17.363 13.065 ( -2.301 -0.900 4.410) 5.055 13.196 ( -7.907 -2.074 -8.652) 11.903 13.303 ( -4.160 4.198 2.805) 6.542 14.156 ( 3.814 -3.802 -1.670) 5.639 14.325 ( 2.601 -2.574 -1.091) 3.819 14.476 ( 3.609 1.206 0.133) 3.807 14.627 ( 5.351 -5.921 -2.268) 8.297 15.482 ( 1.055 3.723 2.035) 4.372 15.587 ( 5.298 0.321 6.902) 8.707 15.848 ( -5.729 -0.643 2.796) 6.407 15.952 ( 2.189 -3.762 -8.675) 9.706 17.726 ( -1.363 1.191 3.096) 3.586 17.855 ( 7.265 0.281 -5.169) 8.921 18.166 ( -7.841 -5.285 2.638) 9.817 18.286 ( -0.798 -6.026 -0.811) 6.132 19.713 ( -1.869 10.285 1.754) 10.599 19.790 ( 2.452 9.795 -2.046) 10.303 20.131 ( -6.162 2.905 3.384) 7.606 20.154 ( -3.218 4.315 -4.191) 6.822 20.408 ( -1.684 1.746 -0.378) 2.455 20.465 ( -0.194 -0.422 -0.179) 0.498 20.516 ( -1.134 6.846 4.117) 8.069 20.585 ( 2.034 8.153 -4.045) 9.326 20.919 ( -2.366 18.422 0.039) 18.574 20.978 ( -0.966 18.802 -0.498) 18.833 21.272 ( 1.318 19.179 -10.229) 21.776 21.537 ( 1.609 14.874 13.446) 20.115 24.263 ( -0.518 -0.787 0.126) 0.950 24.359 ( 4.973 -3.568 -1.931) 6.418 24.424 ( -4.076 -0.440 3.739) 5.549 24.576 ( 3.080 -4.397 -0.379) 5.382 30.198 ( -1.602 0.209 3.925) 4.245 30.220 ( 0.877 -0.704 -4.320) 4.464 30.281 ( 1.506 -1.030 -2.277) 2.918 30.294 ( 0.182 -1.134 3.635) 3.812 34.422 ( -5.247 -4.480 9.640) 11.854 34.776 ( 17.147 -13.642 -6.791) 22.940 35.051 ( -14.610 -8.751 -6.904) 18.377 35.554 ( 3.552 -18.487 11.935) 22.290 37.239 ( -4.070 -10.290 0.914) 11.104 37.401 ( -0.485 -10.313 -4.200) 11.146 37.656 ( 1.225 -11.780 4.633) 12.717 37.954 ( 11.138 -14.922 -3.329) 18.916 41.052 ( 2.310 -5.498 -15.219) 16.346 41.272 ( 7.882 -8.982 10.222) 15.726 41.758 ( -20.025 -18.610 -17.385) 32.398 42.100 ( 1.356 -16.346 0.724) 16.419 42.264 ( -9.999 -15.806 -5.036) 19.369 43.149 ( -14.843 -25.352 -1.074) 29.397 43.670 ( 15.095 -42.797 33.805) 56.588 44.166 ( 21.182 -34.015 -16.893) 43.486 ======================= Grid point 248 (105/126) ======================= q-point: ( 0.33 0.19 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.801 ( 15.774 31.602 -10.894) 36.962 3.448 ( 18.382 24.681 -16.427) 34.884 3.887 ( 3.422 22.865 19.997) 30.568 3.979 ( -18.177 20.888 10.115) 29.480 4.142 ( -1.013 25.821 9.667) 27.590 4.380 ( -31.686 15.939 0.939) 35.481 4.522 ( -12.841 10.270 -6.015) 17.508 4.711 ( -8.235 15.508 -3.681) 17.940 5.148 ( 0.413 14.720 -4.098) 15.285 5.284 ( 13.303 14.532 -9.476) 21.862 5.431 ( -8.157 9.976 3.907) 13.465 5.663 ( -2.178 11.154 -8.210) 14.019 5.723 ( 1.125 24.580 -14.475) 28.548 5.837 ( -5.587 13.266 3.856) 14.902 6.173 ( 6.923 23.082 7.562) 25.257 6.389 ( 2.621 19.678 -2.168) 19.970 6.450 ( -4.178 21.693 -8.043) 23.510 6.508 ( 3.637 25.807 3.281) 26.268 6.634 ( 3.965 14.934 26.661) 30.814 6.759 ( 0.975 16.867 -8.759) 19.031 6.926 ( 2.480 18.231 5.672) 19.253 6.966 ( 2.360 21.669 4.180) 22.194 7.209 ( 9.879 20.887 -7.730) 24.365 7.326 ( 8.853 5.744 -0.092) 10.554 7.586 ( 7.001 20.304 9.057) 23.309 7.696 ( 9.108 5.640 11.070) 15.405 7.870 ( -1.237 2.401 0.081) 2.702 8.094 ( -4.618 7.581 -6.903) 11.245 8.300 ( -6.303 0.248 2.541) 6.801 8.394 ( -4.481 10.198 -2.349) 11.384 8.556 ( -13.468 14.603 -6.283) 20.835 8.636 ( -8.893 5.050 -3.290) 10.743 8.856 ( -6.199 11.962 0.218) 13.475 9.016 ( -4.151 17.046 -6.956) 18.873 9.164 ( -0.349 7.808 -2.563) 8.225 9.234 ( -3.400 12.281 3.283) 13.159 9.441 ( 0.966 3.038 -2.726) 4.195 9.498 ( 4.049 11.124 8.454) 14.547 9.565 ( 3.320 0.478 -5.749) 6.656 9.754 ( -6.054 4.111 -5.456) 9.128 9.956 ( 5.936 7.193 -3.145) 9.842 10.150 ( 1.328 2.110 2.765) 3.723 10.351 ( 14.088 -4.927 7.926) 16.898 10.621 ( 7.988 -3.783 3.168) 9.389 10.794 ( 8.597 -5.703 -4.094) 11.099 11.046 ( 3.083 -1.605 -1.995) 4.007 11.095 ( 2.742 6.513 5.568) 8.997 11.144 ( 3.175 4.428 -0.852) 5.515 11.343 ( 5.837 -3.545 -5.502) 8.770 11.413 ( -0.472 -1.025 -1.079) 1.561 11.551 ( 0.082 -4.738 -0.644) 4.782 11.585 ( 6.928 -4.587 1.898) 8.523 11.842 ( -4.360 1.585 -1.499) 4.875 12.037 ( -4.892 2.010 2.061) 5.676 12.153 ( -5.700 -5.469 2.320) 8.233 12.355 ( -10.619 0.634 2.983) 11.048 12.629 ( 7.150 1.625 0.499) 7.349 12.957 ( -10.321 -5.675 -6.557) 13.481 12.992 ( -6.226 2.151 4.392) 7.917 13.172 ( -10.635 0.857 -1.039) 10.720 14.277 ( 6.609 -1.560 3.644) 7.706 14.363 ( 4.194 -0.798 -6.664) 7.914 14.573 ( 4.384 4.131 3.502) 6.968 14.675 ( 1.563 -1.717 -4.175) 4.777 15.534 ( 2.699 4.137 4.852) 6.924 15.706 ( 0.341 -0.116 6.597) 6.606 15.763 ( -0.637 -0.353 -0.665) 0.986 15.924 ( -0.873 -4.679 -8.007) 9.315 17.754 ( 3.610 0.303 1.023) 3.764 17.977 ( 8.600 -1.094 -4.853) 9.935 18.017 ( -9.430 -3.483 2.399) 10.335 18.230 ( -5.346 -4.749 1.176) 7.247 19.708 ( 0.816 11.419 1.257) 11.517 19.805 ( -0.393 11.744 -1.821) 11.891 20.022 ( -4.905 4.063 0.523) 6.390 20.069 ( -4.260 3.640 -1.162) 5.723 20.395 ( 0.546 0.717 -0.895) 1.270 20.444 ( -2.009 -0.873 1.254) 2.524 20.536 ( 0.663 7.115 3.790) 8.089 20.585 ( 0.391 8.612 -4.267) 9.620 20.899 ( 0.229 18.625 -0.351) 18.630 20.946 ( -1.880 19.099 -0.211) 19.193 21.318 ( 7.076 18.924 -6.730) 21.295 21.544 ( -6.246 16.109 9.574) 19.753 24.272 ( 1.650 -0.219 -0.791) 1.843 24.363 ( -3.076 -0.853 1.891) 3.710 24.465 ( 5.581 -5.310 -0.556) 7.724 24.598 ( -0.847 -6.346 0.730) 6.443 30.195 ( -0.929 0.046 4.420) 4.517 30.212 ( 0.693 -0.649 -4.710) 4.805 30.300 ( 1.111 -1.557 -0.606) 2.007 30.311 ( 0.080 -1.425 1.832) 2.323 34.439 ( 2.508 -4.214 7.052) 8.590 34.777 ( -12.249 -7.028 -4.939) 14.961 35.078 ( 18.018 -19.110 -2.920) 26.426 35.562 ( -7.668 -22.717 7.700) 25.182 37.211 ( -0.450 -9.397 4.203) 10.304 37.326 ( -3.086 -9.467 -6.744) 12.026 37.784 ( 7.113 -12.384 9.296) 17.040 38.052 ( 1.985 -15.980 -9.138) 18.515 41.043 ( 4.537 -5.240 -15.645) 17.112 41.237 ( -12.487 -9.111 -3.718) 15.898 41.673 ( 15.992 -12.238 6.193) 21.069 42.112 ( -0.723 -16.000 1.415) 16.079 42.181 ( -1.366 -15.462 1.567) 15.602 42.685 ( -27.010 -20.645 -6.251) 34.566 44.146 ( 14.406 -46.414 27.362) 55.771 44.384 ( 11.900 -38.727 -19.616) 45.013 ======================= Grid point 249 (106/126) ======================= q-point: ( 0.50 0.19 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.295 ( -37.050 20.477 -0.159) 42.332 3.295 ( 37.050 20.477 0.159) 42.332 3.826 ( 2.749 23.833 -8.215) 25.358 3.826 ( -2.749 23.833 8.215) 25.358 4.156 ( -5.666 18.024 -16.095) 24.819 4.156 ( 5.666 18.024 16.095) 24.819 4.497 ( -8.865 18.920 -9.100) 22.789 4.497 ( 8.865 18.920 9.100) 22.789 5.235 ( 2.908 14.053 -17.774) 22.844 5.235 ( -2.908 14.053 17.774) 22.844 5.538 ( -1.864 10.423 -13.001) 16.767 5.538 ( 1.864 10.423 13.001) 16.767 5.733 ( 6.212 15.774 -10.051) 19.708 5.733 ( -6.212 15.774 10.051) 19.708 6.284 ( -3.763 29.777 -11.825) 32.259 6.284 ( 3.763 29.777 11.825) 32.259 6.482 ( 1.308 18.114 -7.818) 19.772 6.482 ( -1.308 18.114 7.818) 19.772 6.760 ( 3.261 20.214 -14.232) 24.935 6.760 ( -3.261 20.214 14.232) 24.935 7.008 ( -2.146 13.847 -8.923) 16.612 7.008 ( 2.146 13.847 8.923) 16.612 7.332 ( 7.835 14.270 -10.109) 19.163 7.332 ( -7.835 14.270 10.109) 19.163 7.819 ( -8.904 14.322 -4.476) 17.448 7.819 ( 8.904 14.322 4.476) 17.448 7.932 ( -4.818 6.963 -1.006) 8.527 7.932 ( 4.818 6.963 1.006) 8.527 8.282 ( -11.203 5.819 -15.315) 19.848 8.282 ( 11.203 5.819 15.315) 19.848 8.416 ( -5.964 13.403 -2.841) 14.943 8.416 ( 5.964 13.403 2.841) 14.943 8.892 ( -4.808 14.734 -5.578) 16.471 8.892 ( 4.808 14.734 5.578) 16.471 9.191 ( 0.933 5.220 -3.276) 6.233 9.191 ( -0.933 5.220 3.276) 6.233 9.520 ( -4.535 3.509 -3.402) 6.668 9.520 ( 4.535 3.509 3.402) 6.668 9.606 ( -1.932 9.731 -4.668) 10.965 9.606 ( 1.932 9.731 4.668) 10.965 10.081 ( -2.275 4.781 -5.535) 7.660 10.081 ( 2.275 4.781 5.535) 7.660 10.610 ( -6.302 -4.294 -10.135) 12.684 10.610 ( 6.302 -4.294 10.135) 12.684 10.977 ( -9.009 -6.644 -0.023) 11.194 10.977 ( 9.009 -6.644 0.023) 11.194 11.168 ( -1.084 5.529 -5.132) 7.621 11.168 ( 1.084 5.529 5.132) 7.621 11.375 ( 2.918 -2.678 -2.657) 4.769 11.375 ( -2.918 -2.678 2.657) 4.769 11.606 ( -5.405 -3.776 0.409) 6.606 11.606 ( 5.405 -3.776 -0.409) 6.606 11.906 ( 12.200 -4.743 -9.404) 16.117 11.906 ( -12.200 -4.743 9.404) 16.117 12.182 ( -6.149 0.036 -1.561) 6.344 12.182 ( 6.149 0.036 1.561) 6.344 12.777 ( -6.993 -3.079 -4.647) 8.943 12.777 ( 6.993 -3.079 4.647) 8.943 12.991 ( -3.963 2.845 -6.479) 8.111 12.991 ( 3.963 2.845 6.479) 8.111 14.373 ( -0.594 -0.601 -6.672) 6.725 14.373 ( 0.594 -0.601 6.672) 6.725 14.650 ( -0.101 2.652 -7.290) 7.758 14.650 ( 0.101 2.652 7.290) 7.758 15.623 ( -4.308 3.728 -4.696) 7.383 15.623 ( 4.308 3.728 4.696) 7.383 15.850 ( -3.499 -4.212 -6.379) 8.407 15.850 ( 3.499 -4.212 6.379) 8.407 17.862 ( -7.615 -1.501 0.692) 7.792 17.862 ( 7.615 -1.501 -0.692) 7.792 18.114 ( 8.155 -2.836 -3.142) 9.188 18.114 ( -8.155 -2.836 3.142) 9.188 19.755 ( -3.355 12.630 -1.208) 13.124 19.755 ( 3.355 12.630 1.208) 13.124 20.003 ( -1.612 3.298 -0.441) 3.698 20.003 ( 1.612 3.298 0.441) 3.698 20.413 ( 1.814 -0.141 -1.366) 2.275 20.413 ( -1.814 -0.141 1.366) 2.275 20.565 ( -0.061 7.865 -4.819) 9.225 20.565 ( 0.061 7.865 4.819) 9.225 20.915 ( -0.354 18.806 -0.548) 18.817 20.915 ( 0.354 18.806 0.548) 18.817 21.436 ( 7.146 18.103 -7.786) 20.962 21.436 ( -7.146 18.103 7.786) 20.962 24.312 ( 3.022 -0.435 -1.605) 3.450 24.312 ( -3.022 -0.435 1.605) 3.450 24.554 ( 0.075 -6.732 -1.473) 6.891 24.554 ( -0.075 -6.732 1.473) 6.891 30.203 ( 0.775 -0.346 -4.936) 5.008 30.203 ( -0.775 -0.346 4.936) 5.008 30.312 ( 1.175 -1.653 -4.441) 4.882 30.312 ( -1.175 -1.653 4.441) 4.882 34.567 ( -6.150 -5.525 -7.112) 10.905 34.567 ( 6.150 -5.525 7.112) 10.905 35.372 ( -3.541 -22.705 -4.649) 23.445 35.372 ( 3.541 -22.705 4.649) 23.445 37.251 ( -1.278 -9.244 -7.140) 11.750 37.251 ( 1.278 -9.244 7.140) 11.750 37.957 ( -5.708 -13.940 -11.723) 19.088 37.957 ( 5.708 -13.940 11.723) 19.088 41.079 ( 6.789 -5.942 -9.929) 13.415 41.079 ( -6.789 -5.942 9.929) 13.415 42.029 ( -11.800 -13.593 -1.333) 18.049 42.029 ( 11.800 -13.593 1.333) 18.049 42.247 ( -9.749 -18.671 -12.192) 24.337 42.247 ( 9.749 -18.671 12.192) 24.337 44.395 ( -0.363 -43.432 -22.720) 49.017 44.395 ( 0.363 -43.432 22.720) 49.017 ======================= Grid point 253 (107/126) ======================= q-point: ( 0.00 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 114 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.862 ( 1.075 20.358 -26.900) 33.753 3.862 ( -1.075 20.358 26.900) 33.753 4.032 ( -6.366 34.184 -25.618) 43.190 4.032 ( 6.366 34.184 25.618) 43.190 4.948 ( -1.794 14.188 -2.661) 14.547 4.948 ( 1.794 14.188 2.661) 14.547 5.276 ( 7.419 8.212 -4.463) 11.933 5.276 ( -7.419 8.212 4.463) 11.933 5.490 ( 1.987 5.500 -5.610) 8.104 5.490 ( -1.987 5.500 5.610) 8.104 5.781 ( -12.182 7.840 -15.751) 21.400 5.781 ( 12.182 7.840 15.751) 21.400 6.107 ( 1.380 8.615 -2.354) 9.037 6.107 ( -1.380 8.615 2.354) 9.037 6.495 ( 0.376 23.398 -4.197) 23.775 6.495 ( -0.376 23.398 4.197) 23.775 6.711 ( -7.819 12.088 -18.056) 23.093 6.711 ( 7.819 12.088 18.056) 23.093 7.112 ( 6.274 19.093 -12.360) 23.594 7.112 ( -6.274 19.093 12.360) 23.594 7.250 ( 4.949 5.416 -7.393) 10.415 7.250 ( -4.949 5.416 7.393) 10.416 7.407 ( -4.243 20.486 -5.687) 21.680 7.407 ( 4.243 20.486 5.687) 21.680 7.565 ( 2.423 17.042 -11.053) 20.457 7.565 ( -2.423 17.042 11.053) 20.457 8.188 ( 1.134 -1.461 -14.406) 14.525 8.188 ( -1.134 -1.461 14.406) 14.525 8.579 ( -9.734 6.501 -6.560) 13.418 8.579 ( 9.734 6.501 6.560) 13.418 8.837 ( -7.656 9.226 -8.450) 14.667 8.837 ( 7.656 9.226 8.450) 14.667 9.255 ( 0.068 0.560 -1.634) 1.729 9.255 ( -0.068 0.560 1.634) 1.729 9.447 ( -1.589 4.108 -5.581) 7.110 9.447 ( 1.589 4.108 5.581) 7.110 9.544 ( -0.889 10.261 -1.759) 10.448 9.544 ( 0.889 10.261 1.759) 10.448 9.946 ( -5.237 8.547 -2.575) 10.349 9.946 ( 5.237 8.547 2.575) 10.349 10.118 ( -4.299 20.412 -8.429) 22.498 10.118 ( 4.299 20.412 8.429) 22.498 10.338 ( -7.261 12.385 -3.660) 14.816 10.338 ( 7.261 12.385 3.660) 14.816 10.612 ( -7.109 -0.606 -1.207) 7.237 10.612 ( 7.109 -0.606 1.207) 7.237 11.106 ( 2.650 4.683 -2.021) 5.748 11.106 ( -2.650 4.683 2.021) 5.748 11.300 ( 4.858 -2.354 -3.938) 6.682 11.300 ( -4.858 -2.354 3.938) 6.682 11.574 ( 1.278 -3.263 -6.077) 7.015 11.574 ( -1.278 -3.263 6.077) 7.015 12.031 ( -2.112 -0.282 -3.247) 3.884 12.031 ( 2.112 -0.282 3.247) 3.884 12.436 ( -2.931 5.860 0.196) 6.555 12.436 ( 2.931 5.860 -0.196) 6.555 12.906 ( -10.667 -1.018 -2.228) 10.945 12.906 ( 10.667 -1.018 2.228) 10.945 13.365 ( -3.940 -0.916 -6.978) 8.065 13.365 ( 3.940 -0.916 6.978) 8.065 14.182 ( -8.163 0.880 -2.219) 8.505 14.182 ( 8.163 0.880 2.219) 8.505 14.449 ( -0.100 -1.193 -2.451) 2.728 14.449 ( 0.100 -1.193 2.451) 2.728 15.561 ( -0.136 4.230 -4.213) 5.972 15.561 ( 0.136 4.230 4.213) 5.972 15.879 ( 3.096 -2.052 -5.187) 6.379 15.879 ( -3.096 -2.052 5.187) 6.379 17.789 ( 2.800 1.180 -4.874) 5.744 17.789 ( -2.800 1.180 4.874) 5.744 18.143 ( 1.759 -5.485 -2.082) 6.125 18.143 ( -1.759 -5.485 2.082) 6.125 19.882 ( 2.071 3.107 -2.964) 4.767 19.882 ( -2.071 3.107 2.964) 4.767 20.181 ( 1.784 -2.207 -2.213) 3.599 20.181 ( -1.784 -2.207 2.213) 3.599 20.511 ( -1.060 4.981 -0.067) 5.093 20.511 ( 1.060 4.981 0.067) 5.093 20.710 ( 2.869 7.792 -5.236) 9.817 20.710 ( -2.869 7.792 5.236) 9.817 21.329 ( -2.128 17.632 0.295) 17.762 21.329 ( 2.128 17.632 -0.295) 17.762 21.685 ( -1.637 12.971 -12.592) 18.151 21.685 ( 1.637 12.971 12.592) 18.151 24.272 ( 0.393 0.032 -2.686) 2.715 24.272 ( -0.393 0.032 2.686) 2.715 24.473 ( 2.494 -0.947 -1.501) 3.061 24.473 ( -2.494 -0.947 1.501) 3.061 30.209 ( 1.243 -0.244 -4.231) 4.417 30.209 ( -1.243 -0.244 4.231) 4.417 30.260 ( 1.101 -0.787 -4.391) 4.594 30.260 ( -1.101 -0.787 4.391) 4.594 34.406 ( 6.390 -5.498 -8.460) 11.943 34.406 ( -6.390 -5.498 8.460) 11.943 35.088 ( -2.161 -12.489 -16.510) 20.814 35.088 ( 2.161 -12.489 16.510) 20.814 37.115 ( -1.858 -11.011 -3.674) 11.755 37.115 ( 1.858 -11.011 3.674) 11.755 37.481 ( -4.394 -13.903 -2.106) 14.732 37.481 ( 4.394 -13.903 2.106) 14.732 40.979 ( -1.261 -6.628 -9.690) 11.807 40.979 ( 1.261 -6.628 9.690) 11.807 41.706 ( -5.103 -15.299 -6.476) 17.379 41.706 ( 5.103 -15.299 6.476) 17.379 42.214 ( -20.230 -24.312 -15.820) 35.364 42.214 ( 20.230 -24.312 15.820) 35.364 43.192 ( 18.405 -29.878 -9.549) 36.368 43.192 ( -18.405 -29.878 9.549) 36.368 ======================= Grid point 255 (108/126) ======================= q-point: ( 0.17 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.609 ( -11.237 36.258 -17.702) 41.884 3.807 ( 3.885 22.785 -17.353) 28.903 4.113 ( 7.833 19.676 15.415) 26.194 4.317 ( 6.740 27.846 25.523) 38.370 4.849 ( -10.811 18.612 1.583) 21.583 4.956 ( -4.311 10.141 0.692) 11.041 5.024 ( -19.574 5.775 2.623) 20.576 5.219 ( -19.178 12.680 0.487) 22.996 5.390 ( 7.234 7.644 -12.930) 16.671 5.485 ( -7.523 8.860 8.121) 14.179 5.609 ( 0.966 5.592 -9.268) 10.868 5.972 ( -3.151 5.741 8.179) 10.478 6.046 ( 1.911 7.484 -10.692) 13.191 6.177 ( 7.874 9.090 2.225) 12.230 6.315 ( -7.852 14.774 -17.456) 24.180 6.572 ( 8.686 17.274 2.209) 19.460 6.810 ( 10.012 24.449 0.452) 26.424 6.886 ( 0.477 7.054 6.291) 9.464 7.041 ( -3.439 26.653 17.889) 32.283 7.140 ( -3.029 12.648 3.514) 13.471 7.250 ( -4.185 7.939 -1.406) 9.084 7.345 ( 14.098 24.667 -5.970) 29.032 7.366 ( 5.846 7.173 -5.708) 10.873 7.445 ( 4.120 16.126 -0.793) 16.663 7.670 ( 6.034 20.432 11.662) 24.287 7.713 ( 13.797 17.081 -1.260) 21.994 8.050 ( -6.356 -3.107 -10.655) 12.790 8.257 ( -1.720 2.726 6.475) 7.232 8.450 ( 2.934 7.857 -5.835) 10.217 8.624 ( -9.255 11.455 -7.737) 16.635 8.752 ( 1.934 6.822 9.317) 11.708 8.941 ( -0.518 7.344 3.890) 8.327 9.281 ( 0.851 2.024 2.205) 3.112 9.287 ( -10.344 6.464 -7.195) 14.161 9.347 ( 7.651 -3.219 3.660) 9.072 9.419 ( -4.479 4.020 -1.470) 6.195 9.549 ( -1.523 13.721 1.146) 13.853 9.616 ( 3.548 10.059 5.122) 11.832 9.798 ( -6.288 10.439 -6.618) 13.867 9.921 ( -1.574 11.602 -9.278) 14.939 10.057 ( -0.681 14.331 0.156) 14.348 10.209 ( 4.394 20.256 0.927) 20.748 10.324 ( 5.275 10.666 1.776) 12.031 10.446 ( 1.498 4.695 4.018) 6.358 10.631 ( 7.034 1.377 1.941) 7.426 10.860 ( 17.518 -1.135 -1.240) 17.599 11.049 ( -3.931 0.957 -0.081) 4.046 11.168 ( 4.288 3.485 -1.134) 5.641 11.235 ( -3.136 0.461 6.666) 7.381 11.353 ( 2.309 -4.550 -3.437) 6.151 11.499 ( -3.880 -1.156 -0.674) 4.104 11.584 ( -1.104 -0.973 -3.127) 3.456 11.975 ( -3.465 -0.225 -0.913) 3.590 12.071 ( -0.037 -2.997 1.277) 3.258 12.296 ( -8.609 8.042 1.490) 11.875 12.537 ( 3.380 0.656 -3.521) 4.925 12.640 ( -14.138 4.015 5.166) 15.579 13.024 ( -0.401 -1.553 2.040) 2.595 13.178 ( -9.460 -2.592 -6.119) 11.560 13.388 ( -6.667 2.963 2.743) 7.794 14.117 ( 3.692 -0.293 -1.119) 3.869 14.319 ( 5.205 1.726 -0.764) 5.536 14.516 ( 6.825 -0.155 -2.280) 7.198 14.522 ( 6.681 -1.786 2.445) 7.335 15.571 ( 2.395 4.736 -0.652) 5.347 15.613 ( 2.729 2.426 5.448) 6.559 15.829 ( -3.971 -1.438 2.863) 5.102 15.893 ( 0.888 -2.080 -6.333) 6.725 17.751 ( -1.429 1.358 2.100) 2.880 17.860 ( 5.618 0.294 -3.768) 6.771 18.064 ( -6.148 -4.519 2.249) 7.955 18.168 ( -0.091 -5.451 -0.738) 5.501 19.858 ( -1.050 3.576 1.849) 4.160 19.918 ( 2.817 2.740 -2.504) 4.659 20.131 ( -4.669 -1.743 2.455) 5.556 20.170 ( -1.965 -1.640 -1.940) 3.211 20.474 ( -2.358 4.915 -0.567) 5.481 20.500 ( -2.086 4.435 -0.050) 4.901 20.686 ( -0.465 8.532 3.771) 9.340 20.758 ( 2.791 7.875 -3.541) 9.074 21.292 ( -1.730 18.226 0.269) 18.310 21.349 ( -0.164 17.724 -0.291) 17.727 21.619 ( 1.428 15.249 -8.181) 17.364 21.784 ( 1.660 10.328 8.896) 13.732 24.261 ( 0.195 0.671 -0.138) 0.712 24.310 ( 2.817 -1.286 -0.949) 3.238 24.423 ( -3.316 0.287 2.745) 4.315 24.505 ( 0.997 -2.575 -0.790) 2.872 30.203 ( -1.293 0.204 3.408) 3.651 30.207 ( 0.658 -0.551 -3.896) 3.990 30.260 ( 0.272 -1.052 0.392) 1.155 30.273 ( 0.665 -0.945 0.526) 1.270 34.338 ( -3.034 -3.791 6.510) 8.121 34.555 ( 11.711 -8.526 -5.994) 15.678 34.867 ( -11.818 -9.207 -5.322) 15.899 35.209 ( 0.279 -15.527 8.008) 17.472 37.037 ( -3.012 -9.743 1.479) 10.305 37.183 ( 0.668 -11.157 -2.555) 11.465 37.399 ( 0.280 -13.367 3.470) 13.813 37.633 ( 8.332 -16.549 -4.021) 18.959 40.943 ( 2.358 -5.065 -11.762) 13.022 41.086 ( 5.354 -9.286 6.858) 12.725 41.437 ( -14.025 -13.559 -10.196) 22.012 41.781 ( 2.067 -15.002 -1.513) 15.219 41.945 ( -6.507 -15.541 -0.243) 16.850 42.614 ( -0.173 -27.285 3.018) 27.452 42.916 ( -1.585 -32.747 24.024) 40.645 43.482 ( 15.773 -33.499 -13.704) 39.481 ======================= Grid point 256 (109/126) ======================= q-point: ( 0.33 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.481 ( 5.687 35.269 -7.910) 36.590 3.894 ( 13.220 20.368 -15.795) 28.967 4.303 ( -2.894 17.427 16.045) 23.865 4.355 ( -19.188 17.320 5.789) 26.489 4.575 ( -0.645 18.826 13.368) 23.098 4.722 ( -24.388 17.552 5.616) 30.568 4.772 ( -6.705 14.927 -5.328) 17.209 4.993 ( -4.043 11.633 -3.915) 12.923 5.400 ( -1.694 10.138 9.649) 14.098 5.531 ( 14.035 9.583 -20.357) 26.519 5.625 ( -1.696 9.902 7.983) 12.831 5.818 ( -6.791 7.339 -12.190) 15.766 5.975 ( -7.818 4.290 0.233) 8.921 6.092 ( -7.187 9.278 -11.800) 16.643 6.482 ( 16.974 9.130 6.355) 20.295 6.705 ( 3.643 9.468 1.084) 10.203 6.786 ( -5.155 10.679 3.953) 12.500 6.941 ( -1.562 23.636 -8.316) 25.105 7.070 ( 3.113 11.169 2.980) 11.972 7.182 ( 0.722 30.005 15.558) 33.807 7.219 ( 0.732 9.192 1.036) 9.279 7.401 ( -2.002 19.073 -5.271) 19.889 7.488 ( 9.489 11.784 -0.760) 15.149 7.669 ( 6.317 17.721 1.884) 18.907 7.852 ( 12.234 10.223 5.835) 16.977 7.967 ( 10.649 14.968 -2.835) 18.587 7.995 ( 11.291 11.762 3.927) 16.771 8.265 ( -2.979 4.654 6.424) 8.474 8.385 ( -9.379 14.237 -9.591) 19.561 8.500 ( -0.219 3.618 -5.418) 6.518 8.796 ( -1.147 12.186 1.353) 12.314 8.863 ( -8.286 11.958 1.492) 14.625 9.093 ( -3.370 11.833 -2.795) 12.617 9.287 ( -1.480 1.635 1.981) 2.965 9.331 ( -3.521 4.641 -2.061) 6.180 9.424 ( -9.223 16.773 -3.723) 19.500 9.473 ( 3.093 -1.048 3.503) 4.789 9.602 ( -4.481 8.269 -2.662) 9.775 9.792 ( 5.110 12.444 4.232) 14.102 9.912 ( 1.221 10.160 -6.977) 12.386 10.136 ( 7.017 6.720 3.108) 10.201 10.300 ( 6.175 15.795 -0.516) 16.967 10.380 ( 1.787 8.445 0.300) 8.638 10.558 ( 6.787 -0.582 4.984) 8.441 10.718 ( 1.114 1.199 -1.424) 2.170 10.942 ( -7.453 -7.988 -1.745) 11.064 11.131 ( 11.313 -3.004 -1.198) 11.766 11.250 ( 3.625 3.754 2.777) 5.911 11.283 ( 4.906 2.053 1.697) 5.582 11.385 ( 2.889 -4.427 -0.136) 5.288 11.458 ( 0.339 0.685 -0.439) 0.881 11.527 ( -2.195 -0.358 -5.019) 5.490 11.881 ( -6.034 1.829 0.605) 6.334 11.994 ( -8.896 -5.226 3.013) 10.748 12.190 ( -1.282 7.561 -3.980) 8.640 12.371 ( -12.733 -0.678 5.754) 13.990 12.661 ( 5.816 3.602 -0.261) 6.846 12.915 ( -8.057 1.163 -3.294) 8.781 13.060 ( -2.218 1.919 -1.729) 3.405 13.212 ( -11.331 3.242 2.337) 12.015 14.249 ( 8.320 -1.049 0.918) 8.436 14.379 ( 2.303 1.691 -2.234) 3.627 14.618 ( 6.076 -2.009 -4.124) 7.613 14.651 ( 3.673 1.381 4.601) 6.047 15.630 ( 3.460 5.075 1.951) 6.445 15.694 ( 3.030 -0.432 4.727) 5.632 15.773 ( -2.937 0.148 0.893) 3.074 15.853 ( -1.729 -1.981 -6.553) 7.061 17.763 ( 2.235 0.653 0.584) 2.401 17.941 ( -1.558 -2.517 -1.416) 3.281 17.964 ( 0.800 -1.454 0.019) 1.659 18.134 ( -3.492 -4.484 0.657) 5.721 19.869 ( 1.736 3.791 0.887) 4.263 19.960 ( 2.701 3.091 -1.810) 4.486 20.042 ( -5.767 -0.878 1.549) 6.036 20.102 ( -4.288 -0.055 -0.884) 4.379 20.438 ( -0.932 4.375 -0.861) 4.556 20.460 ( -2.086 3.384 0.567) 4.016 20.714 ( 1.155 9.041 3.805) 9.877 20.771 ( 0.630 8.582 -3.697) 9.366 21.278 ( 0.221 18.566 -0.018) 18.567 21.326 ( -1.676 18.258 -0.421) 18.339 21.657 ( 5.697 14.754 -5.805) 16.848 21.807 ( -3.235 10.631 6.856) 13.057 24.276 ( 1.553 0.789 -0.237) 1.758 24.343 ( 0.104 -1.232 -1.484) 1.932 24.400 ( 0.592 -0.974 2.839) 3.059 24.497 ( -1.557 -3.588 -0.350) 3.927 30.198 ( -1.041 0.166 3.541) 3.695 30.201 ( 0.695 -0.455 -3.796) 3.886 30.270 ( 0.551 -1.364 0.369) 1.516 30.283 ( 0.132 -1.260 0.310) 1.305 34.357 ( 2.165 -3.771 4.931) 6.574 34.635 ( -9.907 -6.784 -4.734) 12.907 34.769 ( 12.997 -12.050 -2.902) 17.960 35.168 ( -7.942 -16.537 5.413) 19.127 37.024 ( -0.091 -9.115 4.242) 10.054 37.130 ( -2.634 -9.907 -5.626) 11.693 37.501 ( 5.825 -15.134 8.200) 18.172 37.704 ( 2.221 -18.003 -8.460) 20.015 40.941 ( 3.538 -4.758 -12.767) 14.077 41.061 ( -8.114 -8.290 -0.698) 11.620 41.424 ( 13.261 -12.190 6.229) 19.059 41.798 ( 0.718 -14.933 -0.850) 14.975 41.877 ( -2.947 -14.382 3.242) 15.035 42.263 ( -23.233 -20.984 -6.492) 31.972 43.279 ( 13.894 -39.605 26.463) 49.617 43.617 ( 6.912 -37.066 -17.972) 41.769 ======================= Grid point 257 (110/126) ======================= q-point: ( 0.50 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.744 ( -21.688 23.889 -0.992) 32.281 3.744 ( 21.688 23.889 0.992) 32.281 4.252 ( -2.246 19.223 -8.212) 21.024 4.252 ( 2.246 19.223 8.212) 21.024 4.522 ( -5.972 18.430 -14.074) 23.946 4.522 ( 5.972 18.430 14.074) 23.946 4.849 ( -7.236 15.175 -11.206) 20.204 4.849 ( 7.236 15.175 11.206) 20.204 5.511 ( -3.476 12.252 -10.844) 16.727 5.511 ( 3.476 12.252 10.844) 16.727 5.697 ( 9.710 7.923 -9.896) 15.969 5.697 ( -9.710 7.923 9.896) 15.969 5.926 ( -1.615 4.819 -11.847) 12.891 5.926 ( 1.615 4.819 11.847) 12.891 6.741 ( 1.922 10.415 -6.280) 12.313 6.741 ( -1.922 10.415 6.280) 12.313 6.776 ( -8.543 12.806 -8.586) 17.626 6.776 ( 8.543 12.806 8.586) 17.626 7.182 ( 5.827 19.310 -5.706) 20.961 7.182 ( -5.827 19.310 5.706) 20.961 7.281 ( -4.721 15.443 -5.221) 16.972 7.281 ( 4.721 15.443 5.221) 16.972 7.653 ( -3.095 13.951 -5.752) 15.404 7.653 ( 3.095 13.951 5.752) 15.404 8.092 ( -1.112 9.178 -2.451) 9.565 8.092 ( 1.112 9.178 2.451) 9.565 8.183 ( -5.682 19.067 -4.495) 20.398 8.183 ( 5.682 19.067 4.495) 20.398 8.335 ( -11.300 4.202 -14.972) 19.223 8.335 ( 11.300 4.202 14.972) 19.223 8.767 ( 7.144 17.404 -11.153) 21.871 8.767 ( -7.144 17.404 11.153) 21.871 9.185 ( -9.749 9.556 -2.514) 13.881 9.185 ( 9.749 9.556 2.514) 13.881 9.298 ( -0.958 10.641 -3.543) 11.256 9.298 ( 0.958 10.641 3.543) 11.256 9.534 ( -2.325 0.302 -2.433) 3.378 9.534 ( 2.325 0.302 2.433) 3.378 9.877 ( -1.391 12.712 -6.482) 14.337 9.877 ( 1.391 12.712 6.482) 14.337 10.266 ( -5.035 11.011 -5.599) 13.339 10.266 ( 5.035 11.011 5.599) 13.339 10.553 ( -8.060 1.233 -6.274) 10.288 10.553 ( 8.060 1.233 6.274) 10.288 10.780 ( -6.180 -7.521 -2.506) 10.052 10.780 ( 6.180 -7.521 2.506) 10.052 11.265 ( -2.871 -0.441 -1.707) 3.369 11.265 ( 2.871 -0.441 1.707) 3.369 11.377 ( 3.660 5.116 -9.631) 11.504 11.377 ( -3.660 5.116 9.631) 11.504 11.487 ( -0.236 -5.059 -2.337) 5.578 11.487 ( 0.236 -5.059 2.337) 5.578 11.863 ( 5.975 -0.579 -4.609) 7.568 11.863 ( -5.975 -0.579 4.609) 7.568 12.212 ( 7.015 2.610 -6.871) 10.160 12.212 ( -7.015 2.610 6.871) 10.160 12.774 ( -5.854 2.471 -1.798) 6.604 12.774 ( 5.854 2.471 1.798) 6.604 13.068 ( 2.212 3.976 -5.644) 7.250 13.068 ( -2.212 3.976 5.644) 7.250 14.365 ( -0.385 -0.239 -5.598) 5.616 14.365 ( 0.385 -0.239 5.598) 5.616 14.680 ( 2.601 0.255 -4.896) 5.550 14.680 ( -2.601 0.255 4.896) 5.550 15.701 ( -2.094 3.506 -1.769) 4.451 15.701 ( 2.094 3.506 1.769) 4.451 15.784 ( -2.824 -2.153 -3.797) 5.199 15.784 ( 2.824 -2.153 3.797) 5.199 17.836 ( -5.390 -0.936 0.667) 5.511 17.836 ( 5.390 -0.936 -0.667) 5.511 18.055 ( 5.042 -2.854 -1.850) 6.082 18.055 ( -5.042 -2.854 1.850) 6.082 19.931 ( -4.465 3.618 0.118) 5.748 19.931 ( 4.465 3.618 -0.118) 5.748 20.027 ( -1.141 0.150 -0.562) 1.281 20.027 ( 1.141 0.150 0.562) 1.281 20.435 ( 0.934 3.443 -0.874) 3.673 20.435 ( -0.934 3.443 0.874) 3.673 20.751 ( -0.190 9.072 -4.874) 10.300 20.751 ( 0.190 9.072 4.874) 10.300 21.295 ( -1.070 18.490 -0.374) 18.525 21.295 ( 1.070 18.490 0.374) 18.525 21.745 ( 4.925 12.824 -6.828) 15.340 21.745 ( -4.925 12.824 6.828) 15.340 24.311 ( -1.430 0.369 -0.092) 1.480 24.311 ( 1.430 0.369 0.092) 1.480 24.451 ( -2.763 -3.385 -0.643) 4.417 24.451 ( 2.763 -3.385 0.643) 4.417 30.198 ( 0.955 -0.168 -4.071) 4.184 30.198 ( -0.955 -0.168 4.071) 4.184 30.281 ( 1.067 -1.433 -4.262) 4.621 30.281 ( -1.067 -1.433 4.262) 4.621 34.460 ( -4.969 -4.969 -5.710) 9.054 34.460 ( 4.969 -4.969 5.710) 9.054 34.995 ( -1.427 -15.110 -4.068) 15.713 34.995 ( 1.427 -15.110 4.068) 15.713 37.063 ( -1.105 -9.253 -6.552) 11.391 37.063 ( 1.105 -9.253 6.552) 11.391 37.640 ( -3.783 -16.984 -10.270) 20.205 37.640 ( 3.783 -16.984 10.270) 20.205 40.961 ( 4.794 -5.571 -8.812) 11.475 40.961 ( -4.794 -5.571 8.812) 11.475 41.747 ( -13.030 -14.216 -0.172) 19.285 41.747 ( 13.030 -14.216 0.172) 19.285 41.885 ( -5.311 -16.959 -9.142) 19.985 41.885 ( 5.311 -16.959 9.142) 19.985 43.554 ( -3.604 -39.608 -22.330) 45.611 43.554 ( 3.604 -39.608 22.330) 45.611 ======================= Grid point 261 (111/126) ======================= q-point: ( 0.00 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.247 ( 0.195 18.065 -17.822) 25.377 4.247 ( -0.195 18.065 17.822) 25.377 4.695 ( -6.997 30.250 -19.041) 36.422 4.695 ( 6.997 30.250 19.041) 36.422 5.167 ( 3.943 8.029 -10.757) 13.990 5.167 ( -3.943 8.029 10.757) 13.990 5.416 ( 5.533 6.474 -4.393) 9.582 5.416 ( -5.533 6.474 4.393) 9.582 5.608 ( 4.845 6.435 -5.640) 9.834 5.608 ( -4.845 6.435 5.640) 9.834 5.869 ( -9.336 1.869 -13.579) 16.584 5.869 ( 9.336 1.869 13.579) 16.584 6.270 ( -2.220 8.037 -4.406) 9.431 6.270 ( 2.220 8.037 4.406) 9.431 6.686 ( -8.839 4.634 -9.858) 14.028 6.686 ( 8.839 4.634 9.858) 14.028 6.954 ( 0.640 3.406 -9.117) 9.754 6.954 ( -0.640 3.406 9.117) 9.754 7.247 ( -8.485 4.094 -2.166) 9.666 7.247 ( 8.485 4.094 2.166) 9.666 7.628 ( -6.906 5.916 -10.847) 14.155 7.628 ( 6.906 5.916 10.847) 14.155 7.672 ( 7.214 18.843 -19.075) 27.766 7.672 ( -7.214 18.843 19.075) 27.766 7.815 ( 2.373 7.877 -16.162) 18.135 7.815 ( -2.373 7.877 16.162) 18.135 8.303 ( 1.625 13.795 -10.089) 17.168 8.303 ( -1.625 13.795 10.089) 17.168 8.691 ( -5.054 4.074 -4.641) 7.980 8.691 ( 5.054 4.074 4.641) 7.980 9.073 ( -5.384 11.193 -7.724) 14.627 9.073 ( 5.384 11.193 7.724) 14.627 9.233 ( -2.464 0.629 -3.462) 4.295 9.233 ( 2.464 0.629 3.462) 4.295 9.476 ( -3.677 -0.538 0.036) 3.716 9.476 ( 3.677 -0.538 -0.036) 3.716 9.687 ( 0.712 4.876 -9.434) 10.643 9.687 ( -0.712 4.876 9.434) 10.643 10.163 ( 2.527 10.858 -2.736) 11.479 10.163 ( -2.527 10.858 2.736) 11.479 10.466 ( 3.498 7.687 -9.292) 12.556 10.466 ( -3.498 7.687 9.292) 12.556 10.582 ( -9.037 11.340 -1.776) 14.609 10.582 ( 9.037 11.340 1.776) 14.609 10.813 ( -3.723 22.748 -4.159) 23.423 10.813 ( 3.723 22.748 4.159) 23.423 11.182 ( -3.531 5.571 -1.031) 6.676 11.182 ( 3.531 5.571 1.031) 6.676 11.345 ( 1.470 5.736 -3.727) 6.997 11.345 ( -1.470 5.736 3.727) 6.997 11.537 ( 1.278 1.514 -6.754) 7.039 11.537 ( -1.278 1.514 6.754) 7.039 12.011 ( -2.193 -0.681 -3.186) 3.927 12.011 ( 2.193 -0.681 3.186) 3.927 12.548 ( 4.921 3.641 -7.260) 9.496 12.548 ( -4.921 3.641 7.260) 9.496 12.893 ( -7.714 0.114 0.340) 7.722 12.893 ( 7.714 0.114 -0.340) 7.722 13.266 ( -8.148 -8.406 -4.935) 12.704 13.266 ( 8.148 -8.406 4.935) 12.704 14.228 ( -8.689 3.131 -1.495) 9.356 14.228 ( 8.689 3.131 1.495) 9.356 14.456 ( 3.464 1.212 -1.502) 3.965 14.456 ( -3.464 1.212 1.502) 3.965 15.652 ( -0.091 4.412 -3.738) 5.783 15.652 ( 0.091 4.412 3.738) 5.783 15.844 ( 0.214 -1.310 -3.492) 3.736 15.844 ( -0.214 -1.310 3.492) 3.736 17.814 ( 2.012 1.319 -3.612) 4.340 17.814 ( -2.012 1.319 3.612) 4.340 18.050 ( 0.250 -3.693 -0.799) 3.787 18.050 ( -0.250 -3.693 0.799) 3.787 19.891 ( 1.930 -1.383 -2.249) 3.270 19.891 ( -1.930 -1.383 2.249) 3.270 20.122 ( 1.624 -3.413 -2.136) 4.342 20.122 ( -1.624 -3.413 2.136) 4.342 20.628 ( -1.071 5.843 0.014) 5.941 20.628 ( 1.071 5.843 -0.014) 5.941 20.834 ( 2.254 4.456 -3.469) 6.080 20.834 ( -2.254 4.456 3.469) 6.080 21.662 ( -1.533 15.213 0.111) 15.291 21.662 ( 1.533 15.213 -0.111) 15.291 21.912 ( -0.572 9.704 -7.484) 12.268 21.912 ( 0.572 9.704 7.484) 12.268 24.292 ( 0.525 1.811 -1.929) 2.698 24.292 ( -0.525 1.811 1.929) 2.698 24.463 ( 1.099 -0.018 -1.761) 2.075 24.463 ( -1.099 -0.018 1.761) 2.075 30.205 ( 0.616 -0.164 -3.082) 3.148 30.205 ( -0.616 -0.164 3.082) 3.148 30.245 ( 1.076 -0.691 -3.147) 3.397 30.245 ( -1.076 -0.691 3.147) 3.397 34.320 ( 4.793 -3.152 -5.057) 7.647 34.320 ( -4.793 -3.152 5.057) 7.647 34.859 ( -0.860 -10.149 -13.770) 17.128 34.859 ( 0.860 -10.149 13.770) 17.128 36.906 ( -1.138 -9.598 -2.724) 10.042 36.906 ( 1.138 -9.598 2.724) 10.042 37.205 ( -1.885 -13.219 -2.978) 13.681 37.205 ( 1.885 -13.219 2.978) 13.681 40.858 ( 0.262 -5.269 -5.563) 7.666 40.858 ( -0.262 -5.269 5.563) 7.666 41.438 ( -7.791 -11.307 -4.733) 14.524 41.438 ( 7.791 -11.307 4.733) 14.524 41.779 ( -10.637 -18.896 -8.517) 23.297 41.779 ( 10.637 -18.896 8.517) 23.297 42.617 ( 3.002 -27.016 -2.804) 27.327 42.617 ( -3.002 -27.016 2.804) 27.327 ======================= Grid point 263 (112/126) ======================= q-point: ( 0.17 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.212 ( 5.272 20.754 -15.487) 26.427 4.291 ( -6.106 24.217 6.509) 25.809 4.506 ( -1.090 23.597 -4.235) 23.999 4.862 ( 0.726 24.068 19.401) 30.922 5.106 ( -2.380 4.688 2.314) 5.745 5.139 ( -24.411 7.591 4.025) 25.878 5.197 ( -2.752 15.616 -0.416) 15.862 5.457 ( -9.963 10.154 -3.508) 14.652 5.494 ( 0.362 4.910 -1.398) 5.118 5.614 ( -1.439 4.218 2.126) 4.938 5.724 ( 2.976 5.631 -9.353) 11.315 6.038 ( 1.555 1.452 8.092) 8.367 6.197 ( -1.643 8.203 -13.254) 15.674 6.365 ( 5.598 10.863 2.674) 12.509 6.484 ( -5.801 4.818 -12.171) 14.318 6.768 ( 1.281 3.353 0.216) 3.596 7.021 ( -1.366 -1.613 5.847) 6.217 7.044 ( -0.163 5.547 6.919) 8.870 7.204 ( 12.678 3.335 -0.358) 13.114 7.374 ( -4.065 1.880 -5.283) 6.926 7.483 ( 6.270 7.845 -2.241) 10.290 7.678 ( -2.264 16.999 12.512) 21.228 7.717 ( 0.796 10.443 0.222) 10.476 7.787 ( 11.845 19.161 -3.395) 22.781 7.839 ( 4.059 -1.116 -7.881) 8.935 7.967 ( 10.801 12.327 8.222) 18.337 8.260 ( -0.285 17.785 -2.883) 18.020 8.302 ( -2.760 3.872 10.125) 11.186 8.625 ( 3.075 9.390 -6.046) 11.584 8.862 ( 6.212 4.177 5.580) 9.337 8.903 ( -8.136 12.185 -5.050) 15.497 9.141 ( -1.639 11.644 1.413) 11.843 9.233 ( 2.828 -4.571 -3.754) 6.556 9.291 ( 2.783 1.834 4.145) 5.319 9.382 ( -4.692 2.816 -3.256) 6.368 9.479 ( -2.897 1.958 0.065) 3.497 9.706 ( 4.535 1.813 -2.627) 5.546 9.768 ( 5.192 5.355 0.559) 7.480 10.025 ( -9.304 13.242 0.864) 16.207 10.163 ( -0.959 10.793 -6.752) 12.767 10.407 ( -5.778 7.418 3.263) 9.953 10.495 ( 0.525 10.942 2.608) 11.261 10.575 ( 5.969 8.734 2.907) 10.971 10.649 ( -2.103 17.452 0.030) 17.578 10.820 ( 5.202 13.901 -4.079) 15.393 10.943 ( 7.645 14.469 3.288) 16.692 11.081 ( -6.262 6.021 -0.438) 8.698 11.232 ( 2.128 6.667 0.131) 6.999 11.296 ( -1.498 4.030 1.218) 4.469 11.405 ( 4.571 9.392 -1.235) 10.518 11.491 ( -0.739 2.163 0.042) 2.286 11.600 ( 1.974 2.965 -1.936) 4.054 11.963 ( -0.676 -0.252 -1.790) 1.930 12.026 ( -3.234 -0.923 1.015) 3.513 12.403 ( -10.510 0.999 3.702) 11.188 12.558 ( -5.032 3.123 -3.370) 6.814 12.752 ( -4.521 5.169 1.547) 7.039 12.984 ( 0.227 -2.834 2.230) 3.614 13.094 ( -3.246 -4.789 -3.921) 6.989 13.399 ( -0.923 -2.344 0.593) 2.588 14.129 ( 1.089 1.177 -0.646) 1.728 14.369 ( 4.833 2.582 0.430) 5.497 14.454 ( 2.823 -1.955 0.594) 3.485 14.560 ( 7.307 1.096 0.229) 7.393 15.648 ( 1.290 3.052 -0.408) 3.338 15.690 ( 1.753 4.305 2.463) 5.260 15.796 ( -2.426 -1.287 -0.990) 2.919 15.867 ( 0.416 -0.577 -0.970) 1.203 17.781 ( -1.414 1.633 1.526) 2.645 17.868 ( 3.980 0.442 -2.657) 4.806 17.991 ( -4.337 -2.728 1.255) 5.275 18.073 ( 0.189 -3.901 -0.265) 3.915 19.872 ( -0.820 -1.260 1.483) 2.111 19.922 ( 2.480 -1.585 -2.183) 3.664 20.080 ( -3.962 -3.115 2.273) 5.529 20.118 ( -1.105 -3.264 -1.633) 3.813 20.587 ( -2.530 5.788 -0.060) 6.317 20.615 ( -2.342 5.907 -0.344) 6.363 20.826 ( 0.619 5.248 2.836) 5.997 20.880 ( 2.942 4.289 -2.486) 5.764 21.636 ( -1.125 15.741 0.186) 15.782 21.679 ( 0.047 14.934 0.058) 14.935 21.883 ( 1.489 11.069 -5.688) 12.533 21.966 ( 1.063 7.949 5.547) 9.751 24.291 ( 0.330 2.205 0.219) 2.240 24.307 ( 1.421 0.938 -0.871) 1.912 24.435 ( -2.310 0.864 1.846) 3.081 24.471 ( -0.138 -0.916 -0.832) 1.245 30.198 ( 0.179 -0.298 -2.067) 2.096 30.207 ( -0.589 0.185 1.672) 1.783 30.240 ( -0.356 -0.882 1.630) 1.887 30.256 ( 0.794 -0.774 -1.056) 1.531 34.274 ( -1.961 -2.580 4.433) 5.491 34.426 ( 8.447 -4.580 -4.071) 10.436 34.693 ( -8.918 -7.813 -5.161) 12.931 34.938 ( -0.587 -11.412 6.140) 12.972 36.854 ( -1.905 -8.303 1.531) 8.656 36.964 ( 1.431 -10.418 -1.263) 10.591 37.136 ( -0.736 -12.417 1.732) 12.559 37.308 ( 5.488 -15.441 -3.081) 16.674 40.856 ( 2.419 -3.548 -7.717) 8.831 40.910 ( 2.990 -7.974 3.631) 9.258 41.207 ( -9.697 -9.511 -6.642) 15.120 41.510 ( 1.685 -11.766 -3.251) 12.323 41.660 ( -3.541 -12.229 3.391) 13.175 42.088 ( 8.860 -24.364 8.617) 27.320 42.332 ( -11.751 -25.894 11.209) 30.565 42.841 ( 11.255 -29.996 -10.173) 33.614 ======================= Grid point 264 (113/126) ======================= q-point: ( 0.33 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.168 ( -2.610 30.362 -3.695) 30.697 4.292 ( 8.110 20.564 -9.727) 24.151 4.580 ( 1.888 12.182 7.347) 14.351 4.699 ( -18.001 16.926 3.511) 24.957 4.921 ( -2.752 13.006 7.129) 15.084 5.059 ( -11.342 16.737 5.704) 21.007 5.108 ( -4.688 17.513 2.716) 18.332 5.185 ( -7.720 9.120 -4.982) 12.946 5.544 ( 0.958 4.287 11.223) 12.052 5.657 ( 8.027 3.617 -14.259) 16.758 5.801 ( 6.733 6.214 1.406) 9.270 6.015 ( -7.352 12.058 4.378) 14.786 6.069 ( -4.039 5.670 -11.668) 13.587 6.209 ( -11.071 5.796 -13.343) 18.281 6.627 ( 13.737 6.198 4.129) 15.626 6.817 ( 2.976 2.819 2.337) 4.718 6.934 ( -4.310 3.108 -1.699) 5.579 7.133 ( -5.082 -0.665 4.881) 7.078 7.177 ( 0.747 1.549 -0.068) 1.721 7.486 ( 10.011 10.824 0.755) 14.763 7.573 ( -6.220 0.601 -3.437) 7.132 7.660 ( 1.708 10.773 3.229) 11.376 7.749 ( 3.682 16.770 7.110) 18.583 7.872 ( 3.892 5.469 -6.330) 9.227 8.029 ( 13.059 7.515 -0.218) 15.068 8.194 ( 9.457 9.555 0.737) 13.464 8.306 ( 1.527 7.580 2.742) 8.204 8.332 ( 3.027 5.974 7.544) 10.088 8.678 ( 4.554 17.427 -10.010) 20.607 8.743 ( -6.169 14.668 3.166) 16.225 8.970 ( 1.668 4.857 9.464) 10.768 9.116 ( -1.933 12.064 -7.770) 14.479 9.205 ( -0.129 -5.436 -2.554) 6.007 9.291 ( -1.828 5.578 -3.522) 6.845 9.356 ( 0.649 -0.151 -2.271) 2.367 9.451 ( -0.127 2.230 8.541) 8.829 9.704 ( -4.727 2.576 0.283) 5.391 9.840 ( -7.021 18.071 -0.898) 19.408 9.921 ( 8.609 2.261 -4.473) 9.962 10.146 ( 1.253 11.774 -2.151) 12.035 10.384 ( 0.030 10.211 3.893) 10.928 10.458 ( -3.899 3.883 1.133) 5.618 10.583 ( -2.799 10.142 -1.413) 10.616 10.723 ( 7.109 11.240 3.446) 13.739 10.826 ( -5.354 7.180 -6.279) 10.938 10.928 ( -3.613 9.993 2.379) 10.889 11.139 ( 8.499 8.730 -2.156) 12.373 11.263 ( 0.604 5.005 3.604) 6.197 11.356 ( 5.879 4.319 3.499) 8.091 11.473 ( 2.237 7.637 -7.126) 10.681 11.522 ( 4.646 8.818 4.181) 10.809 11.585 ( -1.808 5.956 -1.207) 6.340 11.900 ( -8.167 -1.978 -1.257) 8.497 11.953 ( -1.766 3.442 -1.386) 4.109 12.262 ( -5.182 -1.221 2.974) 6.098 12.397 ( -9.570 4.734 2.667) 11.005 12.758 ( 3.810 4.662 -3.413) 6.921 12.937 ( -4.735 0.333 0.304) 4.757 13.082 ( 1.964 0.654 -2.951) 3.604 13.277 ( -9.802 2.532 2.315) 10.385 14.232 ( 7.958 -0.927 -0.357) 8.020 14.407 ( -0.580 0.712 0.501) 1.046 14.551 ( 7.110 -3.908 -1.391) 8.232 14.664 ( 2.516 -0.844 2.000) 3.323 15.688 ( 2.164 0.634 2.263) 3.195 15.725 ( 1.077 1.986 -0.164) 2.266 15.763 ( -0.237 0.772 -0.388) 0.896 15.848 ( -1.763 0.807 -1.752) 2.613 17.782 ( 1.162 1.258 0.528) 1.792 17.901 ( -3.377 -1.256 -0.003) 3.603 17.942 ( 2.807 -0.856 -1.229) 3.181 18.055 ( -2.202 -3.339 0.571) 4.040 19.880 ( 1.395 -1.459 0.425) 2.063 19.959 ( 2.306 -2.056 -1.554) 3.458 20.009 ( -4.395 -2.237 1.853) 5.268 20.073 ( -2.933 -2.503 -0.804) 3.939 20.550 ( -1.407 5.886 -0.070) 6.053 20.567 ( -2.318 6.011 -0.128) 6.443 20.864 ( 1.575 5.576 2.747) 6.412 20.906 ( 1.113 4.750 -2.561) 5.510 21.628 ( 0.209 15.929 0.022) 15.931 21.665 ( -1.265 15.257 -0.075) 15.309 21.911 ( 3.819 10.578 -4.469) 12.102 21.988 ( -1.378 7.711 4.604) 9.086 24.305 ( 1.086 2.002 0.210) 2.287 24.330 ( 1.404 0.296 -1.354) 1.973 24.406 ( -1.562 1.010 2.127) 2.825 24.451 ( -1.622 -1.198 -0.640) 2.116 30.194 ( 0.513 -0.216 -2.288) 2.354 30.201 ( -0.928 0.170 2.159) 2.356 30.246 ( 0.260 -0.935 1.083) 1.454 30.261 ( 0.198 -0.922 -0.778) 1.223 34.290 ( 1.736 -2.849 3.713) 4.992 34.513 ( -8.288 -5.535 -3.774) 10.657 34.581 ( 10.311 -6.707 -3.169) 12.702 34.894 ( -6.705 -10.922 4.332) 13.528 36.852 ( 0.188 -7.847 3.585) 8.629 36.936 ( -1.806 -9.170 -4.115) 10.212 37.199 ( 4.205 -14.401 5.788) 16.080 37.351 ( 1.352 -16.760 -6.290) 17.953 40.857 ( 1.940 -3.688 -8.778) 9.717 40.911 ( -3.661 -6.289 0.153) 7.278 41.197 ( 9.446 -10.108 4.251) 14.473 41.524 ( 1.647 -12.131 -1.705) 12.360 41.620 ( -3.417 -10.848 4.026) 12.065 41.859 ( -19.035 -18.862 -6.262) 27.519 42.561 ( 12.204 -31.912 22.406) 40.857 42.917 ( 3.370 -32.300 -14.804) 35.691 ======================= Grid point 265 (114/126) ======================= q-point: ( 0.50 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.226 ( -2.114 23.004 -4.038) 23.452 4.226 ( 2.114 23.004 4.038) 23.452 4.621 ( -5.512 17.697 -2.934) 18.766 4.621 ( 5.512 17.697 2.934) 18.766 4.875 ( 2.152 16.027 -7.669) 17.897 4.875 ( -2.152 16.027 7.669) 17.897 5.115 ( -0.469 12.431 -7.436) 14.493 5.115 ( 0.469 12.431 7.436) 14.493 5.655 ( -0.497 2.970 -21.108) 21.322 5.655 ( 0.497 2.970 21.108) 21.322 5.945 ( -1.854 14.355 -10.594) 17.937 5.945 ( 1.854 14.355 10.594) 17.937 5.983 ( -1.983 3.304 -8.267) 9.121 5.983 ( 1.983 3.304 8.267) 9.121 6.850 ( -3.499 2.569 -7.274) 8.471 6.850 ( 3.499 2.569 7.274) 8.471 6.924 ( -7.919 3.251 -4.058) 9.473 6.924 ( 7.919 3.251 4.058) 9.473 7.358 ( -10.906 0.817 -3.510) 11.486 7.358 ( 10.906 0.817 3.510) 11.486 7.636 ( 3.454 13.620 -12.055) 18.513 7.636 ( -3.454 13.620 12.055) 18.513 7.864 ( -2.235 8.057 -6.645) 10.680 7.864 ( 2.235 8.057 6.645) 10.680 8.233 ( 3.154 2.549 -11.559) 12.250 8.233 ( -3.154 2.549 11.559) 12.250 8.337 ( 3.843 5.890 -3.571) 7.887 8.337 ( -3.843 5.890 3.571) 7.887 8.714 ( 3.058 22.871 -8.848) 24.713 8.714 ( -3.058 22.871 8.848) 24.713 9.028 ( -0.431 7.909 -11.851) 14.254 9.028 ( 0.431 7.909 11.851) 14.254 9.221 ( -0.135 -2.935 -1.009) 3.106 9.221 ( 0.135 -2.935 1.009) 3.106 9.444 ( 5.342 0.397 -6.546) 8.459 9.444 ( -5.342 0.397 6.546) 8.459 9.681 ( -3.492 12.529 -4.819) 13.871 9.681 ( 3.492 12.529 4.819) 13.871 10.093 ( -6.881 10.178 -1.280) 12.353 10.093 ( 6.881 10.178 1.280) 12.353 10.399 ( -0.168 -0.449 -5.658) 5.678 10.399 ( 0.168 -0.449 5.658) 5.678 10.642 ( -6.741 13.325 -6.395) 16.245 10.642 ( 6.741 13.325 6.395) 16.245 10.862 ( -3.964 8.153 -3.773) 9.819 10.862 ( 3.964 8.153 3.773) 9.819 11.257 ( 2.178 6.352 -3.287) 7.477 11.257 ( -2.178 6.352 3.287) 7.477 11.451 ( -1.133 2.780 -6.141) 6.836 11.451 ( 1.133 2.780 6.141) 6.836 11.576 ( 1.046 11.951 -7.700) 14.255 11.576 ( -1.046 11.951 7.700) 14.255 11.859 ( -4.061 0.353 -2.598) 4.834 11.859 ( 4.061 0.353 2.598) 4.834 12.272 ( 1.562 3.347 -8.581) 9.342 12.272 ( -1.562 3.347 8.581) 9.342 12.836 ( -0.012 2.787 -2.926) 4.041 12.836 ( 0.012 2.787 2.926) 4.041 13.140 ( 4.567 2.994 -3.818) 6.663 13.140 ( -4.567 2.994 3.818) 6.663 14.356 ( -0.401 -0.945 -4.227) 4.350 14.356 ( 0.401 -0.945 4.227) 4.350 14.655 ( 2.163 -2.814 -2.730) 4.478 14.655 ( -2.163 -2.814 2.730) 4.478 15.722 ( -0.298 -0.778 -2.274) 2.421 15.722 ( 0.298 -0.778 2.274) 2.421 15.796 ( -2.381 2.589 -1.393) 3.783 15.796 ( 2.381 2.589 1.393) 3.783 17.828 ( -3.518 0.157 0.262) 3.531 17.828 ( 3.518 0.157 -0.262) 3.531 18.004 ( 2.105 -2.169 -1.032) 3.194 18.004 ( -2.105 -2.169 1.032) 3.194 19.927 ( -2.608 -2.178 0.102) 3.399 19.927 ( 2.608 -2.178 -0.102) 3.399 20.015 ( -0.958 -1.655 -1.382) 2.359 20.015 ( 0.958 -1.655 1.382) 2.359 20.541 ( -0.149 5.973 -0.248) 5.981 20.541 ( 0.149 5.973 0.248) 5.981 20.898 ( -0.318 5.321 -3.184) 6.209 20.898 ( 0.318 5.321 3.184) 6.209 21.641 ( -0.953 15.692 -0.153) 15.721 21.641 ( 0.953 15.692 0.153) 15.721 21.962 ( 3.088 9.009 -5.124) 10.814 21.962 ( -3.088 9.009 5.124) 10.814 24.328 ( -1.060 1.294 -0.419) 1.725 24.328 ( 1.060 1.294 0.419) 1.725 24.415 ( -1.213 -0.484 -1.384) 1.903 24.415 ( 1.213 -0.484 1.384) 1.903 30.196 ( 0.975 -0.039 -3.185) 3.331 30.196 ( -0.975 -0.039 3.185) 3.331 30.256 ( 0.824 -0.950 -3.705) 3.913 30.256 ( -0.824 -0.950 3.705) 3.913 34.371 ( -3.870 -3.859 -4.889) 7.333 34.371 ( 3.870 -3.859 4.889) 7.333 34.754 ( 0.014 -9.070 -3.361) 9.673 34.754 ( -0.014 -9.070 3.361) 9.673 36.886 ( -0.849 -8.210 -5.234) 9.773 36.886 ( 0.849 -8.210 5.234) 9.773 37.301 ( -2.444 -16.202 -8.069) 18.264 37.301 ( 2.444 -16.202 8.069) 18.264 40.862 ( 2.382 -4.180 -7.208) 8.666 40.862 ( -2.382 -4.180 7.208) 8.666 41.467 ( -15.308 -13.430 -2.660) 20.537 41.467 ( 15.308 -13.430 2.660) 20.537 41.584 ( 1.056 -12.516 -4.750) 13.429 41.584 ( -1.056 -12.516 4.750) 13.429 42.821 ( -5.102 -33.219 -19.268) 38.740 42.821 ( 5.102 -33.219 19.268) 38.740 ======================= Grid point 269 (115/126) ======================= q-point: ( 0.00 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 114 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.575 ( -0.692 13.992 -5.488) 15.046 4.575 ( 0.692 13.992 5.488) 15.046 5.118 ( -3.045 8.913 -12.407) 15.577 5.118 ( 3.045 8.913 12.407) 15.577 5.346 ( 4.668 10.601 -12.060) 16.722 5.346 ( -4.668 10.601 12.060) 16.722 5.580 ( 0.447 10.773 -4.603) 11.724 5.580 ( -0.447 10.773 4.603) 11.724 5.711 ( 1.014 3.422 -2.210) 4.198 5.711 ( -1.014 3.422 2.210) 4.198 5.931 ( -0.532 6.004 -13.735) 14.999 5.931 ( 0.532 6.004 13.735) 14.999 6.423 ( -2.326 7.222 -5.482) 9.360 6.423 ( 2.326 7.222 5.482) 9.360 6.773 ( -4.535 3.941 -8.422) 10.346 6.773 ( 4.535 3.941 8.422) 10.346 6.955 ( 1.628 -0.213 -4.242) 4.548 6.955 ( -1.628 -0.213 4.242) 4.548 7.282 ( -8.487 -1.710 -1.437) 8.776 7.282 ( 8.487 -1.710 1.437) 8.776 7.522 ( -5.957 -8.503 -14.435) 17.781 7.522 ( 5.957 -8.503 14.435) 17.781 7.828 ( 2.594 0.255 -4.384) 5.100 7.828 ( -2.594 0.255 4.384) 5.100 8.147 ( 1.961 15.962 -6.882) 17.493 8.147 ( -1.961 15.962 6.882) 17.493 8.563 ( 5.782 9.182 -6.064) 12.430 8.563 ( -5.782 9.182 6.064) 12.430 8.740 ( -0.502 0.924 -4.856) 4.969 8.740 ( 0.502 0.924 4.856) 4.969 9.119 ( 2.609 -0.998 -3.404) 4.404 9.119 ( -2.609 -0.998 3.404) 4.404 9.388 ( -0.119 5.301 -8.350) 9.891 9.388 ( 0.119 5.301 8.350) 9.891 9.492 ( 1.062 6.016 -9.311) 11.136 9.492 ( -1.062 6.016 9.311) 11.136 9.799 ( 1.408 6.448 -13.114) 14.681 9.799 ( -1.408 6.448 13.114) 14.681 10.279 ( 0.734 -0.382 -5.009) 5.077 10.279 ( -0.734 -0.382 5.009) 5.077 10.507 ( -2.464 3.697 -7.235) 8.490 10.507 ( 2.464 3.697 7.235) 8.490 10.861 ( 1.771 10.838 -2.819) 11.338 10.861 ( -1.771 10.838 2.819) 11.338 11.179 ( -9.514 11.661 -4.671) 15.757 11.179 ( 9.514 11.661 4.671) 15.757 11.412 ( -3.702 10.392 -3.218) 11.491 11.412 ( 3.702 10.392 3.218) 11.491 11.511 ( -2.056 15.692 -3.302) 16.167 11.511 ( 2.056 15.692 3.302) 16.167 11.673 ( -0.195 10.907 -6.254) 12.574 11.673 ( 0.195 10.907 6.254) 12.574 12.052 ( -3.810 6.341 -2.858) 7.930 12.052 ( 3.810 6.341 2.858) 7.930 12.577 ( 1.786 0.123 -7.806) 8.009 12.577 ( -1.786 0.123 7.806) 8.009 12.895 ( -2.053 -0.958 -2.472) 3.353 12.895 ( 2.053 -0.958 2.472) 3.353 13.053 ( -9.079 -12.173 -4.452) 15.825 13.053 ( 9.079 -12.173 4.452) 15.825 14.289 ( -7.557 2.743 -1.276) 8.140 14.289 ( 7.557 2.743 1.276) 8.140 14.473 ( -2.144 0.138 0.000) 2.148 14.473 ( 2.144 0.138 -0.000) 2.148 15.717 ( 0.294 1.605 -2.722) 3.173 15.717 ( -0.294 1.605 2.722) 3.173 15.839 ( -1.163 1.142 -2.738) 3.186 15.839 ( 1.163 1.142 2.738) 3.186 17.842 ( 1.368 1.398 -2.626) 3.274 17.842 ( -1.368 1.398 2.626) 3.274 17.994 ( -1.710 -2.014 -0.002) 2.642 17.994 ( 1.710 -2.014 0.002) 2.642 19.853 ( 1.463 -1.954 -1.503) 2.866 19.853 ( -1.463 -1.954 1.503) 2.866 20.051 ( 1.343 -3.434 -1.834) 4.119 20.051 ( -1.343 -3.434 1.834) 4.119 20.726 ( 0.062 3.805 -0.529) 3.842 20.726 ( -0.062 3.805 0.529) 3.842 20.894 ( 1.817 1.685 -1.853) 3.094 20.894 ( -1.817 1.685 1.853) 3.094 21.930 ( -0.943 11.237 -0.031) 11.277 21.930 ( 0.943 11.237 0.031) 11.277 22.075 ( -0.279 6.469 -3.859) 7.537 22.075 ( 0.279 6.469 3.859) 7.537 24.337 ( 0.396 2.507 -1.122) 2.775 24.337 ( -0.396 2.507 1.122) 2.775 24.468 ( 0.458 0.417 -1.912) 2.009 24.468 ( -0.458 0.417 1.912) 2.009 30.204 ( 0.127 0.016 -1.958) 1.962 30.204 ( -0.127 0.016 1.958) 1.962 30.232 ( 0.875 -0.606 -1.949) 2.221 30.232 ( -0.875 -0.606 1.949) 2.221 34.278 ( 3.590 -1.012 -2.412) 4.442 34.278 ( -3.590 -1.012 2.412) 4.442 34.684 ( -1.071 -7.258 -10.126) 12.504 34.684 ( 1.071 -7.258 10.126) 12.504 36.740 ( -0.305 -6.706 -1.991) 7.002 36.740 ( 0.305 -6.706 1.991) 7.002 36.963 ( -0.716 -10.627 -2.733) 10.996 36.963 ( 0.716 -10.627 2.733) 10.996 40.774 ( 1.371 -3.013 -2.057) 3.897 40.774 ( -1.371 -3.013 2.057) 3.897 41.245 ( -9.139 -8.528 -7.034) 14.343 41.245 ( 9.139 -8.528 7.034) 14.343 41.473 ( 0.850 -10.731 -2.342) 11.016 41.473 ( -0.850 -10.731 2.342) 11.016 42.120 ( -10.500 -22.204 1.120) 24.588 42.120 ( 10.500 -22.204 -1.120) 24.588 ======================= Grid point 271 (116/126) ======================= q-point: ( 0.17 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.563 ( 1.669 13.368 -3.246) 13.857 4.625 ( 1.367 13.326 5.573) 14.509 5.018 ( -2.109 17.068 -10.859) 20.339 5.149 ( -9.693 8.763 2.604) 13.324 5.235 ( 0.714 8.291 12.223) 14.786 5.307 ( -11.256 9.898 -0.363) 14.993 5.499 ( -5.212 8.493 -0.661) 9.986 5.567 ( -3.330 10.129 -1.471) 10.763 5.671 ( 2.426 3.308 -3.509) 5.398 5.721 ( -6.697 11.422 3.005) 13.577 5.824 ( 0.773 5.143 -2.405) 5.730 6.068 ( 5.138 2.293 -0.026) 5.626 6.390 ( 0.619 10.863 -7.294) 13.099 6.535 ( 5.417 3.172 -1.795) 6.529 6.612 ( -5.144 10.406 -4.382) 12.407 6.805 ( -0.618 1.881 1.438) 2.447 6.946 ( -0.508 -3.464 6.155) 7.081 7.108 ( -1.974 0.279 4.128) 4.585 7.199 ( 9.417 -2.551 3.542) 10.379 7.341 ( -3.601 -4.120 -10.369) 11.724 7.463 ( 7.179 -6.821 -3.704) 10.573 7.705 ( 6.765 -4.290 4.252) 9.069 7.834 ( 2.046 -3.090 9.439) 10.140 7.859 ( 2.639 1.675 -3.077) 4.386 8.139 ( -0.220 13.978 4.291) 14.624 8.239 ( 5.141 9.599 1.381) 10.976 8.402 ( -8.503 9.438 6.661) 14.344 8.531 ( -3.244 7.089 -3.924) 8.728 8.783 ( 5.740 2.790 -3.778) 7.417 8.881 ( 6.779 -2.107 2.315) 7.467 9.060 ( -4.523 4.711 2.011) 6.834 9.127 ( 0.491 -2.577 -2.315) 3.498 9.334 ( -1.161 3.706 -6.808) 7.838 9.431 ( 0.827 5.351 -0.403) 5.430 9.452 ( -1.164 4.719 -6.346) 7.994 9.509 ( -0.555 6.258 4.760) 7.882 9.794 ( 2.191 7.182 -0.327) 7.516 9.858 ( 2.430 3.176 -2.022) 4.480 10.231 ( -7.030 7.278 5.539) 11.535 10.256 ( 0.302 -1.807 1.176) 2.177 10.443 ( 0.361 6.219 -5.397) 8.243 10.600 ( 2.684 0.619 0.952) 2.914 10.852 ( -0.355 13.548 5.541) 14.642 10.907 ( 0.422 7.955 1.025) 8.032 10.994 ( -6.972 6.804 -3.070) 10.214 11.335 ( -1.894 8.381 2.326) 8.901 11.348 ( -6.132 10.387 -1.288) 12.131 11.397 ( 8.501 22.593 0.727) 24.150 11.529 ( 4.508 13.982 0.029) 14.691 11.558 ( 0.525 9.437 -2.596) 9.801 11.677 ( 2.748 9.023 -1.427) 9.539 11.744 ( 4.011 16.167 2.878) 16.904 11.972 ( -2.236 4.290 -2.798) 5.588 12.089 ( -0.683 6.538 -0.663) 6.607 12.401 ( -11.929 0.164 2.684) 12.228 12.614 ( -5.257 1.645 1.229) 5.644 12.795 ( 0.574 -1.308 -5.457) 5.641 12.917 ( -0.517 -3.383 4.779) 5.878 13.007 ( 3.761 -4.087 -2.830) 6.233 13.283 ( 7.844 -9.182 0.634) 12.093 14.162 ( -3.075 2.223 -0.149) 3.797 14.399 ( 3.017 0.105 -0.068) 3.020 14.437 ( -1.060 0.033 1.585) 1.907 14.553 ( 5.019 -1.738 0.203) 5.316 15.696 ( -0.614 1.396 0.239) 1.543 15.736 ( 0.707 0.311 -2.166) 2.299 15.808 ( -0.690 2.339 -0.383) 2.469 15.870 ( 0.464 0.861 1.759) 2.013 17.816 ( -1.230 1.787 1.203) 2.480 17.879 ( 2.640 0.695 -1.667) 3.198 17.952 ( -2.816 -1.256 0.125) 3.086 18.011 ( 0.129 -2.351 0.164) 2.361 19.838 ( -0.597 -1.701 0.948) 2.037 19.880 ( 2.034 -2.235 -1.425) 3.341 20.015 ( -3.372 -3.117 1.865) 4.956 20.048 ( -0.839 -3.473 -1.397) 3.836 20.688 ( -2.470 3.996 0.205) 4.702 20.713 ( -2.181 3.618 -0.438) 4.248 20.900 ( 1.481 2.293 1.782) 3.260 20.936 ( 2.827 1.453 -1.539) 3.532 21.913 ( -0.715 11.586 0.053) 11.609 21.941 ( -0.015 11.000 0.199) 11.002 22.065 ( 1.260 7.046 -3.600) 8.012 22.103 ( 0.560 5.542 3.336) 6.493 24.337 ( 0.077 2.129 0.455) 2.179 24.345 ( 0.824 2.643 -0.694) 2.854 24.453 ( -1.320 0.728 0.035) 1.508 24.464 ( -0.873 0.152 0.322) 0.942 30.195 ( -0.001 -0.034 -1.348) 1.348 30.210 ( -0.333 0.115 1.099) 1.154 30.225 ( -0.308 -0.567 1.463) 1.599 30.242 ( 0.723 -0.625 -1.142) 1.489 34.238 ( -1.628 -0.937 2.641) 3.241 34.361 ( 5.788 -2.258 -1.722) 6.447 34.562 ( -5.915 -4.984 -5.288) 9.370 34.746 ( -0.235 -7.853 4.914) 9.267 36.711 ( -0.975 -5.770 1.241) 5.982 36.778 ( 1.352 -7.793 -0.697) 7.940 36.914 ( -1.090 -9.524 0.809) 9.620 37.026 ( 3.210 -12.310 -1.920) 12.866 40.775 ( 1.095 -5.272 0.874) 5.455 40.800 ( 1.889 -2.199 -3.607) 4.627 41.057 ( -5.539 -5.183 -5.087) 9.134 41.316 ( 0.272 -7.317 -3.745) 8.225 41.476 ( -1.017 -5.786 5.041) 7.741 41.653 ( 10.548 -18.644 10.196) 23.724 41.867 ( -13.636 -20.360 2.612) 24.643 42.291 ( 7.736 -24.471 -6.478) 26.470 ======================= Grid point 272 (117/126) ======================= q-point: ( 0.33 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.583 ( 1.330 14.002 -2.211) 14.238 4.657 ( -0.786 11.942 4.769) 12.883 4.975 ( 1.096 26.391 -6.315) 27.158 5.016 ( -10.149 13.449 2.860) 17.090 5.058 ( -2.578 3.727 -0.538) 4.564 5.320 ( -1.007 9.542 3.367) 10.169 5.416 ( -10.414 12.868 1.223) 16.600 5.462 ( -2.555 13.142 3.089) 13.740 5.606 ( -1.816 4.936 3.990) 6.602 5.714 ( 2.635 3.008 -6.213) 7.389 5.877 ( 4.183 2.304 1.542) 5.019 6.098 ( -0.244 -0.209 -8.332) 8.339 6.327 ( -5.993 15.027 3.494) 16.551 6.407 ( -4.957 13.652 -13.299) 19.693 6.735 ( 8.570 3.656 4.067) 10.166 6.835 ( 2.532 0.422 2.454) 3.552 6.950 ( -1.475 -0.483 -1.495) 2.155 7.083 ( -3.391 -3.469 7.451) 8.891 7.178 ( -0.320 -0.573 -5.290) 5.330 7.465 ( -0.236 -6.786 2.108) 7.110 7.543 ( 10.386 -3.973 -1.860) 11.275 7.750 ( 0.566 -1.573 -4.109) 4.436 7.919 ( 4.847 0.163 2.117) 5.292 7.997 ( 6.418 0.436 7.388) 9.796 8.154 ( -0.878 7.185 9.510) 11.951 8.234 ( -2.442 -2.506 -1.478) 3.798 8.392 ( 0.739 8.349 -1.391) 8.496 8.528 ( 5.162 6.716 -5.667) 10.192 8.841 ( 0.231 -2.716 3.894) 4.753 8.963 ( 2.096 -1.198 6.948) 7.355 9.030 ( 0.461 5.477 0.692) 5.540 9.113 ( -0.496 -1.171 -6.695) 6.815 9.285 ( -1.403 4.684 -3.976) 6.302 9.391 ( -4.504 5.621 -3.137) 7.856 9.424 ( 1.934 3.830 -3.906) 5.802 9.511 ( -1.919 4.936 3.692) 6.456 9.781 ( -2.284 5.253 3.969) 6.969 9.907 ( 1.487 -1.436 -4.507) 4.958 10.150 ( 1.178 12.311 -2.003) 12.528 10.324 ( 4.685 6.165 1.732) 7.935 10.436 ( -1.006 4.130 -3.081) 5.250 10.571 ( -5.784 4.063 0.433) 7.082 10.822 ( -4.209 9.163 4.313) 10.967 10.901 ( 1.846 8.276 2.804) 8.931 10.971 ( 1.255 7.509 -0.594) 7.636 11.196 ( -7.419 13.382 -3.807) 15.767 11.352 ( 0.940 5.393 6.721) 8.668 11.474 ( -1.335 11.566 -5.929) 13.066 11.590 ( 6.644 14.862 -3.900) 16.740 11.636 ( 6.351 16.023 2.872) 17.473 11.744 ( 3.149 6.689 3.046) 7.996 11.826 ( 3.789 17.425 3.165) 18.111 11.892 ( -5.956 6.890 -2.302) 9.394 12.073 ( -2.104 7.139 -5.071) 9.006 12.247 ( -1.546 1.490 2.798) 3.527 12.503 ( -7.576 5.806 3.423) 10.140 12.819 ( 3.608 1.279 -6.866) 7.861 12.917 ( -2.281 -2.510 3.385) 4.792 13.081 ( 5.293 -1.106 -2.309) 5.880 13.290 ( -5.735 -1.918 1.706) 6.283 14.206 ( 6.382 -1.524 -0.497) 6.580 14.400 ( -3.139 -1.487 1.466) 3.771 14.472 ( 4.874 -3.750 -0.254) 6.155 14.613 ( 0.434 -4.071 0.906) 4.193 15.699 ( 0.340 0.242 1.307) 1.372 15.727 ( 0.004 0.248 -2.731) 2.743 15.812 ( 0.999 2.193 -0.003) 2.410 15.868 ( -1.254 1.040 0.858) 1.841 17.813 ( 0.504 1.689 0.694) 1.894 17.891 ( -2.676 0.210 -0.295) 2.700 17.927 ( 2.264 -0.670 -1.022) 2.573 18.000 ( -1.409 -2.139 0.459) 2.602 19.844 ( 1.140 -1.680 0.176) 2.038 19.909 ( 1.358 -2.419 -0.980) 2.942 19.958 ( -3.093 -2.668 1.633) 4.399 20.013 ( -2.239 -3.197 -0.845) 3.994 20.653 ( -1.345 4.126 0.215) 4.345 20.669 ( -2.036 3.887 -0.308) 4.399 20.941 ( 1.752 2.362 1.641) 3.368 20.968 ( 1.368 1.667 -1.532) 2.645 21.907 ( 0.154 11.694 -0.079) 11.695 21.932 ( -0.892 11.160 0.174) 11.197 22.084 ( 2.335 6.661 -3.099) 7.709 22.119 ( -0.534 5.217 2.988) 6.036 24.345 ( 0.672 1.822 0.436) 1.991 24.359 ( 0.954 2.383 -0.782) 2.683 24.426 ( -1.312 0.774 -0.079) 1.526 24.443 ( -1.603 0.279 0.541) 1.715 30.192 ( 0.348 -0.024 -1.303) 1.349 30.203 ( -0.822 -0.019 1.235) 1.484 30.233 ( 0.281 -0.364 1.167) 1.254 30.246 ( 0.276 -0.574 -1.028) 1.210 34.246 ( 1.158 -1.539 2.682) 3.302 34.401 ( -4.317 -5.333 -2.016) 7.152 34.503 ( 5.880 -1.432 -3.763) 7.127 34.719 ( -4.736 -6.735 3.522) 8.955 36.716 ( 0.349 -5.570 2.593) 6.154 36.770 ( -0.830 -7.145 -2.543) 7.630 36.942 ( 2.473 -10.850 3.447) 11.650 37.047 ( 0.430 -13.190 -4.021) 13.796 40.776 ( -0.170 -4.197 -0.867) 4.289 40.825 ( 1.222 -2.831 -3.063) 4.346 41.037 ( 4.776 -5.238 0.810) 7.134 41.323 ( 2.333 -7.542 -0.823) 7.937 41.457 ( -3.157 -5.245 2.742) 6.708 41.518 ( -15.264 -14.594 -5.330) 21.780 41.996 ( 10.720 -24.373 17.282) 31.743 42.331 ( 0.994 -25.862 -10.863) 28.069 ======================= Grid point 273 (118/126) ======================= q-point: ( 0.50 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.617 ( 4.692 14.865 -5.064) 16.389 4.617 ( -4.692 14.865 5.064) 16.389 4.946 ( -0.140 13.534 -3.154) 13.898 4.946 ( 0.140 13.534 3.154) 13.898 5.163 ( -8.175 13.753 -4.551) 16.634 5.163 ( 8.175 13.753 4.551) 16.634 5.391 ( -2.599 15.130 -2.744) 15.594 5.391 ( 2.599 15.130 2.744) 15.594 5.682 ( 2.165 0.276 -19.679) 19.800 5.682 ( -2.165 0.276 19.679) 19.800 5.989 ( -3.953 0.085 -10.205) 10.944 5.989 ( 3.953 0.085 10.205) 10.944 6.300 ( 0.470 17.475 -11.428) 20.885 6.300 ( -0.470 17.475 11.428) 20.885 6.870 ( -1.438 -0.185 -0.566) 1.557 6.870 ( 1.438 -0.185 0.566) 1.557 6.953 ( 1.467 0.014 -3.701) 3.981 6.953 ( -1.467 0.014 3.701) 3.981 7.324 ( -9.521 -2.416 -4.699) 10.889 7.324 ( 9.521 -2.416 4.699) 10.889 7.707 ( -0.854 -3.991 -9.824) 10.638 7.707 ( 0.854 -3.991 9.824) 10.638 8.020 ( -0.525 3.892 -6.745) 7.805 8.020 ( 0.525 3.892 6.745) 7.805 8.198 ( 1.224 -2.670 -10.066) 10.486 8.198 ( -1.224 -2.670 10.066) 10.486 8.471 ( -6.232 4.971 -4.425) 9.118 8.471 ( 6.232 4.971 4.425) 9.118 8.941 ( -5.010 -5.478 -7.141) 10.300 8.941 ( 5.010 -5.478 7.141) 10.300 9.067 ( -2.319 2.648 -6.370) 7.278 9.067 ( 2.319 2.648 6.370) 7.278 9.282 ( -0.086 8.486 -6.735) 10.834 9.282 ( 0.086 8.486 6.735) 10.834 9.473 ( 3.837 2.464 -4.369) 6.315 9.473 ( -3.837 2.464 4.369) 6.315 9.827 ( 0.124 3.708 -6.072) 7.116 9.827 ( -0.124 3.708 6.072) 7.116 10.281 ( 4.675 7.157 -5.112) 9.960 10.281 ( -4.675 7.157 5.112) 9.960 10.457 ( 6.367 8.108 -3.027) 10.745 10.457 ( -6.367 8.108 3.027) 10.745 10.859 ( -2.878 4.419 -8.303) 9.836 10.859 ( 2.878 4.419 8.303) 9.836 11.056 ( -4.947 13.345 -6.855) 15.797 11.056 ( 4.947 13.345 6.855) 15.797 11.412 ( -0.662 6.060 -10.238) 11.915 11.412 ( 0.662 6.060 10.238) 11.915 11.683 ( -0.380 13.350 -3.499) 13.806 11.683 ( 0.380 13.350 3.499) 13.806 11.797 ( 0.863 11.763 -3.649) 12.346 11.797 ( -0.863 11.763 3.649) 12.346 11.941 ( -6.580 10.341 -5.168) 13.302 11.941 ( 6.580 10.341 5.168) 13.302 12.361 ( -3.668 6.213 -2.170) 7.535 12.361 ( 3.668 6.213 2.170) 7.535 12.865 ( 3.479 -0.125 -6.208) 7.118 12.865 ( -3.479 -0.125 6.208) 7.118 13.177 ( 6.424 0.354 -2.757) 7.000 13.177 ( -6.424 0.354 2.757) 7.000 14.321 ( -0.844 -2.496 -2.782) 3.832 14.321 ( 0.844 -2.496 2.782) 3.832 14.571 ( -2.256 -5.309 -1.261) 5.905 14.571 ( 2.256 -5.309 1.261) 5.905 15.714 ( 0.021 0.065 -2.315) 2.316 15.714 ( -0.021 0.065 2.315) 2.316 15.839 ( -0.555 1.489 -0.254) 1.609 15.839 ( 0.555 1.489 0.254) 1.609 17.841 ( -2.247 1.050 -0.289) 2.497 17.841 ( 2.247 1.050 0.289) 2.497 17.968 ( 0.434 -1.451 -0.788) 1.707 17.968 ( -0.434 -1.451 0.788) 1.707 19.881 ( -2.812 -2.006 0.450) 3.483 19.881 ( 2.812 -2.006 -0.450) 3.483 19.968 ( -1.257 -2.822 -1.214) 3.319 19.968 ( 1.257 -2.822 1.214) 3.319 20.645 ( -0.390 4.113 -0.252) 4.139 20.645 ( 0.390 4.113 0.252) 4.139 20.969 ( -0.355 2.060 -1.673) 2.678 20.969 ( 0.355 2.060 1.673) 2.678 21.916 ( -0.444 11.495 -0.049) 11.504 21.916 ( 0.444 11.495 0.049) 11.504 22.110 ( 1.779 5.768 -3.164) 6.815 22.110 ( -1.779 5.768 3.164) 6.815 24.361 ( -0.451 1.904 -0.689) 2.074 24.361 ( 0.451 1.904 0.689) 2.074 24.419 ( 0.409 0.626 -1.164) 1.384 24.419 ( -0.409 0.626 1.164) 1.384 30.195 ( 0.749 -0.018 -2.230) 2.353 30.195 ( -0.749 -0.018 2.230) 2.353 30.243 ( 0.524 -0.441 -2.702) 2.788 30.243 ( -0.524 -0.441 2.702) 2.788 34.304 ( -2.627 -2.798 -4.127) 5.636 34.304 ( 2.627 -2.798 4.127) 5.636 34.621 ( 1.328 -4.481 -2.965) 5.534 34.621 ( -1.328 -4.481 2.965) 5.534 36.741 ( -0.491 -6.090 -3.553) 7.067 36.741 ( 0.491 -6.090 3.553) 7.067 37.008 ( -1.563 -12.600 -5.555) 13.858 37.008 ( 1.563 -12.600 5.555) 13.858 40.796 ( -0.301 -2.458 -5.466) 6.001 40.796 ( 0.301 -2.458 5.466) 6.001 41.221 ( -12.570 -10.740 -4.473) 17.128 41.221 ( 12.570 -10.740 4.473) 17.128 41.396 ( 2.413 -6.005 -0.873) 6.531 41.396 ( -2.413 -6.005 0.873) 6.531 42.226 ( -5.671 -25.922 -14.977) 30.470 42.226 ( 5.671 -25.922 14.977) 30.470 ======================= Grid point 277 (119/126) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.789 ( -1.096 7.074 -4.822) 8.631 4.789 ( 1.096 7.074 4.822) 8.631 5.193 ( -1.065 1.447 -12.509) 12.637 5.193 ( 1.065 1.447 12.509) 12.637 5.484 ( 2.429 3.495 -3.024) 5.221 5.484 ( -2.429 3.495 3.024) 5.221 5.665 ( 0.596 -0.432 -0.681) 1.003 5.665 ( -0.596 -0.432 0.681) 1.003 5.902 ( -0.198 11.621 -0.858) 11.655 5.902 ( 0.198 11.621 0.858) 11.655 6.073 ( 2.369 5.835 -6.209) 8.844 6.073 ( -2.369 5.835 6.209) 8.844 6.581 ( 0.213 8.869 -4.738) 10.057 6.581 ( -0.213 8.869 4.738) 10.057 6.819 ( 3.225 0.548 -6.875) 7.614 6.819 ( -3.225 0.548 6.875) 7.614 6.983 ( -3.273 1.912 -3.367) 5.070 6.983 ( 3.273 1.912 3.367) 5.070 7.179 ( -4.017 -7.570 -4.077) 9.490 7.179 ( 4.017 -7.570 4.077) 9.490 7.409 ( -6.718 -0.876 -3.038) 7.425 7.409 ( 6.718 -0.876 3.038) 7.425 7.768 ( 3.722 -5.873 -2.993) 7.569 7.768 ( -3.722 -5.873 2.993) 7.569 8.362 ( 1.988 6.285 -6.606) 9.332 8.362 ( -1.988 6.285 6.606) 9.332 8.623 ( 1.540 -1.823 -3.315) 4.084 8.623 ( -1.540 -1.823 3.315) 4.084 8.771 ( 1.960 2.403 -5.335) 6.171 8.771 ( -1.960 2.403 5.335) 6.171 9.122 ( 0.239 0.861 -2.788) 2.928 9.122 ( -0.239 0.861 2.788) 2.928 9.429 ( -0.731 1.840 -6.311) 6.614 9.429 ( 0.731 1.840 6.311) 6.614 9.615 ( 1.349 2.624 -6.332) 6.986 9.615 ( -1.349 2.624 6.332) 6.986 9.914 ( 0.214 4.388 -12.006) 12.785 9.914 ( -0.214 4.388 12.006) 12.785 10.219 ( -6.286 -3.471 -3.568) 8.018 10.219 ( 6.286 -3.471 3.568) 8.018 10.656 ( -0.266 9.646 -5.944) 11.334 10.656 ( 0.266 9.646 5.944) 11.334 11.002 ( -0.646 3.799 -2.052) 4.366 11.002 ( 0.646 3.799 2.052) 4.366 11.311 ( -6.738 3.406 -1.997) 7.810 11.311 ( 6.738 3.406 1.997) 7.810 11.520 ( 1.349 -0.988 -3.049) 3.478 11.520 ( -1.349 -0.988 3.049) 3.478 11.785 ( 0.196 12.527 -4.318) 13.252 11.785 ( -0.196 12.527 4.318) 13.252 12.013 ( -0.031 18.895 -3.732) 19.260 12.013 ( 0.031 18.895 3.732) 19.260 12.256 ( -1.392 11.480 -2.298) 11.790 12.256 ( 1.392 11.480 2.298) 11.790 12.590 ( 5.045 1.912 -5.770) 7.900 12.590 ( -5.045 1.912 5.770) 7.900 12.758 ( -10.607 -13.873 -1.429) 17.522 12.758 ( 10.607 -13.873 1.429) 17.522 12.856 ( 0.033 -6.159 -1.294) 6.294 12.856 ( -0.033 -6.159 1.294) 6.294 14.337 ( -4.462 1.999 -1.192) 5.032 14.337 ( 4.462 1.999 1.192) 5.032 14.458 ( -0.584 -1.430 -0.861) 1.768 14.458 ( 0.584 -1.430 0.861) 1.768 15.724 ( 0.594 -0.303 -0.734) 0.991 15.724 ( -0.594 -0.303 0.734) 0.991 15.876 ( -0.766 1.804 -1.165) 2.280 15.876 ( 0.766 1.804 1.165) 2.280 17.868 ( 0.780 1.144 -1.693) 2.187 17.868 ( -0.780 1.144 1.693) 2.187 17.965 ( -0.618 -0.971 -0.577) 1.287 17.965 ( 0.618 -0.971 0.577) 1.287 19.822 ( 0.810 -1.061 -0.839) 1.577 19.822 ( -0.810 -1.061 0.839) 1.577 19.992 ( 0.848 -2.276 -1.093) 2.664 19.992 ( -0.848 -2.276 1.093) 2.664 20.780 ( 0.245 1.684 -0.561) 1.792 20.780 ( -0.245 1.684 0.561) 1.792 20.912 ( 1.089 0.326 -0.835) 1.411 20.912 ( -1.089 0.326 0.835) 1.411 22.107 ( -0.709 6.344 0.013) 6.383 22.107 ( 0.709 6.344 -0.013) 6.383 22.170 ( -0.295 2.859 -1.567) 3.273 22.170 ( 0.295 2.859 1.567) 3.273 24.383 ( -0.062 1.799 -0.710) 1.935 24.383 ( 0.062 1.799 0.710) 1.935 24.476 ( 0.110 0.279 -1.477) 1.507 24.476 ( -0.110 0.279 1.477) 1.507 30.206 ( -0.144 0.205 -1.060) 1.089 30.206 ( 0.144 0.205 1.060) 1.089 30.221 ( 0.577 -0.500 -1.007) 1.264 30.221 ( -0.577 -0.500 1.007) 1.264 34.273 ( -1.348 0.284 0.011) 1.378 34.273 ( 1.348 0.284 -0.011) 1.378 34.569 ( -1.175 -4.113 -5.647) 7.085 34.569 ( 1.175 -4.113 5.647) 7.085 36.642 ( 0.151 -2.963 -1.328) 3.251 36.642 ( -0.151 -2.963 1.328) 3.251 36.789 ( -0.077 -6.371 -1.852) 6.635 36.789 ( 0.077 -6.371 1.852) 6.635 40.738 ( -1.557 -0.667 -1.814) 2.482 40.738 ( 1.557 -0.667 1.814) 2.482 41.083 ( -6.926 -6.901 -7.454) 12.294 41.083 ( 6.926 -6.901 7.454) 12.294 41.372 ( -3.772 0.360 -5.706) 6.849 41.372 ( 3.772 0.360 5.706) 6.849 41.735 ( -9.550 -15.919 -0.891) 18.585 41.735 ( 9.550 -15.919 0.891) 18.585 ======================= Grid point 279 (120/126) ======================= q-point: ( 0.17 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.748 ( -0.696 6.544 -1.206) 6.691 4.845 ( 1.973 5.887 1.925) 6.501 5.116 ( -1.904 3.838 -2.920) 5.185 5.305 ( 2.097 0.310 11.988) 12.174 5.406 ( -5.207 7.468 -0.627) 9.125 5.456 ( -0.984 4.210 -5.238) 6.792 5.635 ( -3.392 3.692 -2.141) 5.452 5.660 ( -2.192 1.676 0.547) 2.813 5.836 ( -2.445 7.045 -0.364) 7.466 5.881 ( -2.538 10.246 -2.666) 10.887 6.009 ( -4.581 8.832 -0.148) 9.951 6.121 ( 2.272 2.084 -6.564) 7.252 6.604 ( 3.034 9.147 -1.526) 9.757 6.615 ( 2.169 6.283 0.404) 6.659 6.785 ( -1.207 6.919 0.285) 7.029 6.840 ( 0.760 -0.200 1.112) 1.361 6.933 ( -1.128 1.909 1.929) 2.939 7.066 ( -2.019 -2.971 0.908) 3.705 7.141 ( 5.752 -2.638 5.442) 8.346 7.197 ( -2.847 -10.594 -4.929) 12.027 7.390 ( 5.002 1.521 2.652) 5.863 7.575 ( 8.985 -5.120 -1.502) 10.450 7.725 ( -2.287 -6.949 5.941) 9.424 7.830 ( 4.228 -5.440 -2.199) 7.232 8.338 ( -2.193 6.366 2.018) 7.029 8.348 ( -5.443 3.813 6.004) 8.956 8.575 ( 1.169 2.274 -2.676) 3.702 8.628 ( -6.647 6.987 0.127) 9.645 8.707 ( 1.974 -6.475 0.411) 6.782 8.832 ( 1.765 -2.739 -2.280) 3.977 9.102 ( -1.380 0.341 0.470) 1.497 9.132 ( -0.619 0.719 2.047) 2.256 9.377 ( -0.796 1.596 -6.828) 7.057 9.453 ( -0.479 -0.202 -3.070) 3.114 9.526 ( -4.022 3.238 0.272) 5.171 9.642 ( -0.876 1.244 0.403) 1.574 9.887 ( 0.538 1.583 -9.466) 9.613 9.919 ( -0.349 2.898 0.979) 3.079 10.234 ( 6.742 2.197 5.228) 8.810 10.349 ( 3.337 2.357 5.529) 6.875 10.601 ( -2.202 8.312 -4.690) 9.795 10.684 ( 0.728 7.893 0.877) 7.975 10.991 ( -0.592 2.688 1.299) 3.044 11.037 ( 1.289 4.754 7.042) 8.594 11.144 ( -9.012 7.060 -0.672) 11.468 11.379 ( 0.973 1.104 -2.500) 2.901 11.461 ( -5.975 -2.236 2.675) 6.918 11.570 ( 3.211 -4.238 -1.908) 5.649 11.756 ( 1.964 13.669 -0.104) 13.810 11.854 ( 2.791 14.412 -7.660) 16.558 12.006 ( 3.415 18.719 1.915) 19.124 12.076 ( 1.136 12.566 3.884) 13.201 12.197 ( -2.776 13.600 0.113) 13.881 12.254 ( -1.125 11.332 -2.485) 11.656 12.410 ( -9.195 0.545 1.384) 9.314 12.634 ( 0.237 0.454 1.427) 1.516 12.748 ( 7.016 -1.534 -3.659) 8.060 12.830 ( -0.980 -5.593 1.829) 5.966 12.911 ( 6.076 -5.839 -2.087) 8.681 13.040 ( 12.586 -14.378 1.969) 19.210 14.222 ( -5.284 3.796 0.090) 6.507 14.377 ( -0.789 -2.301 -0.228) 2.443 14.439 ( -1.720 0.095 1.516) 2.295 14.499 ( 2.544 -3.113 0.360) 4.036 15.707 ( -0.564 0.288 -0.546) 0.836 15.733 ( 0.791 -0.541 -2.277) 2.470 15.856 ( -1.049 2.206 0.498) 2.493 15.891 ( -0.145 0.768 1.557) 1.742 17.851 ( -0.906 1.665 0.923) 2.108 17.891 ( 1.445 0.190 -0.599) 1.575 17.938 ( -1.679 -0.057 -0.532) 1.762 17.975 ( 0.022 -1.407 -0.006) 1.407 19.814 ( -0.172 -0.543 0.572) 0.807 19.841 ( 1.467 -1.596 -0.688) 2.274 19.964 ( -2.661 -1.788 1.060) 3.376 19.985 ( -1.011 -2.612 -0.910) 2.944 20.747 ( -2.321 1.967 0.211) 3.050 20.761 ( -2.162 1.318 -0.293) 2.549 20.929 ( 2.052 0.897 0.776) 2.370 20.948 ( 2.613 0.002 -0.705) 2.706 22.095 ( -0.442 6.557 0.011) 6.571 22.116 ( 0.001 6.353 0.138) 6.354 22.165 ( 0.729 2.856 -1.626) 3.367 22.185 ( 0.406 2.491 1.459) 2.915 24.378 ( -0.021 1.838 -0.224) 1.852 24.392 ( 0.517 1.648 0.278) 1.749 24.462 ( -0.932 0.339 -1.344) 1.671 24.471 ( -1.081 0.263 1.318) 1.725 30.197 ( -0.216 0.185 -0.609) 0.672 30.209 ( -0.593 -0.286 0.499) 0.826 30.220 ( 0.402 0.042 0.797) 0.894 30.231 ( 0.662 -0.455 -0.656) 1.037 34.237 ( -1.552 0.849 1.078) 2.072 34.317 ( 1.776 -2.359 -0.457) 2.988 34.505 ( -1.761 -0.538 -3.390) 3.858 34.616 ( 0.559 -5.259 2.939) 6.051 36.627 ( -0.474 -2.502 0.752) 2.655 36.659 ( 0.573 -4.018 -0.689) 4.117 36.765 ( -0.532 -4.939 0.697) 5.016 36.824 ( 1.681 -7.619 -0.949) 7.859 40.704 ( -0.296 -1.755 -1.021) 2.052 40.752 ( -0.365 -2.782 -2.348) 3.658 41.017 ( 1.071 1.541 -0.185) 1.886 41.224 ( -0.596 -2.164 -1.188) 2.540 41.335 ( 6.353 -11.336 6.391) 14.482 41.441 ( 1.171 -0.225 3.303) 3.512 41.527 ( -11.486 -11.946 -2.228) 16.721 41.866 ( 5.002 -17.734 -2.774) 18.633 ======================= Grid point 280 (121/126) ======================= q-point: ( 0.33 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.758 ( 1.844 5.703 0.947) 6.068 4.861 ( -0.724 4.969 -0.931) 5.107 5.099 ( 0.434 5.740 1.072) 5.855 5.248 ( -7.875 7.263 3.077) 11.146 5.397 ( 2.010 8.878 -2.983) 9.579 5.495 ( 2.534 0.555 2.162) 3.377 5.545 ( -2.544 11.572 1.919) 12.003 5.609 ( -1.655 5.069 3.534) 6.397 5.805 ( -4.459 6.967 -4.744) 9.536 5.821 ( -0.671 7.657 -6.193) 9.870 5.927 ( -2.655 4.117 3.271) 5.890 6.078 ( -2.503 -1.371 -8.127) 8.613 6.584 ( -0.701 10.986 0.365) 11.015 6.709 ( -0.821 13.475 -5.732) 14.666 6.756 ( 2.842 0.387 5.781) 6.454 6.872 ( 1.475 1.907 -0.407) 2.445 6.953 ( 1.231 1.620 0.283) 2.054 7.006 ( -5.328 -3.751 5.505) 8.530 7.162 ( 4.089 -1.817 -4.601) 6.418 7.296 ( 5.212 -9.654 2.885) 11.344 7.489 ( 4.474 0.240 0.429) 4.501 7.656 ( 1.417 -4.716 -4.701) 6.808 7.758 ( 1.396 -11.084 13.451) 17.485 7.913 ( 5.567 -8.821 -5.707) 11.890 8.259 ( -4.592 4.574 4.788) 8.058 8.302 ( -3.153 5.163 2.056) 6.390 8.489 ( -4.448 2.018 -1.242) 5.040 8.624 ( -1.850 0.515 -5.578) 5.899 8.726 ( 2.325 -4.078 4.773) 6.695 8.852 ( 0.841 -5.198 0.847) 5.333 9.082 ( -0.231 0.046 -1.569) 1.586 9.112 ( -2.542 -0.938 1.870) 3.292 9.345 ( 0.272 1.255 -4.047) 4.245 9.397 ( -1.864 -1.688 -3.995) 4.721 9.508 ( 0.555 3.663 -0.023) 3.705 9.590 ( -4.425 0.265 2.277) 4.984 9.875 ( 3.969 5.064 -8.467) 10.635 9.947 ( 0.573 3.202 1.405) 3.543 10.318 ( 0.551 4.788 0.685) 4.868 10.430 ( 0.654 1.433 5.270) 5.500 10.555 ( 2.168 9.750 -3.846) 10.703 10.696 ( 0.093 7.041 -0.006) 7.042 10.975 ( -2.496 3.303 -1.196) 4.309 11.002 ( -5.101 6.456 1.731) 8.408 11.129 ( 3.548 6.216 10.186) 12.449 11.347 ( -3.512 4.310 -6.556) 8.596 11.404 ( 0.286 -2.455 6.768) 7.205 11.563 ( -1.325 -2.735 -7.249) 7.861 11.804 ( 1.381 7.474 1.564) 7.760 11.838 ( -0.195 11.029 -4.420) 11.883 12.055 ( -0.834 11.927 2.016) 12.125 12.081 ( -2.892 5.101 1.797) 6.133 12.200 ( 1.555 16.274 0.374) 16.353 12.228 ( 3.498 13.397 0.605) 13.860 12.398 ( 5.626 13.103 -1.790) 14.372 12.629 ( -2.594 5.168 1.679) 6.022 12.817 ( 3.205 -0.787 -7.802) 8.471 12.841 ( -0.005 -3.975 5.648) 6.906 13.030 ( 7.534 -3.892 -2.150) 8.748 13.179 ( 1.303 -9.284 1.764) 9.539 14.192 ( 2.229 0.861 -0.092) 2.391 14.343 ( -3.400 -4.269 1.002) 5.549 14.417 ( 0.001 -1.229 0.601) 1.368 14.515 ( -1.491 -5.188 0.492) 5.420 15.706 ( 0.674 0.663 -0.464) 1.053 15.734 ( 0.321 0.016 -1.942) 1.968 15.845 ( -0.291 1.352 0.525) 1.480 15.882 ( -1.509 0.098 1.114) 1.878 17.847 ( 0.164 1.699 0.779) 1.877 17.897 ( -1.687 -0.232 -0.254) 1.722 17.920 ( 1.270 0.402 -0.684) 1.498 17.966 ( -0.902 -1.390 -0.047) 1.657 19.823 ( 1.100 -0.273 0.173) 1.146 19.867 ( 1.705 -1.837 -0.521) 2.560 19.913 ( -3.110 -1.405 1.029) 3.564 19.952 ( -2.085 -2.732 -0.652) 3.498 20.713 ( -1.331 1.974 0.195) 2.389 20.722 ( -1.691 1.554 -0.223) 2.308 20.970 ( 1.748 0.813 0.697) 2.050 20.984 ( 1.479 0.149 -0.676) 1.633 22.092 ( 0.142 6.689 -0.096) 6.691 22.109 ( -0.635 6.413 0.159) 6.446 22.178 ( 1.326 2.660 -1.550) 3.352 22.194 ( -0.143 2.209 1.468) 2.656 24.382 ( 0.564 1.734 0.054) 1.824 24.404 ( 0.670 1.618 0.052) 1.752 24.434 ( -1.229 0.302 -1.062) 1.652 24.452 ( -1.522 0.299 0.984) 1.837 30.193 ( 0.097 0.115 -0.532) 0.553 30.201 ( -0.540 -0.203 0.517) 0.775 30.231 ( 0.346 0.035 0.700) 0.782 30.238 ( 0.350 -0.312 -0.654) 0.804 34.231 ( 0.300 0.138 1.418) 1.455 34.309 ( -2.079 -3.748 -1.181) 4.446 34.504 ( 2.949 1.197 -2.153) 3.843 34.612 ( -2.198 -4.184 2.026) 5.143 36.633 ( 0.365 -2.627 1.488) 3.041 36.657 ( -0.116 -3.995 -1.161) 4.162 36.777 ( 1.007 -5.332 1.625) 5.664 36.832 ( -0.003 -7.926 -2.116) 8.203 40.713 ( 1.369 -1.790 0.648) 2.345 40.762 ( 2.447 -3.409 -0.717) 4.257 41.008 ( -1.778 2.196 -2.744) 3.939 41.232 ( 1.677 -1.920 0.996) 2.737 41.264 ( -8.703 -9.105 -4.698) 13.443 41.432 ( -2.905 1.242 1.863) 3.668 41.588 ( 9.432 -15.387 11.318) 21.303 41.884 ( -0.636 -18.548 -6.679) 19.724 ======================= Grid point 281 (122/126) ======================= q-point: ( 0.50 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.815 ( -3.173 5.479 -1.603) 6.531 4.815 ( 3.173 5.479 1.603) 6.531 5.143 ( -0.894 6.434 -3.110) 7.201 5.143 ( 0.894 6.434 3.110) 7.201 5.430 ( -1.258 11.520 -1.080) 11.639 5.430 ( 1.258 11.520 1.080) 11.639 5.643 ( -1.003 2.758 -8.662) 9.146 5.643 ( 1.003 2.758 8.662) 9.146 5.721 ( -0.460 9.379 -7.885) 12.262 5.721 ( 0.460 9.379 7.885) 12.262 5.981 ( -2.740 -0.985 -7.826) 8.350 5.981 ( 2.740 -0.985 7.826) 8.350 6.619 ( -0.220 12.993 -7.240) 14.876 6.619 ( 0.220 12.993 7.240) 14.876 6.855 ( -2.358 -1.181 -5.427) 6.034 6.855 ( 2.358 -1.181 5.427) 6.034 6.959 ( 1.621 2.496 -4.428) 5.335 6.959 ( -1.621 2.496 4.428) 5.335 7.273 ( -6.059 -4.082 -2.035) 7.584 7.273 ( 6.059 -4.082 2.035) 7.584 7.595 ( 0.131 -4.715 -8.495) 9.717 7.595 ( -0.131 -4.715 8.495) 9.717 7.886 ( -2.273 -11.763 -15.269) 19.408 7.886 ( 2.273 -11.763 15.269) 19.408 8.258 ( 0.262 4.747 -4.586) 6.606 8.258 ( -0.262 4.747 4.586) 6.606 8.498 ( -5.267 -1.730 -1.999) 5.894 8.498 ( 5.267 -1.730 1.999) 5.893 8.825 ( -3.826 -3.344 -1.358) 5.260 8.825 ( 3.826 -3.344 1.358) 5.260 9.082 ( 2.258 -0.897 -7.566) 7.946 9.082 ( -2.258 -0.897 7.566) 7.946 9.356 ( 1.854 -0.133 -8.020) 8.233 9.356 ( -1.854 -0.133 8.020) 8.233 9.533 ( 2.139 2.437 -1.754) 3.686 9.533 ( -2.139 2.437 1.754) 3.686 9.925 ( 4.779 5.593 -8.206) 11.021 9.925 ( -4.779 5.593 8.206) 11.021 10.365 ( 5.417 1.701 -5.568) 7.952 10.365 ( -5.417 1.701 5.568) 7.952 10.652 ( -1.615 9.046 0.291) 9.194 10.652 ( 1.615 9.046 -0.291) 9.194 10.949 ( -0.281 4.611 -4.336) 6.336 10.949 ( 0.281 4.611 4.336) 6.336 11.245 ( -3.447 6.233 -9.922) 12.214 11.245 ( 3.447 6.233 9.922) 12.214 11.479 ( -1.739 -1.545 -11.285) 11.522 11.479 ( 1.739 -1.545 11.285) 11.522 11.821 ( -0.333 6.759 -1.088) 6.854 11.821 ( 0.333 6.759 1.088) 6.854 12.045 ( -0.491 6.299 -0.305) 6.325 12.045 ( 0.491 6.299 0.305) 6.325 12.252 ( -1.674 18.006 -1.983) 18.193 12.252 ( 1.674 18.006 1.983) 18.193 12.534 ( -1.508 9.262 -5.195) 10.726 12.534 ( 1.508 9.262 5.195) 10.726 12.840 ( 2.932 -1.190 -8.597) 9.161 12.840 ( -2.932 -1.190 8.597) 9.161 13.140 ( 2.042 -4.349 -3.824) 6.140 13.140 ( -2.042 -4.349 3.824) 6.140 14.266 ( -1.563 -2.494 -1.092) 3.139 14.266 ( 1.563 -2.494 1.092) 3.139 14.460 ( -2.548 -5.060 -0.964) 5.747 14.460 ( 2.548 -5.060 0.964) 5.747 15.723 ( -0.058 0.648 -1.563) 1.693 15.723 ( 0.058 0.648 1.563) 1.693 15.856 ( -0.180 0.253 -0.191) 0.365 15.856 ( 0.180 0.253 0.191) 0.365 17.865 ( -1.364 1.162 -0.582) 1.884 17.865 ( 1.364 1.162 0.582) 1.884 17.945 ( -0.386 -0.899 -0.671) 1.187 17.945 ( 0.386 -0.899 0.671) 1.187 19.856 ( -2.261 -0.379 0.095) 2.295 19.856 ( 2.261 -0.379 -0.095) 2.295 19.911 ( -1.682 -2.666 -0.699) 3.229 19.911 ( 1.682 -2.666 0.699) 3.229 20.704 ( -0.192 1.833 -0.221) 1.856 20.704 ( 0.192 1.833 0.221) 1.856 20.992 ( -0.235 0.483 -0.680) 0.867 20.992 ( 0.235 0.483 0.680) 0.867 22.098 ( -0.189 6.601 -0.029) 6.603 22.098 ( 0.189 6.601 0.029) 6.603 22.192 ( 0.888 2.316 -1.492) 2.894 22.192 ( -0.888 2.316 1.492) 2.894 24.399 ( -0.838 1.682 -0.565) 1.962 24.399 ( 0.838 1.682 0.565) 1.962 24.430 ( 1.104 0.261 -0.634) 1.299 24.430 ( -1.104 0.261 0.634) 1.299 30.195 ( 0.380 -0.024 -1.154) 1.216 30.195 ( -0.380 -0.024 1.154) 1.216 30.237 ( 0.249 -0.121 -1.385) 1.412 30.237 ( -0.249 -0.121 1.385) 1.412 34.260 ( -1.311 -1.539 -2.395) 3.134 34.260 ( 1.311 -1.539 2.395) 3.134 34.563 ( 1.152 -1.580 -1.787) 2.649 34.563 ( -1.152 -1.580 1.787) 2.649 36.647 ( -0.137 -3.147 -1.748) 3.603 36.647 ( 0.137 -3.147 1.748) 3.603 36.808 ( -0.856 -6.989 -2.900) 7.615 36.808 ( 0.856 -6.989 2.900) 7.615 40.761 ( -1.759 -1.045 -3.446) 4.008 40.761 ( 1.759 -1.045 3.446) 4.008 41.049 ( -7.249 -6.096 -3.388) 10.059 41.049 ( 7.249 -6.096 3.388) 10.059 41.352 ( -5.557 1.774 -1.638) 6.059 41.352 ( 5.557 1.774 1.638) 6.059 41.783 ( -5.826 -18.080 -10.240) 21.579 41.783 ( 5.826 -18.080 10.240) 21.579 ======================= Grid point 285 (123/126) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 64 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.859 ( -0.000 0.000 -0.000) 0.000 4.859 ( 0.000 0.000 0.000) 0.000 5.207 ( -0.000 0.000 0.000) 0.000 5.207 ( 0.000 0.000 0.000) 0.000 5.513 ( -0.000 0.000 0.000) 0.000 5.513 ( 0.000 0.000 0.000) 0.000 5.661 ( -0.000 0.000 -0.000) 0.000 5.661 ( 0.000 0.000 0.000) 0.000 6.038 ( 0.000 0.000 -0.000) 0.000 6.038 ( 0.000 0.000 0.000) 0.000 6.119 ( -0.000 0.000 -0.000) 0.000 6.119 ( -0.000 0.000 0.000) 0.000 6.724 ( 0.000 0.000 -0.000) 0.000 6.724 ( -0.000 0.000 -0.000) 0.000 6.794 ( 0.000 0.000 -0.000) 0.000 6.794 ( -0.000 0.000 0.000) 0.000 7.035 ( -0.000 -0.000 0.000) 0.000 7.035 ( 0.000 -0.000 -0.000) 0.000 7.040 ( -0.000 0.000 -0.000) 0.000 7.040 ( 0.000 0.000 -0.000) 0.000 7.450 ( 0.000 0.000 -0.000) 0.000 7.450 ( -0.000 0.000 0.000) 0.000 7.663 ( -0.000 0.000 0.000) 0.000 7.663 ( 0.000 0.000 0.000) 0.000 8.425 ( -0.000 0.000 0.000) 0.000 8.425 ( -0.000 0.000 0.000) 0.000 8.591 ( 0.000 0.000 -0.000) 0.000 8.591 ( -0.000 0.000 0.000) 0.000 8.798 ( 0.000 0.000 -0.000) 0.000 8.798 ( 0.000 0.000 -0.000) 0.000 9.133 ( 0.000 0.000 -0.000) 0.000 9.133 ( 0.000 0.000 0.000) 0.000 9.459 ( 0.000 0.000 0.000) 0.000 9.459 ( 0.000 0.000 0.000) 0.000 9.620 ( -0.000 0.000 -0.000) 0.000 9.620 ( 0.000 0.000 0.000) 0.000 9.966 ( -0.000 0.000 -0.000) 0.000 9.966 ( 0.000 0.000 0.000) 0.000 10.177 ( -0.000 0.000 -0.000) 0.000 10.177 ( 0.000 0.000 0.000) 0.000 10.785 ( -0.000 0.000 -0.000) 0.000 10.785 ( 0.000 0.000 0.000) 0.000 11.032 ( -0.000 0.000 -0.000) 0.000 11.032 ( 0.000 0.000 0.000) 0.000 11.354 ( 0.000 -0.000 -0.000) 0.000 11.354 ( 0.000 0.000 0.000) 0.000 11.475 ( 0.000 0.000 -0.000) 0.000 11.475 ( -0.000 0.000 0.000) 0.000 11.934 ( 0.000 0.000 -0.000) 0.000 11.934 ( -0.000 0.000 0.000) 0.000 12.274 ( 0.000 0.000 -0.000) 0.000 12.274 ( -0.000 0.000 0.000) 0.000 12.431 ( 0.000 0.000 -0.000) 0.000 12.431 ( -0.000 0.000 0.000) 0.000 12.494 ( -0.000 -0.000 -0.000) 0.000 12.494 ( 0.000 -0.000 0.000) 0.000 12.661 ( 0.000 0.000 -0.000) 0.000 12.661 ( -0.000 0.000 0.000) 0.000 12.742 ( 0.000 0.000 -0.000) 0.000 12.742 ( -0.000 -0.000 0.000) 0.000 14.362 ( -0.000 0.000 -0.000) 0.000 14.362 ( 0.000 0.000 0.000) 0.000 14.436 ( -0.000 0.000 -0.000) 0.000 14.436 ( 0.000 0.000 0.000) 0.000 15.719 ( 0.000 0.000 0.000) 0.000 15.719 ( 0.000 0.000 0.000) 0.000 15.895 ( -0.000 0.000 -0.000) 0.000 15.895 ( -0.000 0.000 0.000) 0.000 17.881 ( 0.000 0.000 -0.000) 0.000 17.881 ( -0.000 0.000 0.000) 0.000 17.954 ( 0.000 0.000 -0.000) 0.000 17.954 ( 0.000 0.000 0.000) 0.000 19.811 ( -0.000 0.000 0.000) 0.000 19.811 ( 0.000 0.000 0.000) 0.000 19.968 ( 0.000 0.000 0.000) 0.000 19.968 ( -0.000 0.000 0.000) 0.000 20.797 ( 0.000 0.000 -0.000) 0.000 20.797 ( -0.000 0.000 0.000) 0.000 20.914 ( 0.000 0.000 -0.000) 0.000 20.914 ( -0.000 0.000 0.000) 0.000 22.181 ( -0.000 0.000 -0.000) 0.000 22.181 ( 0.000 0.000 0.000) 0.000 22.189 ( -0.000 -0.000 -0.000) 0.000 22.189 ( 0.000 -0.000 0.000) 0.000 24.402 ( 0.000 0.000 0.000) 0.000 24.402 ( -0.000 0.000 0.000) 0.000 24.479 ( -0.000 0.000 -0.000) 0.000 24.479 ( 0.000 0.000 0.000) 0.000 30.210 ( -0.000 0.000 -0.000) 0.000 30.210 ( 0.000 0.000 0.000) 0.000 30.214 ( -0.000 0.000 -0.000) 0.000 30.214 ( 0.000 0.000 0.000) 0.000 34.279 ( -0.000 0.000 0.000) 0.000 34.279 ( 0.000 0.000 0.000) 0.000 34.526 ( -0.000 0.000 0.000) 0.000 34.526 ( 0.000 0.000 0.000) 0.000 36.615 ( -0.000 0.000 0.000) 0.000 36.615 ( 0.000 0.000 0.000) 0.000 36.721 ( -0.000 0.000 -0.000) 0.000 36.721 ( 0.000 0.000 0.000) 0.000 40.735 ( -0.000 0.000 -0.000) 0.000 40.735 ( 0.000 0.000 0.000) 0.000 41.007 ( -0.000 0.000 -0.000) 0.000 41.007 ( 0.000 0.000 0.000) 0.000 41.436 ( -0.000 0.000 0.000) 0.000 41.436 ( 0.000 0.000 0.000) 0.000 41.517 ( -0.000 -0.000 0.000) 0.000 41.517 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 289 (124/126) ======================= q-point: ( 0.17 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 108 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.849 ( -0.174 -3.458 -1.697) 3.856 4.849 ( -0.174 3.458 -1.697) 3.856 5.237 ( 1.372 -6.150 5.563) 8.405 5.237 ( 1.372 6.150 5.563) 8.405 5.489 ( -1.946 -1.282 -3.546) 4.243 5.489 ( -1.946 1.282 -3.546) 4.243 5.659 ( -0.120 -0.960 2.102) 2.314 5.659 ( -0.120 0.960 2.102) 2.315 5.968 ( -4.474 -3.189 -2.396) 5.993 5.968 ( -4.474 3.189 -2.396) 5.993 6.118 ( -0.995 -2.950 -5.116) 5.989 6.118 ( -0.995 2.950 -5.116) 5.989 6.727 ( 0.487 -1.463 3.272) 3.618 6.727 ( 0.487 1.464 3.272) 3.618 6.845 ( 3.518 -3.509 -0.553) 5.000 6.845 ( 3.518 3.510 -0.553) 5.000 6.968 ( -2.811 -7.565 -0.101) 8.071 6.968 ( -2.811 7.565 -0.101) 8.071 7.090 ( 1.863 -3.970 1.578) 4.661 7.090 ( 1.863 3.970 1.578) 4.661 7.492 ( 3.206 -7.108 3.957) 8.744 7.492 ( 3.206 7.108 3.957) 8.744 7.681 ( 2.190 -6.286 -2.895) 7.259 7.681 ( 2.190 6.286 -2.895) 7.259 8.400 ( -4.201 -0.362 6.101) 7.416 8.400 ( -4.201 0.362 6.101) 7.416 8.601 ( 0.325 -2.758 -2.247) 3.572 8.601 ( 0.325 2.758 -2.247) 3.572 8.760 ( -2.189 -4.792 -2.237) 5.724 8.760 ( -2.189 4.792 -2.237) 5.724 9.117 ( -1.913 -1.316 1.243) 2.634 9.117 ( -1.913 1.316 1.243) 2.634 9.420 ( -2.170 -2.498 -4.955) 5.959 9.420 ( -2.170 2.498 -4.955) 5.959 9.600 ( -2.992 -3.615 2.872) 5.502 9.600 ( -2.992 3.615 2.873) 5.502 9.922 ( 1.789 -1.408 -8.314) 8.620 9.922 ( 1.789 1.408 -8.314) 8.620 10.316 ( 7.224 -4.272 7.532) 11.277 10.316 ( 7.224 4.273 7.532) 11.277 10.750 ( -2.040 -3.723 -3.170) 5.298 10.750 ( -2.040 3.723 -3.170) 5.298 11.050 ( 0.001 -2.826 4.901) 5.658 11.050 ( 0.001 2.826 4.901) 5.658 11.294 ( -5.130 -7.922 2.891) 9.870 11.294 ( -5.130 7.922 2.891) 9.871 11.473 ( 0.581 -3.913 -4.083) 5.685 11.473 ( 0.581 3.913 -4.083) 5.685 11.961 ( 1.980 -4.431 -2.795) 5.601 11.961 ( 1.980 4.431 -2.795) 5.601 12.193 ( -6.494 -4.586 0.984) 8.011 12.193 ( -6.494 4.586 0.984) 8.011 12.393 ( -0.665 -2.358 1.163) 2.712 12.393 ( -0.665 2.358 1.163) 2.713 12.557 ( 4.125 -9.831 -1.771) 10.807 12.557 ( 4.125 9.831 -1.771) 10.807 12.757 ( 4.890 -4.348 2.614) 7.046 12.757 ( 4.890 4.348 2.614) 7.046 12.812 ( 9.397 -3.132 -1.405) 10.004 12.812 ( 9.397 3.132 -1.405) 10.004 14.307 ( -4.247 -4.316 0.069) 6.056 14.307 ( -4.247 4.316 0.069) 6.056 14.451 ( 0.027 -1.406 0.797) 1.616 14.451 ( 0.027 1.406 0.797) 1.616 15.718 ( 0.331 -0.778 -1.324) 1.571 15.718 ( 0.331 0.778 -1.324) 1.571 15.889 ( -0.948 -0.976 0.924) 1.644 15.889 ( -0.947 0.976 0.924) 1.644 17.880 ( -0.232 -1.149 0.431) 1.249 17.880 ( -0.232 1.149 0.431) 1.249 17.950 ( -0.304 -1.056 -0.546) 1.226 17.950 ( -0.304 1.056 -0.546) 1.227 19.817 ( 0.588 -0.742 0.083) 0.951 19.817 ( 0.588 0.742 0.083) 0.951 19.951 ( -1.708 -0.613 -0.058) 1.815 19.951 ( -1.708 0.613 -0.058) 1.815 20.770 ( -2.217 -0.378 -0.006) 2.249 20.770 ( -2.217 0.378 -0.006) 2.249 20.942 ( 2.388 -0.489 -0.005) 2.438 20.942 ( 2.388 0.490 -0.005) 2.438 22.176 ( -0.199 -1.568 -0.232) 1.597 22.176 ( -0.199 1.568 -0.232) 1.597 22.196 ( 0.470 -1.513 0.224) 1.600 22.196 ( 0.470 1.513 0.224) 1.600 24.403 ( 0.177 -0.496 -0.067) 0.531 24.403 ( 0.177 0.496 -0.067) 0.531 24.470 ( -0.965 -0.384 0.071) 1.041 24.470 ( -0.965 0.384 0.071) 1.041 30.202 ( -0.434 -0.336 -0.009) 0.549 30.202 ( -0.434 0.336 -0.009) 0.549 30.224 ( 0.604 -0.303 0.020) 0.676 30.224 ( 0.604 0.303 0.020) 0.676 34.269 ( -0.929 -2.201 -0.023) 2.389 34.269 ( -0.929 2.201 -0.023) 2.389 34.533 ( 0.641 -2.965 0.048) 3.033 34.533 ( 0.641 2.965 0.048) 3.033 36.611 ( -0.222 -0.834 -0.080) 0.867 36.611 ( -0.222 0.834 -0.080) 0.867 36.729 ( 0.617 -1.566 0.057) 1.684 36.729 ( 0.617 1.566 0.057) 1.684 40.703 ( -1.123 -1.550 -2.224) 2.935 40.703 ( -1.123 1.550 -2.224) 2.935 41.110 ( 7.302 -7.229 7.167) 12.527 41.110 ( 7.302 7.229 7.167) 12.527 41.301 ( -8.512 -6.206 -5.673) 11.964 41.301 ( -8.512 6.206 -5.673) 11.964 41.584 ( 2.684 -10.169 0.710) 10.541 41.584 ( 2.684 10.169 0.710) 10.541 ======================= Grid point 291 (125/126) ======================= q-point: ( 0.33 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.851 ( 1.260 -3.531 -1.462) 4.024 4.851 ( 1.260 3.531 -1.462) 4.024 5.254 ( -4.147 -6.337 5.861) 9.576 5.254 ( -4.147 6.337 5.861) 9.576 5.472 ( 4.618 -1.748 -3.149) 5.856 5.472 ( 4.618 1.748 -3.149) 5.856 5.672 ( -0.950 -0.968 2.904) 3.205 5.672 ( -0.950 0.968 2.904) 3.205 5.891 ( -2.122 -1.426 -3.519) 4.350 5.891 ( -2.122 1.426 -3.519) 4.350 6.029 ( -5.178 -4.161 -4.846) 8.222 6.029 ( -5.178 4.161 -4.846) 8.222 6.754 ( 0.492 -3.581 2.143) 4.202 6.754 ( 0.492 3.581 2.143) 4.202 6.848 ( -2.037 -5.018 0.259) 5.422 6.848 ( -2.037 5.018 0.259) 5.422 7.009 ( 6.627 -5.280 -1.532) 8.611 7.009 ( 6.627 5.280 -1.532) 8.611 7.123 ( 0.862 -5.899 1.773) 6.219 7.123 ( 0.862 5.899 1.773) 6.219 7.561 ( -0.539 -7.221 9.595) 12.021 7.561 ( -0.539 7.221 9.595) 12.021 7.707 ( 3.941 -8.952 -8.804) 13.160 7.707 ( 3.941 8.952 -8.804) 13.160 8.343 ( -4.555 -1.980 5.613) 7.494 8.343 ( -4.555 1.980 5.613) 7.494 8.531 ( -5.762 -4.035 -0.894) 7.091 8.531 ( -5.762 4.035 -0.894) 7.091 8.765 ( 3.078 -3.832 -1.788) 5.230 8.765 ( 3.078 3.832 -1.788) 5.230 9.085 ( -1.783 -0.883 0.365) 2.022 9.085 ( -1.783 0.883 0.365) 2.022 9.365 ( -1.348 -1.231 -2.735) 3.288 9.365 ( -1.348 1.231 -2.735) 3.288 9.565 ( -1.210 -2.083 0.314) 2.429 9.565 ( -1.210 2.083 0.314) 2.429 9.957 ( 4.298 -2.271 -5.226) 7.137 9.957 ( 4.298 2.271 -5.226) 7.137 10.397 ( -1.732 -3.316 5.440) 6.602 10.397 ( -1.732 3.316 5.440) 6.602 10.731 ( 1.970 -4.790 -3.052) 6.011 10.731 ( 1.970 4.790 -3.052) 6.012 11.040 ( -2.766 -2.484 0.534) 3.756 11.040 ( -2.766 2.484 0.534) 3.756 11.275 ( 0.338 -7.991 10.520) 13.215 11.275 ( 0.338 7.991 10.520) 13.216 11.454 ( 0.064 -5.760 -8.002) 9.860 11.454 ( 0.064 5.760 -8.002) 9.860 11.938 ( -2.310 -2.421 -2.228) 4.020 11.938 ( -2.310 2.421 -2.228) 4.020 12.116 ( -2.449 -1.322 0.979) 2.950 12.116 ( -2.449 1.322 0.979) 2.950 12.443 ( 4.201 -3.655 3.257) 6.451 12.443 ( 4.201 3.655 3.257) 6.451 12.587 ( 0.280 -7.217 -2.798) 7.745 12.587 ( 0.280 7.217 -2.798) 7.745 12.848 ( 4.506 -1.511 -0.920) 4.841 12.848 ( 4.506 1.511 -0.920) 4.841 12.976 ( 6.939 -4.524 0.742) 8.317 12.976 ( 6.939 4.524 0.742) 8.317 14.248 ( -1.846 -4.374 0.440) 4.768 14.248 ( -1.846 4.374 0.440) 4.768 14.431 ( -2.340 -2.646 0.613) 3.585 14.431 ( -2.340 2.646 0.613) 3.585 15.723 ( 0.888 -0.925 -1.278) 1.810 15.723 ( 0.888 0.925 -1.278) 1.810 15.871 ( -1.440 -1.089 0.873) 2.006 15.871 ( -1.440 1.089 0.873) 2.006 17.878 ( -0.137 -1.350 0.478) 1.439 17.878 ( -0.137 1.350 0.478) 1.439 17.940 ( -0.416 -1.252 -0.590) 1.445 17.940 ( -0.416 1.252 -0.590) 1.445 19.834 ( 1.357 -1.275 0.123) 1.866 19.834 ( 1.357 1.275 0.123) 1.866 19.911 ( -2.477 -1.145 -0.100) 2.731 19.911 ( -2.477 1.145 -0.100) 2.731 20.735 ( -1.442 -0.235 -0.002) 1.461 20.735 ( -1.442 0.236 -0.002) 1.461 20.981 ( 1.618 -0.346 -0.007) 1.655 20.981 ( 1.618 0.346 -0.007) 1.655 22.173 ( -0.066 -0.980 -0.143) 0.993 22.173 ( -0.066 0.980 -0.143) 0.993 22.204 ( 0.338 -0.929 0.136) 0.998 22.204 ( 0.338 0.929 0.136) 0.998 24.409 ( 0.588 -0.835 -0.127) 1.029 24.409 ( 0.588 0.835 -0.127) 1.029 24.448 ( -1.375 -0.722 0.130) 1.559 24.448 ( -1.375 0.722 0.130) 1.559 30.196 ( -0.203 -0.207 0.007) 0.290 30.196 ( -0.203 0.207 0.007) 0.290 30.233 ( 0.372 -0.174 0.004) 0.411 30.233 ( 0.372 0.174 0.004) 0.411 34.252 ( -0.789 -1.941 0.036) 2.096 34.252 ( -0.789 1.941 0.036) 2.096 34.544 ( 0.479 -2.702 -0.031) 2.745 34.544 ( 0.479 2.702 -0.031) 2.745 36.612 ( 0.217 -0.548 0.234) 0.634 36.612 ( 0.217 0.548 0.234) 0.634 36.737 ( 0.185 -1.451 -0.249) 1.483 36.737 ( 0.185 1.451 -0.249) 1.483 40.709 ( 2.295 -1.395 0.370) 2.711 40.709 ( 2.295 1.395 0.370) 2.711 41.097 ( -8.355 -6.161 -4.875) 11.468 41.097 ( -8.355 6.161 -4.875) 11.468 41.309 ( 7.919 -8.022 6.974) 13.255 41.309 ( 7.919 8.022 6.974) 13.255 41.591 ( -1.492 -10.446 -2.476) 10.838 41.591 ( -1.492 10.446 -2.476) 10.838 ======================= Grid point 293 (126/126) ======================= q-point: ( 0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 7.40e-04 Number of triplets: 63 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.865 ( -0.000 0.000 0.000) 0.000 4.865 ( -0.000 0.000 0.000) 0.000 5.208 ( -0.000 0.000 -0.000) 0.000 5.208 ( -0.000 0.000 0.000) 0.000 5.583 ( -0.000 0.000 0.000) 0.000 5.583 ( 0.000 0.000 -0.000) 0.000 5.615 ( -0.000 -0.000 -0.000) 0.000 5.615 ( 0.000 -0.000 0.000) 0.000 5.871 ( -0.000 0.000 -0.000) 0.000 5.871 ( 0.000 0.000 0.000) 0.000 5.952 ( -0.000 0.000 -0.000) 0.000 5.952 ( 0.000 0.000 0.000) 0.000 6.763 ( -0.000 0.000 0.000) 0.000 6.763 ( -0.000 0.000 0.000) 0.000 6.826 ( -0.000 0.000 -0.000) 0.000 6.826 ( -0.000 0.000 0.000) 0.000 7.090 ( -0.000 -0.000 0.000) 0.000 7.090 ( -0.000 0.000 -0.000) 0.000 7.131 ( -0.000 0.000 0.000) 0.000 7.131 ( 0.000 0.000 -0.000) 0.000 7.566 ( -0.000 0.000 -0.000) 0.000 7.566 ( -0.000 0.000 0.000) 0.000 7.729 ( -0.000 0.000 -0.000) 0.000 7.729 ( -0.000 0.000 0.000) 0.000 8.312 ( -0.000 0.000 -0.000) 0.000 8.312 ( -0.000 0.000 0.000) 0.000 8.465 ( -0.000 0.000 -0.000) 0.000 8.465 ( 0.000 0.000 0.000) 0.000 8.798 ( -0.000 0.000 0.000) 0.000 8.798 ( -0.000 0.000 0.000) 0.000 9.066 ( -0.000 0.000 -0.000) 0.000 9.066 ( -0.000 0.000 0.000) 0.000 9.348 ( -0.000 0.000 -0.000) 0.000 9.348 ( -0.000 0.000 0.000) 0.000 9.556 ( -0.000 0.000 -0.000) 0.000 9.556 ( -0.000 0.000 0.000) 0.000 9.991 ( 0.000 0.000 -0.000) 0.000 9.991 ( -0.000 0.000 0.000) 0.000 10.377 ( -0.000 0.000 -0.000) 0.000 10.377 ( -0.000 0.000 0.000) 0.000 10.752 ( 0.000 0.000 -0.000) 0.000 10.752 ( -0.000 0.000 0.000) 0.000 11.004 ( -0.000 0.000 0.000) 0.000 11.004 ( -0.000 0.000 0.000) 0.000 11.340 ( -0.000 0.000 -0.000) 0.000 11.340 ( 0.000 0.000 0.000) 0.000 11.410 ( -0.000 -0.000 -0.000) 0.000 11.410 ( 0.000 -0.000 0.000) 0.000 11.907 ( -0.000 0.000 -0.000) 0.000 11.907 ( -0.000 0.000 0.000) 0.000 12.098 ( -0.000 0.000 -0.000) 0.000 12.098 ( 0.000 0.000 0.000) 0.000 12.524 ( -0.000 0.000 -0.000) 0.000 12.524 ( 0.000 0.000 0.000) 0.000 12.554 ( -0.000 -0.000 -0.000) 0.000 12.554 ( 0.000 -0.000 0.000) 0.000 12.889 ( 0.000 0.000 -0.000) 0.000 12.889 ( -0.000 0.000 0.000) 0.000 13.042 ( 0.000 -0.000 -0.000) 0.000 13.042 ( -0.000 -0.000 0.000) 0.000 14.239 ( 0.000 0.000 -0.000) 0.000 14.239 ( -0.000 0.000 0.000) 0.000 14.402 ( -0.000 0.000 -0.000) 0.000 14.402 ( 0.000 0.000 0.000) 0.000 15.731 ( -0.000 0.000 0.000) 0.000 15.731 ( -0.000 0.000 0.000) 0.000 15.857 ( 0.000 0.000 0.000) 0.000 15.857 ( -0.000 0.000 0.000) 0.000 17.879 ( -0.000 0.000 -0.000) 0.000 17.879 ( -0.000 0.000 0.000) 0.000 17.934 ( -0.000 0.000 -0.000) 0.000 17.934 ( -0.000 0.000 0.000) 0.000 19.865 ( -0.000 -0.000 -0.000) 0.000 19.865 ( -0.000 0.000 0.000) 0.000 19.870 ( 0.000 0.000 0.000) 0.000 19.870 ( 0.000 0.000 0.000) 0.000 20.722 ( -0.000 0.000 -0.000) 0.000 20.722 ( -0.000 0.000 0.000) 0.000 20.996 ( -0.000 0.000 -0.000) 0.000 20.996 ( 0.000 0.000 0.000) 0.000 22.172 ( 0.000 0.000 -0.000) 0.000 22.172 ( -0.000 0.000 0.000) 0.000 22.208 ( 0.000 0.000 -0.000) 0.000 22.208 ( -0.000 0.000 0.000) 0.000 24.422 ( -0.000 0.000 0.000) 0.000 24.422 ( 0.000 0.000 0.000) 0.000 24.428 ( -0.000 0.000 -0.000) 0.000 24.428 ( 0.000 0.000 0.000) 0.000 30.195 ( -0.000 0.000 0.000) 0.000 30.195 ( -0.000 0.000 0.000) 0.000 30.236 ( -0.000 0.000 -0.000) 0.000 30.236 ( -0.000 0.000 0.000) 0.000 34.244 ( -0.000 0.000 0.000) 0.000 34.244 ( -0.000 0.000 0.000) 0.000 34.548 ( -0.000 0.000 0.000) 0.000 34.548 ( -0.000 0.000 0.000) 0.000 36.616 ( -0.000 0.000 -0.000) 0.000 36.616 ( -0.000 0.000 0.000) 0.000 36.737 ( 0.000 0.000 -0.000) 0.000 36.737 ( -0.000 0.000 0.000) 0.000 40.751 ( -0.000 0.000 -0.000) 0.000 40.751 ( -0.000 0.000 0.000) 0.000 40.986 ( -0.000 0.000 -0.000) 0.000 40.986 ( -0.000 0.000 0.000) 0.000 41.432 ( -0.000 0.000 -0.000) 0.000 41.432 ( -0.000 0.000 0.000) 0.000 41.540 ( -0.000 0.000 0.000) 0.000 41.540 ( 0.000 0.000 0.000) 0.000 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/41472 10.0 1941.854 1989.068 1188.858 0.000 90.047 0.000 3/41472 20.0 1016.796 769.781 666.607 0.000 140.765 0.000 3/41472 30.0 417.949 394.482 319.165 0.000 83.549 0.000 3/41472 40.0 203.655 221.284 171.119 0.000 44.216 0.000 3/41472 50.0 115.074 138.114 102.089 0.000 25.945 0.000 3/41472 60.0 73.104 94.137 66.954 0.000 16.823 0.000 3/41472 70.0 50.738 68.780 47.448 0.000 11.809 0.000 3/41472 80.0 37.648 53.036 35.731 0.000 8.813 0.000 3/41472 90.0 29.391 42.637 28.200 0.000 6.896 0.000 3/41472 100.0 23.860 35.406 23.081 0.000 5.597 0.000 3/41472 110.0 19.968 30.160 19.435 0.000 4.675 0.000 3/41472 120.0 17.117 26.216 16.737 0.000 3.995 0.000 3/41472 130.0 14.956 23.162 14.676 0.000 3.477 0.000 3/41472 140.0 13.272 20.738 13.057 0.000 3.072 0.000 3/41472 150.0 11.927 18.773 11.758 0.000 2.749 0.000 3/41472 160.0 10.832 17.151 10.695 0.000 2.485 0.000 3/41472 170.0 9.925 15.792 9.810 0.000 2.266 0.000 3/41472 180.0 9.161 14.637 9.062 0.000 2.082 0.000 3/41472 190.0 8.509 13.645 8.423 0.000 1.926 0.000 3/41472 200.0 7.948 12.784 7.871 0.000 1.791 0.000 3/41472 210.0 7.459 12.029 7.390 0.000 1.674 0.000 3/41472 220.0 7.029 11.363 6.966 0.000 1.571 0.000 3/41472 230.0 6.648 10.771 6.590 0.000 1.481 0.000 3/41472 240.0 6.309 10.241 6.255 0.000 1.400 0.000 3/41472 250.0 6.004 9.763 5.954 0.000 1.328 0.000 3/41472 260.0 5.729 9.332 5.682 0.000 1.264 0.000 3/41472 270.0 5.480 8.939 5.435 0.000 1.205 0.000 3/41472 280.0 5.253 8.581 5.210 0.000 1.152 0.000 3/41472 290.0 5.045 8.253 5.004 0.000 1.103 0.000 3/41472 300.0 4.854 7.951 4.815 0.000 1.059 0.000 3/41472 310.0 4.679 7.672 4.640 0.000 1.018 0.000 3/41472 320.0 4.516 7.414 4.479 0.000 0.980 0.000 3/41472 330.0 4.365 7.174 4.329 0.000 0.946 0.000 3/41472 340.0 4.225 6.951 4.190 0.000 0.913 0.000 3/41472 350.0 4.095 6.743 4.060 0.000 0.883 0.000 3/41472 360.0 3.972 6.549 3.939 0.000 0.855 0.000 3/41472 370.0 3.858 6.366 3.825 0.000 0.829 0.000 3/41472 380.0 3.751 6.195 3.718 0.000 0.804 0.000 3/41472 390.0 3.650 6.033 3.618 0.000 0.781 0.000 3/41472 400.0 3.555 5.881 3.523 0.000 0.759 0.000 3/41472 410.0 3.465 5.737 3.434 0.000 0.739 0.000 3/41472 420.0 3.380 5.601 3.349 0.000 0.720 0.000 3/41472 430.0 3.299 5.472 3.269 0.000 0.701 0.000 3/41472 440.0 3.223 5.349 3.192 0.000 0.684 0.000 3/41472 450.0 3.150 5.233 3.120 0.000 0.668 0.000 3/41472 460.0 3.081 5.122 3.051 0.000 0.652 0.000 3/41472 470.0 3.015 5.016 2.985 0.000 0.637 0.000 3/41472 480.0 2.953 4.915 2.923 0.000 0.623 0.000 3/41472 490.0 2.893 4.818 2.863 0.000 0.610 0.000 3/41472 500.0 2.836 4.726 2.806 0.000 0.597 0.000 3/41472 510.0 2.781 4.638 2.751 0.000 0.585 0.000 3/41472 520.0 2.728 4.553 2.698 0.000 0.573 0.000 3/41472 530.0 2.678 4.471 2.648 0.000 0.562 0.000 3/41472 540.0 2.629 4.393 2.600 0.000 0.551 0.000 3/41472 550.0 2.583 4.318 2.553 0.000 0.541 0.000 3/41472 560.0 2.538 4.246 2.508 0.000 0.531 0.000 3/41472 570.0 2.495 4.176 2.465 0.000 0.521 0.000 3/41472 580.0 2.453 4.109 2.424 0.000 0.512 0.000 3/41472 590.0 2.413 4.044 2.384 0.000 0.503 0.000 3/41472 600.0 2.375 3.981 2.345 0.000 0.495 0.000 3/41472 610.0 2.338 3.920 2.308 0.000 0.486 0.000 3/41472 620.0 2.301 3.862 2.272 0.000 0.478 0.000 3/41472 630.0 2.267 3.805 2.237 0.000 0.471 0.000 3/41472 640.0 2.233 3.750 2.203 0.000 0.463 0.000 3/41472 650.0 2.200 3.697 2.170 0.000 0.456 0.000 3/41472 660.0 2.168 3.645 2.139 0.000 0.449 0.000 3/41472 670.0 2.138 3.595 2.108 0.000 0.443 0.000 3/41472 680.0 2.108 3.547 2.078 0.000 0.436 0.000 3/41472 690.0 2.079 3.500 2.049 0.000 0.430 0.000 3/41472 700.0 2.051 3.454 2.021 0.000 0.424 0.000 3/41472 710.0 2.024 3.409 1.994 0.000 0.418 0.000 3/41472 720.0 1.997 3.366 1.967 0.000 0.412 0.000 3/41472 730.0 1.972 3.324 1.942 0.000 0.406 0.000 3/41472 740.0 1.946 3.283 1.917 0.000 0.401 0.000 3/41472 750.0 1.922 3.243 1.892 0.000 0.396 0.000 3/41472 760.0 1.898 3.204 1.868 0.000 0.391 0.000 3/41472 770.0 1.875 3.166 1.845 0.000 0.386 0.000 3/41472 780.0 1.853 3.129 1.823 0.000 0.381 0.000 3/41472 790.0 1.831 3.093 1.801 0.000 0.376 0.000 3/41472 800.0 1.809 3.058 1.779 0.000 0.371 0.000 3/41472 810.0 1.788 3.023 1.758 0.000 0.367 0.000 3/41472 820.0 1.768 2.990 1.738 0.000 0.362 0.000 3/41472 830.0 1.748 2.957 1.718 0.000 0.358 0.000 3/41472 840.0 1.728 2.925 1.699 0.000 0.354 0.000 3/41472 850.0 1.709 2.893 1.680 0.000 0.350 0.000 3/41472 860.0 1.691 2.863 1.661 0.000 0.346 0.000 3/41472 870.0 1.673 2.833 1.643 0.000 0.342 0.000 3/41472 880.0 1.655 2.803 1.625 0.000 0.338 0.000 3/41472 890.0 1.637 2.775 1.608 0.000 0.335 0.000 3/41472 900.0 1.620 2.747 1.591 0.000 0.331 0.000 3/41472 910.0 1.604 2.719 1.575 0.000 0.327 0.000 3/41472 920.0 1.588 2.692 1.558 0.000 0.324 0.000 3/41472 930.0 1.572 2.666 1.542 0.000 0.321 0.000 3/41472 940.0 1.556 2.640 1.527 0.000 0.317 0.000 3/41472 950.0 1.541 2.615 1.512 0.000 0.314 0.000 3/41472 960.0 1.526 2.590 1.497 0.000 0.311 0.000 3/41472 970.0 1.511 2.566 1.482 0.000 0.308 0.000 3/41472 980.0 1.497 2.542 1.468 0.000 0.305 0.000 3/41472 990.0 1.482 2.518 1.454 0.000 0.302 0.000 3/41472 1000.0 1.469 2.495 1.440 0.000 0.299 0.000 3/41472 Thermal conductivity related properties were written into "kappa-m6164.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:35:33]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|