----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 03:53:34]------------------------- Compiled with OpenMP support (max 48 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.774112805349575 -5.163426370000001 0.000000000000000 b 2.774112805349575 5.163426370000001 0.000000000000000 c -0.461607523470690 0.000000000000000 11.499377089628121 Atomic positions (fractional): *1 N 0.09274296227009 0.90725703772991 0.75000000000000 14.007 2 N 0.90725703772991 0.09274296227009 0.25000000000000 14.007 *3 N 0.50459751029803 0.49540248970197 0.75000000000000 14.007 4 N 0.49540248970197 0.50459751029803 0.25000000000000 14.007 *5 N 0.99121482861971 0.66369546946421 0.12790633882006 14.007 6 N 0.33630453053579 0.00878517138029 0.37209366117994 14.007 7 N 0.00878517138029 0.33630453053579 0.87209366117994 14.007 8 N 0.66369546946421 0.99121482861971 0.62790633882006 14.007 *9 N 0.37931298612465 0.19359202090267 0.96312952698731 14.007 10 N 0.19359202090267 0.37931298612465 0.46312952698731 14.007 11 N 0.62068701387535 0.80640797909733 0.03687047301269 14.007 12 N 0.80640797909733 0.62068701387535 0.53687047301269 14.007 *13 Ca 0.16066032983191 0.38564365238389 0.07721824751067 40.078 *14 Ca 0.94310826671426 0.53601335392746 0.35238512204204 40.078 15 Ca 0.53601335392746 0.94310826671426 0.85238512204204 40.078 16 Ca 0.05689173328574 0.46398664607254 0.64761487795796 40.078 17 Ca 0.83933967016809 0.61435634761611 0.92278175248933 40.078 18 Ca 0.38564365238389 0.16066032983191 0.57721824751067 40.078 19 Ca 0.61435634761611 0.83933967016809 0.42278175248933 40.078 20 Ca 0.46398664607254 0.05689173328574 0.14761487795796 40.078 *21 V 0.23213676413035 0.23140774767070 0.83764045471639 50.941 22 V 0.76859225232930 0.76786323586965 0.66235954528361 50.941 23 V 0.76786323586965 0.76859225232930 0.16235954528361 50.941 24 V 0.23140774767070 0.23213676413035 0.33764045471639 50.941 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.548225610699150 0.000000000000000 0.000000000000000 b 0.000000000000000 10.326852740000001 0.000000000000000 c -0.461607523470690 0.000000000000000 11.499377089628121 Atomic positions (fractional): *1 N 0.50000000000000 0.40725703772991 0.75000000000000 14.007 > 1 2 N 0.00000000000000 0.09274296227009 0.25000000000000 14.007 > 2 *3 N 0.00000000000000 0.49540248970197 0.75000000000000 14.007 > 3 4 N 0.50000000000000 0.00459751029803 0.25000000000000 14.007 > 4 *5 N 0.32745514904196 0.33624032042225 0.12790633882006 14.007 > 5 6 N 0.67254485095804 0.33624032042225 0.37209366117994 14.007 > 6 7 N 0.17254485095804 0.16375967957775 0.87209366117994 14.007 > 7 8 N 0.82745514904196 0.16375967957775 0.62790633882006 14.007 > 8 *9 N 0.78645250351366 0.40713951738901 0.96312952698731 14.007 > 9 10 N 0.28645250351366 0.09286048261099 0.46312952698731 14.007 > 10 11 N 0.71354749648634 0.09286048261099 0.03687047301269 14.007 > 11 12 N 0.21354749648634 0.40713951738901 0.53687047301269 14.007 > 12 13 N 0.00000000000000 0.90725703772991 0.75000000000000 14.007 > 1 14 N 0.50000000000000 0.59274296227009 0.25000000000000 14.007 > 2 15 N 0.50000000000000 0.99540248970197 0.75000000000000 14.007 > 3 16 N 0.00000000000000 0.50459751029803 0.25000000000000 14.007 > 4 17 N 0.82745514904196 0.83624032042225 0.12790633882006 14.007 > 5 18 N 0.17254485095804 0.83624032042225 0.37209366117994 14.007 > 6 19 N 0.67254485095804 0.66375967957775 0.87209366117994 14.007 > 7 20 N 0.32745514904196 0.66375967957775 0.62790633882006 14.007 > 8 21 N 0.28645250351366 0.90713951738901 0.96312952698731 14.007 > 9 22 N 0.78645250351366 0.59286048261099 0.46312952698731 14.007 > 10 23 N 0.21354749648634 0.59286048261099 0.03687047301269 14.007 > 11 24 N 0.71354749648634 0.90713951738901 0.53687047301269 14.007 > 12 *25 Ca 0.27315199110790 0.11249166127599 0.07721824751067 40.078 > 13 *26 Ca 0.23956081032086 0.29645254360660 0.35238512204204 40.078 > 14 27 Ca 0.73956081032086 0.20354745639340 0.85238512204204 40.078 > 15 28 Ca 0.26043918967914 0.20354745639340 0.64761487795796 40.078 > 16 29 Ca 0.22684800889210 0.38750833872401 0.92278175248933 40.078 > 17 30 Ca 0.77315199110790 0.38750833872401 0.57721824751067 40.078 > 18 31 Ca 0.72684800889210 0.11249166127599 0.42278175248933 40.078 > 19 32 Ca 0.76043918967914 0.29645254360660 0.14761487795796 40.078 > 20 33 Ca 0.77315199110790 0.61249166127599 0.07721824751067 40.078 > 13 34 Ca 0.73956081032086 0.79645254360660 0.35238512204204 40.078 > 14 35 Ca 0.23956081032086 0.70354745639340 0.85238512204204 40.078 > 15 36 Ca 0.76043918967914 0.70354745639340 0.64761487795796 40.078 > 16 37 Ca 0.72684800889210 0.88750833872401 0.92278175248933 40.078 > 17 38 Ca 0.27315199110790 0.88750833872401 0.57721824751067 40.078 > 18 39 Ca 0.22684800889210 0.61249166127599 0.42278175248933 40.078 > 19 40 Ca 0.26043918967914 0.79645254360660 0.14761487795796 40.078 > 20 *41 V 0.73177225590053 0.49963549177018 0.83764045471639 50.941 > 21 42 V 0.26822774409947 0.49963549177018 0.66235954528361 50.941 > 22 43 V 0.76822774409947 0.00036450822982 0.16235954528361 50.941 > 23 44 V 0.23177225590053 0.00036450822982 0.33764045471639 50.941 > 24 45 V 0.23177225590053 0.99963549177018 0.83764045471639 50.941 > 21 46 V 0.76822774409947 0.99963549177018 0.66235954528361 50.941 > 22 47 V 0.26822774409947 0.50036450822982 0.16235954528361 50.941 > 23 48 V 0.73177225590053 0.50036450822982 0.33764045471639 50.941 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.096451221398301 0.000000000000000 0.000000000000000 b 0.000000000000000 10.326852740000001 0.000000000000000 c -0.461607523470690 0.000000000000000 11.499377089628121 Atomic positions (fractional): *1 N 0.25000000000000 0.40725703772991 0.75000000000000 14.007 > 1 2 N 0.75000000000000 0.40725703772991 0.75000000000000 14.007 > 1 3 N 0.00000000000000 0.09274296227009 0.25000000000000 14.007 > 2 4 N 0.50000000000000 0.09274296227009 0.25000000000000 14.007 > 2 *5 N 0.00000000000000 0.49540248970197 0.75000000000000 14.007 > 3 6 N 0.50000000000000 0.49540248970197 0.75000000000000 14.007 > 3 7 N 0.25000000000000 0.00459751029803 0.25000000000000 14.007 > 4 8 N 0.75000000000000 0.00459751029803 0.25000000000000 14.007 > 4 *9 N 0.16372757452098 0.33624032042225 0.12790633882006 14.007 > 5 10 N 0.66372757452098 0.33624032042225 0.12790633882006 14.007 > 5 11 N 0.33627242547902 0.33624032042225 0.37209366117994 14.007 > 6 12 N 0.83627242547902 0.33624032042225 0.37209366117994 14.007 > 6 13 N 0.08627242547902 0.16375967957775 0.87209366117994 14.007 > 7 14 N 0.58627242547902 0.16375967957775 0.87209366117994 14.007 > 7 15 N 0.41372757452098 0.16375967957775 0.62790633882006 14.007 > 8 16 N 0.91372757452098 0.16375967957775 0.62790633882006 14.007 > 8 *17 N 0.39322625175683 0.40713951738901 0.96312952698731 14.007 > 9 18 N 0.89322625175683 0.40713951738901 0.96312952698731 14.007 > 9 19 N 0.14322625175683 0.09286048261099 0.46312952698731 14.007 > 10 20 N 0.64322625175683 0.09286048261099 0.46312952698731 14.007 > 10 21 N 0.35677374824317 0.09286048261099 0.03687047301269 14.007 > 11 22 N 0.85677374824317 0.09286048261099 0.03687047301269 14.007 > 11 23 N 0.10677374824317 0.40713951738901 0.53687047301269 14.007 > 12 24 N 0.60677374824317 0.40713951738901 0.53687047301269 14.007 > 12 25 N 0.00000000000000 0.90725703772991 0.75000000000000 14.007 > 1 26 N 0.50000000000000 0.90725703772991 0.75000000000000 14.007 > 1 27 N 0.25000000000000 0.59274296227009 0.25000000000000 14.007 > 2 28 N 0.75000000000000 0.59274296227009 0.25000000000000 14.007 > 2 29 N 0.25000000000000 0.99540248970197 0.75000000000000 14.007 > 3 30 N 0.75000000000000 0.99540248970197 0.75000000000000 14.007 > 3 31 N 0.00000000000000 0.50459751029803 0.25000000000000 14.007 > 4 32 N 0.50000000000000 0.50459751029803 0.25000000000000 14.007 > 4 33 N 0.41372757452098 0.83624032042225 0.12790633882006 14.007 > 5 34 N 0.91372757452098 0.83624032042225 0.12790633882006 14.007 > 5 35 N 0.08627242547902 0.83624032042225 0.37209366117994 14.007 > 6 36 N 0.58627242547902 0.83624032042225 0.37209366117994 14.007 > 6 37 N 0.33627242547902 0.66375967957775 0.87209366117994 14.007 > 7 38 N 0.83627242547902 0.66375967957775 0.87209366117994 14.007 > 7 39 N 0.16372757452098 0.66375967957775 0.62790633882006 14.007 > 8 40 N 0.66372757452098 0.66375967957775 0.62790633882006 14.007 > 8 41 N 0.14322625175683 0.90713951738901 0.96312952698731 14.007 > 9 42 N 0.64322625175683 0.90713951738901 0.96312952698731 14.007 > 9 43 N 0.39322625175683 0.59286048261099 0.46312952698731 14.007 > 10 44 N 0.89322625175683 0.59286048261099 0.46312952698731 14.007 > 10 45 N 0.10677374824317 0.59286048261099 0.03687047301269 14.007 > 11 46 N 0.60677374824317 0.59286048261099 0.03687047301269 14.007 > 11 47 N 0.35677374824317 0.90713951738901 0.53687047301269 14.007 > 12 48 N 0.85677374824317 0.90713951738901 0.53687047301269 14.007 > 12 *49 Ca 0.13657599555395 0.11249166127599 0.07721824751067 40.078 > 13 50 Ca 0.63657599555395 0.11249166127599 0.07721824751067 40.078 > 13 *51 Ca 0.11978040516043 0.29645254360660 0.35238512204204 40.078 > 14 52 Ca 0.61978040516043 0.29645254360660 0.35238512204204 40.078 > 14 53 Ca 0.36978040516043 0.20354745639340 0.85238512204204 40.078 > 15 54 Ca 0.86978040516043 0.20354745639340 0.85238512204204 40.078 > 15 55 Ca 0.13021959483957 0.20354745639340 0.64761487795796 40.078 > 16 56 Ca 0.63021959483957 0.20354745639340 0.64761487795796 40.078 > 16 57 Ca 0.11342400444605 0.38750833872401 0.92278175248933 40.078 > 17 58 Ca 0.61342400444605 0.38750833872401 0.92278175248933 40.078 > 17 59 Ca 0.38657599555395 0.38750833872401 0.57721824751067 40.078 > 18 60 Ca 0.88657599555395 0.38750833872401 0.57721824751067 40.078 > 18 61 Ca 0.36342400444605 0.11249166127599 0.42278175248933 40.078 > 19 62 Ca 0.86342400444605 0.11249166127599 0.42278175248933 40.078 > 19 63 Ca 0.38021959483957 0.29645254360660 0.14761487795796 40.078 > 20 64 Ca 0.88021959483957 0.29645254360660 0.14761487795796 40.078 > 20 65 Ca 0.38657599555395 0.61249166127599 0.07721824751067 40.078 > 13 66 Ca 0.88657599555395 0.61249166127599 0.07721824751067 40.078 > 13 67 Ca 0.36978040516043 0.79645254360660 0.35238512204204 40.078 > 14 68 Ca 0.86978040516043 0.79645254360660 0.35238512204204 40.078 > 14 69 Ca 0.11978040516043 0.70354745639340 0.85238512204204 40.078 > 15 70 Ca 0.61978040516043 0.70354745639340 0.85238512204204 40.078 > 15 71 Ca 0.38021959483957 0.70354745639340 0.64761487795796 40.078 > 16 72 Ca 0.88021959483957 0.70354745639340 0.64761487795796 40.078 > 16 73 Ca 0.36342400444605 0.88750833872401 0.92278175248933 40.078 > 17 74 Ca 0.86342400444605 0.88750833872401 0.92278175248933 40.078 > 17 75 Ca 0.13657599555395 0.88750833872401 0.57721824751067 40.078 > 18 76 Ca 0.63657599555395 0.88750833872401 0.57721824751067 40.078 > 18 77 Ca 0.11342400444605 0.61249166127599 0.42278175248933 40.078 > 19 78 Ca 0.61342400444605 0.61249166127599 0.42278175248933 40.078 > 19 79 Ca 0.13021959483957 0.79645254360660 0.14761487795796 40.078 > 20 80 Ca 0.63021959483957 0.79645254360660 0.14761487795796 40.078 > 20 *81 V 0.36588612795026 0.49963549177018 0.83764045471639 50.941 > 21 82 V 0.86588612795026 0.49963549177018 0.83764045471639 50.941 > 21 83 V 0.13411387204974 0.49963549177018 0.66235954528361 50.941 > 22 84 V 0.63411387204974 0.49963549177018 0.66235954528361 50.941 > 22 85 V 0.38411387204974 0.00036450822982 0.16235954528361 50.941 > 23 86 V 0.88411387204974 0.00036450822982 0.16235954528361 50.941 > 23 87 V 0.11588612795026 0.00036450822982 0.33764045471639 50.941 > 24 88 V 0.61588612795026 0.00036450822982 0.33764045471639 50.941 > 24 89 V 0.11588612795026 0.99963549177018 0.83764045471639 50.941 > 21 90 V 0.61588612795026 0.99963549177018 0.83764045471639 50.941 > 21 91 V 0.38411387204974 0.99963549177018 0.66235954528361 50.941 > 22 92 V 0.88411387204974 0.99963549177018 0.66235954528361 50.941 > 22 93 V 0.13411387204974 0.50036450822982 0.16235954528361 50.941 > 23 94 V 0.63411387204974 0.50036450822982 0.16235954528361 50.941 > 23 95 V 0.36588612795026 0.50036450822982 0.33764045471639 50.941 > 24 96 V 0.86588612795026 0.50036450822982 0.33764045471639 50.941 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 7.7904106 0.0000000 -0.2632419 0.0000000 6.5520440 0.0000000 -0.2632537 0.0000000 7.1396210 -------------------------- Born effective charges -------------------------- 1 N -4.1303195 0.0000000 -2.2083530 0.0000000 -2.0879174 0.0000000 -1.2755288 0.0000000 -2.4405418 2 N -4.1303195 0.0000000 -2.2083530 0.0000000 -2.0879174 0.0000000 -1.2755288 0.0000000 -2.4405418 3 N -5.6827751 0.0000000 2.2792584 0.0000000 -0.9928769 0.0000000 2.2563888 0.0000000 -2.9268430 4 N -5.6827751 0.0000000 2.2792584 0.0000000 -0.9928769 0.0000000 2.2563888 0.0000000 -2.9268430 5 N -2.0432900 0.6640365 0.1227419 0.3739470 -4.0328438 -0.6522422 0.0574487 -0.8649614 -2.0621224 6 N -2.0432900 -0.6640365 0.1227419 -0.3739470 -4.0328438 0.6522422 0.0574487 0.8649614 -2.0621224 7 N -2.0432900 0.6640365 0.1227419 0.3739470 -4.0328438 -0.6522422 0.0574487 -0.8649614 -2.0621224 8 N -2.0432900 -0.6640365 0.1227419 -0.3739470 -4.0328438 0.6522422 0.0574487 0.8649614 -2.0621224 9 N -2.0278044 0.0531743 -0.0176879 0.3194379 -2.5278705 1.1025301 -0.3363497 1.1812803 -3.6508005 10 N -2.0278044 -0.0531743 -0.0176879 -0.3194379 -2.5278705 -1.1025301 -0.3363497 -1.1812803 -3.6508005 11 N -2.0278044 0.0531743 -0.0176879 0.3194379 -2.5278705 1.1025301 -0.3363497 1.1812803 -3.6508005 12 N -2.0278044 -0.0531743 -0.0176879 -0.3194379 -2.5278705 -1.1025301 -0.3363497 -1.1812803 -3.6508005 13 Ca 2.0317063 -0.0676371 -0.1644751 -0.0073939 2.2244254 0.3761364 0.1723649 0.3560197 2.4434603 14 Ca 2.4589180 0.0693025 0.1685247 0.2316256 2.9149978 -0.1173764 -0.0486350 0.2838094 2.4561702 15 Ca 2.4589180 -0.0693025 0.1685247 -0.2316256 2.9149978 0.1173764 -0.0486350 -0.2838094 2.4561702 16 Ca 2.4589180 0.0693025 0.1685247 0.2316256 2.9149978 -0.1173764 -0.0486350 0.2838094 2.4561702 17 Ca 2.0317063 -0.0676371 -0.1644751 -0.0073939 2.2244254 0.3761364 0.1723649 0.3560197 2.4434603 18 Ca 2.0317063 0.0676371 -0.1644751 0.0073939 2.2244254 -0.3761364 0.1723649 -0.3560197 2.4434603 19 Ca 2.0317063 0.0676371 -0.1644751 0.0073939 2.2244254 -0.3761364 0.1723649 -0.3560197 2.4434603 20 Ca 2.4589180 -0.0693025 0.1685247 -0.2316256 2.9149978 0.1173764 -0.0486350 -0.2838094 2.4561702 21 V 4.4870175 0.5065054 -0.1445563 -0.3075505 2.9616883 -0.2493346 -0.3352590 0.3715215 3.4969849 22 V 4.4870175 -0.5065054 -0.1445563 0.3075505 2.9616883 0.2493346 -0.3352590 -0.3715215 3.4969849 23 V 4.4870175 0.5065054 -0.1445563 -0.3075505 2.9616883 -0.2493346 -0.3352590 0.3715215 3.4969849 24 V 4.4870175 -0.5065054 -0.1445563 0.3075505 2.9616883 0.2493346 -0.3352590 -0.3715215 3.4969849 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 12456/12456 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2704 Number of blocks in projector: 2704 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: 584 Use submatrix version of eigh solver. (1) Block: 584 / 584 (2) Block: 250 / 584 (2) 237 eigenvectors found. (2) Block: 500 / 584 (2) 241 eigenvectors found. (2) Block: 584 / 584 (2) 79 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 571 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 240 eigenvectors found. (2) Block: 568 / 568 (2) 60 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 240 eigenvectors found. (2) Block: 568 / 568 (2) 60 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 328 Use standard eigh solver. Tree of FC basis block matrices: - (2704, 2650), data: False |-- (328, 321), data: True |-- (328, 321), data: True |-- (328, 321), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 18), data: (568, 28) @ (28, 18) |-- (68, 60), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 18), data: (568, 28) @ (28, 18) |-- (68, 60), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (584, 571), data: False |-- (584, 571), data: False |-- (584, 14), data: (584, 27) @ (27, 14) |-- (84, 79), data: True |-- (250, 241), data: True |-- (250, 237), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 720 - Time: 0.802 Solver_block: 200 / 720 - Time: 0.730 Solver_block: 300 / 720 - Time: 0.725 Solver_block: 400 / 720 - Time: 0.728 Solver_block: 500 / 720 - Time: 0.726 Solver_block: 600 / 720 - Time: 0.725 Solver_block: 700 / 720 - Time: 0.732 Solver_block: 720 / 720 - Time: 0.247 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.515 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 12456/12456 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2704 Number of blocks in projector: 2704 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: 584 Use submatrix version of eigh solver. (1) Block: 584 / 584 (2) Block: 250 / 584 (2) 237 eigenvectors found. (2) Block: 500 / 584 (2) 241 eigenvectors found. (2) Block: 584 / 584 (2) 79 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 571 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 240 eigenvectors found. (2) Block: 568 / 568 (2) 60 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 240 eigenvectors found. (2) Block: 568 / 568 (2) 60 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 328 Use standard eigh solver. Tree of FC basis block matrices: - (2704, 2650), data: False |-- (328, 321), data: True |-- (328, 321), data: True |-- (328, 321), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 18), data: (568, 28) @ (28, 18) |-- (68, 60), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 18), data: (568, 28) @ (28, 18) |-- (68, 60), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (584, 571), data: False |-- (584, 571), data: False |-- (584, 14), data: (584, 27) @ (27, 14) |-- (84, 79), data: True |-- (250, 241), data: True |-- (250, 237), 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 03:54:09]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 03:54:10]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.774112805349575 -5.163426370000001 0.000000000000000 b 2.774112805349575 5.163426370000001 0.000000000000000 c -0.461607523470690 0.000000000000000 11.499377089628121 Atomic positions (fractional): 1 N 0.09274296227009 0.90725703772991 0.75000000000000 14.007 2 N 0.90725703772991 0.09274296227009 0.25000000000000 14.007 3 N 0.50459751029803 0.49540248970197 0.75000000000000 14.007 4 N 0.49540248970197 0.50459751029803 0.25000000000000 14.007 5 N 0.99121482861971 0.66369546946421 0.12790633882006 14.007 6 N 0.33630453053579 0.00878517138029 0.37209366117994 14.007 7 N 0.00878517138029 0.33630453053579 0.87209366117994 14.007 8 N 0.66369546946421 0.99121482861971 0.62790633882006 14.007 9 N 0.37931298612465 0.19359202090267 0.96312952698731 14.007 10 N 0.19359202090267 0.37931298612465 0.46312952698731 14.007 11 N 0.62068701387535 0.80640797909733 0.03687047301269 14.007 12 N 0.80640797909733 0.62068701387535 0.53687047301269 14.007 13 Ca 0.16066032983191 0.38564365238389 0.07721824751067 40.078 14 Ca 0.94310826671426 0.53601335392746 0.35238512204204 40.078 15 Ca 0.53601335392746 0.94310826671426 0.85238512204204 40.078 16 Ca 0.05689173328574 0.46398664607254 0.64761487795796 40.078 17 Ca 0.83933967016809 0.61435634761611 0.92278175248933 40.078 18 Ca 0.38564365238389 0.16066032983191 0.57721824751067 40.078 19 Ca 0.61435634761611 0.83933967016809 0.42278175248933 40.078 20 Ca 0.46398664607254 0.05689173328574 0.14761487795796 40.078 21 V 0.23213676413035 0.23140774767070 0.83764045471639 50.941 22 V 0.76859225232930 0.76786323586965 0.66235954528361 50.941 23 V 0.76786323586965 0.76859225232930 0.16235954528361 50.941 24 V 0.23140774767070 0.23213676413035 0.33764045471639 50.941 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.096451221398301 0.000000000000000 0.000000000000000 b 0.000000000000000 10.326852740000001 0.000000000000000 c -0.461607523470690 0.000000000000000 11.499377089628121 Atomic positions (fractional): 1 N 0.25000000000000 0.40725703772991 0.75000000000000 14.007 > 1 2 N 0.75000000000000 0.40725703772991 0.75000000000000 14.007 > 1 3 N 0.00000000000000 0.09274296227009 0.25000000000000 14.007 > 3 4 N 0.50000000000000 0.09274296227009 0.25000000000000 14.007 > 3 5 N 0.00000000000000 0.49540248970197 0.75000000000000 14.007 > 5 6 N 0.50000000000000 0.49540248970197 0.75000000000000 14.007 > 5 7 N 0.25000000000000 0.00459751029803 0.25000000000000 14.007 > 7 8 N 0.75000000000000 0.00459751029803 0.25000000000000 14.007 > 7 9 N 0.16372757452098 0.33624032042225 0.12790633882006 14.007 > 9 10 N 0.66372757452098 0.33624032042225 0.12790633882006 14.007 > 9 11 N 0.33627242547902 0.33624032042225 0.37209366117994 14.007 > 11 12 N 0.83627242547902 0.33624032042225 0.37209366117994 14.007 > 11 13 N 0.08627242547902 0.16375967957775 0.87209366117994 14.007 > 13 14 N 0.58627242547902 0.16375967957775 0.87209366117994 14.007 > 13 15 N 0.41372757452098 0.16375967957775 0.62790633882006 14.007 > 15 16 N 0.91372757452098 0.16375967957775 0.62790633882006 14.007 > 15 17 N 0.39322625175683 0.40713951738901 0.96312952698731 14.007 > 17 18 N 0.89322625175683 0.40713951738901 0.96312952698731 14.007 > 17 19 N 0.14322625175683 0.09286048261099 0.46312952698731 14.007 > 19 20 N 0.64322625175683 0.09286048261099 0.46312952698731 14.007 > 19 21 N 0.35677374824317 0.09286048261099 0.03687047301269 14.007 > 21 22 N 0.85677374824317 0.09286048261099 0.03687047301269 14.007 > 21 23 N 0.10677374824317 0.40713951738901 0.53687047301269 14.007 > 23 24 N 0.60677374824317 0.40713951738901 0.53687047301269 14.007 > 23 25 N 0.00000000000000 0.90725703772991 0.75000000000000 14.007 > 1 26 N 0.50000000000000 0.90725703772991 0.75000000000000 14.007 > 1 27 N 0.25000000000000 0.59274296227009 0.25000000000000 14.007 > 3 28 N 0.75000000000000 0.59274296227009 0.25000000000000 14.007 > 3 29 N 0.25000000000000 0.99540248970197 0.75000000000000 14.007 > 5 30 N 0.75000000000000 0.99540248970197 0.75000000000000 14.007 > 5 31 N 0.00000000000000 0.50459751029803 0.25000000000000 14.007 > 7 32 N 0.50000000000000 0.50459751029803 0.25000000000000 14.007 > 7 33 N 0.41372757452098 0.83624032042225 0.12790633882006 14.007 > 9 34 N 0.91372757452098 0.83624032042225 0.12790633882006 14.007 > 9 35 N 0.08627242547902 0.83624032042225 0.37209366117994 14.007 > 11 36 N 0.58627242547902 0.83624032042225 0.37209366117994 14.007 > 11 37 N 0.33627242547902 0.66375967957775 0.87209366117994 14.007 > 13 38 N 0.83627242547902 0.66375967957775 0.87209366117994 14.007 > 13 39 N 0.16372757452098 0.66375967957775 0.62790633882006 14.007 > 15 40 N 0.66372757452098 0.66375967957775 0.62790633882006 14.007 > 15 41 N 0.14322625175683 0.90713951738901 0.96312952698731 14.007 > 17 42 N 0.64322625175683 0.90713951738901 0.96312952698731 14.007 > 17 43 N 0.39322625175683 0.59286048261099 0.46312952698731 14.007 > 19 44 N 0.89322625175683 0.59286048261099 0.46312952698731 14.007 > 19 45 N 0.10677374824317 0.59286048261099 0.03687047301269 14.007 > 21 46 N 0.60677374824317 0.59286048261099 0.03687047301269 14.007 > 21 47 N 0.35677374824317 0.90713951738901 0.53687047301269 14.007 > 23 48 N 0.85677374824317 0.90713951738901 0.53687047301269 14.007 > 23 49 Ca 0.13657599555395 0.11249166127599 0.07721824751067 40.078 > 49 50 Ca 0.63657599555395 0.11249166127599 0.07721824751067 40.078 > 49 51 Ca 0.11978040516043 0.29645254360660 0.35238512204204 40.078 > 51 52 Ca 0.61978040516043 0.29645254360660 0.35238512204204 40.078 > 51 53 Ca 0.36978040516043 0.20354745639340 0.85238512204204 40.078 > 53 54 Ca 0.86978040516043 0.20354745639340 0.85238512204204 40.078 > 53 55 Ca 0.13021959483957 0.20354745639340 0.64761487795796 40.078 > 55 56 Ca 0.63021959483957 0.20354745639340 0.64761487795796 40.078 > 55 57 Ca 0.11342400444605 0.38750833872401 0.92278175248933 40.078 > 57 58 Ca 0.61342400444605 0.38750833872401 0.92278175248933 40.078 > 57 59 Ca 0.38657599555395 0.38750833872401 0.57721824751067 40.078 > 59 60 Ca 0.88657599555395 0.38750833872401 0.57721824751067 40.078 > 59 61 Ca 0.36342400444605 0.11249166127599 0.42278175248933 40.078 > 61 62 Ca 0.86342400444605 0.11249166127599 0.42278175248933 40.078 > 61 63 Ca 0.38021959483957 0.29645254360660 0.14761487795796 40.078 > 63 64 Ca 0.88021959483957 0.29645254360660 0.14761487795796 40.078 > 63 65 Ca 0.38657599555395 0.61249166127599 0.07721824751067 40.078 > 49 66 Ca 0.88657599555395 0.61249166127599 0.07721824751067 40.078 > 49 67 Ca 0.36978040516043 0.79645254360660 0.35238512204204 40.078 > 51 68 Ca 0.86978040516043 0.79645254360660 0.35238512204204 40.078 > 51 69 Ca 0.11978040516043 0.70354745639340 0.85238512204204 40.078 > 53 70 Ca 0.61978040516043 0.70354745639340 0.85238512204204 40.078 > 53 71 Ca 0.38021959483957 0.70354745639340 0.64761487795796 40.078 > 55 72 Ca 0.88021959483957 0.70354745639340 0.64761487795796 40.078 > 55 73 Ca 0.36342400444605 0.88750833872401 0.92278175248933 40.078 > 57 74 Ca 0.86342400444605 0.88750833872401 0.92278175248933 40.078 > 57 75 Ca 0.13657599555395 0.88750833872401 0.57721824751067 40.078 > 59 76 Ca 0.63657599555395 0.88750833872401 0.57721824751067 40.078 > 59 77 Ca 0.11342400444605 0.61249166127599 0.42278175248933 40.078 > 61 78 Ca 0.61342400444605 0.61249166127599 0.42278175248933 40.078 > 61 79 Ca 0.13021959483957 0.79645254360660 0.14761487795796 40.078 > 63 80 Ca 0.63021959483957 0.79645254360660 0.14761487795796 40.078 > 63 81 V 0.36588612795026 0.49963549177018 0.83764045471639 50.941 > 81 82 V 0.86588612795026 0.49963549177018 0.83764045471639 50.941 > 81 83 V 0.13411387204974 0.49963549177018 0.66235954528361 50.941 > 83 84 V 0.63411387204974 0.49963549177018 0.66235954528361 50.941 > 83 85 V 0.38411387204974 0.00036450822982 0.16235954528361 50.941 > 85 86 V 0.88411387204974 0.00036450822982 0.16235954528361 50.941 > 85 87 V 0.11588612795026 0.00036450822982 0.33764045471639 50.941 > 87 88 V 0.61588612795026 0.00036450822982 0.33764045471639 50.941 > 87 89 V 0.11588612795026 0.99963549177018 0.83764045471639 50.941 > 81 90 V 0.61588612795026 0.99963549177018 0.83764045471639 50.941 > 81 91 V 0.38411387204974 0.99963549177018 0.66235954528361 50.941 > 83 92 V 0.88411387204974 0.99963549177018 0.66235954528361 50.941 > 83 93 V 0.13411387204974 0.50036450822982 0.16235954528361 50.941 > 85 94 V 0.63411387204974 0.50036450822982 0.16235954528361 50.941 > 85 95 V 0.36588612795026 0.50036450822982 0.33764045471639 50.941 > 87 96 V 0.86588612795026 0.50036450822982 0.33764045471639 50.941 > 87 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 7.7904106 0.0000000 -0.2632419 0.0000000 6.5520440 0.0000000 -0.2632537 0.0000000 7.1396210 -------------------------- Born effective charges -------------------------- 1 N -4.1303195 0.0000000 -2.2083530 0.0000000 -2.0879174 0.0000000 -1.2755288 0.0000000 -2.4405418 2 N -4.1303195 0.0000000 -2.2083530 0.0000000 -2.0879174 0.0000000 -1.2755288 0.0000000 -2.4405418 3 N -5.6827751 0.0000000 2.2792584 0.0000000 -0.9928769 0.0000000 2.2563888 0.0000000 -2.9268430 4 N -5.6827751 0.0000000 2.2792584 0.0000000 -0.9928769 0.0000000 2.2563888 0.0000000 -2.9268430 5 N -2.0432900 0.6640365 0.1227419 0.3739470 -4.0328438 -0.6522422 0.0574487 -0.8649614 -2.0621224 6 N -2.0432900 -0.6640365 0.1227419 -0.3739470 -4.0328438 0.6522422 0.0574487 0.8649614 -2.0621224 7 N -2.0432900 0.6640365 0.1227419 0.3739470 -4.0328438 -0.6522422 0.0574487 -0.8649614 -2.0621224 8 N -2.0432900 -0.6640365 0.1227419 -0.3739470 -4.0328438 0.6522422 0.0574487 0.8649614 -2.0621224 9 N -2.0278044 0.0531743 -0.0176879 0.3194379 -2.5278705 1.1025301 -0.3363497 1.1812803 -3.6508005 10 N -2.0278044 -0.0531743 -0.0176879 -0.3194379 -2.5278705 -1.1025301 -0.3363497 -1.1812803 -3.6508005 11 N -2.0278044 0.0531743 -0.0176879 0.3194379 -2.5278705 1.1025301 -0.3363497 1.1812803 -3.6508005 12 N -2.0278044 -0.0531743 -0.0176879 -0.3194379 -2.5278705 -1.1025301 -0.3363497 -1.1812803 -3.6508005 13 Ca 2.0317063 -0.0676371 -0.1644751 -0.0073939 2.2244254 0.3761364 0.1723649 0.3560197 2.4434603 14 Ca 2.4589180 0.0693025 0.1685247 0.2316256 2.9149978 -0.1173764 -0.0486350 0.2838094 2.4561702 15 Ca 2.4589180 -0.0693025 0.1685247 -0.2316256 2.9149978 0.1173764 -0.0486350 -0.2838094 2.4561702 16 Ca 2.4589180 0.0693025 0.1685247 0.2316256 2.9149978 -0.1173764 -0.0486350 0.2838094 2.4561702 17 Ca 2.0317063 -0.0676371 -0.1644751 -0.0073939 2.2244254 0.3761364 0.1723649 0.3560197 2.4434603 18 Ca 2.0317063 0.0676371 -0.1644751 0.0073939 2.2244254 -0.3761364 0.1723649 -0.3560197 2.4434603 19 Ca 2.0317063 0.0676371 -0.1644751 0.0073939 2.2244254 -0.3761364 0.1723649 -0.3560197 2.4434603 20 Ca 2.4589180 -0.0693025 0.1685247 -0.2316256 2.9149978 0.1173764 -0.0486350 -0.2838094 2.4561702 21 V 4.4870175 0.5065054 -0.1445563 -0.3075505 2.9616883 -0.2493346 -0.3352590 0.3715215 3.4969849 22 V 4.4870175 -0.5065054 -0.1445563 0.3075505 2.9616883 0.2493346 -0.3352590 -0.3715215 3.4969849 23 V 4.4870175 0.5065054 -0.1445563 -0.3075505 2.9616883 -0.2493346 -0.3352590 0.3715215 3.4969849 24 V 4.4870175 -0.5065054 -0.1445563 0.3075505 2.9616883 0.2493346 -0.3352590 -0.3715215 3.4969849 ---------------------------------------------------------------------------- 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] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] Computing fc3[ 5, 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] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] 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] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] Computing fc3[ 51, 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] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] Computing fc3[ 81, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] 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 (yx) -0.00000000 (yx) 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 03:54:36]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 03:54:37]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.774112805349575 -5.163426370000001 0.000000000000000 b 2.774112805349575 5.163426370000001 0.000000000000000 c -0.461607523470690 0.000000000000000 11.499377089628121 Atomic positions (fractional): 1 N 0.09274296227009 0.90725703772991 0.75000000000000 14.007 2 N 0.90725703772991 0.09274296227009 0.25000000000000 14.007 3 N 0.50459751029803 0.49540248970197 0.75000000000000 14.007 4 N 0.49540248970197 0.50459751029803 0.25000000000000 14.007 5 N 0.99121482861971 0.66369546946421 0.12790633882006 14.007 6 N 0.33630453053579 0.00878517138029 0.37209366117994 14.007 7 N 0.00878517138029 0.33630453053579 0.87209366117994 14.007 8 N 0.66369546946421 0.99121482861971 0.62790633882006 14.007 9 N 0.37931298612465 0.19359202090267 0.96312952698731 14.007 10 N 0.19359202090267 0.37931298612465 0.46312952698731 14.007 11 N 0.62068701387535 0.80640797909733 0.03687047301269 14.007 12 N 0.80640797909733 0.62068701387535 0.53687047301269 14.007 13 Ca 0.16066032983191 0.38564365238389 0.07721824751067 40.078 14 Ca 0.94310826671426 0.53601335392746 0.35238512204204 40.078 15 Ca 0.53601335392746 0.94310826671426 0.85238512204204 40.078 16 Ca 0.05689173328574 0.46398664607254 0.64761487795796 40.078 17 Ca 0.83933967016809 0.61435634761611 0.92278175248933 40.078 18 Ca 0.38564365238389 0.16066032983191 0.57721824751067 40.078 19 Ca 0.61435634761611 0.83933967016809 0.42278175248933 40.078 20 Ca 0.46398664607254 0.05689173328574 0.14761487795796 40.078 21 V 0.23213676413035 0.23140774767070 0.83764045471639 50.941 22 V 0.76859225232930 0.76786323586965 0.66235954528361 50.941 23 V 0.76786323586965 0.76859225232930 0.16235954528361 50.941 24 V 0.23140774767070 0.23213676413035 0.33764045471639 50.941 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.096451221398301 0.000000000000000 0.000000000000000 b 0.000000000000000 10.326852740000001 0.000000000000000 c -0.461607523470690 0.000000000000000 11.499377089628121 Atomic positions (fractional): 1 N 0.25000000000000 0.40725703772991 0.75000000000000 14.007 > 1 2 N 0.75000000000000 0.40725703772991 0.75000000000000 14.007 > 1 3 N 0.00000000000000 0.09274296227009 0.25000000000000 14.007 > 3 4 N 0.50000000000000 0.09274296227009 0.25000000000000 14.007 > 3 5 N 0.00000000000000 0.49540248970197 0.75000000000000 14.007 > 5 6 N 0.50000000000000 0.49540248970197 0.75000000000000 14.007 > 5 7 N 0.25000000000000 0.00459751029803 0.25000000000000 14.007 > 7 8 N 0.75000000000000 0.00459751029803 0.25000000000000 14.007 > 7 9 N 0.16372757452098 0.33624032042225 0.12790633882006 14.007 > 9 10 N 0.66372757452098 0.33624032042225 0.12790633882006 14.007 > 9 11 N 0.33627242547902 0.33624032042225 0.37209366117994 14.007 > 11 12 N 0.83627242547902 0.33624032042225 0.37209366117994 14.007 > 11 13 N 0.08627242547902 0.16375967957775 0.87209366117994 14.007 > 13 14 N 0.58627242547902 0.16375967957775 0.87209366117994 14.007 > 13 15 N 0.41372757452098 0.16375967957775 0.62790633882006 14.007 > 15 16 N 0.91372757452098 0.16375967957775 0.62790633882006 14.007 > 15 17 N 0.39322625175683 0.40713951738901 0.96312952698731 14.007 > 17 18 N 0.89322625175683 0.40713951738901 0.96312952698731 14.007 > 17 19 N 0.14322625175683 0.09286048261099 0.46312952698731 14.007 > 19 20 N 0.64322625175683 0.09286048261099 0.46312952698731 14.007 > 19 21 N 0.35677374824317 0.09286048261099 0.03687047301269 14.007 > 21 22 N 0.85677374824317 0.09286048261099 0.03687047301269 14.007 > 21 23 N 0.10677374824317 0.40713951738901 0.53687047301269 14.007 > 23 24 N 0.60677374824317 0.40713951738901 0.53687047301269 14.007 > 23 25 N 0.00000000000000 0.90725703772991 0.75000000000000 14.007 > 1 26 N 0.50000000000000 0.90725703772991 0.75000000000000 14.007 > 1 27 N 0.25000000000000 0.59274296227009 0.25000000000000 14.007 > 3 28 N 0.75000000000000 0.59274296227009 0.25000000000000 14.007 > 3 29 N 0.25000000000000 0.99540248970197 0.75000000000000 14.007 > 5 30 N 0.75000000000000 0.99540248970197 0.75000000000000 14.007 > 5 31 N 0.00000000000000 0.50459751029803 0.25000000000000 14.007 > 7 32 N 0.50000000000000 0.50459751029803 0.25000000000000 14.007 > 7 33 N 0.41372757452098 0.83624032042225 0.12790633882006 14.007 > 9 34 N 0.91372757452098 0.83624032042225 0.12790633882006 14.007 > 9 35 N 0.08627242547902 0.83624032042225 0.37209366117994 14.007 > 11 36 N 0.58627242547902 0.83624032042225 0.37209366117994 14.007 > 11 37 N 0.33627242547902 0.66375967957775 0.87209366117994 14.007 > 13 38 N 0.83627242547902 0.66375967957775 0.87209366117994 14.007 > 13 39 N 0.16372757452098 0.66375967957775 0.62790633882006 14.007 > 15 40 N 0.66372757452098 0.66375967957775 0.62790633882006 14.007 > 15 41 N 0.14322625175683 0.90713951738901 0.96312952698731 14.007 > 17 42 N 0.64322625175683 0.90713951738901 0.96312952698731 14.007 > 17 43 N 0.39322625175683 0.59286048261099 0.46312952698731 14.007 > 19 44 N 0.89322625175683 0.59286048261099 0.46312952698731 14.007 > 19 45 N 0.10677374824317 0.59286048261099 0.03687047301269 14.007 > 21 46 N 0.60677374824317 0.59286048261099 0.03687047301269 14.007 > 21 47 N 0.35677374824317 0.90713951738901 0.53687047301269 14.007 > 23 48 N 0.85677374824317 0.90713951738901 0.53687047301269 14.007 > 23 49 Ca 0.13657599555395 0.11249166127599 0.07721824751067 40.078 > 49 50 Ca 0.63657599555395 0.11249166127599 0.07721824751067 40.078 > 49 51 Ca 0.11978040516043 0.29645254360660 0.35238512204204 40.078 > 51 52 Ca 0.61978040516043 0.29645254360660 0.35238512204204 40.078 > 51 53 Ca 0.36978040516043 0.20354745639340 0.85238512204204 40.078 > 53 54 Ca 0.86978040516043 0.20354745639340 0.85238512204204 40.078 > 53 55 Ca 0.13021959483957 0.20354745639340 0.64761487795796 40.078 > 55 56 Ca 0.63021959483957 0.20354745639340 0.64761487795796 40.078 > 55 57 Ca 0.11342400444605 0.38750833872401 0.92278175248933 40.078 > 57 58 Ca 0.61342400444605 0.38750833872401 0.92278175248933 40.078 > 57 59 Ca 0.38657599555395 0.38750833872401 0.57721824751067 40.078 > 59 60 Ca 0.88657599555395 0.38750833872401 0.57721824751067 40.078 > 59 61 Ca 0.36342400444605 0.11249166127599 0.42278175248933 40.078 > 61 62 Ca 0.86342400444605 0.11249166127599 0.42278175248933 40.078 > 61 63 Ca 0.38021959483957 0.29645254360660 0.14761487795796 40.078 > 63 64 Ca 0.88021959483957 0.29645254360660 0.14761487795796 40.078 > 63 65 Ca 0.38657599555395 0.61249166127599 0.07721824751067 40.078 > 49 66 Ca 0.88657599555395 0.61249166127599 0.07721824751067 40.078 > 49 67 Ca 0.36978040516043 0.79645254360660 0.35238512204204 40.078 > 51 68 Ca 0.86978040516043 0.79645254360660 0.35238512204204 40.078 > 51 69 Ca 0.11978040516043 0.70354745639340 0.85238512204204 40.078 > 53 70 Ca 0.61978040516043 0.70354745639340 0.85238512204204 40.078 > 53 71 Ca 0.38021959483957 0.70354745639340 0.64761487795796 40.078 > 55 72 Ca 0.88021959483957 0.70354745639340 0.64761487795796 40.078 > 55 73 Ca 0.36342400444605 0.88750833872401 0.92278175248933 40.078 > 57 74 Ca 0.86342400444605 0.88750833872401 0.92278175248933 40.078 > 57 75 Ca 0.13657599555395 0.88750833872401 0.57721824751067 40.078 > 59 76 Ca 0.63657599555395 0.88750833872401 0.57721824751067 40.078 > 59 77 Ca 0.11342400444605 0.61249166127599 0.42278175248933 40.078 > 61 78 Ca 0.61342400444605 0.61249166127599 0.42278175248933 40.078 > 61 79 Ca 0.13021959483957 0.79645254360660 0.14761487795796 40.078 > 63 80 Ca 0.63021959483957 0.79645254360660 0.14761487795796 40.078 > 63 81 V 0.36588612795026 0.49963549177018 0.83764045471639 50.941 > 81 82 V 0.86588612795026 0.49963549177018 0.83764045471639 50.941 > 81 83 V 0.13411387204974 0.49963549177018 0.66235954528361 50.941 > 83 84 V 0.63411387204974 0.49963549177018 0.66235954528361 50.941 > 83 85 V 0.38411387204974 0.00036450822982 0.16235954528361 50.941 > 85 86 V 0.88411387204974 0.00036450822982 0.16235954528361 50.941 > 85 87 V 0.11588612795026 0.00036450822982 0.33764045471639 50.941 > 87 88 V 0.61588612795026 0.00036450822982 0.33764045471639 50.941 > 87 89 V 0.11588612795026 0.99963549177018 0.83764045471639 50.941 > 81 90 V 0.61588612795026 0.99963549177018 0.83764045471639 50.941 > 81 91 V 0.38411387204974 0.99963549177018 0.66235954528361 50.941 > 83 92 V 0.88411387204974 0.99963549177018 0.66235954528361 50.941 > 83 93 V 0.13411387204974 0.50036450822982 0.16235954528361 50.941 > 85 94 V 0.63411387204974 0.50036450822982 0.16235954528361 50.941 > 85 95 V 0.36588612795026 0.50036450822982 0.33764045471639 50.941 > 87 96 V 0.86588612795026 0.50036450822982 0.33764045471639 50.941 > 87 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 7.7904106 0.0000000 -0.2632419 0.0000000 6.5520440 0.0000000 -0.2632537 0.0000000 7.1396210 -------------------------- Born effective charges -------------------------- 1 N -4.1303195 0.0000000 -2.2083530 0.0000000 -2.0879174 0.0000000 -1.2755288 0.0000000 -2.4405418 2 N -4.1303195 0.0000000 -2.2083530 0.0000000 -2.0879174 0.0000000 -1.2755288 0.0000000 -2.4405418 3 N -5.6827751 0.0000000 2.2792584 0.0000000 -0.9928769 0.0000000 2.2563888 0.0000000 -2.9268430 4 N -5.6827751 0.0000000 2.2792584 0.0000000 -0.9928769 0.0000000 2.2563888 0.0000000 -2.9268430 5 N -2.0432900 0.6640365 0.1227419 0.3739470 -4.0328438 -0.6522422 0.0574487 -0.8649614 -2.0621224 6 N -2.0432900 -0.6640365 0.1227419 -0.3739470 -4.0328438 0.6522422 0.0574487 0.8649614 -2.0621224 7 N -2.0432900 0.6640365 0.1227419 0.3739470 -4.0328438 -0.6522422 0.0574487 -0.8649614 -2.0621224 8 N -2.0432900 -0.6640365 0.1227419 -0.3739470 -4.0328438 0.6522422 0.0574487 0.8649614 -2.0621224 9 N -2.0278044 0.0531743 -0.0176879 0.3194379 -2.5278705 1.1025301 -0.3363497 1.1812803 -3.6508005 10 N -2.0278044 -0.0531743 -0.0176879 -0.3194379 -2.5278705 -1.1025301 -0.3363497 -1.1812803 -3.6508005 11 N -2.0278044 0.0531743 -0.0176879 0.3194379 -2.5278705 1.1025301 -0.3363497 1.1812803 -3.6508005 12 N -2.0278044 -0.0531743 -0.0176879 -0.3194379 -2.5278705 -1.1025301 -0.3363497 -1.1812803 -3.6508005 13 Ca 2.0317063 -0.0676371 -0.1644751 -0.0073939 2.2244254 0.3761364 0.1723649 0.3560197 2.4434603 14 Ca 2.4589180 0.0693025 0.1685247 0.2316256 2.9149978 -0.1173764 -0.0486350 0.2838094 2.4561702 15 Ca 2.4589180 -0.0693025 0.1685247 -0.2316256 2.9149978 0.1173764 -0.0486350 -0.2838094 2.4561702 16 Ca 2.4589180 0.0693025 0.1685247 0.2316256 2.9149978 -0.1173764 -0.0486350 0.2838094 2.4561702 17 Ca 2.0317063 -0.0676371 -0.1644751 -0.0073939 2.2244254 0.3761364 0.1723649 0.3560197 2.4434603 18 Ca 2.0317063 0.0676371 -0.1644751 0.0073939 2.2244254 -0.3761364 0.1723649 -0.3560197 2.4434603 19 Ca 2.0317063 0.0676371 -0.1644751 0.0073939 2.2244254 -0.3761364 0.1723649 -0.3560197 2.4434603 20 Ca 2.4589180 -0.0693025 0.1685247 -0.2316256 2.9149978 0.1173764 -0.0486350 -0.2838094 2.4561702 21 V 4.4870175 0.5065054 -0.1445563 -0.3075505 2.9616883 -0.2493346 -0.3352590 0.3715215 3.4969849 22 V 4.4870175 -0.5065054 -0.1445563 0.3075505 2.9616883 0.2493346 -0.3352590 -0.3715215 3.4969849 23 V 4.4870175 0.5065054 -0.1445563 -0.3075505 2.9616883 -0.2493346 -0.3352590 0.3715215 3.4969849 24 V 4.4870175 -0.5065054 -0.1445563 0.3075505 2.9616883 0.2493346 -0.3352590 -0.3715215 3.4969849 ---------------------------------------------------------------------------- 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 ... [ 10 10 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: 0.60, Number of G-points: 305, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/117) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 117 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 2.365 ( 0.000 0.000 0.000) 0.000 3.399 ( 0.000 0.000 0.000) 0.000 3.507 ( 0.000 0.000 0.000) 0.000 3.524 ( 0.000 0.000 0.000) 0.000 3.893 ( 0.000 0.000 0.000) 0.000 4.558 ( 0.000 0.000 0.000) 0.000 4.650 ( 0.000 0.000 0.000) 0.000 5.191 ( 0.000 0.000 0.000) 0.000 5.229 ( 0.000 0.000 0.000) 0.000 5.243 ( 0.000 0.000 0.000) 0.000 5.268 ( 0.000 0.000 0.000) 0.000 5.722 ( 0.000 0.000 0.000) 0.000 5.818 ( 0.000 0.000 0.000) 0.000 5.878 ( 0.000 0.000 0.000) 0.000 5.949 ( 0.000 0.000 0.000) 0.000 6.176 ( 0.000 0.000 0.000) 0.000 6.276 ( 0.000 0.000 0.000) 0.000 6.315 ( 0.000 0.000 0.000) 0.000 6.535 ( 0.000 0.000 0.000) 0.000 6.684 ( 0.000 0.000 0.000) 0.000 6.747 ( 0.000 0.000 0.000) 0.000 6.806 ( 0.000 0.000 0.000) 0.000 7.029 ( 0.000 0.000 0.000) 0.000 7.041 ( 0.000 0.000 0.000) 0.000 7.368 ( 0.000 0.000 0.000) 0.000 7.401 ( 0.000 0.000 0.000) 0.000 7.488 ( 0.000 0.000 0.000) 0.000 7.509 ( 0.000 0.000 0.000) 0.000 7.958 ( 0.000 0.000 0.000) 0.000 7.974 ( 0.000 0.000 0.000) 0.000 8.052 ( 0.000 0.000 0.000) 0.000 8.191 ( 0.000 0.000 0.000) 0.000 8.433 ( 0.000 0.000 0.000) 0.000 8.499 ( 0.000 0.000 0.000) 0.000 8.517 ( 0.000 0.000 0.000) 0.000 9.028 ( 0.000 0.000 0.000) 0.000 9.217 ( 0.000 0.000 0.000) 0.000 9.450 ( 0.000 0.000 0.000) 0.000 9.716 ( 0.000 0.000 0.000) 0.000 9.815 ( 0.000 0.000 0.000) 0.000 10.560 ( 0.000 0.000 0.000) 0.000 10.802 ( 0.000 0.000 0.000) 0.000 10.895 ( 0.000 0.000 0.000) 0.000 11.394 ( 0.000 0.000 0.000) 0.000 11.896 ( 0.000 0.000 0.000) 0.000 12.027 ( 0.000 0.000 0.000) 0.000 12.230 ( 0.000 0.000 0.000) 0.000 12.240 ( 0.000 0.000 0.000) 0.000 12.570 ( 0.000 0.000 0.000) 0.000 12.829 ( 0.000 0.000 0.000) 0.000 12.861 ( 0.000 0.000 0.000) 0.000 13.312 ( 0.000 0.000 0.000) 0.000 13.594 ( 0.000 0.000 0.000) 0.000 14.432 ( 0.000 0.000 0.000) 0.000 14.576 ( 0.000 0.000 0.000) 0.000 17.385 ( 0.000 0.000 0.000) 0.000 17.489 ( 0.000 0.000 0.000) 0.000 20.999 ( 0.000 0.000 0.000) 0.000 21.028 ( 0.000 0.000 0.000) 0.000 22.648 ( 0.000 0.000 0.000) 0.000 23.054 ( 0.000 0.000 0.000) 0.000 23.201 ( 0.000 0.000 0.000) 0.000 23.574 ( 0.000 0.000 0.000) 0.000 23.676 ( 0.000 0.000 0.000) 0.000 25.693 ( 0.000 0.000 0.000) 0.000 25.949 ( 0.000 0.000 0.000) 0.000 26.500 ( 0.000 0.000 0.000) 0.000 27.780 ( 0.000 0.000 0.000) 0.000 28.088 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/117) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.768 ( 25.054 -28.787 7.008) 38.801 0.848 ( 33.201 -24.405 8.718) 42.118 1.318 ( 52.080 -29.347 -8.464) 60.376 2.704 ( 31.901 -1.942 4.360) 32.256 3.201 ( -19.820 -4.178 -10.082) 22.626 3.481 ( -5.804 -6.095 18.798) 20.596 3.671 ( -0.692 -8.723 5.602) 10.390 3.772 ( 2.951 -2.532 -20.629) 20.992 4.541 ( -2.616 2.202 3.229) 4.703 4.928 ( 10.167 9.548 3.875) 14.475 5.129 ( -3.625 6.619 -8.029) 11.019 5.220 ( -4.360 -5.361 -2.837) 7.470 5.267 ( 2.209 1.596 -1.849) 3.293 5.360 ( 1.194 -6.217 -0.123) 6.331 5.683 ( -3.086 2.721 2.144) 4.639 5.722 ( -3.383 8.059 -0.410) 8.750 5.900 ( -4.054 -2.611 3.403) 5.902 6.114 ( -13.918 -1.032 -0.925) 13.986 6.142 ( -1.948 1.384 2.770) 3.658 6.244 ( -3.940 1.343 3.068) 5.171 6.354 ( -6.023 7.562 2.055) 9.883 6.543 ( -2.793 1.374 -3.941) 5.022 6.758 ( 9.442 17.269 1.263) 19.722 6.847 ( 1.019 11.903 -0.872) 11.978 6.871 ( 8.133 4.448 -3.811) 10.022 7.029 ( 1.679 5.391 5.083) 7.597 7.131 ( 4.647 -1.440 -4.226) 6.444 7.382 ( 2.572 2.665 1.041) 3.847 7.433 ( 2.306 10.456 4.566) 11.640 7.576 ( 8.851 -2.292 -4.052) 10.001 7.597 ( 1.311 -2.208 -3.517) 4.355 7.942 ( -0.907 -1.173 -8.232) 8.364 8.093 ( 2.168 -1.929 1.778) 3.403 8.142 ( -9.534 -15.913 1.136) 18.585 8.345 ( -1.738 -15.481 10.435) 18.751 8.510 ( -1.393 -3.519 2.230) 4.392 8.541 ( 7.685 4.172 -0.844) 8.785 8.632 ( 11.673 -4.328 13.632) 18.462 9.165 ( 11.520 2.892 -2.991) 12.248 9.253 ( 3.414 -3.309 -2.469) 5.357 9.531 ( -9.173 -16.723 1.208) 19.112 9.685 ( -4.213 -1.244 3.696) 5.741 9.874 ( 6.589 3.004 -4.358) 8.451 10.438 ( -17.419 0.959 8.170) 19.264 10.785 ( 0.751 4.739 -0.468) 4.821 10.914 ( -1.166 3.942 -7.374) 8.442 11.783 ( -10.573 -0.330 -0.582) 10.594 11.977 ( 1.028 3.396 3.413) 4.923 12.153 ( -2.786 4.909 -11.294) 12.626 12.224 ( -4.674 -3.584 6.440) 8.727 12.333 ( 9.515 7.675 6.908) 14.042 12.508 ( -7.886 -4.020 -2.795) 9.282 12.861 ( -3.472 -4.129 8.560) 10.118 12.885 ( 7.393 3.652 -2.254) 8.548 13.295 ( -2.139 -0.550 -5.241) 5.687 13.533 ( -3.701 2.009 -2.557) 4.927 14.528 ( 9.807 2.347 -4.093) 10.883 14.635 ( 5.910 0.194 5.032) 7.765 17.413 ( -2.023 -3.374 1.806) 4.329 17.463 ( -2.683 0.121 -1.805) 3.236 21.131 ( 10.993 0.310 -4.541) 11.898 21.846 ( 10.112 23.726 43.605) 50.661 23.052 ( 7.253 13.575 -4.158) 15.943 23.215 ( 11.227 9.340 -5.309) 15.539 23.293 ( 15.911 15.969 -6.613) 23.493 23.685 ( -0.534 -2.331 6.544) 6.968 25.181 ( -31.530 -42.379 -21.545) 57.046 25.665 ( -7.078 -6.583 -4.113) 10.504 25.948 ( -0.759 -1.281 0.683) 1.638 26.474 ( -6.375 -3.010 -0.762) 7.091 28.108 ( 2.384 0.303 5.571) 6.067 28.453 ( 12.502 18.777 -32.072) 39.211 ======================= Grid point 2 (3/117) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.419 ( 14.271 -28.301 0.975) 31.710 1.667 ( 33.410 -16.280 19.189) 41.826 2.197 ( 12.818 -15.503 -18.630) 27.418 2.982 ( -5.966 -13.590 -6.902) 16.368 3.284 ( 15.673 -10.817 3.179) 19.307 3.500 ( 8.390 -12.637 0.555) 15.178 3.827 ( 10.997 -8.282 30.356) 33.332 4.040 ( 15.200 -4.698 -26.742) 31.117 4.440 ( -0.961 2.867 0.322) 3.040 4.884 ( -7.381 6.444 -2.205) 10.043 5.020 ( 1.875 6.334 1.216) 6.717 5.145 ( -6.995 2.969 -1.856) 7.823 5.283 ( -1.501 -2.573 -6.290) 6.960 5.314 ( -5.037 3.444 1.156) 6.211 5.472 ( -6.859 12.645 1.037) 14.423 5.648 ( -15.560 -2.656 -1.225) 15.833 5.747 ( -6.455 -2.522 -1.569) 7.106 5.939 ( -4.310 -7.670 5.939) 10.615 6.157 ( -0.432 -1.492 4.885) 5.126 6.193 ( -0.806 -0.300 7.860) 7.907 6.244 ( -1.746 6.916 1.394) 7.268 6.465 ( -4.999 1.984 -2.793) 6.060 6.674 ( -0.489 17.013 0.040) 17.021 6.752 ( 2.791 6.184 -3.210) 7.506 6.900 ( 1.418 6.079 1.026) 6.326 7.044 ( 0.901 1.494 -2.667) 3.187 7.264 ( 5.983 -0.980 6.842) 9.142 7.364 ( 10.108 12.829 1.541) 16.406 7.481 ( 7.157 -0.462 0.217) 7.175 7.676 ( 7.991 0.711 -7.581) 11.038 7.796 ( 9.877 -3.495 -2.640) 10.804 7.965 ( 3.823 -0.009 -13.455) 13.988 8.136 ( 0.929 -4.261 1.561) 4.632 8.186 ( 0.103 -8.391 -6.344) 10.519 8.451 ( 0.059 -7.435 -0.371) 7.444 8.501 ( -4.096 -3.771 7.101) 9.023 8.672 ( 9.259 0.264 4.950) 10.503 8.924 ( 14.923 1.070 11.076) 18.615 9.250 ( 4.906 2.679 0.829) 5.651 9.370 ( 4.974 1.604 -2.884) 5.970 9.611 ( -4.206 -1.798 7.138) 8.478 9.672 ( 9.364 -5.314 2.816) 11.129 9.934 ( 4.264 6.599 -8.303) 11.431 10.136 ( -12.734 0.790 6.470) 14.306 10.728 ( -6.622 5.061 -1.741) 8.514 10.770 ( -1.238 6.682 -9.342) 11.552 11.483 ( -24.653 -4.364 -1.789) 25.100 11.938 ( -13.789 -1.736 1.688) 14.000 12.004 ( -6.129 1.431 4.651) 7.826 12.178 ( -4.519 -1.173 3.272) 5.701 12.275 ( 0.057 0.918 1.460) 1.725 12.588 ( 7.644 0.806 2.131) 7.976 12.849 ( -2.448 -5.345 4.954) 7.688 12.979 ( 8.031 6.772 -8.249) 13.356 13.249 ( -2.478 -1.533 -8.186) 8.689 13.492 ( 2.271 2.342 1.719) 3.688 14.657 ( 7.638 5.142 2.718) 9.600 14.786 ( 10.096 0.213 -0.864) 10.135 17.390 ( -4.684 0.537 -3.022) 5.600 17.407 ( -0.879 -0.333 2.844) 2.996 21.370 ( 14.921 -0.054 -7.540) 16.718 21.826 ( 3.814 10.885 20.699) 23.696 23.063 ( 6.899 9.518 -4.814) 12.703 23.379 ( 9.768 -2.677 0.455) 10.138 23.429 ( 9.414 3.092 -4.415) 10.848 23.710 ( -0.801 -3.937 9.598) 10.405 24.957 ( -18.770 -8.860 -11.334) 23.649 25.553 ( -11.246 -5.926 -3.943) 13.310 25.945 ( -1.818 -2.283 0.750) 3.014 26.361 ( -7.227 -0.208 -0.222) 7.233 28.179 ( 5.349 0.641 6.037) 8.091 28.478 ( 7.159 9.539 -11.706) 16.711 ======================= Grid point 3 (4/117) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( -7.554 -25.555 -7.102) 27.578 2.141 ( 13.519 7.258 4.133) 15.891 2.572 ( 23.174 -27.988 -5.827) 36.801 3.098 ( -0.260 -11.549 3.386) 12.038 3.419 ( -13.798 0.351 -0.435) 13.810 3.769 ( 4.295 -23.046 8.716) 25.011 4.178 ( 13.883 5.384 -4.562) 15.573 4.373 ( 17.112 -10.766 2.139) 20.330 4.566 ( 4.363 -3.448 -7.857) 9.626 4.709 ( -2.452 2.226 -3.513) 4.828 4.935 ( -2.873 3.228 7.394) 8.565 5.003 ( -2.427 4.477 -1.275) 5.250 5.163 ( -0.834 5.997 1.994) 6.374 5.262 ( -1.193 6.871 -2.176) 7.305 5.304 ( -9.490 -1.307 2.566) 9.918 5.444 ( 1.044 -3.005 -6.458) 7.199 5.677 ( -5.353 -1.364 2.622) 6.115 5.989 ( -0.269 -4.226 0.550) 4.270 6.071 ( -6.331 2.329 2.293) 7.125 6.144 ( -8.757 2.840 5.983) 10.979 6.210 ( -1.531 -2.710 1.475) 3.444 6.397 ( 1.818 -2.052 2.425) 3.660 6.466 ( 0.211 19.756 -1.041) 19.784 6.772 ( 2.212 3.612 -2.292) 4.816 6.828 ( -2.616 5.054 0.339) 5.701 7.020 ( 1.184 2.654 0.772) 3.007 7.354 ( 7.558 4.468 -4.607) 9.915 7.549 ( 13.916 1.983 -1.681) 14.157 7.656 ( 8.638 -2.702 -2.348) 9.350 7.796 ( 3.930 -2.966 6.606) 8.239 7.988 ( 4.919 1.960 -7.757) 9.392 8.056 ( 12.605 1.242 -1.498) 12.754 8.224 ( 3.434 -4.668 -8.134) 9.987 8.328 ( 9.458 -5.186 -3.404) 11.312 8.449 ( -5.183 -3.201 11.502) 13.015 8.511 ( 0.568 -5.572 -3.029) 6.367 8.826 ( 6.302 -1.216 1.999) 6.723 9.086 ( 4.332 3.770 -4.169) 7.097 9.347 ( 7.897 1.890 5.425) 9.765 9.451 ( 7.298 4.386 3.048) 9.044 9.585 ( 1.715 1.682 6.329) 6.770 9.768 ( -2.347 5.806 2.448) 6.724 9.874 ( 0.783 0.429 4.822) 4.904 10.064 ( 0.095 4.598 -7.159) 8.508 10.541 ( -5.985 0.984 -4.127) 7.336 10.719 ( 0.275 5.497 0.814) 5.564 11.032 ( -27.700 -5.110 -5.126) 28.630 11.557 ( -29.362 -5.212 0.811) 29.832 11.885 ( -5.083 1.672 3.103) 6.185 12.061 ( -5.329 3.675 3.716) 7.464 12.378 ( 6.249 -0.814 3.910) 7.416 12.700 ( 5.038 -0.552 6.068) 7.906 12.885 ( 0.216 -4.328 -2.392) 4.950 13.013 ( 3.074 4.994 -9.861) 11.473 13.262 ( 3.455 -1.382 -9.748) 10.434 13.547 ( 4.233 1.235 6.030) 7.470 14.723 ( 5.520 5.397 5.141) 9.275 14.946 ( 7.788 0.982 -2.639) 8.281 17.288 ( -5.538 0.344 -3.316) 6.464 17.392 ( -0.808 0.576 2.878) 3.044 21.624 ( 12.649 -0.730 -7.378) 14.661 21.807 ( 1.691 5.401 11.138) 12.494 23.109 ( 6.649 5.770 -4.896) 10.073 23.545 ( 5.855 0.853 1.687) 6.153 23.590 ( 8.000 -5.270 -0.282) 9.584 23.745 ( -0.610 -4.469 9.476) 10.495 24.688 ( -13.704 0.598 -9.282) 16.563 25.396 ( -10.644 -4.359 -2.566) 11.785 25.920 ( -3.027 -1.394 0.979) 3.473 26.238 ( -5.641 0.779 0.121) 5.696 28.283 ( 6.091 0.887 3.609) 7.135 28.504 ( 4.620 5.939 -4.447) 8.740 ======================= Grid point 4 (5/117) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -1.550 -17.372 -9.820) 20.015 2.384 ( 15.296 -1.891 -5.074) 16.226 3.037 ( -14.158 5.842 15.411) 21.727 3.080 ( -13.249 -1.342 -6.769) 14.938 3.287 ( 24.802 -20.167 7.441) 32.821 4.048 ( 0.623 -15.779 -1.223) 15.839 4.199 ( 0.750 1.805 -5.253) 5.605 4.313 ( -10.892 7.071 -1.623) 13.087 4.684 ( 6.318 1.501 -4.113) 7.687 4.785 ( -9.973 7.255 4.061) 12.984 4.830 ( 1.256 -6.359 -2.089) 6.810 5.073 ( -4.297 0.159 0.645) 4.348 5.145 ( 9.477 -13.653 9.731) 19.259 5.188 ( 2.867 3.406 0.702) 4.507 5.384 ( 10.594 3.626 -0.968) 11.239 5.522 ( 1.408 0.446 -5.223) 5.428 5.640 ( 0.358 -4.234 -0.203) 4.254 5.864 ( -10.765 9.005 -2.194) 14.206 5.931 ( -1.204 1.388 -0.695) 1.965 6.059 ( -1.243 -1.232 -0.272) 1.771 6.142 ( -4.209 5.003 5.722) 8.688 6.325 ( -0.797 6.427 -0.676) 6.511 6.529 ( 3.996 -4.824 6.587) 9.090 6.718 ( -1.597 3.964 0.117) 4.275 6.765 ( -2.707 -0.072 -4.297) 5.079 7.091 ( 7.528 0.711 2.348) 7.918 7.432 ( 4.911 2.446 -8.144) 9.820 7.727 ( 4.297 -0.250 -6.571) 7.856 7.794 ( 4.122 -3.128 5.301) 7.408 7.932 ( 5.165 4.031 4.636) 8.026 7.963 ( 3.651 -2.284 -3.344) 5.453 8.247 ( 5.363 3.609 3.933) 7.567 8.375 ( 4.133 -3.871 -3.718) 6.774 8.437 ( 1.115 -1.352 1.253) 2.154 8.521 ( 9.666 -4.624 0.328) 10.721 8.614 ( 5.422 -3.404 -1.149) 6.504 8.930 ( 4.310 1.152 -1.881) 4.841 9.103 ( 5.887 -0.750 -2.360) 6.387 9.380 ( -7.147 3.237 4.780) 9.187 9.507 ( 2.531 -0.354 0.655) 2.638 9.635 ( 6.953 4.976 -3.127) 9.104 9.775 ( 9.899 6.254 1.637) 11.823 9.860 ( -14.516 3.491 1.138) 14.973 9.925 ( 5.862 3.784 -0.651) 7.007 10.384 ( -13.615 -0.005 4.231) 14.257 10.689 ( -6.150 0.261 1.253) 6.282 10.750 ( -0.174 -3.524 -4.490) 5.711 11.050 ( -29.632 -3.938 1.213) 29.917 11.818 ( 0.143 2.699 -4.630) 5.361 11.945 ( -5.182 0.812 6.636) 8.459 12.469 ( 3.850 0.837 0.673) 3.997 12.771 ( 0.312 -0.646 5.378) 5.426 12.913 ( 1.238 -0.937 -2.756) 3.163 13.023 ( 1.038 -0.965 -5.144) 5.335 13.355 ( 6.060 0.861 -8.386) 10.382 13.596 ( 0.800 -0.393 5.828) 5.896 14.767 ( 3.901 3.724 3.453) 6.404 15.037 ( 3.534 0.855 -1.553) 3.953 17.195 ( -3.892 0.159 -2.210) 4.478 17.375 ( -0.674 0.429 1.776) 1.948 21.789 ( 2.992 2.954 7.523) 8.618 21.819 ( 4.796 -1.712 -7.208) 8.826 23.172 ( 5.041 3.155 -3.976) 7.154 23.615 ( 1.639 -1.369 3.078) 3.746 23.745 ( 4.944 -1.381 0.872) 5.207 23.782 ( -0.858 -3.975 6.973) 8.072 24.474 ( -7.079 2.031 -7.362) 10.414 25.271 ( -6.263 -2.314 -1.237) 6.791 25.874 ( -2.527 -0.317 0.785) 2.665 26.153 ( -2.930 0.655 0.030) 3.003 28.370 ( 3.890 0.669 1.419) 4.194 28.521 ( 2.301 3.043 -1.363) 4.051 ======================= Grid point 5 (6/117) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( 0.000 0.000 0.000) 0.000 2.630 ( 0.000 -0.000 0.000) 0.000 2.783 ( 0.000 -0.000 0.000) 0.000 2.900 ( 0.000 -0.000 0.000) 0.000 3.833 ( -0.000 0.000 -0.000) 0.000 3.905 ( 0.000 -0.000 0.000) 0.000 4.092 ( 0.000 -0.000 0.000) 0.000 4.436 ( -0.000 0.000 0.000) 0.000 4.465 ( 0.000 -0.000 -0.000) 0.000 4.765 ( 0.000 -0.000 0.000) 0.000 4.906 ( -0.000 0.000 0.000) 0.000 5.048 ( 0.000 0.000 0.000) 0.000 5.161 ( 0.000 -0.000 -0.000) 0.000 5.365 ( -0.000 0.000 -0.000) 0.000 5.426 ( 0.000 -0.000 0.000) 0.000 5.504 ( 0.000 -0.000 0.000) 0.000 5.713 ( -0.000 -0.000 0.000) 0.000 5.716 ( 0.000 0.000 -0.000) 0.000 5.938 ( 0.000 -0.000 -0.000) 0.000 6.006 ( 0.000 -0.000 0.000) 0.000 6.067 ( 0.000 -0.000 0.000) 0.000 6.294 ( 0.000 -0.000 0.000) 0.000 6.604 ( 0.000 -0.000 0.000) 0.000 6.672 ( 0.000 -0.000 -0.000) 0.000 6.734 ( 0.000 -0.000 0.000) 0.000 7.182 ( 0.000 -0.000 0.000) 0.000 7.464 ( 0.000 -0.000 -0.000) 0.000 7.733 ( 0.000 0.000 0.000) 0.000 7.853 ( 0.000 -0.000 -0.000) 0.000 7.913 ( 0.000 -0.000 0.000) 0.000 8.114 ( 0.000 -0.000 -0.000) 0.000 8.267 ( 0.000 -0.000 0.000) 0.000 8.407 ( 0.000 0.000 0.000) 0.000 8.439 ( 0.000 -0.000 -0.000) 0.000 8.566 ( 0.000 -0.000 0.000) 0.000 8.793 ( 0.000 -0.000 0.000) 0.000 9.090 ( 0.000 -0.000 0.000) 0.000 9.113 ( -0.000 0.000 0.000) 0.000 9.357 ( 0.000 -0.000 -0.000) 0.000 9.364 ( -0.000 0.000 0.000) 0.000 9.664 ( 0.000 0.000 -0.000) 0.000 9.690 ( 0.000 -0.000 0.000) 0.000 9.858 ( 0.000 0.000 -0.000) 0.000 10.060 ( 0.000 -0.000 0.000) 0.000 10.190 ( 0.000 -0.000 -0.000) 0.000 10.664 ( -0.000 -0.000 -0.000) 0.000 10.701 ( 0.000 -0.000 0.000) 0.000 10.799 ( 0.000 -0.000 0.000) 0.000 11.816 ( 0.000 -0.000 -0.000) 0.000 11.886 ( -0.000 -0.000 0.000) 0.000 12.503 ( -0.000 -0.000 0.000) 0.000 12.760 ( 0.000 -0.000 0.000) 0.000 12.940 ( 0.000 -0.000 0.000) 0.000 13.038 ( 0.000 -0.000 -0.000) 0.000 13.411 ( 0.000 -0.000 -0.000) 0.000 13.602 ( 0.000 -0.000 0.000) 0.000 14.788 ( 0.000 -0.000 0.000) 0.000 15.063 ( 0.000 -0.000 0.000) 0.000 17.156 ( 0.000 -0.000 0.000) 0.000 17.367 ( 0.000 -0.000 0.000) 0.000 21.793 ( 0.000 -0.000 0.000) 0.000 21.881 ( 0.000 -0.000 -0.000) 0.000 23.205 ( 0.000 -0.000 0.000) 0.000 23.639 ( 0.000 -0.000 0.000) 0.000 23.792 ( 0.000 0.000 -0.000) 0.000 23.797 ( -0.000 -0.000 0.000) 0.000 24.399 ( 0.000 -0.000 0.000) 0.000 25.224 ( 0.000 -0.000 0.000) 0.000 25.851 ( 0.000 -0.000 0.000) 0.000 26.123 ( 0.000 -0.000 0.000) 0.000 28.404 ( 0.000 -0.000 0.000) 0.000 28.527 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 12 (7/117) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.050 ( 21.406 0.000 -18.467) 28.271 1.416 ( 37.540 0.000 9.090) 38.624 2.142 ( 39.022 0.000 6.327) 39.532 2.768 ( -18.349 -0.000 -11.418) 21.612 3.257 ( -7.970 -0.000 -5.022) 9.420 3.352 ( 31.066 0.000 8.155) 32.119 3.713 ( 11.362 0.000 33.822) 35.680 4.015 ( 19.796 0.000 -30.232) 36.136 4.472 ( -4.011 -0.000 1.979) 4.473 4.947 ( -8.572 -0.000 -1.673) 8.733 5.081 ( -4.181 -0.000 -1.316) 4.383 5.182 ( 3.952 0.000 -1.994) 4.427 5.250 ( -10.363 -0.000 -5.973) 11.961 5.351 ( 3.574 0.000 -1.657) 3.940 5.586 ( -13.255 -0.000 1.294) 13.318 5.705 ( -10.699 -0.000 0.112) 10.700 5.705 ( -9.319 -0.000 -0.165) 9.320 5.830 ( -5.898 -0.000 8.023) 9.958 6.168 ( -4.889 -0.000 7.939) 9.324 6.170 ( -0.085 -0.000 4.698) 4.699 6.312 ( 1.230 0.000 1.969) 2.321 6.490 ( -7.696 -0.000 -3.196) 8.333 6.816 ( -5.960 -0.000 -2.198) 6.352 6.904 ( 2.476 0.000 -0.846) 2.616 6.978 ( 0.372 0.000 -2.860) 2.884 7.038 ( 0.381 0.000 -5.645) 5.658 7.233 ( 10.311 0.000 8.352) 13.269 7.458 ( 5.093 0.000 2.315) 5.594 7.603 ( 4.082 0.000 3.535) 5.400 7.693 ( 11.013 0.000 -15.325) 18.872 7.745 ( 8.049 0.000 -1.895) 8.269 7.944 ( 1.993 0.000 -3.517) 4.042 7.995 ( 3.688 0.000 -8.749) 9.494 8.133 ( 1.850 0.000 -0.115) 1.854 8.310 ( 4.399 0.000 5.077) 6.717 8.465 ( -2.708 -0.000 3.671) 4.562 8.665 ( 5.381 0.000 9.908) 11.275 8.940 ( 17.699 0.000 4.712) 18.315 9.272 ( 2.970 0.000 -1.721) 3.432 9.400 ( 8.424 0.000 1.487) 8.554 9.593 ( 17.095 0.000 6.407) 18.256 9.598 ( -4.403 -0.000 1.641) 4.699 10.025 ( 7.811 0.000 -10.662) 13.217 10.131 ( -16.901 -0.000 10.221) 19.751 10.789 ( -12.304 -0.000 -7.900) 14.621 10.834 ( 1.543 0.000 -2.080) 2.589 11.436 ( -24.823 -0.000 -3.265) 25.036 11.907 ( -18.576 -0.000 -1.276) 18.620 12.047 ( -9.680 -0.000 9.634) 13.657 12.141 ( 8.903 0.000 6.826) 11.219 12.301 ( -6.973 -0.000 -2.664) 7.464 12.606 ( 9.092 0.000 -2.429) 9.410 12.771 ( -4.043 -0.000 10.522) 11.272 13.053 ( 8.915 0.000 -7.938) 11.936 13.223 ( -4.896 -0.000 -9.176) 10.400 13.520 ( 2.052 0.000 0.562) 2.127 14.748 ( 5.769 0.000 7.166) 9.200 14.757 ( 12.118 0.000 -6.528) 13.765 17.400 ( 0.102 0.000 2.875) 2.877 17.401 ( -4.455 -0.000 -2.445) 5.081 21.368 ( 14.411 0.000 -8.931) 16.954 21.954 ( -2.380 -0.000 26.976) 27.081 23.214 ( 6.588 0.000 -0.259) 6.593 23.290 ( 5.005 0.000 -7.677) 9.164 23.523 ( -1.239 -0.000 7.927) 8.023 23.671 ( -0.533 -0.000 9.735) 9.749 24.822 ( -0.081 -0.000 -28.413) 28.414 25.473 ( -11.611 -0.000 -3.061) 12.008 25.922 ( -1.474 -0.000 1.478) 2.087 26.359 ( -6.257 -0.000 0.995) 6.336 28.185 ( 5.371 0.000 6.308) 8.285 28.588 ( 2.116 0.000 -13.953) 14.113 ======================= Grid point 13 (8/117) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( -0.067 -15.148 -23.199) 27.706 2.120 ( 30.156 -14.230 -8.112) 34.318 2.398 ( 10.654 17.648 9.465) 22.684 2.792 ( 5.602 -19.579 4.908) 20.948 3.307 ( 4.634 -6.076 -13.361) 15.392 3.602 ( -4.061 0.416 18.419) 18.866 4.075 ( 20.772 -8.034 27.626) 35.485 4.353 ( 18.319 4.214 -24.738) 31.070 4.503 ( 1.661 -2.548 -8.587) 9.109 4.787 ( -5.537 3.288 -2.362) 6.859 4.961 ( -8.974 -0.750 2.162) 9.261 5.107 ( 2.137 3.603 -2.939) 5.118 5.229 ( -2.155 1.540 -0.475) 2.691 5.295 ( -6.352 1.782 4.295) 7.873 5.378 ( -3.595 0.410 -0.376) 3.638 5.463 ( -3.978 5.510 -1.816) 7.034 5.628 ( -5.693 -2.743 3.153) 7.063 5.872 ( 3.957 -4.507 3.357) 6.874 6.131 ( -4.779 -1.332 3.630) 6.148 6.133 ( -0.530 -0.230 5.935) 5.963 6.194 ( -14.978 3.336 -1.838) 15.455 6.357 ( -1.565 -2.247 4.296) 5.094 6.709 ( -5.101 3.618 -0.507) 6.274 6.918 ( 0.299 7.528 -0.660) 7.562 6.963 ( 2.829 7.272 0.059) 7.803 7.057 ( 3.126 0.157 -6.661) 7.359 7.416 ( 8.055 1.275 -2.260) 8.462 7.587 ( 8.439 -0.697 2.606) 8.859 7.662 ( 6.226 2.210 0.262) 6.612 7.760 ( 2.679 5.610 -1.946) 6.514 7.953 ( 9.498 -6.245 -8.986) 14.490 8.052 ( 10.342 -1.706 -5.799) 11.979 8.145 ( 2.840 -2.762 -2.887) 4.902 8.197 ( 8.619 -6.013 -6.966) 12.608 8.404 ( -0.405 -1.512 7.069) 7.240 8.414 ( -0.318 -2.730 3.311) 4.303 8.779 ( 5.331 -2.144 9.226) 10.869 9.145 ( 5.148 1.959 -4.620) 7.189 9.337 ( 3.711 -1.000 -0.181) 3.848 9.547 ( 3.756 3.143 -1.367) 5.085 9.616 ( 12.118 1.208 11.859) 16.999 9.862 ( -9.473 2.771 6.235) 11.674 9.891 ( 11.330 0.962 6.536) 13.116 10.132 ( 3.844 1.990 -8.899) 9.896 10.539 ( -12.484 -0.371 -5.588) 13.683 10.806 ( -4.474 2.465 1.903) 5.451 10.958 ( -25.640 -2.039 -7.004) 26.658 11.475 ( -29.034 -2.555 0.849) 29.159 11.917 ( -3.759 1.004 1.443) 4.150 12.154 ( -5.780 4.688 3.136) 8.076 12.349 ( 9.055 -2.023 9.457) 13.248 12.700 ( 2.753 1.544 3.292) 4.561 12.776 ( 1.036 -5.860 -0.005) 5.951 13.087 ( -5.408 2.671 -9.327) 11.107 13.223 ( 7.279 -2.030 -9.916) 12.468 13.584 ( 4.587 1.547 3.364) 5.895 14.820 ( 4.146 3.636 5.430) 7.740 14.944 ( 7.639 -0.855 -4.081) 8.703 17.305 ( -5.128 0.951 -2.389) 5.737 17.396 ( -0.953 -0.151 2.494) 2.674 21.606 ( 11.876 -0.689 -11.368) 16.454 21.909 ( -1.765 3.643 18.314) 18.756 23.229 ( 1.914 6.596 -2.746) 7.397 23.441 ( 4.692 -8.020 -7.311) 11.823 23.575 ( 7.344 0.873 8.698) 11.417 23.680 ( -0.282 -2.144 9.822) 10.057 24.770 ( -2.625 5.622 -17.480) 18.548 25.273 ( -12.435 -6.327 -2.105) 14.109 25.896 ( -2.063 -0.747 0.876) 2.362 26.249 ( -5.624 0.318 1.751) 5.898 28.295 ( 5.956 0.317 3.442) 6.887 28.594 ( 1.216 2.729 -4.560) 5.451 ======================= Grid point 14 (9/117) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.464 ( 5.700 -17.600 -20.689) 27.754 2.443 ( 13.589 5.151 -12.305) 19.042 2.816 ( 19.368 -14.105 2.177) 24.058 3.047 ( 1.383 -5.364 22.414) 23.088 3.243 ( -3.517 5.742 -5.812) 8.895 3.632 ( 3.750 -16.743 4.779) 17.810 4.226 ( -17.064 -0.806 -7.773) 18.768 4.487 ( 6.056 3.377 10.008) 12.175 4.589 ( 6.406 -9.483 2.620) 11.740 4.773 ( 7.521 4.584 -9.866) 13.225 4.934 ( -5.341 3.225 -6.300) 8.866 5.036 ( 3.526 6.551 3.737) 8.325 5.126 ( -3.936 4.056 2.364) 6.126 5.232 ( -1.703 0.161 2.913) 3.378 5.394 ( 7.305 -2.926 1.196) 7.960 5.517 ( 6.105 0.105 -5.412) 8.160 5.576 ( -3.135 -3.770 5.013) 7.012 5.901 ( -11.696 2.189 -2.130) 12.088 6.002 ( 4.505 -3.115 -0.869) 5.545 6.030 ( -5.275 1.568 1.595) 5.729 6.174 ( -0.899 -1.967 8.880) 9.140 6.369 ( 0.937 -2.822 1.334) 3.259 6.573 ( -4.006 6.616 2.648) 8.175 6.798 ( -5.326 4.355 1.099) 6.967 6.905 ( 3.563 14.131 -3.038) 14.887 7.143 ( 6.971 2.713 -3.959) 8.463 7.491 ( 3.576 2.595 -6.516) 7.873 7.710 ( -0.479 -3.206 1.055) 3.409 7.740 ( 5.061 3.463 -4.421) 7.560 7.834 ( 7.847 -6.299 0.286) 10.067 8.056 ( 0.290 3.272 -1.807) 3.749 8.228 ( 3.552 -7.192 -7.137) 10.737 8.266 ( -1.067 -5.798 2.279) 6.321 8.402 ( 13.095 -3.038 0.307) 13.446 8.434 ( 3.088 -1.698 4.415) 5.649 8.531 ( 8.815 -4.017 0.526) 9.701 8.917 ( 7.177 -2.112 4.090) 8.526 9.129 ( -0.964 2.755 -3.250) 4.368 9.378 ( -4.048 -2.137 2.446) 5.189 9.554 ( 1.080 3.649 -4.181) 5.654 9.749 ( 7.345 6.291 -0.332) 9.676 9.869 ( 9.952 3.133 6.684) 12.391 9.955 ( -18.332 5.066 0.437) 19.024 10.013 ( 6.812 4.505 -0.507) 8.182 10.341 ( -15.565 -3.500 1.470) 16.022 10.679 ( -4.313 -2.218 -8.418) 9.715 10.715 ( -1.982 0.567 5.911) 6.260 10.970 ( -27.989 -3.706 1.887) 28.296 11.890 ( 2.469 3.125 -6.802) 7.882 12.003 ( -5.601 5.075 4.857) 8.984 12.492 ( 5.337 1.119 6.030) 8.130 12.753 ( 1.915 -1.152 6.965) 7.315 12.845 ( 0.175 -5.364 -4.231) 6.834 12.962 ( -6.260 -3.045 -3.954) 8.006 13.352 ( 4.779 -1.053 -5.404) 7.290 13.640 ( 4.254 3.401 -0.067) 5.447 14.836 ( 0.721 2.957 2.785) 4.126 15.039 ( 2.464 -0.481 -1.726) 3.047 17.212 ( -3.373 1.329 -0.984) 3.757 17.377 ( -1.241 -0.180 0.982) 1.592 21.781 ( 6.759 -1.657 -11.387) 13.346 21.858 ( -1.035 3.400 12.752) 13.238 23.201 ( -1.327 0.421 0.573) 1.505 23.562 ( 2.756 -4.872 -6.409) 8.509 23.688 ( 1.345 -1.985 8.890) 9.208 23.757 ( 8.007 0.482 4.232) 9.069 24.620 ( -2.122 11.387 -9.554) 15.015 25.167 ( -7.094 -8.155 -1.497) 10.912 25.864 ( -2.083 -0.598 -0.339) 2.194 26.162 ( -3.728 0.258 1.751) 4.126 28.380 ( 3.344 0.340 0.522) 3.402 28.574 ( -0.686 2.148 -0.218) 2.265 ======================= Grid point 15 (10/117) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( 17.198 -10.030 -5.309) 20.605 2.647 ( 10.418 2.807 -4.030) 11.518 2.865 ( -10.043 5.862 9.121) 14.779 2.923 ( -1.927 1.258 -8.038) 8.361 3.549 ( 18.893 -11.418 5.542) 22.760 3.935 ( 2.634 -13.125 -1.921) 13.524 4.114 ( 6.166 -12.914 -1.686) 14.409 4.308 ( -11.311 17.734 -2.554) 21.188 4.633 ( -8.312 1.190 -4.246) 9.409 4.731 ( -5.373 -0.761 10.540) 11.855 4.848 ( 6.187 3.033 -4.317) 8.131 5.042 ( -0.497 2.120 -2.295) 3.164 5.207 ( 7.390 -7.035 7.334) 12.566 5.369 ( 11.233 3.365 1.022) 11.771 5.514 ( 1.055 -0.973 0.720) 1.606 5.533 ( 0.156 0.073 -1.131) 1.144 5.596 ( -4.161 -4.840 -6.363) 9.012 5.661 ( -7.428 3.543 1.243) 8.323 6.010 ( 4.040 2.763 -0.379) 4.909 6.050 ( -1.188 -0.245 3.126) 3.354 6.112 ( -4.233 4.396 8.877) 10.773 6.378 ( 0.181 5.612 -1.180) 5.738 6.521 ( 0.155 -2.272 1.282) 2.614 6.688 ( -3.218 0.448 0.062) 3.250 6.851 ( 4.412 10.949 -3.965) 12.452 7.215 ( 3.340 2.730 -1.277) 4.499 7.491 ( -0.805 2.937 -0.860) 3.164 7.677 ( -4.703 -4.424 -0.986) 6.531 7.811 ( 0.508 -3.264 -0.502) 3.341 7.948 ( -2.868 1.164 -1.219) 3.327 8.050 ( 4.437 -2.150 -1.992) 5.317 8.302 ( -1.391 -9.044 -3.267) 9.716 8.305 ( -2.450 -0.398 -3.000) 3.894 8.440 ( -2.241 -0.938 6.024) 6.495 8.513 ( -0.153 -4.082 3.420) 5.328 8.744 ( -2.046 -4.235 -3.647) 5.952 9.070 ( 14.295 -0.113 1.040) 14.333 9.191 ( -13.289 4.723 -0.027) 14.104 9.273 ( 15.565 -3.864 -1.847) 16.144 9.457 ( -14.170 4.940 0.045) 15.006 9.632 ( -3.113 -0.372 2.866) 4.248 9.772 ( -3.274 4.683 -1.591) 5.931 9.900 ( -3.062 4.574 3.883) 6.736 10.052 ( -13.348 -1.051 -0.035) 13.389 10.184 ( 7.332 -0.918 -5.456) 9.186 10.643 ( -2.217 -1.613 -0.981) 2.912 10.703 ( 7.656 0.072 2.409) 8.026 10.795 ( 3.264 -0.392 3.652) 4.914 11.876 ( -3.361 4.238 4.276) 6.895 11.916 ( 4.835 4.277 -8.997) 11.074 12.527 ( -0.186 2.225 2.070) 3.045 12.759 ( -0.261 -0.400 -1.667) 1.734 12.877 ( -2.810 -5.936 -2.179) 6.920 12.954 ( -1.533 -6.446 9.076) 11.238 13.382 ( -3.289 -2.616 3.286) 5.335 13.679 ( 5.128 6.000 -7.176) 10.668 14.790 ( -3.977 0.215 -1.260) 4.177 15.049 ( -1.800 -1.173 0.605) 2.232 17.172 ( 0.668 1.491 1.511) 2.226 17.362 ( -0.630 -0.453 -1.126) 1.367 21.806 ( -1.801 1.176 1.849) 2.837 21.873 ( 1.153 -0.765 -2.361) 2.736 23.159 ( -5.364 -3.554 4.393) 7.792 23.624 ( -0.414 -3.418 -4.747) 5.864 23.734 ( 2.034 -1.423 2.535) 3.548 23.866 ( 5.776 4.616 0.260) 7.398 24.512 ( 3.061 10.227 -2.258) 10.912 25.166 ( -0.521 -5.861 -0.092) 5.885 25.844 ( -0.220 -0.569 -1.823) 1.923 26.119 ( -1.039 -0.352 1.770) 2.083 28.402 ( -0.785 -0.123 -1.288) 1.513 28.529 ( -3.075 0.184 1.682) 3.509 ======================= Grid point 16 (11/117) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( 5.674 7.192 6.516) 11.241 2.541 ( -6.752 12.640 4.736) 15.092 2.904 ( 13.499 -6.160 -4.827) 15.604 3.081 ( 16.918 0.686 -8.297) 18.855 3.707 ( -18.193 17.552 -7.172) 26.277 3.998 ( 8.973 -8.556 -1.238) 12.460 4.042 ( 0.877 -5.992 8.594) 10.514 4.493 ( 3.697 -2.717 -2.548) 5.248 4.563 ( 10.589 -3.263 3.286) 11.557 4.658 ( -3.365 -4.190 5.862) 7.953 4.927 ( 0.343 -0.005 -6.615) 6.624 5.023 ( -0.171 1.193 -2.385) 2.673 5.258 ( -2.501 10.888 0.265) 11.175 5.339 ( -6.303 -0.876 5.700) 8.543 5.439 ( -3.290 8.426 -7.894) 12.006 5.528 ( 4.715 6.419 5.043) 9.426 5.600 ( -0.058 -11.938 -1.417) 12.022 5.695 ( -1.011 -1.477 0.208) 1.802 5.944 ( -4.927 0.883 6.220) 7.984 6.080 ( 2.346 -0.625 1.507) 2.858 6.100 ( 8.244 2.429 -0.842) 8.635 6.319 ( -0.130 5.232 0.120) 5.235 6.510 ( -4.529 -4.229 -0.516) 6.218 6.697 ( 2.741 -0.165 0.208) 2.754 6.840 ( 3.861 6.447 -3.754) 8.401 7.154 ( -5.927 6.621 -2.302) 9.179 7.408 ( -6.237 0.252 7.571) 9.812 7.653 ( -5.388 -7.784 3.574) 10.119 7.790 ( -6.351 -3.731 -3.986) 8.375 7.874 ( -4.324 1.024 -1.762) 4.780 8.014 ( -9.687 0.318 -0.529) 9.706 8.172 ( -4.638 -2.915 -8.098) 9.777 8.390 ( -4.470 -2.193 2.626) 5.629 8.416 ( 0.971 -4.064 1.270) 4.367 8.564 ( -4.403 -1.534 -0.371) 4.678 8.638 ( -4.105 -1.329 3.892) 5.811 8.927 ( -7.810 3.141 -3.432) 9.090 9.152 ( -12.700 3.537 2.819) 13.482 9.293 ( 3.436 -3.930 -2.807) 5.927 9.529 ( 3.184 -0.553 -3.906) 5.070 9.565 ( -9.649 -2.019 4.311) 10.759 9.650 ( -5.568 -4.839 4.209) 8.494 9.834 ( 1.780 -0.500 -1.862) 2.624 9.891 ( 0.426 1.088 0.230) 1.191 10.330 ( 5.409 -5.178 -4.673) 8.826 10.693 ( 5.486 0.584 -2.959) 6.261 10.826 ( 5.839 4.095 7.375) 10.259 11.110 ( 31.189 2.132 -0.698) 31.269 11.825 ( 2.101 3.291 -0.070) 3.906 11.961 ( 4.354 2.618 -6.700) 8.408 12.469 ( -3.552 0.946 1.986) 4.178 12.757 ( -3.570 -3.562 -9.118) 10.420 12.886 ( 0.436 -2.548 4.816) 5.466 12.969 ( -4.745 -4.922 12.646) 14.376 13.317 ( -6.479 -3.294 7.569) 10.493 13.668 ( 0.126 5.967 -9.918) 11.575 14.705 ( -5.715 -2.455 -5.007) 7.985 15.003 ( -5.366 -2.471 2.332) 6.351 17.208 ( 4.525 1.498 3.755) 6.068 17.363 ( 0.224 -0.739 -2.926) 3.026 21.752 ( -4.350 -0.748 -3.351) 5.542 21.841 ( -4.769 0.327 2.991) 5.639 23.084 ( -7.697 -5.084 4.896) 10.443 23.599 ( -5.876 -3.828 -0.362) 7.022 23.769 ( 0.757 1.840 -4.171) 4.621 23.885 ( 3.351 6.929 -4.275) 8.804 24.544 ( 10.540 7.863 4.129) 13.783 25.259 ( 5.558 -3.406 1.063) 6.604 25.871 ( 2.741 -0.574 -2.839) 3.988 26.137 ( 2.206 -0.956 1.888) 3.057 28.356 ( -4.518 -0.783 -2.483) 5.215 28.465 ( -5.442 -2.613 2.777) 6.645 ======================= Grid point 17 (12/117) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( -0.498 4.991 -1.158) 5.148 2.316 ( 1.393 24.015 2.830) 24.221 3.050 ( -15.080 18.299 -7.253) 24.797 3.258 ( 9.779 3.243 -6.260) 12.056 3.429 ( 17.869 7.520 6.326) 20.393 4.034 ( -7.161 -6.465 10.277) 14.096 4.193 ( 3.623 4.521 -2.099) 6.162 4.512 ( -5.635 12.835 4.699) 14.784 4.583 ( 4.411 -4.940 2.682) 7.146 4.754 ( -10.203 8.449 -4.763) 14.077 4.904 ( 4.910 -8.125 -2.171) 9.739 5.018 ( -7.531 -2.926 -1.533) 8.223 5.090 ( -4.190 -0.551 -2.313) 4.818 5.113 ( -5.195 8.510 -4.438) 10.913 5.394 ( 10.531 5.584 -1.075) 11.968 5.513 ( 0.152 4.291 7.868) 8.964 5.679 ( 2.307 -0.973 0.611) 2.577 5.846 ( 7.740 -19.096 1.523) 20.661 5.971 ( 5.063 -3.399 -0.030) 6.098 6.133 ( 2.381 1.905 -4.125) 5.130 6.189 ( 2.156 -0.084 -3.468) 4.085 6.328 ( 3.385 1.298 -0.495) 3.659 6.436 ( -6.990 -0.382 1.300) 7.120 6.738 ( 1.432 0.002 -2.086) 2.530 6.812 ( -2.146 3.968 4.502) 6.373 7.002 ( -0.837 1.612 -6.514) 6.763 7.286 ( -8.723 -2.010 6.668) 11.162 7.515 ( -15.604 -2.890 3.750) 16.306 7.676 ( -9.054 -2.178 -2.296) 9.591 7.781 ( -7.314 -4.707 -0.079) 8.698 7.924 ( -0.845 -1.018 2.144) 2.519 8.058 ( -12.192 0.220 -4.402) 12.964 8.278 ( -4.775 1.173 5.341) 7.260 8.397 ( -3.909 1.259 0.326) 4.119 8.497 ( 0.959 1.993 -6.199) 6.582 8.601 ( -2.255 3.002 5.728) 6.849 8.799 ( -9.366 -3.074 5.244) 11.166 9.006 ( -5.463 -4.171 1.207) 6.979 9.213 ( -12.057 -9.464 -11.518) 19.173 9.450 ( -4.193 2.205 -1.582) 4.995 9.547 ( 1.637 -2.528 -5.670) 6.420 9.679 ( 0.598 -3.008 -0.292) 3.081 9.862 ( 4.823 -1.243 -5.173) 7.181 9.982 ( 0.455 -3.188 9.492) 10.024 10.448 ( 1.621 -8.485 8.034) 11.797 10.663 ( -4.342 0.084 -5.666) 7.139 11.135 ( 27.748 5.127 5.012) 28.660 11.651 ( 29.567 4.063 -1.125) 29.866 11.890 ( 8.231 2.819 -7.334) 11.379 12.017 ( 3.626 -0.965 -2.384) 4.445 12.391 ( -4.677 0.691 0.893) 4.811 12.685 ( -6.376 -3.056 -8.605) 11.137 12.892 ( -10.032 -6.353 13.431) 17.927 12.932 ( 1.915 0.593 4.698) 5.107 13.255 ( -3.609 -2.441 8.518) 9.567 13.557 ( -6.498 1.806 -9.628) 11.755 14.640 ( -3.836 -2.614 -6.193) 7.739 14.905 ( -8.873 -3.177 2.817) 9.837 17.294 ( 5.186 0.689 3.825) 6.481 17.382 ( 1.865 -0.140 -2.875) 3.430 21.618 ( -12.232 -1.186 -0.894) 12.321 21.740 ( -6.146 -1.617 -0.334) 6.364 22.998 ( -7.828 -5.556 3.384) 10.179 23.489 ( -10.908 -4.497 1.684) 11.918 23.698 ( -3.907 5.775 -2.046) 7.267 23.861 ( 2.394 7.538 -6.548) 10.268 24.748 ( 18.495 5.575 4.126) 19.753 25.423 ( 9.675 -1.323 1.561) 9.889 25.938 ( 4.141 0.331 -2.572) 4.886 26.220 ( 5.770 -1.092 1.932) 6.182 28.262 ( -6.318 -1.212 -3.852) 7.498 28.387 ( -7.971 -5.691 4.543) 10.797 ======================= Grid point 18 (13/117) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( -18.778 7.073 -15.628) 25.434 2.007 ( -10.302 31.431 -8.540) 34.161 2.757 ( 10.585 29.959 21.086) 38.134 3.128 ( -10.996 8.842 -2.924) 14.410 3.697 ( 6.157 15.054 4.793) 16.956 3.889 ( -5.339 27.207 -1.283) 27.755 3.908 ( -17.057 8.408 -0.905) 19.038 4.197 ( -5.727 5.830 -2.079) 8.433 4.440 ( -6.922 4.669 5.752) 10.140 4.729 ( 0.505 -6.403 1.382) 6.570 4.903 ( -3.137 -4.856 0.229) 5.786 5.008 ( 8.354 -8.547 -2.345) 12.180 5.222 ( 5.589 -8.587 -4.556) 11.213 5.277 ( 12.036 -4.843 -0.780) 12.998 5.386 ( -0.831 6.017 4.577) 7.605 5.696 ( 14.276 0.688 2.059) 14.440 5.777 ( 8.012 0.176 1.790) 8.211 6.041 ( -0.892 -2.411 -2.677) 3.712 6.118 ( 0.661 -3.963 -0.456) 4.044 6.186 ( 2.746 -0.938 -6.510) 7.127 6.248 ( -0.487 -12.792 -3.623) 13.304 6.263 ( 1.475 2.903 -3.480) 4.766 6.397 ( 2.684 -3.544 5.334) 6.944 6.707 ( -4.274 -0.154 1.732) 4.614 6.812 ( -0.380 -2.897 -0.519) 2.968 7.006 ( -1.628 -1.277 -2.258) 3.063 7.167 ( -8.838 -6.258 -3.178) 11.285 7.274 ( -8.862 -0.657 -0.567) 8.905 7.516 ( -8.383 1.462 -2.015) 8.744 7.656 ( -10.701 -2.322 7.727) 13.402 7.807 ( -11.885 -1.552 2.463) 12.236 7.949 ( 0.828 -0.572 5.841) 5.928 8.250 ( 0.587 3.409 5.650) 6.625 8.268 ( -3.029 3.670 0.488) 4.783 8.528 ( -0.357 0.126 1.004) 1.073 8.555 ( -0.037 1.162 -2.142) 2.437 8.605 ( -15.574 -5.333 0.750) 16.479 8.907 ( -7.744 -1.685 -15.407) 17.326 9.165 ( -4.315 -6.235 0.462) 7.596 9.368 ( -2.266 1.111 0.992) 2.712 9.629 ( 3.420 -0.126 -2.203) 4.070 9.689 ( 1.566 -3.568 -13.713) 14.256 9.881 ( -8.648 0.359 16.306) 18.460 10.086 ( 12.740 -4.328 -7.598) 15.452 10.594 ( -2.031 -8.868 7.719) 11.931 10.642 ( 6.141 -4.284 4.400) 8.685 11.575 ( 23.578 4.246 0.332) 23.960 11.921 ( 0.725 -0.628 -9.110) 9.160 12.069 ( 12.419 5.140 5.800) 14.639 12.144 ( 9.100 -2.733 0.959) 9.550 12.314 ( 0.369 3.441 -5.561) 6.550 12.571 ( -8.176 -1.228 -4.617) 9.469 12.804 ( -8.040 -9.485 6.788) 14.167 12.939 ( 1.050 2.550 -0.038) 2.758 13.248 ( -0.073 -1.796 7.371) 7.587 13.445 ( -4.282 -2.703 -4.315) 6.653 14.587 ( -5.161 -1.872 -1.775) 5.770 14.759 ( -9.386 -2.110 -1.024) 9.675 17.359 ( 1.059 -2.277 -0.818) 2.642 17.444 ( 6.606 3.268 1.756) 7.576 21.364 ( -15.771 -0.780 3.639) 16.204 21.633 ( -11.260 -7.615 -8.892) 16.244 22.912 ( -8.379 -5.921 3.519) 10.847 23.301 ( -14.325 -4.587 3.009) 15.340 23.541 ( -5.041 8.386 1.237) 9.862 23.820 ( 1.686 7.354 -6.533) 9.980 25.084 ( 23.110 4.275 1.644) 23.559 25.621 ( 11.507 0.711 1.356) 11.609 25.994 ( 3.363 2.148 -1.154) 4.154 26.364 ( 9.132 -0.127 2.174) 9.388 28.161 ( -5.431 -1.248 -5.329) 7.710 28.288 ( -11.760 -8.944 8.346) 16.969 ======================= Grid point 19 (14/117) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.227 ( -29.905 18.449 -18.009) 39.484 1.415 ( -16.037 36.301 -4.762) 39.971 2.348 ( -10.676 60.238 10.842) 62.130 2.781 ( -26.011 6.601 2.560) 26.958 3.380 ( 8.629 15.261 2.112) 17.658 3.692 ( 4.616 13.280 -5.309) 15.028 3.875 ( 10.837 10.134 2.476) 15.042 3.992 ( -5.620 20.703 2.715) 21.624 4.457 ( 3.574 -5.913 -1.038) 6.987 4.733 ( -11.529 -9.264 -2.638) 15.024 4.985 ( 2.298 -7.224 5.681) 9.473 5.186 ( 1.960 -6.479 1.988) 7.055 5.322 ( -0.579 3.669 3.271) 4.949 5.399 ( 5.165 -4.324 -1.255) 6.852 5.546 ( 11.835 -3.131 -0.822) 12.270 5.755 ( 1.704 5.287 3.443) 6.536 5.938 ( 4.666 1.879 -4.643) 6.845 6.015 ( -10.220 -9.048 -2.490) 13.875 6.153 ( 6.510 -1.631 -5.543) 8.705 6.200 ( 5.824 1.530 4.268) 7.381 6.272 ( 4.254 -0.494 -4.453) 6.178 6.493 ( 3.287 -9.525 0.207) 10.079 6.556 ( 3.549 -7.822 0.724) 8.620 6.620 ( -5.425 -8.281 -2.025) 10.105 6.767 ( -7.523 -3.867 0.924) 8.508 6.944 ( -4.959 -2.935 -2.091) 6.130 7.068 ( -7.615 -7.034 3.671) 10.997 7.235 ( -2.922 -1.901 -3.970) 5.284 7.383 ( -4.302 0.296 -0.614) 4.355 7.557 ( -0.160 -3.102 -0.022) 3.106 7.666 ( -4.810 1.536 3.034) 5.890 7.980 ( 2.379 1.391 7.992) 8.454 8.174 ( -0.370 6.054 -2.826) 6.691 8.279 ( -0.248 -2.272 3.810) 4.443 8.385 ( -9.666 -4.499 0.973) 10.706 8.483 ( -2.621 -0.149 2.882) 3.898 8.583 ( 1.286 0.727 0.619) 1.601 8.738 ( -7.501 4.631 -20.951) 22.730 9.104 ( -7.574 -2.539 3.271) 8.632 9.321 ( -1.865 3.058 2.865) 4.587 9.665 ( 2.036 -2.262 -0.860) 3.162 9.764 ( -5.112 -2.866 16.208) 17.235 9.854 ( 18.605 4.141 -16.834) 25.430 10.382 ( 12.286 -6.461 -4.533) 14.602 10.642 ( -0.048 -8.338 -4.238) 9.353 10.827 ( 6.592 -2.834 13.730) 15.492 11.803 ( -8.999 -0.155 -1.159) 9.075 11.883 ( 6.726 -2.744 -0.934) 7.324 12.073 ( -8.964 -2.433 7.300) 11.814 12.281 ( 1.049 2.627 -0.278) 2.843 12.318 ( 1.510 2.448 -9.344) 9.777 12.521 ( 6.323 -1.242 1.081) 6.533 12.781 ( -2.955 -5.699 -0.956) 6.491 12.941 ( 1.758 3.242 -3.908) 5.373 13.298 ( 2.727 -0.395 4.525) 5.298 13.464 ( 2.001 -4.852 0.942) 5.332 14.472 ( -9.253 -3.760 4.694) 11.036 14.648 ( -2.246 2.132 -6.910) 7.572 17.398 ( 0.754 -3.154 -1.159) 3.444 17.538 ( 8.319 5.629 2.121) 10.266 21.118 ( -11.511 -1.129 3.044) 11.960 21.414 ( -26.166 -14.074 -13.924) 32.812 22.793 ( -12.134 -5.613 7.284) 15.225 23.109 ( -9.218 -2.260 1.759) 9.653 23.378 ( -3.496 8.681 1.841) 9.537 23.771 ( 0.794 6.435 -4.399) 7.835 25.465 ( 19.407 0.174 -0.400) 19.412 25.826 ( 13.144 2.509 -0.406) 13.387 26.026 ( 5.506 5.161 0.351) 7.555 26.554 ( 14.532 3.369 2.055) 15.058 28.090 ( -6.582 -3.731 -1.206) 7.661 28.123 ( -17.114 -9.622 11.150) 22.579 ======================= Grid point 20 (15/117) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.580 ( 0.000 29.642 0.000) 29.642 0.836 ( 0.000 42.754 0.000) 42.754 1.523 ( 0.000 76.954 0.000) 76.954 2.419 ( 0.000 5.893 0.000) 5.893 3.430 ( 0.000 3.539 0.000) 3.539 3.662 ( 0.000 11.712 0.000) 11.712 3.714 ( 0.000 19.561 0.000) 19.561 3.966 ( 0.000 7.481 0.000) 7.481 4.522 ( -0.000 -3.685 -0.000) 3.685 4.601 ( -0.000 -4.440 -0.000) 4.440 5.063 ( -0.000 -6.680 -0.000) 6.680 5.234 ( -0.000 -2.980 -0.000) 2.980 5.283 ( 0.000 1.333 0.000) 1.333 5.425 ( 0.000 7.003 0.000) 7.003 5.707 ( 0.000 0.753 0.000) 0.753 5.804 ( -0.000 -6.019 -0.000) 6.019 5.931 ( -0.000 -2.692 -0.000) 2.692 5.971 ( 0.000 0.932 0.000) 0.932 6.171 ( -0.000 -0.612 -0.000) 0.612 6.293 ( -0.000 -1.554 -0.000) 1.554 6.296 ( 0.000 1.893 0.000) 1.893 6.545 ( 0.000 0.722 0.000) 0.722 6.660 ( -0.000 -3.142 -0.000) 3.142 6.692 ( -0.000 -5.891 -0.000) 5.891 6.707 ( -0.000 -11.727 -0.000) 11.727 6.971 ( -0.000 -7.817 -0.000) 7.817 7.020 ( -0.000 -2.552 -0.000) 2.552 7.258 ( -0.000 -12.773 -0.000) 12.773 7.357 ( -0.000 -2.381 -0.000) 2.381 7.544 ( 0.000 6.354 0.000) 6.354 7.650 ( 0.000 0.182 0.000) 0.182 7.993 ( 0.000 2.859 0.000) 2.859 8.109 ( 0.000 5.701 0.000) 5.701 8.302 ( -0.000 -10.416 -0.000) 10.416 8.352 ( 0.000 7.957 0.000) 7.957 8.475 ( -0.000 -2.717 -0.000) 2.717 8.577 ( 0.000 4.733 0.000) 4.733 8.626 ( -0.000 -2.385 -0.000) 2.385 9.013 ( -0.000 -0.374 -0.000) 0.374 9.268 ( 0.000 4.016 0.000) 4.016 9.714 ( -0.000 -0.585 -0.000) 0.585 9.758 ( -0.000 -5.283 -0.000) 5.283 10.310 ( -0.000 -10.382 -0.000) 10.382 10.492 ( -0.000 -6.374 -0.000) 6.374 10.711 ( -0.000 -9.301 -0.000) 9.301 11.024 ( 0.000 7.312 0.000) 7.312 11.404 ( 0.000 0.902 0.000) 0.902 11.975 ( -0.000 -0.046 -0.000) 0.046 12.006 ( -0.000 -2.095 -0.000) 2.095 12.251 ( 0.000 2.557 0.000) 2.557 12.282 ( 0.000 3.111 0.000) 3.111 12.655 ( -0.000 -5.102 -0.000) 5.102 12.824 ( -0.000 -1.314 -0.000) 1.314 12.896 ( 0.000 3.526 0.000) 3.526 13.320 ( 0.000 0.852 0.000) 0.852 13.549 ( -0.000 -4.548 -0.000) 4.548 14.419 ( -0.000 -4.165 -0.000) 4.165 14.610 ( 0.000 3.269 0.000) 3.269 17.444 ( -0.000 -3.654 -0.000) 3.654 17.617 ( 0.000 3.756 0.000) 3.756 20.994 ( -0.000 -0.462 -0.000) 0.462 21.033 ( 0.000 0.391 0.000) 0.391 22.656 ( 0.000 0.782 0.000) 0.782 23.044 ( -0.000 -0.945 -0.000) 0.945 23.269 ( 0.000 6.729 0.000) 6.729 23.722 ( 0.000 4.641 0.000) 4.641 25.662 ( -0.000 -3.090 -0.000) 3.090 25.942 ( -0.000 -0.772 -0.000) 0.772 26.157 ( -0.000 -0.766 -0.000) 0.766 26.876 ( -0.000 -3.297 -0.000) 3.297 27.779 ( -0.000 -0.066 -0.000) 0.066 28.082 ( -0.000 -0.562 -0.000) 0.562 ======================= Grid point 23 (16/117) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( 9.693 0.000 -29.993) 31.520 2.454 ( 17.807 0.000 -27.157) 32.474 2.822 ( 9.572 0.000 0.318) 9.577 2.862 ( 17.372 0.000 40.829) 44.371 3.309 ( 1.462 0.000 -14.143) 14.218 3.489 ( -2.685 -0.000 10.591) 10.926 4.205 ( -22.225 -0.000 -7.821) 23.561 4.405 ( 17.116 0.000 20.870) 26.990 4.579 ( -2.511 -0.000 -4.007) 4.728 4.864 ( 16.495 0.000 -16.467) 23.307 4.915 ( -0.348 -0.000 -0.206) 0.404 5.145 ( -3.110 -0.000 -3.923) 5.006 5.210 ( -6.854 -0.000 6.043) 9.137 5.259 ( 7.593 0.000 4.934) 9.055 5.323 ( -6.870 -0.000 1.971) 7.147 5.504 ( -5.631 -0.000 5.506) 7.875 5.522 ( 6.715 0.000 -5.361) 8.592 5.922 ( -11.611 -0.000 -1.238) 11.677 5.980 ( 8.078 0.000 -3.167) 8.677 6.024 ( -3.929 -0.000 2.402) 4.605 6.147 ( -0.540 -0.000 12.777) 12.788 6.350 ( 1.801 0.000 0.914) 2.020 6.612 ( -6.096 -0.000 -1.733) 6.338 6.865 ( -7.392 -0.000 5.636) 9.295 7.129 ( 4.955 0.000 -5.858) 7.673 7.129 ( 6.935 0.000 -4.133) 8.073 7.506 ( 1.529 0.000 -6.866) 7.034 7.669 ( -1.058 -0.000 3.898) 4.039 7.756 ( 10.216 0.000 -2.158) 10.441 7.914 ( 2.017 0.000 -5.231) 5.607 7.976 ( 5.777 0.000 -9.392) 11.026 8.139 ( -0.952 -0.000 -1.941) 2.162 8.193 ( -5.573 -0.000 2.517) 6.115 8.350 ( 15.941 0.000 -0.403) 15.946 8.441 ( 3.515 0.000 5.845) 6.820 8.489 ( 9.805 0.000 0.136) 9.806 8.889 ( 8.528 0.000 7.610) 11.430 9.166 ( -2.542 -0.000 -2.858) 3.825 9.349 ( -2.897 -0.000 1.839) 3.431 9.595 ( 1.812 0.000 -6.781) 7.019 9.841 ( 9.159 0.000 -1.745) 9.324 9.878 ( 6.647 0.000 11.013) 12.864 10.015 ( -17.651 -0.000 -3.067) 17.916 10.066 ( 4.265 0.000 4.114) 5.925 10.295 ( -13.052 -0.000 -1.126) 13.101 10.651 ( -2.730 -0.000 -8.974) 9.380 10.725 ( -5.262 -0.000 6.226) 8.151 10.930 ( -27.244 -0.000 2.155) 27.329 11.920 ( 2.479 0.000 -4.902) 5.493 12.073 ( -4.731 -0.000 0.898) 4.815 12.502 ( 6.449 0.000 10.735) 12.523 12.740 ( 2.133 0.000 9.524) 9.760 12.773 ( 0.628 0.000 -5.829) 5.863 12.936 ( -9.474 -0.000 -7.308) 11.965 13.336 ( 3.935 0.000 -3.415) 5.210 13.679 ( 5.377 0.000 -1.978) 5.729 14.867 ( -1.125 -0.000 2.926) 3.135 15.031 ( 2.461 0.000 -2.238) 3.327 17.229 ( -3.257 -0.000 -0.781) 3.350 17.373 ( -1.476 -0.000 0.947) 1.754 21.763 ( 6.935 0.000 -12.961) 14.700 21.896 ( -2.471 -0.000 15.193) 15.393 23.206 ( -5.514 -0.000 4.133) 6.891 23.492 ( 5.048 0.000 -9.448) 10.712 23.677 ( 1.162 0.000 6.984) 7.080 23.766 ( 11.160 0.000 5.030) 12.241 24.796 ( 0.836 0.000 -13.591) 13.616 25.028 ( -9.117 -0.000 1.607) 9.258 25.857 ( -1.838 -0.000 -0.494) 1.903 26.164 ( -4.104 -0.000 2.374) 4.741 28.383 ( 3.130 0.000 0.182) 3.135 28.596 ( -1.966 -0.000 0.207) 1.977 ======================= Grid point 24 (17/117) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( 25.639 -7.340 -12.730) 29.552 2.734 ( 13.194 5.052 -10.689) 17.716 2.872 ( 0.470 -4.448 0.017) 4.473 2.955 ( -6.518 1.484 10.785) 12.688 3.493 ( 17.442 3.539 3.850) 18.209 3.684 ( 14.738 -7.355 -2.708) 16.692 3.925 ( -6.582 -7.909 -3.614) 10.906 4.476 ( -5.116 -0.637 2.866) 5.899 4.621 ( -2.601 0.859 8.644) 9.068 4.843 ( -6.259 7.736 -1.542) 10.070 4.948 ( -1.928 6.575 -6.268) 9.286 5.071 ( -1.466 0.727 -5.106) 5.362 5.148 ( 0.895 -2.053 -0.288) 2.258 5.315 ( 12.152 -1.960 0.375) 12.314 5.406 ( 2.612 -7.076 6.779) 10.142 5.465 ( -0.115 -2.428 2.924) 3.803 5.612 ( 1.859 0.331 -7.375) 7.613 5.758 ( -6.259 2.204 7.888) 10.308 6.041 ( 4.402 2.941 3.325) 6.252 6.063 ( -0.837 1.286 1.039) 1.853 6.130 ( -0.721 -2.077 10.082) 10.319 6.438 ( 6.614 0.787 -7.858) 10.301 6.510 ( -5.144 -0.298 -1.702) 5.426 6.711 ( -7.231 1.682 7.000) 10.204 7.115 ( 2.806 11.638 -3.432) 12.454 7.251 ( 4.399 0.833 -4.657) 6.460 7.507 ( -1.387 -2.641 -4.476) 5.379 7.637 ( -4.278 -0.173 3.767) 5.703 7.822 ( -3.193 6.586 -1.232) 7.422 7.931 ( 6.158 -0.799 -9.700) 11.517 8.057 ( -2.254 -0.622 3.224) 3.982 8.133 ( -2.261 -4.344 -5.056) 7.039 8.178 ( 1.710 -11.168 -6.534) 13.052 8.409 ( -7.188 -1.043 6.454) 9.716 8.467 ( 0.890 -1.311 8.947) 9.086 8.678 ( -3.633 -1.743 -3.802) 5.540 9.079 ( 11.313 0.598 4.918) 12.350 9.217 ( 14.226 -1.658 -3.457) 14.733 9.252 ( -6.462 1.367 1.086) 6.694 9.548 ( -17.991 3.663 -2.361) 18.511 9.632 ( -1.049 -0.315 -0.606) 1.252 9.856 ( -12.347 3.631 7.857) 15.079 10.011 ( 1.677 5.157 -2.405) 5.932 10.017 ( -16.519 -1.682 -0.742) 16.621 10.140 ( 3.568 -3.488 -6.820) 8.451 10.619 ( 1.570 -0.695 -1.893) 2.555 10.703 ( 8.651 -0.043 2.916) 9.130 10.787 ( 5.987 -0.292 6.630) 8.938 11.929 ( -1.270 1.697 1.912) 2.855 12.037 ( 4.360 5.035 -10.964) 12.829 12.561 ( -0.687 0.419 5.050) 5.113 12.734 ( -6.859 -0.734 -5.638) 8.909 12.780 ( -1.312 -3.565 1.843) 4.222 12.849 ( 1.953 -3.029 10.619) 11.214 13.332 ( -5.005 -1.845 4.367) 6.894 13.773 ( 6.028 2.803 -8.937) 11.138 14.794 ( -6.308 0.142 -2.000) 6.619 15.029 ( -2.851 -0.698 1.022) 3.108 17.202 ( 1.109 1.182 2.071) 2.630 17.351 ( -1.142 -0.550 -1.517) 1.977 21.827 ( 0.025 0.689 -7.359) 7.392 21.860 ( -1.512 -0.405 6.960) 7.133 23.105 ( -6.675 -1.589 5.349) 8.700 23.540 ( -1.415 -3.125 -1.031) 3.582 23.736 ( 5.058 0.469 -2.856) 5.828 23.944 ( 8.718 2.540 1.784) 9.254 24.738 ( 2.376 11.658 -4.601) 12.756 25.008 ( -0.265 -9.663 0.870) 9.705 25.835 ( -0.323 -0.280 -2.531) 2.566 26.112 ( -1.698 -0.245 2.649) 3.156 28.400 ( -1.240 -0.071 -2.052) 2.399 28.532 ( -5.016 0.108 2.689) 5.692 ======================= Grid point 25 (18/117) ======================= q-point: (-0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( 15.451 -2.006 5.281) 16.451 2.765 ( 1.210 8.322 5.551) 10.077 2.835 ( 6.433 -0.813 -0.070) 6.485 3.117 ( 18.372 2.318 -15.205) 23.960 3.741 ( 10.357 -3.732 -1.688) 11.138 3.881 ( 0.797 -4.380 -0.297) 4.462 4.186 ( 12.283 -11.053 -3.024) 16.799 4.226 ( -11.919 13.500 -3.472) 18.340 4.504 ( -2.350 -8.983 6.963) 11.606 4.694 ( -2.223 6.259 6.301) 9.155 4.918 ( -1.959 -1.928 -4.286) 5.091 5.087 ( 4.712 3.723 -5.389) 8.069 5.283 ( 5.684 -4.010 4.476) 8.272 5.372 ( -5.178 -4.707 -4.650) 8.402 5.470 ( -3.658 3.622 1.934) 5.499 5.521 ( -1.953 0.463 -4.074) 4.542 5.617 ( 5.375 -2.545 -0.368) 5.958 5.737 ( 7.349 9.023 5.437) 12.844 5.951 ( -7.109 0.188 12.438) 14.328 6.098 ( 0.626 0.768 3.990) 4.112 6.148 ( 4.157 2.254 3.672) 5.987 6.410 ( -3.030 2.197 0.332) 3.758 6.465 ( -4.214 -0.190 -6.956) 8.135 6.689 ( 4.402 -1.132 0.045) 4.545 7.019 ( 0.014 11.666 -1.701) 11.790 7.277 ( 1.358 4.104 -2.667) 5.080 7.464 ( -6.643 5.447 4.572) 9.732 7.510 ( -7.845 -4.422 0.792) 9.040 7.707 ( -9.011 -3.764 -1.372) 9.861 7.912 ( -3.883 2.922 -6.212) 7.887 8.001 ( -9.111 -1.329 -2.096) 9.443 8.120 ( -4.123 -3.034 -7.292) 8.910 8.289 ( -0.199 -7.203 1.880) 7.447 8.313 ( -2.971 -6.261 1.559) 7.103 8.482 ( -3.509 -4.825 1.963) 6.280 8.561 ( -4.075 -5.220 2.576) 7.106 9.054 ( -9.823 7.962 -5.313) 13.715 9.185 ( -10.412 -0.174 1.825) 10.572 9.289 ( -1.334 2.094 1.114) 2.721 9.445 ( -6.644 -4.125 4.211) 8.882 9.571 ( -3.535 0.940 -4.347) 5.681 9.606 ( -4.275 -1.282 8.070) 9.221 9.816 ( -1.328 -0.964 -4.741) 5.016 9.963 ( -0.003 5.242 -0.142) 5.244 10.206 ( -0.926 -7.066 -3.554) 7.963 10.704 ( 5.637 0.431 -3.819) 6.823 10.899 ( 10.131 3.157 9.027) 13.932 11.133 ( 32.048 0.439 -0.588) 32.056 11.904 ( 2.666 3.704 -0.987) 4.669 12.060 ( 4.650 7.176 -10.634) 13.645 12.490 ( -5.837 -0.062 2.413) 6.316 12.631 ( -7.393 -6.274 -5.962) 11.383 12.808 ( -1.903 -6.413 6.688) 9.459 12.923 ( 2.489 0.932 13.136) 13.403 13.235 ( -8.401 -4.600 7.533) 12.185 13.776 ( -2.434 4.256 -11.368) 12.381 14.676 ( -5.272 -0.635 -6.883) 8.693 14.954 ( -6.915 -2.227 3.706) 8.155 17.247 ( 4.938 2.211 4.307) 6.915 17.345 ( -0.035 -1.181 -3.336) 3.539 21.758 ( -5.180 1.259 -1.234) 5.472 21.829 ( -4.736 -1.453 0.434) 4.973 23.003 ( -7.406 -2.941 4.348) 9.078 23.506 ( -6.477 -4.456 2.651) 8.297 23.810 ( 3.809 1.916 -6.894) 8.106 24.023 ( 4.982 6.136 -1.093) 7.979 24.725 ( 8.576 9.931 1.000) 13.160 25.149 ( 6.083 -7.497 1.667) 9.797 25.859 ( 2.897 -0.575 -4.282) 5.202 26.119 ( 1.692 -0.837 2.927) 3.483 28.343 ( -4.928 -0.476 -3.227) 5.910 28.424 ( -7.719 -1.494 3.833) 8.747 ======================= Grid point 26 (19/117) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( 1.488 9.055 2.544) 9.522 2.712 ( 6.232 13.623 3.019) 15.282 3.201 ( 22.402 0.279 -7.480) 23.619 3.356 ( 4.143 8.781 -8.073) 12.627 3.673 ( 5.587 10.796 1.424) 12.239 3.878 ( -6.048 -6.512 7.283) 11.490 4.148 ( 3.265 -0.679 3.677) 4.964 4.484 ( -0.508 -3.879 2.227) 4.502 4.544 ( 7.258 -13.369 -3.801) 15.680 4.764 ( 2.405 -4.283 1.890) 5.263 4.873 ( -2.179 -2.507 -4.565) 5.646 5.073 ( -1.406 10.412 -2.422) 10.782 5.105 ( -14.491 7.575 1.486) 16.419 5.341 ( -2.477 6.767 -3.745) 8.121 5.435 ( 2.790 -0.794 -2.273) 3.685 5.541 ( 3.190 -5.823 -1.806) 6.880 5.654 ( -2.805 2.791 1.435) 4.209 5.786 ( 9.642 9.821 5.546) 14.839 5.897 ( 1.534 -3.474 7.217) 8.155 6.122 ( 3.960 -2.006 -1.592) 4.716 6.230 ( 2.535 3.949 -1.311) 4.872 6.361 ( -1.879 -2.452 3.748) 4.857 6.397 ( -1.307 0.292 -2.314) 2.674 6.770 ( 3.458 2.830 -1.841) 4.833 6.916 ( -2.573 5.776 -0.099) 6.324 7.117 ( -7.517 11.272 0.619) 13.562 7.287 ( -8.565 0.080 3.068) 9.098 7.412 ( -10.532 -5.840 3.816) 12.633 7.571 ( -9.468 -5.037 -2.820) 11.089 7.745 ( -8.977 0.557 -0.543) 9.010 7.915 ( -1.476 -0.416 -2.163) 2.652 8.034 ( -8.802 -3.000 -2.158) 9.546 8.267 ( -2.577 -2.570 -3.050) 4.749 8.392 ( -2.013 -1.218 1.074) 2.587 8.472 ( 0.288 -6.689 -2.392) 7.110 8.594 ( -3.260 -3.901 11.340) 12.427 8.788 ( -11.394 3.274 -5.024) 12.875 8.953 ( -11.299 -0.732 1.004) 11.367 9.058 ( -16.905 -4.743 -2.254) 17.702 9.440 ( 2.023 -4.911 -4.907) 7.231 9.527 ( -3.011 1.599 -7.707) 8.427 9.640 ( 2.374 -1.540 3.653) 4.620 9.838 ( 2.392 -0.517 -6.713) 7.145 9.942 ( -2.950 -1.385 9.962) 10.482 10.272 ( 1.940 -8.543 9.508) 12.928 10.687 ( -4.676 1.783 -7.639) 9.132 11.222 ( 25.827 3.769 5.603) 26.695 11.710 ( 30.663 1.959 -1.617) 30.768 11.971 ( 8.616 3.205 -4.197) 10.106 12.041 ( 1.072 5.160 -7.954) 9.541 12.387 ( -6.645 -2.371 1.708) 7.259 12.585 ( -3.183 -5.037 -4.793) 7.647 12.782 ( -10.355 -5.704 12.131) 16.939 12.940 ( 0.931 0.886 6.608) 6.732 13.177 ( -3.386 -5.116 9.834) 11.591 13.586 ( -13.289 0.732 -12.329) 18.142 14.628 ( -0.065 1.072 -7.575) 7.651 14.835 ( -9.489 -3.684 3.825) 10.874 17.303 ( 1.516 0.151 -1.091) 1.874 17.394 ( 6.200 1.245 2.169) 6.685 21.603 ( -11.630 0.014 -3.142) 12.047 21.715 ( -9.159 -1.417 2.652) 9.640 22.907 ( -6.845 -3.550 1.791) 7.916 23.396 ( -10.728 -4.497 3.849) 12.252 23.806 ( -0.178 4.970 -5.033) 7.076 24.022 ( 3.257 8.331 -2.711) 9.346 24.863 ( 14.821 5.687 2.040) 16.005 25.360 ( 10.183 -4.749 1.733) 11.369 25.937 ( 5.321 -0.108 -4.432) 6.926 26.196 ( 5.471 -1.388 2.971) 6.378 28.239 ( -6.710 -1.017 -3.692) 7.726 28.295 ( -9.715 -3.754 4.438) 11.321 ======================= Grid point 27 (20/117) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -6.157 14.905 -8.715) 18.331 2.590 ( -4.193 26.530 -5.726) 27.462 3.099 ( 1.495 11.474 5.943) 13.008 3.519 ( 4.248 25.688 -0.728) 26.047 3.763 ( 12.819 -5.631 1.025) 14.039 3.929 ( -3.669 2.156 9.960) 10.831 4.189 ( 7.640 -11.236 -1.556) 13.676 4.414 ( -18.169 9.616 8.311) 22.173 4.586 ( 2.468 10.040 5.937) 11.922 4.753 ( -8.216 0.892 -9.094) 12.288 4.814 ( 4.113 2.198 0.594) 4.702 4.967 ( -2.075 5.737 -5.197) 8.014 5.014 ( 1.173 -8.371 -0.572) 8.472 5.285 ( 10.946 5.365 -8.290) 14.741 5.462 ( -1.823 2.305 6.057) 6.732 5.630 ( 3.438 -5.724 -0.339) 6.686 5.685 ( 3.497 -11.232 -0.244) 11.766 5.926 ( 11.137 5.561 2.945) 12.792 6.062 ( 7.141 -4.775 0.995) 8.648 6.176 ( -1.316 0.817 -6.206) 6.397 6.208 ( 4.649 2.519 -5.307) 7.492 6.342 ( -1.828 0.466 3.885) 4.319 6.393 ( 0.151 1.948 1.312) 2.354 6.710 ( -7.176 0.788 0.367) 7.229 6.810 ( -0.494 3.468 1.913) 3.991 7.019 ( -1.368 0.655 -5.556) 5.759 7.104 ( -9.317 1.552 2.337) 9.730 7.263 ( -7.620 -0.453 1.288) 7.741 7.464 ( -8.145 -6.896 -4.650) 11.641 7.592 ( -9.421 -0.800 9.355) 13.301 7.845 ( -10.702 3.529 -0.558) 11.282 7.931 ( 1.475 -1.360 1.341) 2.413 8.226 ( -1.925 -1.470 -0.348) 2.447 8.372 ( -2.897 2.268 0.164) 3.683 8.440 ( -16.779 -6.002 4.545) 18.390 8.489 ( -3.077 -3.671 -2.264) 5.298 8.616 ( -3.860 1.603 1.428) 4.417 8.830 ( -5.992 -5.890 -9.943) 13.018 8.996 ( -1.804 -11.012 2.548) 11.446 9.393 ( -4.060 1.052 -5.088) 6.594 9.619 ( -4.410 -0.777 -0.537) 4.510 9.625 ( 9.959 -2.850 -12.857) 16.510 9.835 ( -12.344 -5.364 16.929) 21.627 9.975 ( 8.226 -6.459 -5.973) 12.044 10.469 ( 8.223 -3.580 12.548) 15.424 10.590 ( -0.721 -1.117 -3.175) 3.443 11.625 ( 18.726 1.149 -0.733) 18.775 11.942 ( -4.412 1.556 -5.061) 6.892 12.107 ( 7.615 0.577 1.893) 7.868 12.144 ( 11.103 0.681 4.178) 11.883 12.382 ( 8.836 3.483 -7.210) 11.925 12.541 ( -10.918 -1.885 -1.924) 11.245 12.638 ( -4.545 -6.130 5.633) 9.485 12.956 ( 0.279 -0.869 0.081) 0.916 13.196 ( -0.509 -2.949 8.619) 9.123 13.371 ( -8.600 -4.958 -7.091) 12.200 14.567 ( -8.802 -0.952 5.095) 10.215 14.731 ( -2.254 -0.108 -7.378) 7.715 17.316 ( -0.339 -1.987 -3.512) 4.050 17.518 ( 9.322 3.939 4.544) 11.094 21.346 ( -15.961 -0.719 -0.041) 15.977 21.532 ( -14.215 -3.477 -1.462) 14.707 22.826 ( -6.139 -3.199 0.901) 6.981 23.225 ( -11.901 -3.277 4.105) 13.009 23.711 ( -2.317 8.537 -1.812) 9.029 23.985 ( 2.395 9.211 -3.023) 9.985 25.129 ( 16.875 0.537 0.498) 16.890 25.597 ( 11.805 -2.591 0.640) 12.103 26.025 ( 4.957 1.369 -2.748) 5.831 26.347 ( 9.267 -1.774 2.483) 9.757 28.122 ( -9.000 -3.460 0.002) 9.642 28.159 ( -8.765 -3.489 1.672) 9.580 ======================= Grid point 28 (21/117) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -17.038 22.952 -11.278) 30.729 2.127 ( -9.288 35.981 -3.788) 37.353 2.901 ( -17.320 9.405 2.355) 19.850 3.352 ( 12.865 34.581 7.206) 37.594 3.762 ( -8.894 16.513 1.775) 18.839 3.934 ( 6.454 14.564 6.809) 17.324 4.197 ( 2.068 1.752 -4.390) 5.160 4.216 ( 8.034 19.288 -0.298) 20.896 4.522 ( 2.495 14.932 1.694) 15.233 4.578 ( -8.072 -3.786 -2.175) 9.177 4.856 ( 0.950 -6.104 3.741) 7.222 5.032 ( 3.089 -8.421 -1.180) 9.047 5.193 ( 5.117 -15.144 -4.470) 16.599 5.392 ( -0.316 3.084 7.923) 8.508 5.502 ( 6.385 -3.856 -2.916) 8.008 5.752 ( -1.564 -8.561 1.248) 8.792 5.851 ( 5.989 -7.669 -1.969) 9.928 6.001 ( 3.759 4.384 -1.722) 6.026 6.070 ( -5.417 -1.843 -2.573) 6.274 6.230 ( 0.968 0.193 1.182) 1.540 6.276 ( 6.769 2.032 -1.555) 7.237 6.352 ( 5.785 0.472 -3.026) 6.546 6.434 ( 2.791 -3.974 2.616) 5.516 6.596 ( -4.577 0.193 -1.895) 4.957 6.730 ( -7.657 0.532 1.643) 7.849 6.926 ( -4.682 1.284 -3.572) 6.027 6.983 ( -4.596 -1.270 2.747) 5.503 7.221 ( -1.620 -1.068 -4.277) 4.696 7.401 ( -4.052 0.102 -6.110) 7.333 7.474 ( -2.755 -5.105 7.912) 9.811 7.674 ( -2.458 1.711 3.034) 4.263 7.967 ( -1.213 -2.390 3.279) 4.235 8.172 ( -8.896 -4.984 -0.465) 10.208 8.260 ( -3.664 -0.666 -0.593) 3.771 8.309 ( -1.170 -1.835 0.036) 2.177 8.440 ( -6.817 -3.998 3.377) 8.594 8.597 ( 1.329 0.599 0.193) 1.470 8.770 ( -5.270 -1.851 -12.632) 13.812 9.047 ( -2.886 -4.188 6.220) 8.034 9.364 ( 0.630 0.526 -1.929) 2.096 9.570 ( -1.992 -5.739 -5.766) 8.376 9.692 ( -9.277 -5.748 18.276) 21.287 9.840 ( 11.848 -3.144 -15.191) 19.520 10.192 ( 5.322 -10.937 2.670) 12.452 10.510 ( -1.695 -4.689 -6.759) 8.399 10.816 ( 17.982 0.537 11.765) 21.495 11.734 ( -14.242 -4.365 2.074) 15.040 11.892 ( 5.306 -0.433 -2.502) 5.882 12.059 ( -9.507 1.009 4.650) 10.631 12.312 ( -3.701 -2.025 5.295) 6.770 12.348 ( 7.387 2.028 -7.699) 10.861 12.519 ( 3.178 2.946 -5.761) 7.209 12.684 ( 1.903 -4.300 -0.975) 4.803 12.985 ( 3.044 1.047 -3.560) 4.800 13.267 ( 4.816 -3.593 4.739) 7.653 13.368 ( 1.004 -3.904 -0.087) 4.032 14.379 ( -13.274 -5.417 7.628) 16.239 14.715 ( 2.090 4.259 -8.286) 9.548 17.334 ( -0.118 -3.124 -2.163) 3.801 17.646 ( 9.048 5.304 3.087) 10.933 21.093 ( -11.860 -1.232 1.086) 11.974 21.261 ( -19.081 -3.926 -3.670) 19.823 22.740 ( -5.708 -1.127 2.211) 6.224 23.072 ( -7.028 -1.602 2.035) 7.490 23.572 ( -2.085 10.771 0.113) 10.971 23.926 ( 1.221 9.229 -2.392) 9.611 25.416 ( 11.357 -4.398 -0.170) 12.180 25.818 ( 9.195 -1.968 -1.042) 9.461 26.088 ( 4.662 2.125 -1.110) 5.242 26.565 ( 12.687 -2.162 1.298) 12.935 27.950 ( -14.814 -5.264 7.063) 17.235 28.080 ( -2.848 -1.251 -3.271) 4.514 ======================= Grid point 29 (22/117) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( 0.000 29.357 0.000) 29.357 1.647 ( 0.000 40.736 0.000) 40.736 2.592 ( 0.000 11.436 0.000) 11.436 2.930 ( 0.000 66.005 0.000) 66.005 3.555 ( 0.000 8.915 0.000) 8.915 3.920 ( 0.000 14.378 0.000) 14.378 4.140 ( 0.000 17.747 0.000) 17.747 4.180 ( 0.000 14.633 0.000) 14.633 4.437 ( -0.000 -1.715 -0.000) 1.715 4.512 ( -0.000 -3.550 -0.000) 3.550 4.941 ( -0.000 -6.570 -0.000) 6.570 5.125 ( -0.000 -7.501 -0.000) 7.501 5.341 ( 0.000 3.877 0.000) 3.877 5.392 ( -0.000 -10.089 -0.000) 10.089 5.654 ( -0.000 -9.542 -0.000) 9.542 5.786 ( -0.000 -5.783 -0.000) 5.783 5.862 ( 0.000 6.106 0.000) 6.106 6.003 ( 0.000 3.374 0.000) 3.374 6.141 ( -0.000 -2.453 -0.000) 2.453 6.240 ( -0.000 -9.494 -0.000) 9.494 6.341 ( 0.000 1.646 0.000) 1.646 6.388 ( -0.000 -8.003 -0.000) 8.003 6.564 ( -0.000 -5.918 -0.000) 5.918 6.577 ( 0.000 0.689 0.000) 0.689 6.587 ( -0.000 -1.884 -0.000) 1.884 6.904 ( -0.000 -0.407 -0.000) 0.407 6.938 ( -0.000 -2.973 -0.000) 2.973 7.171 ( 0.000 0.170 0.000) 0.170 7.345 ( 0.000 0.785 0.000) 0.785 7.548 ( -0.000 -3.967 -0.000) 3.967 7.681 ( 0.000 1.735 0.000) 1.735 7.969 ( -0.000 -8.271 -0.000) 8.271 8.140 ( -0.000 -2.197 -0.000) 2.197 8.214 ( 0.000 2.932 0.000) 2.932 8.375 ( -0.000 -3.359 -0.000) 3.359 8.381 ( -0.000 -6.603 -0.000) 6.603 8.611 ( 0.000 1.163 0.000) 1.163 8.681 ( 0.000 3.669 0.000) 3.669 9.020 ( 0.000 0.275 0.000) 0.275 9.342 ( 0.000 3.508 0.000) 3.508 9.646 ( -0.000 -5.352 -0.000) 5.352 9.661 ( -0.000 -6.608 -0.000) 6.608 10.072 ( -0.000 -12.619 -0.000) 12.619 10.339 ( -0.000 -9.072 -0.000) 9.072 10.530 ( -0.000 -8.012 -0.000) 8.012 11.126 ( 0.000 2.897 0.000) 2.897 11.422 ( 0.000 0.777 0.000) 0.777 11.934 ( -0.000 -4.108 -0.000) 4.108 11.996 ( 0.000 0.718 0.000) 0.718 12.302 ( 0.000 0.325 0.000) 0.325 12.350 ( 0.000 5.594 0.000) 5.594 12.558 ( -0.000 -3.983 -0.000) 3.983 12.765 ( -0.000 -4.643 -0.000) 4.643 12.984 ( 0.000 4.782 0.000) 4.782 13.344 ( 0.000 1.134 0.000) 1.134 13.433 ( -0.000 -6.399 -0.000) 6.399 14.306 ( -0.000 -7.201 -0.000) 7.201 14.692 ( 0.000 4.794 0.000) 4.794 17.368 ( -0.000 -3.893 -0.000) 3.893 17.701 ( 0.000 4.727 0.000) 4.727 20.982 ( -0.000 -0.722 -0.000) 0.722 21.042 ( 0.000 0.508 0.000) 0.508 22.675 ( 0.000 1.136 0.000) 1.136 23.022 ( -0.000 -1.185 -0.000) 1.185 23.445 ( 0.000 10.852 0.000) 10.852 23.850 ( 0.000 8.310 0.000) 8.310 25.576 ( -0.000 -5.738 -0.000) 5.738 25.919 ( -0.000 -1.688 -0.000) 1.688 26.143 ( -0.000 -0.362 -0.000) 0.362 26.785 ( -0.000 -5.935 -0.000) 5.935 27.778 ( -0.000 -0.038 -0.000) 0.038 28.066 ( -0.000 -1.113 -0.000) 1.113 ======================= Grid point 34 (23/117) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( 22.049 0.000 2.565) 22.198 2.831 ( -4.218 -0.000 4.336) 6.049 2.847 ( 8.975 0.000 4.147) 9.887 3.138 ( 19.399 0.000 -14.422) 24.173 3.773 ( 7.445 0.000 0.760) 7.483 3.805 ( 8.332 0.000 -7.082) 10.935 4.027 ( 17.391 0.000 -2.398) 17.555 4.388 ( -5.229 -0.000 6.289) 8.178 4.435 ( -15.904 -0.000 -2.091) 16.041 4.810 ( -4.934 -0.000 -4.337) 6.569 4.820 ( -5.312 -0.000 4.611) 7.034 5.156 ( 3.981 0.000 -1.729) 4.340 5.201 ( 10.520 0.000 -2.128) 10.733 5.327 ( -2.485 -0.000 -1.974) 3.174 5.492 ( 2.281 0.000 -0.382) 2.313 5.521 ( -4.358 -0.000 -1.401) 4.578 5.600 ( 7.952 0.000 3.715) 8.777 5.837 ( 7.868 0.000 7.407) 10.806 5.960 ( -8.616 -0.000 13.976) 16.418 6.107 ( -1.278 -0.000 2.725) 3.010 6.166 ( 4.413 0.000 3.837) 5.848 6.402 ( -5.914 -0.000 -4.208) 7.258 6.491 ( -3.601 -0.000 -5.594) 6.653 6.670 ( 4.265 0.000 2.804) 5.104 7.132 ( -4.414 -0.000 -1.960) 4.829 7.361 ( 3.640 0.000 -2.330) 4.322 7.420 ( -4.854 -0.000 -2.292) 5.368 7.573 ( -3.755 -0.000 2.994) 4.803 7.689 ( -11.615 -0.000 -0.190) 11.616 7.927 ( -7.372 -0.000 -8.392) 11.170 8.028 ( -4.356 -0.000 -1.202) 4.519 8.096 ( -2.495 -0.000 -4.904) 5.502 8.125 ( 2.844 0.000 -3.606) 4.592 8.246 ( -7.460 -0.000 2.921) 8.012 8.437 ( -6.973 -0.000 3.125) 7.641 8.500 ( -3.044 -0.000 2.895) 4.201 9.148 ( -6.343 -0.000 0.784) 6.391 9.215 ( -16.739 -0.000 -6.882) 18.098 9.249 ( 3.927 0.000 4.195) 5.746 9.440 ( -8.954 -0.000 8.825) 12.572 9.583 ( -5.305 -0.000 6.210) 8.167 9.585 ( -6.244 -0.000 -3.740) 7.278 9.805 ( 1.639 0.000 -8.319) 8.479 10.065 ( -0.909 -0.000 3.040) 3.173 10.083 ( -4.317 -0.000 -5.536) 7.020 10.709 ( 5.777 0.000 -4.019) 7.037 10.933 ( 11.797 0.000 9.734) 15.294 11.135 ( 32.251 0.000 -0.762) 32.260 11.945 ( 2.551 0.000 -2.117) 3.315 12.158 ( 6.283 0.000 -13.051) 14.484 12.452 ( -10.345 -0.000 -0.816) 10.377 12.599 ( -5.831 -0.000 -0.919) 5.903 12.717 ( -3.127 -0.000 9.668) 10.161 12.943 ( 6.005 0.000 12.374) 13.754 13.179 ( -10.366 -0.000 7.542) 12.819 13.818 ( -4.020 -0.000 -11.743) 12.412 14.672 ( -4.499 -0.000 -7.923) 9.111 14.931 ( -7.559 -0.000 4.543) 8.819 17.276 ( 5.935 0.000 5.120) 7.838 17.326 ( -0.995 -0.000 -4.140) 4.258 21.790 ( -5.201 -0.000 -9.668) 10.978 21.795 ( -5.043 -0.000 8.728) 10.080 22.975 ( -7.016 -0.000 3.906) 8.030 23.459 ( -5.924 -0.000 3.484) 6.872 23.830 ( 4.662 0.000 -7.543) 8.867 24.087 ( 5.446 0.000 0.336) 5.456 24.869 ( 4.259 0.000 -2.805) 5.100 25.027 ( 9.235 0.000 4.433) 10.243 25.853 ( 3.003 0.000 -4.699) 5.577 26.109 ( 1.485 0.000 3.181) 3.511 28.338 ( -5.005 -0.000 -3.505) 6.110 28.409 ( -8.599 -0.000 4.236) 9.586 ======================= Grid point 35 (24/117) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( 10.155 4.471 5.253) 12.276 2.830 ( 5.075 1.048 1.918) 5.525 3.208 ( 27.344 0.192 4.363) 27.690 3.402 ( 8.090 -2.236 -15.028) 17.213 3.784 ( -3.671 2.691 4.158) 6.165 3.960 ( 3.945 12.559 -2.998) 13.501 4.183 ( 2.259 -1.309 -4.151) 4.903 4.330 ( 11.186 -6.017 0.514) 12.712 4.397 ( 0.429 -5.128 4.297) 6.704 4.683 ( -5.197 0.926 -1.949) 5.627 4.793 ( -5.104 -6.711 -2.277) 8.733 5.142 ( -8.469 1.642 4.135) 9.566 5.294 ( 3.838 5.569 -8.065) 10.525 5.382 ( 3.969 -1.512 -5.894) 7.265 5.450 ( -0.235 1.590 -2.421) 2.906 5.498 ( -0.153 0.175 -2.806) 2.815 5.708 ( 3.466 3.877 6.130) 8.039 5.840 ( -3.355 -1.617 14.179) 14.660 5.909 ( 3.542 0.981 5.360) 6.499 6.097 ( 1.403 -0.621 0.456) 1.600 6.279 ( 0.832 -2.923 6.998) 7.630 6.310 ( 1.298 2.685 -2.596) 3.954 6.410 ( -2.769 0.242 -0.330) 2.799 6.769 ( 3.710 -1.682 -5.519) 6.860 7.048 ( -2.022 3.036 1.021) 3.788 7.225 ( -14.847 0.301 1.703) 14.948 7.330 ( -10.628 -0.562 2.680) 10.975 7.471 ( 0.016 14.884 -1.182) 14.931 7.540 ( -3.043 2.362 0.510) 3.886 7.762 ( -8.012 -1.988 -5.809) 10.094 7.926 ( -3.837 1.174 -1.265) 4.208 7.950 ( -10.658 -2.011 0.479) 10.857 8.226 ( 1.356 -2.401 -3.851) 4.736 8.236 ( -0.206 -13.137 -3.863) 13.695 8.342 ( -4.028 -2.824 -2.051) 5.330 8.522 ( 0.464 -2.293 10.137) 10.404 8.872 ( -17.257 3.508 -7.810) 19.263 8.970 ( -11.966 1.709 4.275) 12.821 9.037 ( -23.310 0.629 4.895) 23.827 9.331 ( 5.155 -4.490 -6.536) 9.458 9.552 ( -4.362 0.651 -8.633) 9.694 9.614 ( 3.576 -0.926 4.632) 5.924 9.844 ( 0.919 0.615 -8.234) 8.308 9.921 ( -11.822 -0.688 7.959) 14.268 10.149 ( 8.369 -3.495 10.966) 14.230 10.717 ( -3.792 0.970 -7.775) 8.705 11.278 ( 23.969 1.753 5.757) 24.713 11.729 ( 31.599 0.220 -2.181) 31.675 12.008 ( 4.302 1.397 -0.852) 4.603 12.179 ( -4.008 6.130 -9.352) 11.878 12.294 ( -3.223 -4.791 -6.907) 9.003 12.551 ( 1.058 0.519 1.729) 2.092 12.664 ( -7.674 -5.241 11.712) 14.951 12.974 ( -6.015 2.227 8.251) 10.450 13.079 ( 1.214 -4.201 11.922) 12.699 13.589 ( -18.424 -0.093 -13.418) 22.792 14.661 ( 3.415 1.623 -10.641) 11.293 14.775 ( -10.605 -2.110 6.596) 12.666 17.304 ( -0.892 -0.019 -5.407) 5.480 17.416 ( 8.934 0.721 6.414) 11.021 21.617 ( -12.220 1.065 -4.757) 13.156 21.683 ( -9.610 -1.555 4.262) 10.627 22.863 ( -5.967 -1.051 0.869) 6.121 23.332 ( -9.363 -1.815 4.743) 10.651 23.876 ( 1.885 1.998 -6.736) 7.275 24.148 ( 3.651 3.817 0.175) 5.285 24.952 ( 8.178 2.923 0.041) 8.684 25.269 ( 13.298 -3.446 3.031) 14.068 25.938 ( 6.524 0.072 -5.571) 8.579 26.173 ( 4.828 -0.751 3.348) 5.923 28.227 ( -7.290 -0.077 -2.583) 7.734 28.243 ( -10.040 -1.602 3.419) 10.726 ======================= Grid point 36 (25/117) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( 3.609 16.817 -3.499) 17.552 2.929 ( 4.727 8.344 0.531) 9.605 3.361 ( -0.470 8.792 -11.486) 14.472 3.620 ( -2.235 -2.205 8.194) 8.775 3.782 ( 16.775 -3.823 9.862) 19.831 3.965 ( 5.970 -4.390 3.225) 8.081 4.107 ( -3.951 18.360 -2.340) 18.925 4.493 ( -1.385 -5.850 6.078) 8.549 4.543 ( 5.608 -6.443 -3.886) 9.384 4.610 ( -5.296 -0.297 1.353) 5.474 4.783 ( -0.531 -10.201 -6.085) 11.890 5.060 ( 6.000 2.872 3.286) 7.420 5.211 ( -0.971 16.959 -10.362) 19.898 5.382 ( 1.977 2.682 -5.036) 6.038 5.452 ( 1.049 -5.352 -6.901) 8.796 5.554 ( 1.372 -3.204 -1.079) 3.648 5.629 ( -5.832 7.056 9.897) 13.481 5.920 ( 4.164 -8.028 6.487) 11.130 6.059 ( 13.005 3.048 5.139) 14.312 6.176 ( 1.005 -0.574 -6.507) 6.609 6.242 ( 4.195 -0.681 -4.914) 6.497 6.355 ( 0.831 1.650 6.766) 7.013 6.405 ( 0.643 0.443 1.387) 1.592 6.751 ( -8.983 1.720 -2.807) 9.567 6.918 ( -5.394 1.464 1.793) 5.869 7.051 ( -4.400 11.330 3.230) 12.577 7.141 ( -3.246 -6.855 0.582) 7.607 7.287 ( -6.274 11.562 2.832) 13.456 7.460 ( -4.420 5.917 -1.020) 7.456 7.615 ( -6.980 3.018 -1.887) 7.836 7.830 ( -7.336 -5.428 -0.269) 9.130 7.918 ( 2.798 -0.150 0.261) 2.814 8.208 ( -5.934 -4.886 -2.962) 8.238 8.283 ( -7.087 -2.594 -3.132) 8.170 8.374 ( -3.066 -9.153 -4.569) 10.680 8.453 ( -9.509 1.973 11.117) 14.761 8.605 ( -7.450 -2.232 -4.043) 8.765 8.739 ( -7.484 -3.968 -3.634) 9.217 8.796 ( -7.367 -5.581 3.503) 9.884 9.402 ( -8.190 -0.000 -7.900) 11.379 9.535 ( 8.985 -5.358 -14.874) 18.184 9.624 ( -2.445 0.239 6.540) 6.986 9.714 ( -14.127 -5.672 14.874) 21.283 9.885 ( 4.298 -2.296 -5.009) 6.988 10.430 ( 17.199 -1.070 12.476) 21.274 10.596 ( -5.624 1.307 -6.303) 8.548 11.641 ( 14.769 0.890 -2.015) 14.932 11.930 ( -13.168 -2.603 0.944) 13.456 12.095 ( 1.293 -2.368 7.198) 7.687 12.183 ( 17.512 4.020 -2.771) 18.180 12.423 ( 13.456 0.466 -10.738) 17.222 12.488 ( -15.167 -2.498 2.854) 15.634 12.616 ( 5.610 2.473 2.716) 6.705 12.912 ( -0.861 -3.151 2.067) 3.866 13.154 ( 0.271 -1.070 8.695) 8.765 13.267 ( -12.536 -5.146 -8.832) 16.175 14.543 ( -14.271 -1.200 10.153) 17.555 14.751 ( 4.704 1.483 -11.793) 12.782 17.287 ( -0.972 -1.005 -5.428) 5.605 17.583 ( 10.477 2.541 6.199) 12.436 21.342 ( -16.269 0.200 -2.081) 16.402 21.481 ( -14.833 -1.981 1.638) 15.054 22.784 ( -4.205 -1.274 -0.786) 4.464 23.176 ( -9.638 -1.776 4.768) 10.899 23.850 ( -0.169 5.382 -4.072) 6.751 24.152 ( 2.834 7.227 -0.126) 7.764 25.114 ( 9.990 -1.594 0.196) 10.119 25.543 ( 13.128 -2.496 1.496) 13.447 26.055 ( 7.013 1.659 -4.176) 8.329 26.302 ( 7.538 -2.468 2.512) 8.320 28.055 ( -11.537 -2.524 4.521) 12.646 28.126 ( -5.559 -0.926 -3.380) 6.571 ======================= Grid point 37 (26/117) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( -8.362 25.266 -7.035) 27.528 2.741 ( -4.531 24.148 -3.134) 24.768 3.128 ( -12.315 15.746 4.600) 20.513 3.713 ( 2.038 -1.349 -1.568) 2.904 3.820 ( 2.069 -5.625 4.657) 7.591 4.087 ( 16.186 13.479 1.880) 21.147 4.283 ( 2.246 -4.047 7.760) 9.036 4.396 ( 9.170 3.449 0.037) 9.797 4.632 ( 2.028 -7.652 -1.685) 8.094 4.766 ( 1.485 7.021 4.853) 8.663 4.826 ( 0.210 -5.831 -0.427) 5.851 4.966 ( -5.147 4.659 1.049) 7.021 5.011 ( -3.626 14.697 -13.700) 20.416 5.422 ( -0.011 -2.798 -7.189) 7.714 5.471 ( -3.012 4.926 8.449) 10.233 5.566 ( -2.108 -8.259 3.650) 9.273 5.709 ( 15.461 -5.851 -3.384) 16.874 6.003 ( -4.547 -6.925 -1.299) 8.386 6.156 ( 3.282 5.908 -3.301) 7.522 6.251 ( 5.921 4.330 -1.405) 7.469 6.321 ( 0.083 0.400 2.758) 2.788 6.366 ( 1.380 -0.146 1.818) 2.287 6.418 ( 5.864 2.865 0.059) 6.527 6.598 ( -1.226 2.474 -0.992) 2.934 6.802 ( -6.704 5.326 3.386) 9.207 6.929 ( -3.222 -2.712 1.578) 4.498 7.051 ( -6.756 8.697 0.116) 11.013 7.225 ( 2.002 1.691 -2.414) 3.563 7.329 ( -0.632 -1.290 -6.937) 7.085 7.464 ( -6.318 2.737 7.296) 10.032 7.732 ( -5.025 1.417 -1.273) 5.373 7.953 ( -2.327 2.669 1.256) 3.757 8.094 ( -7.828 -4.482 3.094) 9.536 8.161 ( -4.380 -6.081 -4.286) 8.633 8.276 ( -4.980 -3.372 -4.276) 7.379 8.401 ( -4.827 -0.131 4.102) 6.336 8.577 ( -0.735 -2.671 1.582) 3.190 8.669 ( -4.004 -7.634 -6.339) 10.700 8.913 ( 4.209 -10.609 6.262) 13.019 9.269 ( -7.950 -9.156 -7.985) 14.519 9.500 ( -7.703 -0.824 3.204) 8.383 9.581 ( -5.742 -3.988 8.811) 11.248 9.793 ( 10.500 -2.290 -12.864) 16.762 10.007 ( 3.734 -7.534 4.768) 9.666 10.472 ( -3.626 0.501 -4.845) 6.072 10.822 ( 21.622 0.022 8.307) 23.163 11.658 ( -13.558 -3.585 4.592) 14.757 11.846 ( 0.767 -3.416 -2.700) 4.421 12.067 ( -12.733 -0.629 3.726) 13.282 12.232 ( -3.493 -4.945 4.730) 7.683 12.404 ( 9.802 3.527 -8.276) 13.304 12.599 ( 3.697 -0.596 -5.480) 6.637 12.645 ( -1.454 5.116 -0.026) 5.319 12.971 ( 5.012 -2.498 -4.271) 7.042 13.168 ( 3.495 -5.262 4.000) 7.477 13.326 ( 7.717 -1.251 -0.282) 7.822 14.283 ( -16.562 -3.959 10.244) 19.872 14.794 ( 3.286 3.574 -8.464) 9.757 17.284 ( -0.471 -1.911 -3.271) 3.817 17.737 ( 8.831 3.869 3.802) 10.364 21.075 ( -11.893 -0.550 -0.305) 11.909 21.213 ( -15.276 -1.493 -0.316) 15.352 22.729 ( -2.790 -0.288 -0.133) 2.808 23.048 ( -5.702 -0.852 2.701) 6.367 23.769 ( -0.764 8.808 -1.458) 8.961 24.112 ( 1.581 9.312 -0.537) 9.461 25.312 ( 7.022 -5.825 0.012) 9.124 25.771 ( 8.595 -2.567 -0.042) 8.970 26.135 ( 4.457 2.920 -1.607) 5.565 26.489 ( 8.551 -5.042 0.772) 9.957 27.882 ( -10.270 -2.203 4.311) 11.354 28.056 ( -2.839 -1.084 -2.663) 4.040 ======================= Grid point 38 (27/117) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 0.000 29.223 0.000) 29.223 2.392 ( 0.000 34.937 0.000) 34.937 2.838 ( 0.000 13.627 0.000) 13.627 3.651 ( 0.000 7.197 0.000) 7.197 4.011 ( 0.000 32.132 0.000) 32.132 4.083 ( -0.000 -14.459 -0.000) 14.459 4.247 ( 0.000 20.866 0.000) 20.866 4.421 ( -0.000 -4.857 -0.000) 4.857 4.540 ( 0.000 23.216 0.000) 23.216 4.732 ( 0.000 16.100 0.000) 16.100 4.785 ( -0.000 -6.095 -0.000) 6.095 4.970 ( -0.000 -7.720 -0.000) 7.720 5.060 ( -0.000 -21.390 -0.000) 21.390 5.416 ( 0.000 3.669 0.000) 3.669 5.465 ( -0.000 -8.902 -0.000) 8.902 5.598 ( -0.000 -7.685 -0.000) 7.685 5.973 ( -0.000 -4.933 -0.000) 4.933 6.032 ( -0.000 -3.904 -0.000) 3.904 6.082 ( 0.000 3.598 0.000) 3.598 6.175 ( 0.000 9.671 0.000) 9.671 6.318 ( -0.000 -2.412 -0.000) 2.412 6.402 ( 0.000 1.648 0.000) 1.648 6.500 ( -0.000 -0.347 -0.000) 0.347 6.586 ( 0.000 0.829 0.000) 0.829 6.652 ( 0.000 7.239 0.000) 7.239 6.922 ( -0.000 -0.031 -0.000) 0.031 6.925 ( 0.000 3.002 0.000) 3.002 7.175 ( 0.000 0.659 0.000) 0.659 7.371 ( 0.000 1.815 0.000) 1.815 7.442 ( -0.000 -6.164 -0.000) 6.164 7.697 ( -0.000 -0.082 -0.000) 0.082 7.845 ( -0.000 -0.509 -0.000) 0.509 8.120 ( -0.000 -2.442 -0.000) 2.442 8.165 ( -0.000 -7.526 -0.000) 7.526 8.286 ( -0.000 -2.379 -0.000) 2.379 8.314 ( -0.000 -1.271 -0.000) 1.271 8.619 ( -0.000 -2.005 -0.000) 2.005 8.677 ( -0.000 -3.991 -0.000) 3.991 9.005 ( -0.000 -1.618 -0.000) 1.618 9.379 ( -0.000 -21.840 -0.000) 21.840 9.403 ( 0.000 2.646 0.000) 2.646 9.567 ( -0.000 -3.034 -0.000) 3.034 9.912 ( -0.000 -3.443 -0.000) 3.443 10.149 ( -0.000 -10.226 -0.000) 10.226 10.434 ( -0.000 -1.797 -0.000) 1.797 11.148 ( -0.000 -0.151 -0.000) 0.151 11.429 ( -0.000 -0.189 -0.000) 0.189 11.848 ( -0.000 -4.320 -0.000) 4.320 11.975 ( -0.000 -3.555 -0.000) 3.555 12.267 ( -0.000 -3.081 -0.000) 3.081 12.489 ( 0.000 7.996 0.000) 7.996 12.527 ( 0.000 0.572 0.000) 0.572 12.660 ( -0.000 -5.368 -0.000) 5.368 13.042 ( 0.000 0.382 0.000) 0.382 13.275 ( -0.000 -5.804 -0.000) 5.804 13.418 ( 0.000 3.121 0.000) 3.121 14.158 ( -0.000 -7.516 -0.000) 7.516 14.783 ( 0.000 4.386 0.000) 4.386 17.302 ( -0.000 -2.758 -0.000) 2.758 17.791 ( 0.000 4.270 0.000) 4.270 20.968 ( -0.000 -0.755 -0.000) 0.755 21.051 ( 0.000 0.411 0.000) 0.411 22.696 ( 0.000 0.886 0.000) 0.886 23.003 ( -0.000 -0.688 -0.000) 0.688 23.662 ( 0.000 10.889 0.000) 10.889 24.031 ( 0.000 9.948 0.000) 9.948 25.447 ( -0.000 -7.311 -0.000) 7.311 25.876 ( -0.000 -2.615 -0.000) 2.615 26.155 ( 0.000 1.771 0.000) 1.771 26.654 ( -0.000 -7.415 -0.000) 7.415 27.778 ( -0.000 -0.003 -0.000) 0.003 28.042 ( -0.000 -1.286 -0.000) 1.286 ======================= Grid point 45 (28/117) ======================= q-point: (-0.60 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.576 ( 10.702 0.000 0.372) 10.709 2.992 ( 9.871 0.000 1.427) 9.974 3.311 ( -7.803 -0.000 -15.407) 17.270 3.699 ( 24.287 0.000 8.097) 25.601 3.743 ( -6.636 -0.000 12.837) 14.451 3.969 ( -8.116 -0.000 6.744) 10.552 4.273 ( 3.151 0.000 -6.368) 7.105 4.471 ( 5.009 0.000 -4.613) 6.810 4.507 ( 7.314 0.000 -0.326) 7.321 4.560 ( -3.265 -0.000 -1.554) 3.616 4.637 ( -2.024 -0.000 -2.439) 3.169 5.090 ( 7.856 0.000 4.711) 9.160 5.354 ( -4.111 -0.000 -11.458) 12.173 5.401 ( 3.295 0.000 -19.079) 19.362 5.487 ( 0.836 0.000 3.064) 3.176 5.488 ( -0.358 -0.000 -3.442) 3.460 5.735 ( -7.129 -0.000 17.518) 18.913 5.782 ( -0.224 -0.000 9.301) 9.304 6.068 ( 13.206 0.000 3.831) 13.750 6.192 ( -1.288 -0.000 -2.272) 2.612 6.200 ( 9.701 0.000 -4.836) 10.839 6.374 ( 0.049 0.000 2.119) 2.119 6.419 ( -0.196 -0.000 5.485) 5.489 6.762 ( -1.450 -0.000 -4.405) 4.637 6.911 ( -13.937 -0.000 2.885) 14.233 7.045 ( -3.442 -0.000 1.612) 3.801 7.221 ( -0.596 -0.000 4.446) 4.486 7.545 ( -2.434 -0.000 2.095) 3.212 7.564 ( -6.652 -0.000 -6.866) 9.560 7.638 ( 0.896 0.000 2.299) 2.468 7.729 ( -8.549 -0.000 -0.445) 8.561 7.930 ( 2.565 0.000 2.433) 3.536 8.031 ( -9.186 -0.000 -9.984) 13.567 8.237 ( -7.280 -0.000 -1.527) 7.439 8.301 ( 4.825 0.000 -2.502) 5.435 8.475 ( -10.371 -0.000 11.956) 15.828 8.584 ( -13.131 -0.000 -6.805) 14.789 8.674 ( -10.126 -0.000 -2.895) 10.531 8.782 ( -11.267 -0.000 3.615) 11.833 9.405 ( -11.633 -0.000 -7.943) 14.086 9.464 ( 10.790 0.000 -13.366) 17.178 9.627 ( -2.111 -0.000 8.154) 8.423 9.654 ( -13.587 -0.000 13.387) 19.074 9.868 ( 3.093 0.000 -6.395) 7.104 10.419 ( 19.599 0.000 11.797) 22.875 10.614 ( -6.615 -0.000 -6.673) 9.397 11.655 ( 14.201 0.000 -2.422) 14.406 11.891 ( -17.144 -0.000 1.634) 17.222 12.069 ( 2.464 0.000 7.109) 7.524 12.228 ( 18.227 0.000 -0.213) 18.228 12.436 ( -15.336 -0.000 7.552) 17.095 12.453 ( 12.282 0.000 -17.748) 21.583 12.654 ( 10.071 0.000 0.860) 10.107 12.871 ( -2.168 -0.000 6.057) 6.433 13.152 ( 5.166 0.000 9.904) 11.170 13.204 ( -19.092 -0.000 -11.672) 22.377 14.530 ( -15.404 -0.000 11.129) 19.003 14.768 ( 6.194 0.000 -12.546) 13.992 17.277 ( -1.160 -0.000 -6.147) 6.255 17.609 ( 10.786 0.000 6.769) 12.734 21.346 ( -16.711 -0.000 -3.297) 17.034 21.459 ( -14.572 -0.000 3.031) 14.884 22.772 ( -3.601 -0.000 -1.376) 3.855 23.158 ( -8.727 -0.000 5.066) 10.091 23.905 ( 0.631 0.000 -4.950) 4.990 24.229 ( 3.090 0.000 1.138) 3.293 25.093 ( 7.022 0.000 -0.231) 7.025 25.516 ( 13.913 0.000 2.138) 14.076 26.075 ( 8.465 0.000 -5.229) 9.950 26.273 ( 6.085 0.000 3.043) 6.803 28.031 ( -11.381 -0.000 4.647) 12.293 28.117 ( -5.362 -0.000 -3.651) 6.487 ======================= Grid point 47 (29/117) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.557 ( -3.154 19.077 -3.751) 19.697 2.969 ( -6.903 0.711 -2.421) 7.350 3.426 ( 0.776 -6.846 0.363) 6.900 3.520 ( 1.909 10.868 0.920) 11.072 3.818 ( -8.226 0.220 5.947) 10.152 4.070 ( 11.709 -7.266 7.313) 15.601 4.339 ( 8.456 -0.382 1.559) 8.607 4.457 ( 3.244 4.667 -6.193) 8.405 4.524 ( 1.979 -2.413 1.655) 3.533 4.706 ( 7.134 -1.872 2.090) 7.666 4.725 ( 2.976 -2.423 -0.544) 3.876 5.155 ( -5.711 7.561 -3.064) 9.959 5.306 ( -4.274 -1.346 -6.043) 7.523 5.357 ( -2.689 7.179 -15.970) 17.715 5.462 ( 3.066 -0.363 -6.842) 7.507 5.577 ( -5.713 4.145 14.749) 16.351 5.638 ( 13.921 -1.270 3.783) 14.482 5.787 ( -5.296 -13.655 4.878) 15.437 6.230 ( 4.055 2.694 -0.985) 4.967 6.289 ( 0.650 -1.494 2.075) 2.638 6.292 ( 5.005 -1.070 2.130) 5.544 6.361 ( 0.040 -0.073 -0.572) 0.578 6.492 ( 12.193 2.496 -6.245) 13.925 6.703 ( -0.304 5.304 -0.954) 5.397 6.823 ( -2.075 -3.555 6.121) 7.376 6.906 ( -10.677 -0.350 7.286) 12.930 7.257 ( 5.860 7.448 -0.448) 9.487 7.349 ( -5.125 16.251 -1.579) 17.113 7.419 ( -5.212 5.146 -2.035) 7.601 7.561 ( -4.312 6.282 -1.304) 7.731 7.690 ( -2.653 -3.494 -1.563) 4.657 7.929 ( -8.072 -11.712 1.170) 14.273 8.039 ( -14.186 -5.936 -10.152) 18.427 8.042 ( 6.767 2.300 2.921) 7.721 8.265 ( -5.568 0.943 1.225) 5.779 8.359 ( -0.232 -1.383 1.423) 1.998 8.477 ( -2.276 -7.461 -1.105) 7.878 8.574 ( -10.743 -0.712 0.670) 10.788 8.696 ( 3.997 -7.461 2.066) 8.713 9.150 ( -15.099 -2.583 -1.527) 15.395 9.497 ( -4.980 0.316 2.934) 5.789 9.524 ( -3.748 -2.290 1.852) 4.767 9.739 ( 11.760 -2.305 -8.441) 14.658 9.924 ( 1.504 -1.466 2.970) 3.638 10.498 ( -4.336 1.295 -3.785) 5.900 10.821 ( 22.900 -0.069 6.226) 23.731 11.601 ( -14.774 -1.831 7.263) 16.564 11.789 ( 1.707 -1.845 -4.303) 4.983 12.056 ( -19.854 -0.175 2.119) 19.968 12.153 ( 1.954 -2.562 5.546) 6.414 12.443 ( 5.335 0.305 -4.359) 6.896 12.593 ( 4.429 0.823 -5.675) 7.245 12.765 ( -5.122 4.959 -5.041) 8.731 12.906 ( 7.631 -3.339 -2.199) 8.615 13.091 ( 5.421 -2.346 4.764) 7.588 13.306 ( 12.300 -0.659 -1.900) 12.464 14.233 ( -18.335 -1.245 12.020) 21.959 14.843 ( 3.440 1.343 -8.504) 9.272 17.260 ( -0.574 -0.606 -3.947) 4.034 17.789 ( 8.592 1.418 4.175) 9.657 21.069 ( -12.200 -0.126 -1.404) 12.281 21.195 ( -13.539 -0.470 1.226) 13.602 22.725 ( -1.683 -0.071 -1.176) 2.054 23.038 ( -4.871 -0.227 3.198) 5.831 23.891 ( 0.038 3.407 -2.451) 4.197 24.254 ( 1.839 4.406 0.698) 4.825 25.217 ( 4.819 -3.130 -0.184) 5.749 25.732 ( 8.486 -1.174 0.874) 8.611 26.197 ( 5.770 2.842 -2.745) 6.993 26.394 ( 5.221 -3.821 1.384) 6.616 27.856 ( -8.164 -0.613 3.224) 8.799 28.041 ( -2.896 -0.432 -2.301) 3.723 ======================= Grid point 48 (30/117) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.265 ( 0.000 26.379 0.000) 26.379 2.859 ( 0.000 9.008 0.000) 9.008 3.174 ( 0.000 21.708 0.000) 21.708 3.714 ( 0.000 0.749 0.000) 0.749 3.773 ( -0.000 -14.639 -0.000) 14.639 4.266 ( -0.000 -10.485 -0.000) 10.485 4.398 ( 0.000 13.014 0.000) 13.014 4.543 ( -0.000 -9.973 -0.000) 9.973 4.592 ( 0.000 12.563 0.000) 12.563 4.700 ( -0.000 -14.844 -0.000) 14.844 4.854 ( -0.000 -3.915 -0.000) 3.915 4.947 ( 0.000 13.985 0.000) 13.985 5.128 ( 0.000 18.360 0.000) 18.360 5.318 ( -0.000 -7.232 -0.000) 7.232 5.484 ( 0.000 3.000 0.000) 3.000 5.512 ( -0.000 -1.733 -0.000) 1.733 5.806 ( -0.000 -10.978 -0.000) 10.978 5.931 ( -0.000 -5.096 -0.000) 5.096 6.181 ( 0.000 3.949 0.000) 3.949 6.308 ( 0.000 1.266 0.000) 1.266 6.344 ( -0.000 -5.788 -0.000) 5.788 6.385 ( 0.000 6.265 0.000) 6.265 6.582 ( 0.000 9.608 0.000) 9.608 6.644 ( 0.000 4.274 0.000) 4.274 6.767 ( 0.000 3.165 0.000) 3.165 6.863 ( -0.000 -5.213 -0.000) 5.213 7.091 ( 0.000 16.207 0.000) 16.207 7.264 ( 0.000 6.564 0.000) 6.564 7.362 ( -0.000 -0.365 -0.000) 0.365 7.441 ( 0.000 6.340 0.000) 6.340 7.675 ( -0.000 -2.133 -0.000) 2.133 7.891 ( -0.000 -0.453 -0.000) 0.453 7.988 ( -0.000 -10.835 -0.000) 10.835 8.092 ( 0.000 3.617 0.000) 3.617 8.247 ( -0.000 -2.050 -0.000) 2.050 8.326 ( 0.000 1.659 0.000) 1.659 8.512 ( -0.000 -8.508 -0.000) 8.508 8.552 ( -0.000 -8.030 -0.000) 8.030 8.931 ( -0.000 -20.571 -0.000) 20.571 8.974 ( -0.000 -1.213 -0.000) 1.213 9.440 ( 0.000 1.334 0.000) 1.334 9.514 ( -0.000 -2.586 -0.000) 2.586 9.890 ( 0.000 0.104 0.000) 0.104 9.965 ( -0.000 -7.844 -0.000) 7.844 10.441 ( 0.000 1.624 0.000) 1.624 11.137 ( -0.000 -0.651 -0.000) 0.651 11.418 ( -0.000 -0.690 -0.000) 0.690 11.783 ( -0.000 -1.941 -0.000) 1.941 11.876 ( -0.000 -5.687 -0.000) 5.687 12.208 ( -0.000 -2.503 -0.000) 2.503 12.511 ( -0.000 -2.970 -0.000) 2.970 12.618 ( 0.000 1.333 0.000) 1.333 12.632 ( 0.000 6.063 0.000) 6.063 13.006 ( -0.000 -2.807 -0.000) 2.807 13.193 ( -0.000 -2.883 -0.000) 2.883 13.480 ( 0.000 2.738 0.000) 2.738 14.036 ( -0.000 -4.600 -0.000) 4.600 14.852 ( 0.000 2.543 0.000) 2.543 17.263 ( -0.000 -1.293 -0.000) 1.293 17.858 ( 0.000 2.499 0.000) 2.499 20.955 ( -0.000 -0.485 -0.000) 0.485 21.057 ( 0.000 0.205 0.000) 0.205 22.708 ( 0.000 0.369 0.000) 0.369 22.996 ( -0.000 -0.126 -0.000) 0.126 23.840 ( 0.000 6.806 0.000) 6.806 24.211 ( 0.000 7.771 0.000) 7.771 25.310 ( -0.000 -6.119 -0.000) 6.119 25.827 ( -0.000 -2.116 -0.000) 2.116 26.212 ( 0.000 3.958 0.000) 3.958 26.509 ( -0.000 -7.138 -0.000) 7.138 27.778 ( -0.000 -0.000 -0.000) 0.000 28.020 ( -0.000 -0.852 -0.000) 0.852 ======================= Grid point 58 (31/117) ======================= q-point: ( 0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.628 ( 0.000 0.000 0.000) 0.000 2.840 ( 0.000 0.000 0.000) 0.000 3.418 ( -0.000 -0.000 -0.000) 0.000 3.649 ( 0.000 0.000 0.000) 0.000 3.715 ( 0.000 0.000 0.000) 0.000 4.139 ( 0.000 0.000 0.000) 0.000 4.413 ( 0.000 0.000 0.000) 0.000 4.529 ( 0.000 0.000 0.000) 0.000 4.550 ( 0.000 0.000 0.000) 0.000 4.726 ( 0.000 0.000 0.000) 0.000 4.812 ( 0.000 0.000 0.000) 0.000 5.149 ( 0.000 0.000 0.000) 0.000 5.155 ( -0.000 -0.000 -0.000) 0.000 5.381 ( -0.000 -0.000 -0.000) 0.000 5.514 ( 0.000 0.000 0.000) 0.000 5.542 ( -0.000 -0.000 -0.000) 0.000 5.581 ( 0.000 0.000 0.000) 0.000 5.875 ( -0.000 -0.000 -0.000) 0.000 6.222 ( 0.000 0.000 0.000) 0.000 6.274 ( 0.000 0.000 0.000) 0.000 6.325 ( 0.000 0.000 0.000) 0.000 6.429 ( -0.000 -0.000 -0.000) 0.000 6.690 ( 0.000 0.000 0.000) 0.000 6.705 ( 0.000 0.000 0.000) 0.000 6.791 ( 0.000 0.000 0.000) 0.000 6.792 ( 0.000 0.000 0.000) 0.000 7.327 ( 0.000 0.000 0.000) 0.000 7.374 ( -0.000 -0.000 -0.000) 0.000 7.428 ( 0.000 0.000 0.000) 0.000 7.555 ( -0.000 -0.000 -0.000) 0.000 7.686 ( 0.000 0.000 0.000) 0.000 7.737 ( -0.000 -0.000 -0.000) 0.000 7.832 ( 0.000 0.000 0.000) 0.000 8.192 ( 0.000 0.000 0.000) 0.000 8.213 ( 0.000 0.000 0.000) 0.000 8.358 ( -0.000 -0.000 -0.000) 0.000 8.392 ( 0.000 0.000 0.000) 0.000 8.426 ( 0.000 0.000 0.000) 0.000 8.723 ( 0.000 0.000 0.000) 0.000 8.963 ( 0.000 0.000 0.000) 0.000 9.466 ( -0.000 -0.000 -0.000) 0.000 9.471 ( 0.000 0.000 0.000) 0.000 9.883 ( 0.000 0.000 0.000) 0.000 9.894 ( 0.000 0.000 0.000) 0.000 10.463 ( 0.000 0.000 0.000) 0.000 11.130 ( 0.000 0.000 0.000) 0.000 11.410 ( 0.000 0.000 0.000) 0.000 11.788 ( -0.000 -0.000 -0.000) 0.000 11.790 ( 0.000 0.000 0.000) 0.000 12.182 ( 0.000 0.000 0.000) 0.000 12.475 ( 0.000 0.000 0.000) 0.000 12.639 ( 0.000 0.000 0.000) 0.000 12.695 ( 0.000 0.000 0.000) 0.000 12.976 ( 0.000 0.000 0.000) 0.000 13.161 ( 0.000 0.000 0.000) 0.000 13.509 ( 0.000 0.000 0.000) 0.000 13.991 ( 0.000 0.000 0.000) 0.000 14.877 ( 0.000 0.000 0.000) 0.000 17.251 ( 0.000 0.000 0.000) 0.000 17.883 ( 0.000 0.000 0.000) 0.000 20.950 ( 0.000 0.000 0.000) 0.000 21.059 ( 0.000 0.000 0.000) 0.000 22.711 ( 0.000 0.000 0.000) 0.000 22.995 ( 0.000 0.000 0.000) 0.000 23.908 ( 0.000 0.000 0.000) 0.000 24.294 ( 0.000 0.000 0.000) 0.000 25.244 ( 0.000 0.000 0.000) 0.000 25.805 ( 0.000 0.000 0.000) 0.000 26.273 ( 0.000 0.000 0.000) 0.000 26.417 ( 0.000 0.000 0.000) 0.000 27.778 ( 0.000 0.000 0.000) 0.000 28.012 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 105 (32/117) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( 0.604 0.000 37.122) 37.127 0.890 ( -13.533 -0.000 41.034) 43.208 1.676 ( 4.651 0.000 74.709) 74.854 2.145 ( 3.372 0.000 -19.127) 19.422 2.694 ( 7.771 0.000 -39.618) 40.373 3.461 ( -12.213 -0.000 4.772) 13.112 3.744 ( 5.331 0.000 -2.701) 5.976 4.378 ( -3.278 -0.000 31.716) 31.885 4.543 ( -2.617 -0.000 -16.958) 17.158 4.650 ( 7.639 0.000 -30.789) 31.722 4.653 ( -1.837 -0.000 -1.202) 2.196 5.225 ( 2.022 0.000 -5.254) 5.630 5.297 ( -7.509 -0.000 4.463) 8.735 5.507 ( -11.318 -0.000 0.886) 11.353 5.579 ( 1.816 0.000 -3.889) 4.292 5.792 ( 12.699 0.000 -11.158) 16.904 5.950 ( 9.078 0.000 5.163) 10.443 6.036 ( 0.312 0.000 7.859) 7.866 6.176 ( -6.653 -0.000 -5.874) 8.875 6.264 ( -0.117 -0.000 7.537) 7.537 6.311 ( -1.760 -0.000 -0.134) 1.765 6.463 ( 6.129 0.000 -5.871) 8.487 6.548 ( -1.612 -0.000 -9.252) 9.391 6.726 ( -7.787 -0.000 -7.700) 10.951 6.853 ( 4.225 0.000 1.994) 4.672 6.951 ( -1.090 -0.000 -1.579) 1.918 7.137 ( 1.087 0.000 5.850) 5.950 7.350 ( 2.886 0.000 -3.271) 4.362 7.482 ( 1.472 0.000 9.527) 9.640 7.582 ( -1.401 -0.000 2.529) 2.891 7.715 ( 1.624 0.000 2.830) 3.263 7.885 ( -5.343 -0.000 14.119) 15.096 8.087 ( -2.832 -0.000 3.390) 4.418 8.133 ( 0.193 0.000 -9.513) 9.515 8.324 ( -0.963 -0.000 2.248) 2.445 8.463 ( 9.205 0.000 3.562) 9.870 8.497 ( -1.306 -0.000 0.364) 1.356 8.919 ( 9.358 0.000 -10.522) 14.082 9.090 ( -2.679 -0.000 5.606) 6.213 9.428 ( 16.563 0.000 -14.415) 21.957 9.578 ( 0.879 0.000 10.791) 10.827 9.960 ( -7.312 -0.000 12.772) 14.717 10.073 ( -13.061 -0.000 -2.557) 13.309 10.528 ( 14.371 0.000 -2.547) 14.595 10.774 ( -6.112 -0.000 -9.345) 11.166 10.774 ( -1.060 -0.000 -2.467) 2.685 11.504 ( -3.224 -0.000 9.757) 10.276 11.910 ( -1.399 -0.000 -0.026) 1.399 12.078 ( -1.774 -0.000 2.556) 3.111 12.113 ( 8.459 0.000 -7.805) 11.510 12.427 ( 1.914 0.000 1.475) 2.416 12.593 ( -6.040 -0.000 -1.345) 6.188 12.885 ( 0.733 0.000 5.022) 5.076 12.935 ( 11.882 0.000 7.274) 13.932 13.260 ( -6.455 -0.000 -3.955) 7.570 13.531 ( -3.388 -0.000 -9.785) 10.355 14.469 ( -7.107 -0.000 3.016) 7.721 14.574 ( 7.359 0.000 -0.588) 7.382 17.402 ( 2.173 0.000 1.462) 2.619 17.476 ( -2.085 -0.000 -1.195) 2.403 21.039 ( -6.069 -0.000 0.966) 6.146 21.095 ( 33.094 0.000 -1.047) 33.111 22.911 ( -14.383 -0.000 2.219) 14.554 23.030 ( 1.273 0.000 -2.093) 2.450 23.253 ( -4.442 -0.000 4.581) 6.381 23.517 ( 4.279 0.000 -4.965) 6.554 25.731 ( -3.239 -0.000 3.301) 4.625 25.911 ( 3.065 0.000 -3.313) 4.513 26.424 ( 3.357 0.000 1.410) 3.641 26.488 ( -0.859 -0.000 -1.003) 1.321 28.049 ( -50.158 -0.000 0.604) 50.161 28.081 ( 8.797 0.000 -0.556) 8.814 ======================= Grid point 106 (33/117) ======================= q-point: ( 0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( 9.355 -35.317 24.131) 43.785 1.251 ( 25.202 -11.415 27.341) 38.897 2.148 ( 27.573 -10.801 59.908) 66.827 2.450 ( 22.611 -1.580 -23.945) 32.971 2.935 ( 14.063 -7.300 -36.735) 40.007 3.173 ( -9.987 -7.888 3.651) 13.240 3.597 ( -18.714 -4.233 1.070) 19.217 4.351 ( 0.309 -1.238 29.790) 29.817 4.589 ( 5.631 -2.181 -13.837) 15.097 4.726 ( 1.025 0.806 -19.922) 19.964 4.822 ( 7.608 1.773 -12.904) 15.084 5.113 ( -1.818 6.505 0.463) 6.770 5.220 ( -3.728 -0.625 -2.955) 4.798 5.398 ( -1.692 -0.696 5.910) 6.186 5.600 ( 2.373 -0.902 -2.190) 3.353 5.766 ( -7.306 9.227 2.744) 12.085 5.894 ( -12.861 -0.015 -4.460) 13.612 6.045 ( 0.466 -4.481 -7.393) 8.657 6.220 ( -4.846 1.403 -2.624) 5.687 6.274 ( 3.542 3.209 5.577) 7.345 6.380 ( 1.566 2.808 -2.223) 3.909 6.434 ( -6.985 -2.887 -1.339) 7.676 6.553 ( 7.632 -1.576 -10.109) 12.765 6.711 ( 5.730 2.625 -6.587) 9.117 6.845 ( -0.500 7.291 -2.504) 7.726 6.980 ( 5.482 1.116 -4.988) 7.495 7.101 ( -0.319 3.525 2.483) 4.324 7.344 ( 4.515 5.586 -5.027) 8.767 7.493 ( 4.276 13.165 5.222) 14.794 7.623 ( 1.769 -5.339 12.698) 13.888 7.770 ( -0.575 -3.037 15.237) 15.547 7.898 ( 2.257 -4.785 -2.985) 6.075 8.043 ( -2.932 0.410 1.304) 3.235 8.075 ( -5.742 -5.698 -9.409) 12.408 8.365 ( 2.911 -1.263 -0.716) 3.253 8.512 ( 1.134 -3.148 1.401) 3.628 8.685 ( 13.832 2.762 -0.039) 14.105 8.957 ( 3.129 3.559 1.606) 5.004 9.175 ( 5.462 -4.157 2.457) 7.290 9.501 ( 2.312 5.543 13.903) 15.145 9.599 ( -15.087 -1.157 6.164) 16.338 9.685 ( 1.350 -2.260 -4.617) 5.314 9.982 ( -0.551 -6.657 8.940) 11.160 10.489 ( -11.247 4.723 -1.658) 12.311 10.698 ( -1.040 8.741 -5.953) 10.627 10.829 ( 2.527 -2.770 -0.555) 3.790 11.737 ( 6.863 1.553 -7.763) 10.477 11.790 ( -8.091 -3.664 -5.486) 10.440 12.007 ( -0.463 1.830 -0.232) 1.902 12.234 ( 5.309 1.469 -4.114) 6.875 12.434 ( -5.511 -1.316 4.293) 7.109 12.474 ( -3.143 -2.182 -1.442) 4.089 12.881 ( -3.225 1.518 1.718) 3.957 13.059 ( 0.903 -0.534 9.039) 9.099 13.155 ( -5.263 -1.499 -5.451) 7.724 13.461 ( 0.299 1.430 -5.552) 5.741 14.448 ( 5.634 2.027 -2.157) 6.364 14.742 ( 9.325 0.135 3.105) 9.829 17.420 ( -3.604 0.660 -2.088) 4.217 17.448 ( 1.098 -1.189 1.755) 2.387 21.060 ( 7.270 -0.350 -2.124) 7.582 21.999 ( 48.068 24.833 -30.570) 62.143 22.733 ( 0.441 -0.161 7.034) 7.049 23.092 ( 6.464 0.685 -1.720) 6.724 23.236 ( 0.401 -3.995 1.039) 4.147 23.628 ( 3.441 -8.611 -3.800) 10.022 25.580 ( -21.142 2.495 9.062) 23.138 25.711 ( -29.083 -11.208 13.462) 33.950 26.041 ( -8.189 -3.141 11.085) 14.135 26.430 ( -5.486 -0.017 -3.112) 6.307 27.916 ( 19.040 1.483 -9.576) 21.364 28.235 ( 7.340 1.105 6.285) 9.726 ======================= Grid point 107 (34/117) ======================= q-point: ( 0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( -5.936 -46.315 0.642) 46.698 1.772 ( 17.338 -9.183 14.868) 24.617 2.283 ( -1.929 1.750 5.697) 6.264 3.058 ( 30.592 -12.367 5.895) 33.520 3.224 ( -10.783 -7.000 -1.160) 12.908 3.353 ( 24.921 -13.541 -11.848) 30.737 3.657 ( 23.656 -13.725 2.035) 27.426 4.399 ( -2.176 2.772 14.828) 15.241 4.550 ( -3.707 1.549 12.825) 13.440 4.709 ( -3.269 6.153 -11.883) 13.775 4.907 ( 8.188 -9.150 -18.698) 22.370 5.047 ( -3.463 3.716 -6.462) 8.220 5.178 ( 0.967 2.025 0.338) 2.269 5.373 ( 0.666 0.732 6.339) 6.415 5.514 ( -8.099 11.162 1.786) 13.906 5.563 ( -18.887 -0.792 -5.796) 19.772 5.727 ( 2.895 -4.263 0.489) 5.176 5.991 ( -6.280 -0.801 0.216) 6.334 6.176 ( -2.655 1.348 -4.910) 5.742 6.247 ( 0.914 0.113 -3.940) 4.046 6.301 ( -7.422 2.720 1.188) 7.994 6.370 ( -3.905 -0.850 0.137) 3.998 6.651 ( 1.152 9.194 -3.330) 9.846 6.676 ( 2.190 6.203 -2.520) 7.045 6.812 ( 2.183 3.050 -6.009) 7.084 6.954 ( -1.369 3.982 -3.068) 5.210 7.271 ( 15.060 -1.286 -4.666) 15.819 7.438 ( 13.772 11.773 -2.078) 18.237 7.463 ( 3.856 4.596 0.125) 6.000 7.699 ( 0.965 0.479 4.442) 4.571 7.789 ( 3.425 -2.801 18.863) 19.375 7.943 ( -0.200 -1.123 -1.055) 1.554 8.020 ( -0.275 -6.036 -5.970) 8.494 8.110 ( 0.625 -9.107 -1.328) 9.224 8.425 ( 2.197 -0.928 -1.543) 2.840 8.568 ( 0.657 -3.300 1.414) 3.650 8.840 ( 8.924 5.916 0.214) 10.709 9.039 ( 4.962 0.674 3.905) 6.350 9.262 ( 3.532 2.219 -1.097) 4.313 9.517 ( 5.783 -5.511 1.831) 8.196 9.640 ( -0.074 1.906 6.260) 6.544 9.673 ( 6.291 1.555 -2.722) 7.029 10.025 ( 1.131 2.125 10.628) 10.897 10.236 ( -11.839 2.989 3.928) 12.827 10.566 ( -2.111 11.161 -5.157) 12.475 10.811 ( -3.014 -0.352 6.451) 7.129 11.448 ( -25.315 -5.268 -0.784) 25.869 11.790 ( -7.730 -3.347 -11.435) 14.203 12.118 ( 9.924 4.829 -0.038) 11.037 12.192 ( -10.298 1.738 0.386) 10.451 12.334 ( 1.436 -1.043 0.984) 2.029 12.520 ( 0.743 -4.008 -3.928) 5.661 12.775 ( -1.474 3.695 -7.465) 8.459 13.032 ( -3.651 -0.653 7.793) 8.631 13.101 ( -2.318 -2.264 -0.862) 3.353 13.525 ( 6.673 1.287 -0.333) 6.805 14.585 ( 11.421 3.855 -5.084) 13.082 14.882 ( 6.226 0.591 5.020) 8.019 17.333 ( -4.516 1.349 -1.985) 5.114 17.460 ( -0.574 -0.197 1.870) 1.966 21.255 ( 11.932 -2.075 -2.983) 12.474 22.145 ( 7.262 21.989 2.981) 23.348 22.893 ( 10.549 2.701 -6.741) 12.807 23.273 ( 15.539 4.279 -7.624) 17.830 23.341 ( 4.600 -8.628 -1.531) 9.897 23.769 ( 2.568 -8.398 -1.470) 8.904 25.068 ( -28.793 -5.251 15.397) 33.071 25.507 ( -12.728 -6.713 0.761) 14.409 26.010 ( -2.236 -2.050 4.778) 5.660 26.318 ( -5.302 2.051 -3.535) 6.695 28.206 ( 15.572 4.464 -10.487) 19.297 28.328 ( 4.425 1.793 7.357) 8.771 ======================= Grid point 108 (35/117) ======================= q-point: ( 0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( -19.609 -25.511 -15.473) 35.704 2.083 ( 7.765 -9.270 9.967) 15.670 2.694 ( 20.133 -24.204 7.929) 32.466 3.114 ( -5.039 -8.453 -7.485) 12.364 3.500 ( 11.665 4.831 -0.866) 12.656 3.876 ( 5.471 -0.356 -6.353) 8.392 4.048 ( 6.707 -19.096 17.797) 26.951 4.387 ( -0.251 -3.979 -5.969) 7.178 4.543 ( 9.009 2.242 4.774) 10.440 4.620 ( -0.535 4.412 -1.662) 4.745 4.952 ( -3.390 -1.739 -4.289) 5.737 5.066 ( 2.642 3.172 1.077) 4.266 5.163 ( -1.394 5.159 -0.149) 5.346 5.311 ( -7.116 0.505 0.416) 7.146 5.333 ( 0.749 -0.790 0.433) 1.172 5.474 ( 5.631 -6.319 11.073) 13.938 5.764 ( -1.729 0.240 4.870) 5.174 5.941 ( 1.012 -1.690 -5.670) 6.002 6.084 ( -13.486 -3.099 -3.286) 14.222 6.134 ( -3.753 0.609 -6.068) 7.161 6.237 ( -6.024 1.259 -0.205) 6.158 6.275 ( 1.860 7.876 -6.935) 10.657 6.537 ( 5.583 11.876 4.056) 13.736 6.682 ( -0.322 1.509 -2.097) 2.604 6.799 ( 0.023 2.067 -4.295) 4.767 6.940 ( 3.116 -0.018 -4.640) 5.589 7.371 ( -3.312 8.325 4.313) 9.943 7.533 ( 8.214 2.977 1.837) 8.927 7.572 ( 12.247 3.665 -5.770) 14.026 7.854 ( 13.784 3.145 -5.775) 15.272 7.933 ( 1.721 -1.193 2.735) 3.445 8.042 ( 13.037 -7.116 5.429) 15.814 8.066 ( 0.475 -5.018 -4.151) 6.530 8.285 ( 10.032 -8.945 -0.252) 13.443 8.449 ( -0.294 -0.855 -2.936) 3.072 8.590 ( -0.373 -1.264 2.176) 2.544 8.917 ( 4.352 3.325 -0.397) 5.491 9.057 ( 0.469 4.668 5.817) 7.473 9.368 ( 8.062 -2.877 0.629) 8.583 9.524 ( -3.666 2.025 -3.285) 5.323 9.713 ( 5.875 -0.237 6.838) 9.018 9.789 ( 5.159 4.856 -5.287) 8.841 9.970 ( -5.960 5.563 -0.271) 8.158 10.047 ( -1.009 6.271 9.589) 11.501 10.436 ( -0.197 5.985 -3.167) 6.774 10.805 ( -1.406 0.876 5.606) 5.846 10.998 ( -27.601 -6.699 4.116) 28.699 11.525 ( -24.637 -4.335 -4.339) 25.389 11.937 ( -13.752 -0.341 -0.518) 13.766 12.168 ( 0.898 4.047 4.928) 6.440 12.449 ( 8.935 3.288 3.004) 9.984 12.586 ( 4.986 -1.898 -13.250) 14.284 12.802 ( 6.313 1.969 -7.272) 9.829 12.981 ( -2.505 -0.179 4.605) 5.245 13.120 ( 1.394 -3.041 3.153) 4.597 13.621 ( 3.698 -0.385 -0.590) 3.765 14.734 ( 9.337 4.674 -3.846) 11.127 14.968 ( 3.944 0.708 3.880) 5.577 17.239 ( -3.792 1.619 -0.908) 4.222 17.436 ( -2.264 -0.175 0.977) 2.472 21.490 ( 10.287 -4.493 -4.097) 11.950 22.043 ( 1.746 14.415 7.921) 16.540 23.007 ( 5.946 1.719 -3.318) 7.023 23.448 ( 7.700 0.330 -4.632) 8.992 23.594 ( 14.034 -4.463 -5.255) 15.636 23.870 ( 0.951 -5.644 1.815) 6.005 24.658 ( -21.631 -1.367 7.148) 22.822 25.351 ( -10.544 -5.091 -0.693) 11.729 25.981 ( -3.539 -1.757 3.979) 5.608 26.205 ( -3.890 2.916 -2.994) 5.710 28.370 ( 6.232 2.966 -0.624) 6.930 28.395 ( 6.743 3.199 -0.166) 7.465 ======================= Grid point 109 (36/117) ======================= q-point: ( 0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 8.779 -20.035 -2.464) 22.012 2.306 ( 8.540 -7.189 1.220) 11.229 2.914 ( -9.893 -7.446 -8.205) 14.854 3.251 ( -7.841 2.312 7.023) 10.778 3.529 ( 11.760 -11.323 7.731) 18.063 3.930 ( 7.508 3.042 -12.120) 14.578 4.140 ( -10.404 8.490 0.534) 13.439 4.277 ( -6.168 -9.131 -0.817) 11.049 4.547 ( 1.227 2.875 -3.366) 4.593 4.772 ( 2.410 -8.581 8.270) 12.159 4.977 ( -2.131 -2.298 3.736) 4.877 5.085 ( 2.898 -1.463 -5.382) 6.285 5.128 ( 2.499 3.200 -1.252) 4.249 5.281 ( 2.891 -6.344 0.773) 7.015 5.442 ( 6.618 4.529 5.315) 9.621 5.612 ( 0.781 -5.546 8.566) 10.235 5.725 ( -0.854 2.029 6.624) 6.980 5.809 ( -12.713 9.920 -0.847) 16.147 5.895 ( -4.174 1.462 -1.160) 4.572 6.041 ( 2.649 4.466 -2.883) 5.939 6.187 ( -0.940 -1.151 0.888) 1.731 6.353 ( 5.094 0.015 -0.866) 5.167 6.531 ( 0.487 4.596 -3.753) 5.954 6.663 ( 0.493 0.384 -2.776) 2.845 6.777 ( -3.314 -2.973 1.137) 4.595 7.082 ( 9.811 -2.264 -1.080) 10.127 7.294 ( 4.415 4.700 -3.498) 7.336 7.597 ( 2.856 1.562 -3.590) 4.846 7.762 ( 9.150 -0.927 -7.019) 11.569 7.929 ( -1.388 2.125 -4.380) 5.062 7.940 ( 0.552 0.838 1.810) 2.069 8.131 ( 3.898 1.780 -7.568) 8.697 8.412 ( 14.921 -6.218 2.600) 16.373 8.436 ( -0.720 -1.109 -0.230) 1.342 8.552 ( 5.552 -3.544 2.458) 7.030 8.655 ( 8.103 -0.360 2.937) 8.626 8.952 ( 2.179 -3.173 2.266) 4.467 9.066 ( 8.147 1.569 -0.184) 8.299 9.464 ( -2.787 0.694 -0.894) 3.008 9.558 ( 5.368 -2.749 3.880) 7.171 9.610 ( -10.835 5.747 4.843) 13.186 9.800 ( 5.422 7.903 -0.042) 9.585 9.840 ( -3.778 1.761 -4.127) 5.866 10.008 ( 0.664 6.489 5.853) 8.764 10.426 ( -9.620 1.582 -0.515) 9.763 10.550 ( -1.848 -2.088 -6.351) 6.936 10.844 ( -6.480 -1.437 6.657) 9.400 11.053 ( -28.337 -2.093 -1.646) 28.462 11.764 ( -5.234 -1.314 0.180) 5.400 12.133 ( -2.194 1.174 8.933) 9.273 12.547 ( 4.804 2.760 6.227) 8.335 12.685 ( 3.706 -1.449 -11.898) 12.546 12.868 ( 1.661 1.001 -0.666) 2.050 12.993 ( 6.316 3.366 -5.540) 9.051 13.199 ( 3.678 -2.118 3.968) 5.810 13.654 ( -1.655 -2.921 -2.219) 4.024 14.811 ( 3.428 3.050 -0.384) 4.605 15.023 ( 2.808 0.613 0.832) 2.992 17.178 ( -0.903 1.657 0.782) 2.042 17.390 ( -3.093 -0.699 -0.431) 3.200 21.681 ( 4.996 -5.116 -4.903) 8.670 21.961 ( 1.555 8.512 7.143) 11.220 23.085 ( 5.161 2.223 -3.003) 6.371 23.553 ( 3.629 -1.366 -3.785) 5.419 23.852 ( 8.969 -1.791 1.405) 9.253 23.920 ( -0.618 -4.283 3.705) 5.697 24.337 ( -12.861 0.836 -0.988) 12.926 25.239 ( -5.642 -2.755 -1.084) 6.371 25.928 ( -3.880 -1.470 3.475) 5.412 26.128 ( -1.416 2.574 -2.203) 3.672 28.416 ( 1.398 0.049 2.337) 2.724 28.475 ( 5.262 3.786 -2.366) 6.901 ======================= Grid point 110 (37/117) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.040 ( 9.088 -3.527 7.704) 12.425 2.518 ( 9.396 -2.786 -6.305) 11.653 2.839 ( -10.471 6.081 2.106) 12.290 2.905 ( -5.905 -4.905 -0.427) 7.689 3.674 ( -11.790 10.488 -7.417) 17.436 3.902 ( 2.017 -6.879 -1.187) 7.266 4.122 ( 9.238 -4.110 0.825) 10.145 4.356 ( 5.772 -8.444 -5.574) 11.649 4.578 ( -0.004 7.943 5.400) 9.605 4.772 ( -2.767 7.807 1.665) 8.449 4.893 ( -4.319 -7.225 0.572) 8.437 5.096 ( -3.451 -5.224 -0.599) 6.289 5.235 ( 6.239 3.455 5.336) 8.907 5.281 ( -4.980 8.195 3.794) 10.313 5.449 ( 4.198 3.192 -3.380) 6.264 5.619 ( -4.420 -5.891 1.551) 7.526 5.703 ( 1.064 -2.077 3.500) 4.207 5.754 ( 3.847 -6.183 1.468) 7.429 5.875 ( 1.647 0.252 -1.819) 2.467 6.000 ( -0.443 10.060 -0.901) 10.110 6.165 ( -0.717 5.602 7.640) 9.501 6.354 ( -0.507 0.797 5.402) 5.485 6.508 ( -1.578 0.247 -3.591) 3.931 6.696 ( -1.856 -8.176 -3.021) 8.912 6.747 ( 0.806 3.068 -0.064) 3.172 7.183 ( -2.936 -0.954 0.934) 3.225 7.424 ( 9.450 -1.831 -3.586) 10.272 7.628 ( 2.887 -1.073 -7.542) 8.147 7.827 ( -3.369 2.812 -4.170) 6.054 7.900 ( -2.860 -2.399 1.773) 4.133 7.920 ( 0.924 -0.438 -12.688) 12.729 8.113 ( -3.674 -1.489 -7.484) 8.469 8.451 ( 1.295 -0.037 3.258) 3.506 8.543 ( -1.455 2.500 3.399) 4.464 8.632 ( -1.815 0.477 3.525) 3.993 8.770 ( 7.529 -2.453 -1.218) 8.012 9.168 ( -8.353 2.790 3.077) 9.329 9.171 ( 2.918 -6.134 6.689) 9.533 9.350 ( 13.257 -3.325 1.023) 13.706 9.418 ( -17.276 4.835 1.970) 18.048 9.547 ( 5.128 0.859 -5.336) 7.450 9.783 ( 2.217 2.848 1.169) 3.794 9.876 ( 1.611 0.734 3.365) 3.802 10.034 ( 7.867 -1.015 -2.613) 8.352 10.230 ( -12.960 -3.738 5.385) 14.524 10.642 ( -9.508 -0.437 -1.747) 9.677 10.704 ( 8.710 2.026 0.082) 8.943 10.754 ( 1.681 3.027 -5.258) 6.296 11.755 ( 1.050 -2.359 1.148) 2.826 12.084 ( -4.204 -1.622 11.192) 12.065 12.563 ( -1.543 2.132 2.054) 3.339 12.699 ( -2.805 -1.620 -3.191) 4.547 12.907 ( 4.532 1.084 0.316) 4.671 13.071 ( 7.014 6.690 -7.082) 12.004 13.284 ( 3.866 -0.622 1.148) 4.080 13.622 ( -5.685 -4.990 -2.802) 8.067 14.798 ( -3.618 -1.023 0.909) 3.869 15.059 ( 1.641 0.496 -0.286) 1.738 17.183 ( 3.097 1.563 2.207) 4.112 17.346 ( -2.538 -1.253 -1.696) 3.299 21.725 ( -1.535 0.806 -3.229) 3.665 21.966 ( 1.403 -1.360 4.519) 4.924 23.145 ( 4.961 3.581 -3.925) 7.269 23.592 ( -1.822 -3.019 -3.358) 4.869 23.839 ( -9.300 2.580 7.207) 12.046 23.915 ( -2.408 -0.430 5.336) 5.870 24.312 ( 8.723 -2.346 -7.144) 11.517 25.208 ( 0.943 -0.038 -1.160) 1.495 25.893 ( -1.834 -1.989 3.255) 4.232 26.102 ( 1.086 1.858 -1.779) 2.792 28.420 ( -2.080 -1.389 1.390) 2.862 28.512 ( 2.108 1.689 -1.278) 2.989 ======================= Grid point 111 (38/117) ======================= q-point: (-0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.981 ( -11.955 6.820 -3.068) 14.101 2.435 ( -10.461 13.837 4.719) 17.977 2.700 ( 10.522 -0.494 -11.169) 15.353 3.224 ( 8.388 -8.506 5.503) 13.153 3.288 ( -5.302 12.468 6.570) 15.057 4.107 ( -11.556 15.930 -2.457) 19.833 4.195 ( 1.582 -4.849 -6.078) 7.935 4.265 ( 12.328 3.265 -3.973) 13.358 4.587 ( 6.823 -2.899 -0.420) 7.425 4.745 ( -5.390 -1.424 0.893) 5.646 4.928 ( -2.049 -1.648 3.547) 4.415 5.000 ( -2.686 -0.400 -2.005) 3.375 5.208 ( 0.916 0.683 5.685) 5.799 5.282 ( 1.175 6.907 11.183) 13.196 5.445 ( -5.374 -0.464 3.232) 6.288 5.585 ( 0.236 0.832 -3.044) 3.165 5.756 ( -2.297 4.572 7.379) 8.979 5.853 ( 4.066 -0.680 -1.552) 4.405 5.922 ( 2.425 -6.072 -2.345) 6.946 5.939 ( 2.761 -1.668 -7.673) 8.324 6.096 ( 0.475 5.060 3.213) 6.012 6.378 ( -3.848 -0.532 -0.820) 3.970 6.450 ( 0.626 0.167 4.257) 4.306 6.668 ( -3.289 -1.352 -4.782) 5.959 6.783 ( 1.277 -3.858 -2.885) 4.984 7.059 ( -8.959 -3.443 0.486) 9.610 7.593 ( 4.878 -2.472 4.234) 6.916 7.662 ( -8.078 -0.063 -4.917) 9.457 7.736 ( -2.570 -5.868 -12.163) 13.747 7.818 ( -1.853 0.386 1.167) 2.224 7.927 ( -1.195 -1.444 -5.181) 5.510 8.058 ( -5.706 -4.838 -7.881) 10.866 8.390 ( -6.661 2.940 1.944) 7.536 8.513 ( 1.708 0.213 1.517) 2.294 8.543 ( -13.599 5.164 1.625) 14.637 8.676 ( -7.995 2.672 4.490) 9.551 8.962 ( -4.118 4.944 -1.204) 6.546 9.156 ( -1.477 -0.735 1.320) 2.112 9.362 ( -0.105 -1.976 2.813) 3.439 9.530 ( -0.229 -6.853 3.357) 7.634 9.663 ( -10.874 1.309 2.434) 11.219 9.757 ( 1.402 -3.647 -2.175) 4.472 9.869 ( 3.506 -1.739 -1.836) 4.322 9.993 ( -5.660 -3.799 6.397) 9.348 10.325 ( 17.166 -3.150 0.816) 17.472 10.573 ( 0.154 -0.796 -6.517) 6.568 10.882 ( 15.124 3.983 4.514) 16.278 11.018 ( 26.117 3.404 -1.617) 26.387 11.833 ( 4.599 -3.691 -0.965) 5.975 12.026 ( -6.032 -3.337 11.574) 13.471 12.449 ( -6.868 4.521 -3.690) 9.012 12.642 ( -4.343 -1.312 -2.067) 4.985 12.954 ( 1.675 4.167 -2.239) 5.018 13.120 ( 4.700 2.852 -0.640) 5.535 13.342 ( 2.125 0.244 -0.266) 2.156 13.553 ( -6.952 -5.234 -2.044) 8.939 14.716 ( -8.012 -4.600 -0.225) 9.241 15.065 ( -1.148 -0.317 0.660) 1.361 17.253 ( 5.472 1.234 1.909) 5.925 17.327 ( -0.771 -1.517 -1.562) 2.310 21.656 ( -3.562 1.923 -4.142) 5.792 21.976 ( -5.166 -4.572 6.325) 9.359 23.188 ( 3.829 3.451 -3.940) 6.488 23.502 ( -12.937 -5.606 -1.698) 14.202 23.664 ( -2.417 7.592 -2.072) 8.232 23.853 ( -4.479 1.832 6.039) 7.739 24.549 ( 13.482 -4.012 -1.074) 14.107 25.273 ( 7.296 2.161 -1.133) 7.694 25.909 ( 0.931 -2.246 3.609) 4.352 26.127 ( 3.530 1.341 -2.156) 4.348 28.363 ( -6.268 -2.081 0.844) 6.658 28.527 ( 0.138 -1.302 -0.873) 1.573 ======================= Grid point 112 (39/117) ======================= q-point: (-0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( -18.164 8.918 -22.034) 29.916 2.201 ( -5.963 15.927 21.233) 27.204 2.860 ( 5.189 5.347 6.740) 10.047 2.996 ( -1.147 5.209 -9.264) 10.689 3.494 ( 5.741 8.633 10.105) 14.478 3.579 ( -15.737 19.870 -15.709) 29.820 4.075 ( -10.122 22.151 6.792) 25.283 4.558 ( -1.925 -9.794 6.788) 12.071 4.673 ( -5.352 -4.115 -2.270) 7.122 4.710 ( -4.453 5.166 2.140) 7.148 4.832 ( 9.813 -10.127 -1.546) 14.186 5.035 ( -0.129 -8.644 -3.467) 9.315 5.105 ( -6.790 1.225 1.198) 7.002 5.320 ( 12.127 1.832 1.641) 12.374 5.360 ( -4.789 1.910 3.390) 6.171 5.611 ( -4.498 5.325 4.982) 8.567 5.673 ( 10.576 2.386 3.387) 11.358 5.861 ( -1.008 6.864 -6.270) 9.351 6.013 ( 3.947 -3.394 -4.787) 7.072 6.039 ( 0.594 2.935 -1.327) 3.275 6.161 ( 3.893 -2.511 -2.376) 5.206 6.231 ( 2.568 -1.627 -6.957) 7.592 6.570 ( 2.417 -9.203 5.671) 11.077 6.703 ( 0.454 -8.746 -3.758) 9.530 6.824 ( -0.777 -2.878 -2.916) 4.170 6.969 ( -6.243 -6.315 -3.105) 9.407 7.450 ( -14.855 -3.742 0.053) 15.319 7.585 ( -10.450 1.414 4.835) 11.601 7.651 ( -6.323 -0.430 -3.006) 7.014 7.802 ( -3.515 -3.146 4.356) 6.421 7.953 ( -1.881 -3.146 -4.900) 6.120 8.033 ( 1.759 -5.934 -13.413) 14.772 8.220 ( -8.080 5.376 1.558) 9.829 8.285 ( -2.799 4.173 -0.914) 5.107 8.492 ( -3.351 3.053 5.368) 7.026 8.602 ( -0.265 6.649 3.322) 7.437 8.790 ( -5.769 4.624 -3.297) 8.095 9.160 ( -13.792 -2.384 4.932) 14.840 9.299 ( -0.104 -3.819 2.761) 4.713 9.445 ( -5.286 0.528 -0.113) 5.314 9.589 ( -7.401 -7.023 6.840) 12.283 9.705 ( 0.718 -0.965 -5.595) 5.723 9.807 ( -6.143 -2.804 2.552) 7.218 10.198 ( 7.697 -2.889 3.128) 8.796 10.576 ( 5.884 -4.268 -2.771) 7.779 10.742 ( 15.891 -3.656 4.062) 16.804 11.160 ( 19.829 3.836 5.745) 20.998 11.499 ( 28.304 4.411 -4.818) 29.048 11.941 ( -7.428 -4.201 8.638) 12.142 11.993 ( 8.726 -1.589 -2.975) 9.356 12.267 ( -5.483 4.478 -4.516) 8.396 12.568 ( -5.233 -1.254 -4.191) 6.821 12.882 ( -2.885 6.580 -4.932) 8.715 13.152 ( -2.108 -1.816 1.017) 2.962 13.360 ( 0.136 -0.690 2.150) 2.262 13.492 ( -3.741 -3.480 -0.337) 5.121 14.616 ( -8.367 -6.145 -2.607) 10.703 15.014 ( -5.688 -0.985 2.484) 6.284 17.317 ( 1.391 -0.713 -3.347) 3.694 17.371 ( 4.834 0.165 3.408) 5.917 21.560 ( -5.714 0.175 -7.675) 9.570 21.858 ( -13.415 -4.194 10.554) 17.577 23.199 ( -3.231 -2.497 2.077) 4.581 23.323 ( -7.184 -0.695 -10.767) 12.962 23.556 ( -2.478 6.770 -5.977) 9.364 23.728 ( -6.007 5.120 6.828) 10.436 24.870 ( 16.629 -5.919 4.266) 18.160 25.419 ( 11.587 3.314 -0.890) 12.084 25.964 ( 2.693 -0.969 4.780) 5.571 26.199 ( 6.075 1.357 -3.345) 7.067 28.237 ( -9.459 -1.645 -0.322) 9.606 28.549 ( -0.668 -4.859 -0.520) 4.932 ======================= Grid point 113 (40/117) ======================= q-point: (-0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( -11.533 9.498 -5.515) 15.926 1.819 ( -20.743 15.788 25.788) 36.669 2.720 ( -11.352 11.214 7.405) 17.591 3.084 ( -9.436 14.634 -27.107) 32.218 3.121 ( 3.942 -0.217 -1.174) 4.119 3.269 ( -26.959 35.559 17.531) 47.943 3.538 ( -2.190 11.426 2.019) 11.808 4.435 ( -7.235 -4.422 4.045) 9.395 4.594 ( -6.507 -1.450 14.935) 16.355 4.771 ( 0.702 -8.201 -9.917) 12.888 4.966 ( 2.219 4.926 -13.455) 14.499 5.138 ( 1.370 -6.177 -0.259) 6.333 5.182 ( 5.926 -7.811 -8.851) 13.209 5.401 ( 9.296 -4.885 2.685) 10.839 5.466 ( -3.562 5.593 0.490) 6.649 5.608 ( 11.735 -2.301 -0.802) 11.985 5.751 ( 1.666 6.063 -0.491) 6.306 5.848 ( 5.009 7.026 -1.424) 8.745 6.007 ( 11.044 -1.662 -0.826) 11.199 6.121 ( 0.628 -2.123 -0.639) 2.305 6.239 ( 5.535 -3.411 0.764) 6.546 6.429 ( 7.919 -3.684 -5.166) 10.148 6.637 ( -4.335 -6.121 -2.968) 8.066 6.787 ( -0.568 -8.303 -7.354) 11.106 6.808 ( -5.734 -9.209 2.751) 11.192 6.978 ( 0.301 -5.197 -5.243) 7.389 7.200 ( -13.851 -1.200 -0.237) 13.905 7.346 ( -13.225 -1.600 -3.830) 13.861 7.528 ( -6.262 -1.549 4.867) 8.080 7.767 ( -3.867 0.235 6.618) 7.668 7.971 ( -1.636 -5.225 2.737) 6.122 8.052 ( -3.017 0.550 1.126) 3.267 8.083 ( -2.608 6.364 -12.759) 14.495 8.235 ( 1.182 5.138 -0.302) 5.281 8.399 ( -3.005 1.326 6.703) 7.465 8.530 ( 1.828 8.902 2.730) 9.489 8.675 ( -3.412 1.998 -1.743) 4.322 8.831 ( -21.575 -2.092 8.009) 23.108 9.316 ( -5.734 -2.982 2.280) 6.854 9.434 ( 4.398 0.005 -0.808) 4.472 9.501 ( -10.270 -1.489 4.113) 11.163 9.700 ( 6.290 2.495 0.017) 6.766 9.893 ( 8.192 -6.340 -0.572) 10.375 10.253 ( -1.615 -0.487 9.068) 9.223 10.722 ( 1.520 -8.611 -1.840) 8.935 10.999 ( 7.415 0.096 7.536) 10.573 11.506 ( 19.641 1.484 -0.238) 19.699 11.785 ( 4.613 1.481 -8.603) 9.873 11.928 ( 4.353 3.174 -5.150) 7.453 12.086 ( 9.687 3.260 0.311) 10.225 12.330 ( 8.004 -4.921 4.524) 10.428 12.457 ( -7.396 -2.013 -6.565) 10.092 12.748 ( -2.339 7.727 -4.825) 9.405 13.071 ( -8.345 -2.198 1.465) 8.753 13.380 ( -0.002 -2.074 3.363) 3.951 13.488 ( 0.080 -2.403 -1.190) 2.683 14.537 ( -6.399 -5.740 -4.586) 9.743 14.877 ( -10.790 -1.009 4.444) 11.713 17.345 ( 1.554 -0.409 -2.490) 2.964 17.453 ( 3.789 0.511 2.346) 4.486 21.419 ( -10.695 -1.645 -12.654) 16.649 21.597 ( -19.719 -3.072 11.808) 23.188 23.109 ( -9.395 -6.838 -0.161) 11.621 23.257 ( -3.913 -1.427 -8.585) 9.542 23.449 ( -0.068 7.160 -8.131) 10.834 23.562 ( -5.481 7.346 5.518) 10.698 25.259 ( 18.762 -6.813 9.133) 21.951 25.606 ( 11.864 3.022 -0.013) 12.243 26.022 ( 3.359 1.063 7.452) 8.243 26.317 ( 9.221 2.296 -4.430) 10.484 28.076 ( -8.453 -0.521 -3.070) 9.009 28.600 ( -1.431 -9.207 -1.057) 9.377 ======================= Grid point 114 (41/117) ======================= q-point: (-0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.991 ( -7.123 5.913 29.859) 31.261 1.270 ( -24.999 9.404 33.557) 42.889 2.118 ( -35.344 27.399 48.692) 66.112 2.416 ( -25.552 6.485 -18.867) 32.418 2.751 ( -4.548 11.525 -35.613) 37.707 3.424 ( 14.259 -0.404 6.486) 15.670 3.554 ( 12.616 8.714 -0.972) 15.364 4.427 ( -5.188 -3.874 18.696) 19.786 4.506 ( 1.543 1.846 5.003) 5.552 4.755 ( -7.411 -1.682 -29.744) 30.699 4.866 ( -11.085 -0.403 -12.143) 16.446 5.199 ( 0.821 -1.837 -3.297) 3.862 5.368 ( 1.624 1.564 6.112) 6.514 5.420 ( 5.778 -0.159 7.104) 9.158 5.480 ( 6.411 1.379 -9.403) 11.463 5.660 ( 1.286 -1.977 -4.811) 5.358 5.828 ( 2.315 -4.111 -3.889) 6.114 6.062 ( 16.777 0.330 -5.758) 17.740 6.140 ( 0.157 -2.803 3.385) 4.397 6.272 ( 8.245 -0.004 4.094) 9.205 6.344 ( 3.692 -4.067 0.365) 5.505 6.517 ( -18.427 -5.457 -8.490) 21.010 6.527 ( 3.012 0.652 -6.869) 7.529 6.805 ( -2.491 -4.923 1.277) 5.663 6.854 ( 1.936 -4.766 -7.847) 9.383 6.934 ( -8.781 -0.812 -4.947) 10.111 7.091 ( 0.636 -3.151 2.707) 4.203 7.238 ( 0.462 -4.997 -6.527) 8.233 7.476 ( -4.152 -5.082 8.962) 11.108 7.671 ( -5.355 2.169 5.990) 8.322 7.833 ( -6.205 11.659 -2.356) 13.416 7.974 ( -5.732 -2.373 9.670) 11.489 8.087 ( -0.448 -6.493 1.685) 6.723 8.175 ( 0.543 9.938 0.189) 9.955 8.354 ( 1.761 6.348 7.724) 10.152 8.495 ( -13.815 -2.302 2.602) 14.245 8.529 ( -0.426 4.022 4.648) 6.162 8.686 ( 10.375 1.523 -8.501) 13.499 9.204 ( -10.074 -3.876 0.431) 10.802 9.320 ( -3.973 3.066 0.997) 5.117 9.529 ( 5.793 2.442 4.563) 7.768 9.888 ( 11.672 -2.329 13.114) 17.709 10.113 ( 0.923 -2.554 5.810) 6.414 10.242 ( 10.705 2.787 2.468) 11.334 10.771 ( -2.987 -6.932 -2.066) 7.825 10.977 ( -7.241 3.280 -5.421) 9.622 11.736 ( -1.997 -3.510 -6.142) 7.350 11.847 ( 7.716 4.464 -2.972) 9.396 11.970 ( 6.605 0.110 -9.192) 11.319 12.173 ( -15.087 -2.315 -1.761) 15.365 12.302 ( 10.949 -0.092 3.653) 11.543 12.655 ( 15.201 0.958 -0.542) 15.241 12.674 ( 1.393 3.496 1.870) 4.202 12.936 ( -7.191 -1.086 2.898) 7.829 13.361 ( -4.097 -0.541 0.765) 4.203 13.537 ( 1.648 -2.367 -5.217) 5.961 14.504 ( -1.498 -3.923 -3.812) 5.671 14.664 ( -13.113 -0.475 5.020) 14.049 17.375 ( 2.209 1.241 -0.916) 2.694 17.492 ( 0.837 0.499 0.541) 1.115 21.158 ( -18.382 -0.990 -13.263) 22.689 21.265 ( -18.488 -1.322 7.768) 20.097 23.035 ( -5.072 -5.135 -2.838) 7.756 23.135 ( -11.221 -3.669 -5.934) 13.213 23.367 ( -5.760 3.136 4.962) 8.224 23.471 ( 4.936 7.212 -7.437) 11.476 25.657 ( 13.328 -6.563 6.898) 16.379 25.765 ( 10.261 3.202 -0.119) 10.750 26.114 ( 10.207 0.597 13.957) 17.301 26.455 ( 8.105 3.668 -2.767) 9.317 27.989 ( 0.211 -0.003 -5.366) 5.371 28.621 ( -12.558 -12.965 -9.790) 20.534 ======================= Grid point 116 (42/117) ======================= q-point: ( 0.10 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.010 ( 0.045 0.000 13.733) 13.733 1.669 ( 20.682 0.000 21.835) 30.075 2.394 ( -9.538 -0.000 -19.725) 21.910 2.807 ( 33.837 0.000 33.610) 47.692 3.121 ( -0.295 -0.000 -8.732) 8.737 3.355 ( 11.282 0.000 -16.620) 20.088 3.473 ( 35.721 0.000 2.832) 35.833 4.435 ( 6.783 0.000 28.128) 28.935 4.555 ( -14.114 -0.000 2.721) 14.374 4.760 ( 12.401 0.000 -27.428) 30.101 4.809 ( -4.714 -0.000 -8.970) 10.134 5.098 ( -8.725 -0.000 -6.349) 10.790 5.180 ( 3.311 0.000 1.601) 3.678 5.403 ( 1.812 0.000 5.780) 6.057 5.551 ( -15.131 -0.000 -4.035) 15.660 5.675 ( -1.770 -0.000 -1.842) 2.555 5.697 ( -9.269 -0.000 -1.000) 9.322 5.955 ( -4.328 -0.000 3.060) 5.300 6.210 ( -5.959 -0.000 -2.825) 6.595 6.252 ( 2.181 0.000 -6.643) 6.992 6.307 ( -3.239 -0.000 4.807) 5.796 6.366 ( -9.784 -0.000 -6.944) 11.998 6.655 ( 4.353 0.000 -5.781) 7.237 6.805 ( 3.065 0.000 -7.958) 8.528 6.843 ( 1.597 0.000 -3.621) 3.957 7.016 ( -4.291 -0.000 1.724) 4.624 7.252 ( 15.604 0.000 -6.231) 16.802 7.521 ( 12.211 0.000 -8.602) 14.936 7.619 ( 1.781 0.000 11.484) 11.621 7.695 ( 6.459 0.000 3.466) 7.330 7.762 ( 1.765 0.000 16.531) 16.625 7.872 ( 1.326 0.000 -1.054) 1.694 7.952 ( -4.125 -0.000 -2.917) 5.052 8.027 ( -0.024 -0.000 -3.837) 3.838 8.404 ( 2.349 0.000 2.684) 3.567 8.518 ( 0.793 0.000 1.195) 1.434 8.917 ( 8.675 0.000 -5.840) 10.458 9.022 ( 2.678 0.000 7.419) 7.888 9.340 ( -3.982 -0.000 9.666) 10.455 9.393 ( 17.891 0.000 -2.566) 18.074 9.659 ( -4.431 -0.000 0.878) 4.518 9.686 ( 9.872 0.000 -2.879) 10.283 10.056 ( 5.798 0.000 15.394) 16.450 10.271 ( -13.358 -0.000 2.883) 13.666 10.711 ( -10.661 -0.000 1.217) 10.730 10.781 ( 3.400 0.000 -1.478) 3.707 11.391 ( -25.496 -0.000 -0.374) 25.499 11.753 ( -9.011 -0.000 -11.541) 14.642 12.196 ( 15.021 0.000 -3.337) 15.388 12.199 ( -13.747 -0.000 1.764) 13.860 12.305 ( 0.932 0.000 3.365) 3.492 12.477 ( 0.731 0.000 -5.481) 5.529 12.818 ( -1.161 -0.000 -9.606) 9.676 13.023 ( -3.617 -0.000 5.568) 6.640 13.067 ( -3.462 -0.000 2.966) 4.559 13.543 ( 6.342 0.000 -0.197) 6.345 14.625 ( 11.506 0.000 -5.136) 12.601 14.889 ( 6.188 0.000 5.034) 7.977 17.352 ( -4.314 -0.000 -1.964) 4.740 17.457 ( -0.202 -0.000 2.025) 2.035 21.234 ( 11.174 0.000 -3.463) 11.698 22.410 ( -3.371 -0.000 8.818) 9.441 22.975 ( 13.672 0.000 -23.396) 27.098 23.202 ( 5.873 0.000 -0.544) 5.898 23.355 ( 15.004 0.000 -12.724) 19.672 23.630 ( 3.468 0.000 1.552) 3.800 24.996 ( -24.531 -0.000 27.982) 37.213 25.427 ( -12.020 -0.000 -0.680) 12.039 25.992 ( -1.617 -0.000 4.516) 4.797 26.339 ( -5.020 -0.000 -2.846) 5.771 28.256 ( 15.709 0.000 -12.857) 20.300 28.345 ( 3.881 0.000 8.289) 9.153 ======================= Grid point 117 (43/117) ======================= q-point: ( 0.20 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.941 ( -18.338 -28.832 -10.652) 35.792 1.973 ( 9.846 -4.221 8.838) 13.888 2.474 ( 18.874 -0.052 1.639) 18.946 2.958 ( -0.304 -6.364 -14.770) 16.085 3.497 ( 18.557 -5.703 35.378) 40.354 3.758 ( 26.501 -2.012 -19.596) 33.021 3.905 ( 1.487 -1.341 5.781) 6.118 4.291 ( -8.985 -2.113 -8.811) 12.760 4.608 ( 7.850 -0.006 16.587) 18.351 4.713 ( -1.499 4.393 -3.372) 5.738 4.939 ( -5.202 -1.115 -3.712) 6.487 5.077 ( 14.754 -0.740 -1.583) 14.857 5.201 ( -8.728 1.577 -3.986) 9.724 5.264 ( 0.307 -2.950 -4.602) 5.475 5.431 ( 0.056 2.105 2.034) 2.927 5.487 ( -4.839 8.532 6.074) 11.537 5.718 ( -0.238 -3.796 3.173) 4.953 5.901 ( -2.313 -2.347 0.270) 3.306 6.056 ( -16.226 0.444 -6.791) 17.596 6.111 ( -2.685 -1.064 -5.572) 6.276 6.240 ( -5.679 -0.392 1.471) 5.879 6.353 ( 6.265 1.618 -7.261) 9.726 6.662 ( -2.945 -0.201 -0.997) 3.115 6.791 ( -1.855 1.477 -9.010) 9.317 6.873 ( 2.617 8.666 -3.154) 9.586 6.975 ( 3.047 1.947 0.835) 3.712 7.472 ( 4.705 1.170 2.519) 5.464 7.582 ( 3.402 5.509 -0.749) 6.518 7.705 ( 2.817 1.917 5.370) 6.360 7.866 ( 3.747 0.164 3.340) 5.022 7.884 ( 15.345 1.597 -5.722) 16.454 7.915 ( 8.585 -3.278 7.626) 11.942 8.028 ( 1.142 -0.465 -7.499) 7.600 8.082 ( 12.344 -11.878 0.511) 17.138 8.444 ( 1.469 0.254 -0.228) 1.508 8.531 ( -1.002 -3.294 2.997) 4.565 8.995 ( 3.273 4.107 -4.676) 7.032 9.082 ( 0.643 -1.824 8.704) 8.916 9.351 ( 4.993 0.412 1.365) 5.193 9.550 ( -5.756 0.535 1.253) 5.914 9.680 ( 9.331 -1.015 -3.652) 10.071 9.883 ( 11.790 3.544 -9.826) 15.752 10.038 ( -10.578 1.003 6.366) 12.386 10.157 ( 6.119 3.748 9.942) 12.261 10.497 ( -9.366 0.881 1.829) 9.584 10.854 ( 2.888 2.420 4.385) 5.782 10.888 ( -29.713 -3.470 2.556) 30.024 11.453 ( -23.893 -2.406 -3.730) 24.302 11.946 ( -12.811 0.703 -0.884) 12.861 12.265 ( -1.055 5.096 6.077) 8.001 12.467 ( 10.493 -3.735 -6.452) 12.872 12.526 ( 4.332 -0.397 -2.782) 5.164 12.859 ( 7.169 2.933 -15.189) 17.050 12.964 ( -3.252 -1.447 2.200) 4.184 13.048 ( -0.225 -2.767 10.116) 10.490 13.633 ( 3.243 0.734 -0.750) 3.408 14.809 ( 9.741 2.494 -4.884) 11.178 14.967 ( 2.108 -0.452 4.563) 5.047 17.271 ( -3.570 1.131 -0.633) 3.798 17.434 ( -2.484 -0.093 0.744) 2.594 21.428 ( 9.363 -1.738 -4.879) 10.700 22.288 ( -4.400 8.313 14.036) 16.896 23.073 ( 6.043 5.544 -11.488) 14.114 23.333 ( 2.571 -9.049 -2.180) 9.656 23.603 ( 14.376 2.560 -10.232) 17.830 23.751 ( 4.851 -5.104 2.078) 7.342 24.687 ( -12.888 2.732 11.361) 17.396 25.234 ( -11.308 -5.067 -0.899) 12.424 25.958 ( -2.843 -0.556 4.048) 4.977 26.246 ( -4.342 1.117 -2.175) 4.983 28.398 ( 2.031 0.610 5.583) 5.972 28.457 ( 8.836 2.012 -6.949) 11.419 ======================= Grid point 118 (44/117) ======================= q-point: ( 0.30 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( 16.167 -28.651 -2.081) 32.963 2.197 ( 11.103 -5.931 -2.558) 12.845 2.794 ( 7.811 -0.331 -4.279) 8.912 3.144 ( 11.702 -8.684 0.027) 14.572 3.571 ( -8.906 8.134 13.125) 17.825 3.898 ( 0.634 -12.140 16.933) 20.845 4.001 ( -3.459 0.398 -12.850) 13.313 4.326 ( 7.308 -6.651 -7.639) 12.489 4.609 ( -5.567 8.485 -5.334) 11.465 4.682 ( 1.481 1.580 1.968) 2.927 4.901 ( 1.232 -3.841 2.449) 4.719 5.061 ( -0.701 -2.225 -3.801) 4.459 5.218 ( -4.176 3.396 -2.643) 5.996 5.268 ( 1.598 4.788 5.625) 7.558 5.462 ( 9.764 -1.240 1.014) 9.895 5.542 ( 2.877 -1.021 8.460) 8.994 5.719 ( -3.328 -3.960 7.703) 9.278 5.810 ( -7.016 0.923 -4.212) 8.235 5.973 ( 4.792 -4.062 -1.337) 6.423 6.103 ( -4.710 3.480 1.437) 6.029 6.154 ( 1.270 -1.332 -5.733) 6.021 6.399 ( 2.918 4.430 -5.801) 7.861 6.609 ( -2.977 -0.469 2.416) 3.863 6.732 ( -4.401 -1.383 -7.912) 9.159 6.807 ( 5.421 14.152 -2.627) 15.381 7.075 ( 8.480 1.071 1.136) 8.622 7.425 ( 0.271 7.032 1.067) 7.118 7.608 ( 0.477 0.373 -2.628) 2.697 7.759 ( 5.275 1.639 1.187) 5.650 7.892 ( -0.720 -4.705 2.541) 5.396 7.983 ( -1.678 2.352 -4.775) 5.581 8.117 ( 6.310 -3.919 -1.672) 7.614 8.272 ( 16.614 -5.756 -0.590) 17.592 8.371 ( 0.598 -6.842 0.436) 6.882 8.496 ( 8.319 -0.209 0.148) 8.323 8.612 ( 7.531 -3.502 3.547) 9.031 8.954 ( -1.915 3.254 -2.904) 4.763 9.091 ( 1.583 -0.193 1.470) 2.168 9.468 ( -4.554 -0.245 1.148) 4.703 9.494 ( 8.278 -2.226 2.377) 8.895 9.732 ( -3.919 4.086 -3.615) 6.718 9.820 ( -0.857 2.703 -0.575) 2.893 9.963 ( -7.943 3.789 -0.317) 8.806 10.173 ( 0.111 8.772 5.271) 10.235 10.410 ( -15.585 -2.133 4.343) 16.319 10.502 ( 4.388 -3.669 -6.240) 8.464 10.846 ( -4.827 1.746 5.772) 7.724 11.009 ( -24.691 -2.356 0.719) 24.813 11.777 ( -3.249 2.046 -2.171) 4.411 12.179 ( -4.221 3.215 9.914) 11.244 12.576 ( -0.072 -3.000 -5.129) 5.942 12.648 ( 7.277 1.320 -2.636) 7.852 12.873 ( -2.146 -0.310 3.021) 3.719 13.040 ( 10.035 1.340 -13.919) 17.212 13.124 ( 3.410 -4.254 10.530) 11.858 13.636 ( -1.973 0.292 -3.163) 3.739 14.879 ( 0.694 3.742 0.152) 3.809 15.008 ( 1.731 -1.995 -0.087) 2.643 17.216 ( -0.475 1.899 1.319) 2.360 17.378 ( -3.679 -0.501 -0.937) 3.830 21.589 ( 5.804 -3.691 -5.952) 9.096 22.141 ( -3.566 8.614 11.787) 15.028 23.126 ( 5.225 2.926 -6.918) 9.150 23.441 ( -0.747 -9.615 -3.087) 10.126 23.806 ( 6.869 -2.611 -1.325) 7.467 23.866 ( 5.253 -0.376 4.141) 6.700 24.464 ( -4.645 9.820 0.055) 10.863 25.134 ( -6.179 -7.352 -1.056) 9.662 25.907 ( -3.654 -0.698 3.529) 5.128 26.167 ( -2.626 1.396 -1.411) 3.292 28.416 ( -0.096 -0.044 2.561) 2.564 28.540 ( 3.567 2.569 -2.727) 5.173 ======================= Grid point 119 (45/117) ======================= q-point: ( 0.40 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( 27.961 -14.334 8.118) 32.453 2.473 ( 13.766 -3.083 -8.116) 16.275 2.794 ( -0.471 2.290 -5.383) 5.868 3.065 ( -17.201 8.715 8.974) 21.269 3.590 ( 5.519 -7.649 -1.537) 9.557 3.968 ( -6.523 -1.703 0.481) 6.759 4.073 ( 11.356 -11.831 -1.360) 16.455 4.219 ( -4.394 11.562 -2.314) 12.583 4.614 ( 5.384 -3.883 -1.209) 6.747 4.747 ( 1.657 -3.935 -0.458) 4.294 4.930 ( -2.583 4.559 7.144) 8.859 5.022 ( -6.230 -1.325 0.565) 6.394 5.196 ( 4.678 -6.825 -4.816) 9.574 5.342 ( 5.414 0.833 -1.957) 5.816 5.475 ( -9.174 -1.980 -2.850) 9.809 5.545 ( 0.525 -0.297 0.536) 0.807 5.723 ( 1.271 -0.086 9.587) 9.671 5.784 ( 1.336 8.438 8.012) 11.713 5.944 ( 1.976 7.001 -3.445) 8.049 6.125 ( 2.960 -2.997 4.424) 6.109 6.175 ( 0.300 2.751 -3.669) 4.596 6.406 ( 0.340 -1.369 -0.006) 1.410 6.550 ( -2.886 3.008 3.106) 5.199 6.641 ( -2.942 2.645 -6.501) 7.610 6.819 ( 6.064 7.737 2.072) 10.046 7.176 ( 1.919 0.366 0.782) 2.104 7.439 ( 5.715 2.750 -4.259) 7.640 7.602 ( -1.038 -1.457 -4.351) 4.704 7.821 ( -1.601 -2.911 0.147) 3.325 7.884 ( -3.350 2.162 -4.137) 5.746 7.915 ( -1.919 -1.280 -4.337) 4.912 8.117 ( -7.171 0.604 -6.619) 9.777 8.378 ( 0.799 -7.441 4.034) 8.502 8.556 ( -3.404 -0.993 0.412) 3.570 8.602 ( 0.878 -2.063 2.218) 3.154 8.669 ( -0.987 -6.872 0.246) 6.947 9.052 ( 15.354 -2.641 -0.351) 15.583 9.215 ( -3.177 -1.191 0.300) 3.407 9.321 ( -0.170 1.246 4.348) 4.527 9.484 ( -18.144 1.918 1.757) 18.330 9.617 ( 0.823 4.286 -6.485) 7.817 9.751 ( 4.149 -2.202 4.972) 6.839 9.945 ( 6.229 1.446 -5.799) 8.632 10.060 ( -6.604 3.252 5.701) 9.311 10.188 ( -13.086 0.334 4.730) 13.918 10.628 ( -1.411 -0.993 -0.780) 1.893 10.742 ( 6.355 1.758 0.972) 6.665 10.805 ( 3.930 2.078 -4.381) 6.241 11.764 ( 3.036 3.030 -0.992) 4.403 12.078 ( -5.477 0.623 11.499) 12.752 12.567 ( -3.682 -3.043 -5.460) 7.255 12.675 ( -2.209 1.132 2.516) 3.534 12.900 ( 3.535 -1.856 2.163) 4.541 13.173 ( 6.628 3.044 -6.092) 9.503 13.242 ( 5.049 -2.504 3.019) 6.394 13.564 ( -5.809 -1.244 -5.307) 7.966 14.788 ( -7.780 -0.054 1.280) 7.885 15.049 ( 0.543 -1.249 -0.626) 1.499 17.226 ( 3.783 2.522 2.861) 5.372 17.320 ( -3.280 -1.273 -2.345) 4.229 21.687 ( 1.137 -3.604 -5.160) 6.396 22.016 ( -3.470 5.265 7.590) 9.868 23.184 ( 3.068 0.715 -3.384) 4.623 23.476 ( -4.706 -7.811 -4.159) 10.023 23.868 ( -1.115 -2.603 5.419) 6.114 23.921 ( 0.016 4.469 4.885) 6.621 24.401 ( 9.713 9.534 -6.112) 14.919 25.150 ( 0.730 -5.813 -1.187) 5.977 25.859 ( -2.462 -1.304 2.777) 3.934 26.130 ( -0.101 0.923 -0.953) 1.331 28.394 ( -3.168 -1.162 0.572) 3.422 28.543 ( -0.562 1.466 -0.461) 1.636 ======================= Grid point 120 (46/117) ======================= q-point: (-0.50 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( -3.941 9.121 -2.386) 10.218 2.702 ( -6.801 12.982 9.416) 17.419 2.704 ( 10.448 1.092 -9.179) 13.950 3.017 ( 22.227 -10.547 2.105) 24.693 3.607 ( -7.780 15.639 -1.483) 17.530 3.925 ( 9.686 -13.166 -3.784) 16.777 4.191 ( 3.940 -1.869 3.249) 5.439 4.420 ( 4.683 -2.560 -5.507) 7.669 4.604 ( -7.608 4.044 -2.352) 8.931 4.733 ( 3.660 0.448 3.432) 5.037 4.859 ( -0.972 -1.776 2.720) 3.391 4.988 ( -3.450 -1.235 -0.773) 3.745 5.255 ( -4.875 3.435 1.237) 6.090 5.350 ( 3.648 -1.812 -0.697) 4.132 5.486 ( -2.282 -4.870 3.762) 6.563 5.515 ( -0.541 -3.605 -1.096) 3.806 5.734 ( 3.500 6.111 7.574) 10.342 5.765 ( 2.483 -1.913 5.027) 5.924 5.969 ( 3.256 4.551 -5.884) 8.120 6.056 ( -2.897 10.399 -0.001) 10.795 6.176 ( -1.990 0.067 6.566) 6.861 6.382 ( -1.034 5.132 5.231) 7.401 6.513 ( 0.161 0.043 -0.816) 0.833 6.605 ( 0.861 -2.625 -4.671) 5.427 6.833 ( 2.274 7.222 -0.282) 7.577 7.081 ( -9.460 5.723 -2.481) 11.332 7.530 ( 3.147 -4.320 -1.612) 5.582 7.605 ( -2.533 -4.168 -4.049) 6.339 7.679 ( -10.310 -0.236 -6.155) 12.010 7.840 ( -4.512 -0.253 -0.185) 4.522 7.859 ( -4.866 -3.168 -9.265) 10.934 7.992 ( -4.515 -2.020 -5.399) 7.323 8.403 ( -9.719 -1.752 1.963) 10.069 8.463 ( 1.470 -4.906 1.101) 5.239 8.581 ( -8.204 -2.425 0.681) 8.582 8.690 ( -6.586 -1.040 0.844) 6.721 8.962 ( -3.803 -2.754 3.904) 6.107 9.182 ( -11.952 1.927 -0.345) 12.111 9.315 ( 3.236 -1.436 3.093) 4.701 9.446 ( -1.482 -1.722 -2.932) 3.709 9.623 ( -6.721 -3.706 0.728) 7.710 9.774 ( -5.503 2.051 5.507) 8.051 9.850 ( -3.450 0.310 1.092) 3.632 9.930 ( 0.446 -2.022 4.078) 4.574 10.249 ( 14.450 -4.125 1.085) 15.066 10.595 ( 0.475 2.560 -6.988) 7.457 10.970 ( 16.321 4.568 4.152) 17.450 11.070 ( 27.294 1.916 -2.530) 27.477 11.795 ( 2.457 0.447 -0.465) 2.540 11.998 ( -3.726 -0.142 9.176) 9.904 12.489 ( -7.117 -1.561 -6.452) 9.733 12.609 ( -4.227 -0.557 1.324) 4.464 12.983 ( 2.491 -1.103 2.043) 3.405 13.200 ( 0.578 3.736 0.071) 3.782 13.332 ( 2.594 -0.210 -1.037) 2.801 13.463 ( -6.805 -3.764 -4.675) 9.074 14.634 ( -10.395 -3.544 -0.226) 10.985 15.045 ( -2.660 -1.663 1.016) 3.298 17.283 ( -0.536 -0.923 -4.090) 4.227 17.304 ( 5.348 1.831 4.387) 7.155 21.679 ( -3.846 -0.409 -2.234) 4.467 21.919 ( -5.916 -0.453 2.943) 6.623 23.193 ( -4.022 -2.933 3.078) 5.852 23.423 ( -5.501 -2.750 -9.023) 10.920 23.828 ( -1.879 8.026 1.514) 8.381 23.853 ( -2.207 0.176 5.181) 5.634 24.573 ( 15.888 5.342 -1.774) 16.856 25.261 ( 6.566 -3.219 -0.888) 7.367 25.862 ( 0.734 -2.363 2.003) 3.184 26.146 ( 2.756 0.503 -1.108) 3.012 28.323 ( -6.500 -1.985 -0.421) 6.809 28.503 ( -3.354 -1.071 0.524) 3.560 ======================= Grid point 121 (47/117) ======================= q-point: (-0.40 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( -12.553 14.464 -14.232) 23.861 2.527 ( -1.780 17.385 15.512) 23.367 2.894 ( 11.264 0.190 -8.397) 14.051 3.266 ( 1.979 17.498 4.194) 18.102 3.572 ( 17.218 2.492 6.874) 18.706 3.982 ( -16.518 17.988 -13.980) 28.140 4.201 ( 5.780 -12.432 -0.390) 13.715 4.551 ( 11.223 1.923 -7.102) 13.420 4.604 ( 0.890 -5.809 0.294) 5.884 4.644 ( -5.701 4.424 4.578) 8.546 4.881 ( -9.994 -2.687 -0.311) 10.353 4.928 ( 2.017 8.331 2.345) 8.887 5.127 ( -7.449 -0.854 1.096) 7.577 5.245 ( -8.992 -0.740 13.479) 16.220 5.522 ( 7.833 4.223 7.136) 11.406 5.637 ( 4.872 -1.465 0.147) 5.089 5.748 ( -1.486 2.642 5.783) 6.530 5.850 ( 3.926 -11.767 -0.940) 12.440 5.950 ( 4.032 0.696 -1.763) 4.455 6.003 ( 4.159 4.404 -8.397) 10.353 6.124 ( -0.932 1.174 1.065) 1.839 6.337 ( -3.944 5.707 -1.215) 7.043 6.475 ( -1.193 1.569 4.601) 5.005 6.653 ( 0.727 3.054 -4.333) 5.350 6.767 ( 0.857 -2.083 -9.289) 9.559 6.902 ( -6.175 0.580 0.191) 6.205 7.389 ( -15.133 -2.551 0.317) 15.350 7.573 ( -6.392 -5.334 -6.643) 10.651 7.602 ( -12.278 -1.875 5.353) 13.525 7.738 ( -2.374 -4.139 -2.132) 5.226 7.906 ( 3.923 -5.639 -10.269) 12.355 7.931 ( -3.027 0.036 -3.232) 4.428 8.276 ( -5.771 -0.068 0.208) 5.775 8.348 ( -6.560 2.397 -0.814) 7.032 8.510 ( -2.329 -1.857 3.071) 4.278 8.660 ( -0.905 -0.514 -1.479) 1.808 8.873 ( -11.062 4.313 -1.323) 11.946 9.091 ( -6.751 -6.460 8.295) 12.495 9.212 ( -6.873 -4.282 6.112) 10.146 9.420 ( -6.090 -2.815 -0.063) 6.709 9.455 ( -7.289 -5.043 -0.327) 8.869 9.692 ( 0.625 -1.149 -3.379) 3.623 9.772 ( -5.643 0.390 3.127) 6.463 10.140 ( 8.735 -3.818 2.311) 9.809 10.532 ( 4.828 -0.699 -2.698) 5.574 10.646 ( 12.032 -5.002 5.990) 14.341 11.264 ( 21.376 6.574 4.648) 22.842 11.576 ( 28.086 3.114 -5.072) 28.710 11.835 ( -0.851 -4.513 4.203) 6.226 11.999 ( 6.070 0.952 1.062) 6.236 12.341 ( -7.939 1.656 -5.877) 10.015 12.536 ( -5.256 -1.274 -3.960) 6.703 12.968 ( -4.285 1.517 -2.437) 5.158 13.141 ( -4.697 0.503 4.987) 6.869 13.325 ( -3.153 -2.357 -3.624) 5.351 13.424 ( -1.601 -3.264 2.600) 4.469 14.507 ( -7.680 -4.607 -3.386) 9.575 14.983 ( -6.651 -2.133 3.025) 7.612 17.284 ( -0.365 -2.487 -3.482) 4.294 17.404 ( 7.206 3.147 3.402) 8.568 21.570 ( -7.645 0.455 -2.025) 7.922 21.779 ( -12.633 -3.299 2.603) 13.314 23.098 ( -10.726 -6.235 5.532) 13.585 23.346 ( -3.427 0.946 -11.711) 12.239 23.718 ( -1.089 9.090 -1.690) 9.310 23.795 ( -2.913 3.191 4.963) 6.580 24.846 ( 18.622 2.559 3.012) 19.037 25.434 ( 9.754 -1.444 -0.711) 9.886 25.930 ( 3.776 -2.292 2.040) 4.865 26.217 ( 5.835 0.396 -2.156) 6.233 28.202 ( -8.643 -1.875 -1.410) 8.955 28.454 ( -5.142 -4.688 1.181) 7.058 ======================= Grid point 122 (48/117) ======================= q-point: (-0.30 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.478 ( -6.761 17.261 -6.364) 19.600 2.200 ( -14.115 23.123 18.894) 33.028 2.998 ( -8.903 7.069 -10.087) 15.198 3.170 ( 15.330 17.245 12.663) 26.320 3.502 ( -12.494 21.536 -24.252) 34.757 3.754 ( 10.418 9.855 0.632) 14.355 4.050 ( -24.058 40.555 18.319) 50.587 4.335 ( -10.659 -4.288 6.187) 13.049 4.562 ( 4.130 -8.526 -3.802) 10.208 4.621 ( -6.515 -0.260 -0.501) 6.539 4.954 ( 9.016 -11.253 -5.828) 15.553 5.027 ( 5.665 -5.723 -0.457) 8.065 5.047 ( 0.692 2.405 -3.247) 4.100 5.302 ( 6.202 -6.841 6.834) 11.488 5.577 ( -0.975 8.012 6.081) 10.106 5.672 ( 9.044 6.067 -5.340) 12.129 5.820 ( 4.344 -1.949 3.460) 5.886 5.966 ( -2.660 -0.964 -7.062) 7.608 6.008 ( 6.808 6.740 -0.254) 9.583 6.102 ( -0.184 0.836 -4.461) 4.543 6.163 ( 5.307 -9.433 -2.142) 11.034 6.225 ( 4.692 -8.210 -0.174) 9.458 6.497 ( -0.935 -4.768 5.703) 7.492 6.654 ( -1.687 -3.621 -3.645) 5.407 6.751 ( -6.980 1.709 -5.532) 9.069 6.856 ( 1.140 -6.688 -6.762) 9.579 7.165 ( -11.526 -1.271 1.689) 11.718 7.307 ( -17.884 -2.407 0.132) 18.045 7.484 ( -7.308 -3.499 -0.201) 8.105 7.767 ( -1.730 -1.188 4.822) 5.259 7.839 ( -3.583 -4.602 -1.520) 6.027 8.064 ( 4.845 -2.069 -2.497) 5.831 8.202 ( -2.071 3.119 -8.669) 9.443 8.296 ( 0.035 1.465 -1.581) 2.156 8.423 ( -5.663 1.362 7.565) 9.547 8.617 ( -5.274 -2.793 -7.329) 9.451 8.666 ( -6.653 1.049 5.013) 8.396 8.845 ( -14.534 2.271 14.075) 20.359 9.271 ( -4.711 -1.614 2.895) 5.760 9.380 ( 3.666 -7.079 -5.213) 9.525 9.435 ( -3.359 -5.051 3.358) 6.933 9.681 ( -4.225 -2.511 3.549) 6.062 9.818 ( 11.917 -1.706 -10.715) 16.117 10.235 ( -0.136 -2.137 9.966) 10.194 10.578 ( -0.569 -5.516 -1.516) 5.749 10.945 ( 9.904 -4.757 11.699) 16.050 11.575 ( 18.344 5.550 -2.109) 19.281 11.766 ( -0.143 -2.497 -0.603) 2.573 12.030 ( 12.432 5.757 -12.198) 18.343 12.134 ( 5.353 -0.537 -1.696) 5.641 12.260 ( 4.157 -0.433 4.840) 6.395 12.435 ( -2.960 -0.385 -5.482) 6.242 12.836 ( -7.422 0.319 -3.188) 8.084 13.035 ( -7.241 -0.867 6.634) 9.859 13.322 ( 0.038 -3.752 -0.744) 3.825 13.432 ( -1.347 -2.951 1.572) 3.605 14.442 ( -3.401 -3.171 -6.277) 7.812 14.844 ( -11.461 -2.259 5.013) 12.712 17.314 ( 1.102 -2.669 -2.246) 3.658 17.494 ( 5.955 3.693 1.620) 7.192 21.393 ( -12.211 -0.972 -4.162) 12.937 21.527 ( -18.704 -3.608 3.596) 19.385 22.978 ( -8.917 -6.268 2.354) 11.151 23.241 ( -7.653 -0.812 -7.331) 10.629 23.610 ( -1.698 8.467 0.229) 8.639 23.702 ( -0.899 8.033 0.858) 8.129 25.194 ( 20.342 -0.470 6.007) 21.216 25.623 ( 9.588 -0.820 -1.110) 9.687 26.025 ( 4.492 -0.674 3.704) 5.861 26.349 ( 9.469 0.527 -3.610) 10.147 28.062 ( -7.325 -0.824 -3.370) 8.105 28.409 ( -7.760 -9.326 2.038) 12.302 ======================= Grid point 123 (49/117) ======================= q-point: (-0.20 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( -3.494 17.193 19.172) 25.988 1.653 ( -17.316 28.148 22.548) 40.007 2.560 ( -20.378 12.727 -9.987) 26.019 2.967 ( -22.457 45.905 23.557) 56.272 3.118 ( -5.063 23.578 -23.199) 33.463 3.521 ( 13.040 12.612 4.123) 18.604 3.800 ( 9.814 16.124 -0.037) 18.876 4.335 ( 0.606 -6.234 6.509) 9.033 4.531 ( -2.465 0.338 8.349) 8.712 4.661 ( -2.892 -5.155 -4.309) 7.315 4.941 ( -7.267 5.726 -25.504) 27.130 5.106 ( 2.146 -6.150 -3.923) 7.604 5.295 ( 7.011 -10.976 2.890) 13.341 5.444 ( -1.149 6.053 6.016) 8.611 5.587 ( 5.613 -2.191 -4.996) 7.828 5.605 ( 6.534 6.576 0.462) 9.282 5.803 ( -2.922 3.093 -5.630) 7.057 6.019 ( -2.826 -7.788 2.179) 8.567 6.072 ( 11.560 -0.975 -3.044) 11.994 6.248 ( 9.491 -0.901 1.371) 9.632 6.313 ( 2.023 -0.564 3.263) 3.880 6.406 ( -1.403 -9.268 -5.401) 10.818 6.501 ( -1.673 -3.401 -3.184) 4.950 6.641 ( -2.530 -11.414 1.840) 11.835 6.693 ( -0.019 -5.189 -6.279) 8.146 6.885 ( -7.292 -4.747 -4.858) 9.966 7.045 ( -0.032 -1.710 -4.608) 4.915 7.109 ( -6.408 -5.058 -0.988) 8.223 7.389 ( -6.548 -2.993 4.821) 8.665 7.710 ( -3.617 0.998 8.528) 9.317 7.884 ( -0.095 -6.458 5.362) 8.394 8.003 ( -11.480 2.713 -2.154) 11.991 8.102 ( 1.216 7.153 -2.910) 7.817 8.315 ( 1.571 2.164 -4.905) 5.587 8.366 ( -1.691 -4.076 5.885) 7.356 8.487 ( -9.068 1.951 5.734) 10.905 8.630 ( -5.136 4.074 7.303) 9.814 8.713 ( 11.370 0.667 -1.108) 11.443 9.146 ( -8.558 -1.547 -1.051) 8.760 9.367 ( -5.467 1.621 2.443) 6.204 9.547 ( 8.092 -1.691 -6.081) 10.263 9.726 ( -0.665 -12.422 7.482) 14.517 10.111 ( 18.094 -0.642 -9.736) 20.557 10.263 ( 1.870 -1.542 15.535) 15.723 10.609 ( -2.203 -8.319 -1.270) 8.699 11.028 ( -3.516 1.578 0.201) 3.859 11.709 ( -4.925 0.888 -3.710) 6.230 11.873 ( 8.721 -1.635 1.271) 8.963 11.987 ( -0.993 0.680 -13.948) 14.000 12.129 ( -6.627 -1.603 -1.458) 6.972 12.347 ( 8.638 5.112 4.643) 11.059 12.643 ( 15.936 -1.392 7.753) 17.777 12.728 ( -3.836 -0.971 -4.936) 6.326 12.929 ( -4.297 1.095 4.432) 6.269 13.346 ( -1.962 -0.870 -0.548) 2.215 13.457 ( 0.267 -5.344 -3.751) 6.535 14.442 ( 2.098 -0.979 -5.399) 5.874 14.633 ( -13.842 -2.597 4.969) 14.934 17.370 ( 2.460 -2.116 -0.974) 3.388 17.541 ( 3.297 4.499 -1.339) 5.736 21.140 ( -15.414 -0.461 -5.910) 16.514 21.221 ( -17.123 -2.829 4.004) 17.811 22.903 ( -6.800 -6.179 2.467) 9.514 23.089 ( -8.863 -1.579 -3.613) 9.700 23.477 ( -4.612 7.636 6.258) 10.897 23.641 ( 4.085 9.738 -6.307) 12.300 25.557 ( 14.575 -3.818 6.743) 16.507 25.786 ( 8.211 -0.399 -3.082) 8.779 26.120 ( 6.627 -0.022 6.574) 9.335 26.521 ( 9.943 1.541 -4.613) 11.068 27.987 ( -0.058 -0.176 -5.000) 5.003 28.318 ( -17.493 -14.236 2.248) 22.665 ======================= Grid point 124 (50/117) ======================= q-point: (-0.10 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.022 ( 3.984 20.904 27.556) 34.817 1.295 ( 5.749 27.034 33.567) 43.482 2.165 ( -6.761 35.028 24.348) 43.191 2.238 ( 0.979 21.330 9.672) 23.441 2.896 ( 6.002 18.448 -35.862) 40.773 3.528 ( -10.146 6.717 4.849) 13.099 3.836 ( 3.557 9.213 -3.878) 10.610 4.356 ( -0.501 -0.179 22.679) 22.685 4.566 ( 1.324 0.874 3.466) 3.812 4.600 ( -0.670 -3.945 -3.299) 5.185 4.734 ( 1.173 8.548 -38.386) 39.344 5.134 ( -5.478 -7.875 -2.456) 9.902 5.320 ( -6.641 0.905 3.612) 7.614 5.407 ( -0.597 -4.066 2.791) 4.968 5.578 ( 1.752 3.680 -2.558) 4.812 5.849 ( 5.842 -1.787 -8.931) 10.820 5.902 ( 2.402 -4.966 6.663) 8.651 6.036 ( 9.163 -1.122 0.289) 9.236 6.141 ( -4.962 -2.494 -6.268) 8.374 6.261 ( -0.011 -0.613 5.651) 5.684 6.328 ( -2.162 1.408 0.656) 2.662 6.472 ( 8.171 0.736 -7.371) 11.029 6.536 ( -0.898 -1.524 -6.746) 6.974 6.677 ( -6.880 -5.286 -5.766) 10.417 6.774 ( -3.273 -9.431 3.632) 10.623 6.856 ( 5.027 -7.582 -2.892) 9.546 7.080 ( -0.271 -1.548 -0.962) 1.843 7.195 ( 4.533 -11.748 -5.537) 13.756 7.346 ( -1.776 -5.828 5.966) 8.527 7.653 ( -1.163 2.430 10.566) 10.904 7.795 ( -3.528 2.900 12.283) 13.104 7.927 ( -1.229 2.250 -0.878) 2.710 8.077 ( 0.887 2.577 0.791) 2.838 8.255 ( -3.625 7.888 -7.442) 11.434 8.324 ( -1.732 -2.364 -0.574) 2.986 8.470 ( 6.596 -0.608 5.297) 8.482 8.543 ( -1.321 3.102 3.363) 4.762 8.916 ( 2.569 0.893 -2.673) 3.813 9.125 ( 9.327 -0.033 6.614) 11.434 9.286 ( -0.041 -3.987 -0.807) 4.068 9.671 ( 4.606 0.549 -1.649) 4.923 9.776 ( -8.349 -9.976 6.101) 14.369 10.278 ( -2.814 4.227 -2.229) 5.546 10.444 ( 6.712 -7.618 -5.773) 11.679 10.693 ( 3.661 -4.093 -2.092) 5.876 10.821 ( -10.996 3.781 -8.574) 14.447 11.507 ( -1.530 0.262 9.369) 9.496 11.957 ( -0.414 3.274 -1.181) 3.505 12.059 ( -2.561 -2.058 3.419) 4.741 12.099 ( 6.783 -1.814 -9.436) 11.761 12.405 ( 2.370 1.757 6.064) 6.744 12.648 ( -5.376 1.923 -2.690) 6.311 12.867 ( 0.656 -1.779 5.834) 6.134 12.946 ( 11.137 1.328 5.812) 12.632 13.274 ( -5.113 1.094 -4.548) 6.930 13.484 ( -2.847 -4.467 -8.188) 9.752 14.434 ( -6.811 -3.199 2.637) 7.974 14.570 ( 8.621 0.541 -2.103) 8.890 17.427 ( 1.760 -0.882 -0.407) 2.010 17.506 ( -2.343 4.511 -3.894) 6.404 21.024 ( -1.501 -1.492 1.203) 2.434 21.062 ( 15.137 -1.632 0.684) 15.240 22.816 ( -9.372 -4.891 7.457) 12.937 23.015 ( 0.281 -1.319 -2.594) 2.924 23.327 ( -3.781 7.189 5.199) 9.644 23.636 ( 5.056 8.428 -6.501) 11.784 25.702 ( -1.916 -2.757 3.794) 5.066 25.905 ( 2.932 -0.756 -3.403) 4.555 26.286 ( 2.693 -5.318 7.578) 9.642 26.624 ( 0.185 3.776 -11.366) 11.978 27.954 ( -30.304 -5.960 6.344) 31.529 28.072 ( 7.582 -0.959 -0.984) 7.706 ======================= Grid point 127 (51/117) ======================= q-point: ( 0.20 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.820 ( 27.614 0.000 -3.756) 27.868 2.119 ( 11.471 0.000 -2.207) 11.681 2.889 ( 22.555 0.000 7.854) 23.883 2.984 ( 4.749 0.000 -16.097) 16.783 3.712 ( 6.216 0.000 34.245) 34.805 3.713 ( -14.529 -0.000 8.356) 16.761 4.035 ( -16.430 -0.000 -8.649) 18.567 4.195 ( 21.896 0.000 -19.815) 29.531 4.695 ( -2.008 -0.000 -1.551) 2.537 4.761 ( 4.703 0.000 6.579) 8.087 4.849 ( -5.186 -0.000 -4.486) 6.857 5.026 ( -2.163 -0.000 -5.910) 6.293 5.236 ( -9.634 -0.000 -1.842) 9.808 5.387 ( 9.566 0.000 4.182) 10.440 5.410 ( 3.814 0.000 -2.173) 4.389 5.565 ( 5.655 0.000 14.247) 15.329 5.624 ( -7.166 -0.000 4.749) 8.597 5.859 ( -2.856 -0.000 -3.114) 4.226 5.891 ( 3.815 0.000 -4.534) 5.925 6.140 ( -5.042 -0.000 5.127) 7.191 6.141 ( 5.395 0.000 -8.835) 10.352 6.449 ( 2.300 0.000 -1.948) 3.014 6.587 ( -4.336 -0.000 2.807) 5.165 6.715 ( -3.706 -0.000 -13.649) 14.143 7.004 ( 5.433 0.000 -7.352) 9.142 7.073 ( 6.671 0.000 3.879) 7.717 7.490 ( -2.160 -0.000 4.885) 5.341 7.644 ( 1.190 0.000 -3.096) 3.317 7.747 ( 1.821 0.000 3.950) 4.350 7.886 ( 0.633 0.000 1.196) 1.354 8.014 ( 5.425 0.000 6.367) 8.365 8.017 ( -0.885 -0.000 -7.236) 7.290 8.230 ( 21.187 0.000 -5.809) 21.969 8.266 ( -1.136 -0.000 5.509) 5.624 8.507 ( 4.539 0.000 -1.058) 4.660 8.564 ( 10.352 0.000 3.551) 10.944 9.041 ( -0.479 -0.000 -9.155) 9.168 9.042 ( -2.111 -0.000 5.733) 6.110 9.458 ( -1.085 -0.000 6.869) 6.954 9.480 ( 4.974 0.000 -3.449) 6.053 9.756 ( 0.865 0.000 -11.496) 11.529 9.888 ( -2.509 -0.000 5.689) 6.217 9.980 ( -14.627 -0.000 -1.226) 14.679 10.316 ( 2.011 0.000 5.830) 6.167 10.336 ( -8.877 -0.000 5.044) 10.210 10.456 ( -1.468 -0.000 -5.314) 5.513 10.876 ( -4.154 -0.000 6.354) 7.591 10.978 ( -23.969 -0.000 1.425) 24.011 11.805 ( -2.026 -0.000 -3.223) 3.806 12.224 ( -6.030 -0.000 11.354) 12.856 12.515 ( 0.442 0.000 -13.074) 13.081 12.683 ( 8.968 0.000 1.785) 9.144 12.865 ( -5.757 -0.000 4.051) 7.040 13.051 ( 11.423 0.000 -18.876) 22.063 13.076 ( 3.827 0.000 16.979) 17.405 13.642 ( -2.299 -0.000 -4.042) 4.650 14.941 ( -4.858 -0.000 3.687) 6.099 14.963 ( 5.764 0.000 -3.794) 6.901 17.237 ( -0.417 -0.000 1.416) 1.476 17.373 ( -3.929 -0.000 -1.023) 4.060 21.552 ( 5.850 0.000 -6.275) 8.579 22.236 ( -6.140 -0.000 14.548) 15.791 23.210 ( 6.077 0.000 -14.881) 16.074 23.271 ( -2.171 -0.000 2.327) 3.183 23.782 ( 5.812 0.000 -0.937) 5.888 23.867 ( 8.188 0.000 3.411) 8.870 24.596 ( -1.385 -0.000 -0.285) 1.414 25.031 ( -7.088 -0.000 -0.662) 7.119 25.900 ( -3.526 -0.000 3.579) 5.024 26.181 ( -3.181 -0.000 -1.081) 3.359 28.415 ( -0.653 -0.000 2.589) 2.670 28.566 ( 2.800 0.000 -2.818) 3.972 ======================= Grid point 128 (52/117) ======================= q-point: ( 0.30 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( 40.842 -11.263 7.999) 43.115 2.410 ( 18.141 -2.284 -10.580) 21.124 2.939 ( 0.204 9.873 -4.003) 10.656 3.130 ( -8.230 -2.642 11.535) 14.414 3.590 ( 2.849 6.226 1.320) 6.973 3.791 ( 3.821 -7.547 6.702) 10.793 3.867 ( -2.999 -10.212 1.302) 10.722 4.475 ( 7.133 -1.128 -8.281) 10.988 4.554 ( -8.889 11.349 -3.789) 14.905 4.744 ( 2.807 0.441 -6.807) 7.376 4.859 ( 0.782 -7.249 0.819) 7.337 5.067 ( 1.918 -1.291 -0.902) 2.482 5.083 ( -4.460 -0.324 2.429) 5.089 5.392 ( -0.206 5.480 1.751) 5.757 5.492 ( -5.238 -0.079 -2.300) 5.722 5.509 ( -0.997 -2.588 0.645) 2.848 5.714 ( 7.048 -1.261 14.452) 16.128 5.875 ( 5.841 2.915 -1.024) 6.607 6.001 ( 3.050 -5.421 -2.047) 6.548 6.082 ( 0.539 4.763 3.639) 6.018 6.223 ( 3.790 1.290 -8.202) 9.127 6.434 ( -1.907 2.785 4.857) 5.914 6.532 ( -3.604 -3.071 6.234) 7.829 6.648 ( -2.902 -0.976 -13.638) 13.977 7.054 ( 7.419 11.594 -2.340) 13.962 7.186 ( 3.206 -0.808 3.849) 5.074 7.458 ( -1.241 -1.432 0.462) 1.951 7.636 ( 1.165 4.966 -6.680) 8.405 7.783 ( -1.920 -4.619 4.180) 6.518 7.874 ( -0.046 4.722 2.758) 5.469 7.956 ( -4.033 2.055 -8.125) 9.301 8.100 ( -7.235 -1.377 0.625) 7.392 8.180 ( -0.930 -11.603 5.334) 12.804 8.499 ( 2.645 -3.144 -5.337) 6.735 8.581 ( -10.224 -1.510 6.898) 12.426 8.596 ( 1.293 0.429 -3.678) 3.922 9.065 ( 12.662 3.407 -4.088) 13.734 9.151 ( 7.508 -4.551 -2.727) 9.194 9.359 ( -5.507 1.475 4.776) 7.437 9.512 ( -24.962 1.014 -0.093) 24.983 9.661 ( 7.617 0.733 1.628) 7.823 9.722 ( -0.433 -1.074 -8.585) 8.663 9.965 ( 3.850 0.922 -3.029) 4.985 10.090 ( -14.650 0.386 8.310) 16.847 10.227 ( -11.018 1.875 6.817) 13.092 10.611 ( 5.601 -0.536 -0.082) 5.627 10.766 ( 4.991 0.658 2.642) 5.686 10.833 ( 5.123 0.742 -4.000) 6.542 11.836 ( 5.122 2.933 -3.034) 6.637 12.097 ( -7.386 1.030 11.633) 13.818 12.481 ( -5.057 -3.646 -10.380) 12.108 12.736 ( -3.392 3.792 5.358) 7.389 12.841 ( 3.249 -3.660 1.818) 5.221 13.187 ( 5.567 -0.351 16.432) 17.353 13.219 ( 7.615 -0.406 -12.837) 14.931 13.558 ( -5.846 0.165 -9.681) 11.311 14.792 ( -10.896 0.228 2.047) 11.089 15.025 ( 0.690 -0.882 -1.353) 1.757 17.266 ( 4.057 1.209 3.283) 5.358 17.302 ( -3.756 -0.526 -2.757) 4.689 21.630 ( 2.212 -1.747 -6.445) 7.034 22.110 ( -6.823 3.135 11.018) 13.333 23.198 ( -2.422 1.092 1.325) 2.969 23.333 ( 1.685 -5.542 -10.954) 12.392 23.836 ( 0.051 -0.677 6.143) 6.180 23.991 ( 5.420 2.077 2.227) 6.217 24.599 ( 7.042 8.527 -5.158) 12.203 25.011 ( 1.007 -6.787 -0.825) 6.910 25.844 ( -2.818 -0.342 2.742) 3.947 26.139 ( -0.960 0.193 -0.373) 1.048 28.378 ( -3.782 -0.454 0.073) 3.809 28.564 ( -2.266 0.584 0.038) 2.340 ======================= Grid point 129 (53/117) ======================= q-point: (-0.60 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 16.094 0.404 6.303) 17.289 2.701 ( 12.598 -1.187 -14.371) 19.147 2.879 ( 3.886 5.363 -0.317) 6.630 2.960 ( 4.976 5.863 10.662) 13.146 3.658 ( 10.047 -4.692 -3.615) 11.663 3.846 ( -3.690 -1.608 -2.385) 4.679 4.200 ( 16.741 -13.882 2.752) 21.922 4.268 ( -3.373 11.336 6.157) 13.334 4.585 ( -2.667 -5.612 -0.698) 6.253 4.732 ( -4.066 -2.079 -4.360) 6.314 4.888 ( -5.346 2.347 -0.633) 5.873 5.009 ( 4.886 3.969 2.620) 6.818 5.214 ( 4.568 -6.591 -5.147) 9.529 5.313 ( -5.759 -2.796 -0.394) 6.414 5.401 ( -2.012 2.566 -3.018) 4.443 5.494 ( -3.229 -1.529 -0.507) 3.609 5.796 ( 2.854 4.623 9.301) 10.772 5.922 ( 2.644 8.690 6.953) 11.439 6.064 ( 3.572 5.262 -5.998) 8.742 6.113 ( 2.795 -6.353 4.769) 8.421 6.220 ( -1.096 4.839 -4.692) 6.829 6.387 ( 0.289 -0.422 3.187) 3.227 6.507 ( -2.880 -1.453 8.169) 8.783 6.617 ( -0.945 -0.687 -8.455) 8.536 7.034 ( 3.250 13.071 4.719) 14.272 7.207 ( 1.053 5.482 -2.639) 6.175 7.448 ( -3.629 -3.541 -2.276) 5.558 7.577 ( -5.809 1.129 -1.970) 6.237 7.694 ( -7.662 2.457 -1.350) 8.159 7.757 ( -10.590 -3.016 1.218) 11.079 7.908 ( 0.619 2.142 -9.044) 9.315 7.945 ( -7.719 -1.232 -2.646) 8.252 8.315 ( -0.003 -9.661 -0.536) 9.676 8.360 ( -10.116 -2.995 3.355) 11.070 8.456 ( -8.163 -8.274 -2.363) 11.861 8.634 ( 0.468 -3.337 -1.112) 3.548 8.982 ( -15.053 4.586 1.107) 15.775 9.171 ( -8.047 -2.323 -2.319) 8.691 9.340 ( 3.901 2.595 0.908) 4.772 9.419 ( 1.131 -1.390 -2.730) 3.266 9.570 ( -12.723 -0.754 0.848) 12.774 9.752 ( -9.340 -5.257 0.855) 10.752 9.857 ( 3.773 0.783 7.020) 8.008 9.947 ( -7.687 2.709 2.581) 8.549 10.191 ( 11.554 -1.522 4.702) 12.567 10.646 ( 1.001 2.156 -4.736) 5.299 11.044 ( 17.841 2.899 3.488) 18.408 11.093 ( 27.734 0.521 -2.728) 27.873 11.852 ( -0.149 4.564 -2.446) 5.181 12.005 ( -1.492 0.711 7.306) 7.491 12.396 ( -8.535 -6.027 -9.674) 14.239 12.640 ( -3.588 2.571 5.803) 7.292 12.925 ( 1.087 -4.059 2.629) 4.957 13.236 ( -1.827 0.462 4.392) 4.779 13.328 ( 4.035 -1.233 7.552) 8.651 13.430 ( -6.771 0.688 -17.096) 18.401 14.585 ( -11.520 -1.588 -0.267) 11.632 15.011 ( -3.343 -1.560 1.151) 3.865 17.251 ( -2.508 -1.385 -3.610) 4.609 17.356 ( 7.310 2.403 3.849) 8.604 21.644 ( -2.688 -2.213 -4.438) 5.641 21.951 ( -8.437 2.610 5.821) 10.578 23.119 ( -8.266 -3.602 5.671) 10.652 23.376 ( -0.327 -2.114 -12.154) 12.341 23.827 ( -1.771 -0.531 6.593) 6.847 24.010 ( 2.436 7.586 0.196) 7.970 24.706 ( 13.569 7.391 -2.334) 15.626 25.160 ( 7.305 -6.633 -0.912) 9.909 25.826 ( 0.330 -1.174 1.412) 1.866 26.148 ( 2.067 -0.125 -0.254) 2.086 28.291 ( -6.545 -1.164 -1.345) 6.783 28.487 ( -5.955 -0.585 1.544) 6.180 ======================= Grid point 130 (54/117) ======================= q-point: (-0.50 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( -6.494 17.715 -7.020) 20.131 2.829 ( 4.161 10.711 7.235) 13.579 2.903 ( 10.464 2.018 -10.041) 14.642 3.436 ( 28.317 -2.131 7.249) 29.308 3.732 ( 5.159 14.748 3.351) 15.980 3.919 ( 3.255 -12.123 -3.098) 12.929 4.238 ( -4.850 7.058 -0.179) 8.566 4.438 ( 3.447 -2.427 -0.657) 4.266 4.555 ( 4.500 -6.190 -0.138) 7.654 4.738 ( -8.500 1.094 -2.206) 8.849 4.806 ( 2.151 -12.117 0.522) 12.318 4.952 ( -4.988 7.767 -4.734) 10.373 5.193 ( -4.546 2.461 5.562) 7.594 5.358 ( -6.729 7.783 4.477) 11.220 5.386 ( 2.225 -10.572 -4.164) 11.578 5.442 ( 3.078 -9.268 -2.327) 10.039 5.819 ( 2.518 2.288 8.249) 8.923 5.919 ( 5.888 8.029 3.981) 10.723 6.026 ( -1.248 6.152 0.394) 6.290 6.117 ( -0.514 3.601 -1.140) 3.812 6.158 ( -0.130 4.210 2.570) 4.934 6.416 ( 0.611 3.261 3.711) 4.978 6.504 ( 0.210 -0.699 5.132) 5.184 6.621 ( 2.026 -2.166 -8.287) 8.802 6.954 ( -0.126 9.011 2.491) 9.350 7.004 ( -9.968 16.719 -8.605) 21.282 7.334 ( -13.704 -3.915 -1.161) 14.300 7.453 ( -5.698 -4.559 -2.214) 7.626 7.560 ( -13.420 -3.462 0.485) 13.868 7.640 ( -1.484 -3.037 -2.580) 4.252 7.854 ( 2.019 0.042 -3.225) 3.805 7.931 ( -1.683 -0.752 -6.091) 6.364 8.230 ( -5.546 -3.646 0.421) 6.651 8.367 ( -6.642 -2.876 -4.060) 8.298 8.421 ( -3.497 -6.734 1.145) 7.674 8.606 ( -3.207 -3.521 -4.580) 6.608 8.883 ( -0.085 -8.903 5.093) 10.257 8.969 ( -14.034 2.380 1.691) 14.335 9.188 ( -15.769 1.136 8.344) 17.876 9.354 ( -7.827 -4.707 -1.442) 9.246 9.397 ( -4.845 -0.487 -2.256) 5.366 9.652 ( -2.325 -3.057 -0.949) 3.957 9.818 ( -4.057 3.545 3.714) 6.544 10.040 ( 5.673 -6.151 -2.016) 8.607 10.495 ( 15.600 -3.159 10.298) 18.957 10.612 ( -0.926 1.429 -0.556) 1.792 11.387 ( 22.479 5.169 6.633) 24.001 11.614 ( 26.319 0.977 -5.508) 26.907 11.802 ( 1.909 1.218 -3.635) 4.282 12.020 ( 3.487 1.211 1.965) 4.182 12.290 ( -8.412 -6.035 -8.016) 13.094 12.560 ( -3.000 3.309 0.581) 4.504 12.936 ( -5.795 -4.141 1.090) 7.206 13.144 ( -8.279 -1.479 6.470) 10.611 13.279 ( -7.667 -1.603 -13.283) 15.421 13.389 ( 1.205 -0.174 10.302) 10.374 14.446 ( -5.002 -1.725 -5.574) 7.685 14.939 ( -6.924 -2.119 3.944) 8.245 17.235 ( -0.956 -2.267 -3.153) 3.999 17.474 ( 8.260 3.541 2.920) 9.449 21.558 ( -8.913 -1.751 -0.755) 9.114 21.753 ( -12.463 0.607 0.698) 12.497 22.989 ( -10.245 -4.654 5.293) 12.435 23.338 ( -4.876 -1.332 -9.283) 10.570 23.798 ( -1.513 1.594 5.105) 5.558 23.962 ( 2.768 10.891 -2.127) 11.437 24.922 ( 16.226 4.222 2.235) 16.915 25.373 ( 9.979 -4.441 -0.754) 10.949 25.887 ( 4.527 -1.854 0.290) 4.901 26.215 ( 4.988 -0.489 -1.064) 5.124 28.170 ( -7.801 -1.307 -2.265) 8.227 28.376 ( -8.246 -3.185 2.423) 9.166 ======================= Grid point 131 (55/117) ======================= q-point: (-0.40 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -1.669 21.969 -4.012) 22.394 2.665 ( -4.690 22.944 11.323) 26.013 3.074 ( 5.100 3.977 -7.244) 9.711 3.616 ( 8.881 23.760 7.514) 26.455 3.803 ( 0.222 0.456 -3.487) 3.524 3.892 ( -3.910 12.876 -6.011) 14.738 4.202 ( 10.781 -11.905 -1.861) 16.168 4.460 ( -12.123 4.027 -4.782) 13.640 4.595 ( -2.810 -5.015 -2.666) 6.337 4.641 ( -3.937 11.288 -1.323) 12.028 4.787 ( 3.160 -4.854 0.453) 5.809 4.960 ( -4.449 -5.493 1.309) 7.189 5.168 ( 9.365 -2.417 8.451) 12.844 5.174 ( 1.910 14.343 8.963) 17.020 5.578 ( 3.251 -11.406 -0.300) 11.864 5.638 ( 3.951 -15.501 0.730) 16.013 5.794 ( -1.269 1.674 8.743) 8.992 5.916 ( 7.646 9.756 -4.249) 13.103 6.009 ( -2.590 3.157 -3.060) 5.103 6.114 ( 4.784 3.888 0.792) 6.215 6.188 ( 7.663 0.008 0.635) 7.689 6.352 ( -2.339 12.778 -3.756) 13.522 6.456 ( -1.329 0.634 5.203) 5.407 6.648 ( -6.730 0.772 -2.963) 7.394 6.751 ( -1.512 -1.736 -11.665) 11.890 6.830 ( -4.448 7.473 -3.412) 9.342 7.168 ( -6.944 1.084 2.731) 7.540 7.238 ( -17.826 -3.633 -4.187) 18.668 7.414 ( -7.267 -2.660 0.200) 7.741 7.672 ( -1.331 -7.219 -2.001) 7.609 7.839 ( -5.278 2.319 0.738) 5.812 7.981 ( 7.195 -4.712 -0.516) 8.616 8.197 ( -2.829 -2.859 -1.889) 4.444 8.302 ( -1.892 -1.026 -3.850) 4.411 8.399 ( -6.010 -4.896 3.369) 8.453 8.558 ( -8.094 -2.237 -5.008) 9.777 8.688 ( -8.175 1.390 6.715) 10.671 8.866 ( -12.541 -0.257 12.226) 17.517 9.116 ( 3.666 -15.219 3.102) 15.958 9.278 ( -7.538 -0.407 -2.364) 7.910 9.345 ( 0.268 -4.619 -6.283) 7.803 9.676 ( -5.138 0.674 0.879) 5.256 9.772 ( 8.575 -2.265 -8.610) 12.361 10.135 ( -2.678 -8.258 8.051) 11.840 10.526 ( -3.378 0.027 0.541) 3.421 10.851 ( 13.346 -4.330 14.503) 20.179 11.676 ( 9.884 0.740 5.889) 11.529 11.749 ( 6.475 4.845 -9.733) 12.654 12.050 ( 3.811 -4.330 -4.911) 7.576 12.140 ( 8.269 2.409 -12.384) 15.085 12.257 ( 8.234 -1.182 4.636) 9.523 12.459 ( -2.330 2.742 -4.917) 6.093 12.791 ( -11.601 -3.600 3.112) 12.539 13.014 ( -7.701 -2.219 6.202) 10.133 13.234 ( -0.452 -4.910 -2.128) 5.370 13.395 ( -1.430 -0.713 5.356) 5.589 14.419 ( 1.378 0.393 -10.318) 10.417 14.799 ( -11.615 -2.155 6.749) 13.605 17.257 ( 0.887 -2.811 -1.433) 3.277 17.579 ( 7.329 4.567 0.567) 8.655 21.366 ( -13.993 -2.200 1.745) 14.272 21.484 ( -17.051 -0.500 -2.360) 17.221 22.874 ( -7.298 -4.382 3.130) 9.070 23.219 ( -8.821 -1.378 -5.262) 10.363 23.741 ( -1.595 5.406 5.042) 7.563 23.903 ( 3.184 11.830 -3.725) 12.805 25.202 ( 16.605 0.372 5.085) 17.371 25.587 ( 9.715 -2.579 -1.629) 10.183 26.006 ( 6.248 -1.047 1.188) 6.446 26.337 ( 7.620 -1.523 -3.085) 8.360 28.047 ( -6.215 -0.735 -3.457) 7.150 28.258 ( -10.352 -6.230 3.439) 12.561 ======================= Grid point 132 (56/117) ======================= q-point: (-0.30 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( -0.137 23.626 12.029) 26.512 2.265 ( -8.641 33.056 14.751) 37.215 2.805 ( -18.289 12.623 -8.746) 23.881 3.506 ( -4.731 17.063 -17.647) 24.999 3.663 ( 12.532 23.320 6.979) 27.379 3.987 ( -2.279 23.938 1.297) 24.081 4.142 ( 4.725 -4.284 2.334) 6.792 4.240 ( -4.140 24.001 7.331) 25.435 4.475 ( -3.111 -4.858 -5.793) 8.175 4.638 ( 2.355 1.320 2.960) 4.007 4.906 ( 1.015 -9.401 -6.284) 11.353 4.988 ( 1.188 -8.123 -5.820) 10.063 5.178 ( 3.498 1.562 9.756) 10.481 5.486 ( 14.979 -4.468 -0.277) 15.634 5.590 ( -2.713 3.250 4.769) 6.377 5.752 ( -1.615 4.165 -1.646) 4.761 5.811 ( -5.756 -6.129 2.447) 8.757 5.953 ( 3.044 -14.684 -0.364) 15.000 5.969 ( 1.359 9.181 -5.072) 10.577 6.184 ( 4.294 1.294 -7.702) 8.912 6.240 ( 4.659 0.043 2.125) 5.121 6.352 ( 8.208 1.960 1.422) 8.557 6.455 ( -10.714 -4.426 -1.991) 11.762 6.491 ( 2.884 -0.025 -2.957) 4.131 6.697 ( -3.058 3.870 -5.224) 7.185 6.774 ( -3.845 -5.803 -7.243) 10.045 7.022 ( -3.768 -0.381 -1.933) 4.252 7.069 ( -4.508 -0.271 -1.646) 4.806 7.331 ( -5.309 -3.296 1.823) 6.509 7.683 ( -4.608 -5.405 -0.420) 7.115 7.785 ( 1.421 -0.505 3.503) 3.814 8.034 ( -12.751 -0.040 9.032) 15.626 8.173 ( 4.190 -0.595 -3.616) 5.567 8.262 ( -2.167 -5.135 3.071) 6.364 8.323 ( -4.440 -1.366 3.504) 5.819 8.488 ( -3.521 -0.880 1.811) 4.056 8.682 ( -7.616 0.911 5.647) 9.525 8.692 ( 7.621 -3.069 1.877) 8.428 9.138 ( -7.926 0.052 -1.936) 8.159 9.338 ( 1.014 -9.026 3.204) 9.631 9.425 ( 5.996 -8.030 -6.952) 12.197 9.567 ( -4.825 -1.282 -4.941) 7.024 10.041 ( 13.448 -6.282 -8.187) 16.951 10.153 ( -4.345 -9.422 14.870) 18.132 10.491 ( -0.872 -3.134 2.284) 3.974 11.039 ( 2.971 -0.404 4.006) 5.004 11.739 ( -6.810 0.621 -1.322) 6.965 11.853 ( 6.954 0.972 -1.784) 7.245 11.958 ( -8.256 -3.240 -6.867) 11.217 12.103 ( -0.131 -1.388 -8.178) 8.296 12.466 ( 7.292 5.515 1.930) 9.345 12.600 ( 10.375 -2.918 8.894) 13.974 12.683 ( 0.069 -1.559 1.710) 2.315 12.941 ( -1.903 -0.870 2.383) 3.172 13.305 ( 1.332 -4.455 -1.437) 4.867 13.371 ( -2.253 -2.062 -1.393) 3.357 14.465 ( 5.445 2.625 -8.647) 10.550 14.578 ( -14.261 -2.617 5.946) 15.671 17.317 ( 2.575 -2.771 0.822) 3.872 17.639 ( 4.278 5.199 -3.238) 7.471 21.130 ( -13.130 -1.475 1.620) 13.311 21.179 ( -15.367 -0.692 -2.281) 15.551 22.813 ( -4.421 -3.394 3.474) 6.567 23.065 ( -8.061 -0.898 -3.078) 8.675 23.641 ( -2.209 8.810 6.141) 10.964 23.846 ( 3.406 11.319 -4.790) 12.754 25.486 ( 10.982 -3.976 6.368) 13.303 25.765 ( 7.922 -1.560 -3.744) 8.900 26.119 ( 5.783 0.067 3.579) 6.801 26.503 ( 7.961 -2.959 -6.056) 10.432 27.981 ( -0.837 -0.545 -4.054) 4.175 28.111 ( -14.381 -7.515 4.707) 16.895 ======================= Grid point 133 (57/117) ======================= q-point: (-0.20 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( 8.750 23.979 22.746) 34.190 1.887 ( 5.827 33.764 20.495) 39.924 2.437 ( -2.281 14.323 -12.156) 18.924 3.204 ( -5.537 38.138 -3.906) 38.735 3.339 ( -0.939 35.686 2.764) 35.805 3.722 ( -7.460 13.624 2.619) 15.752 4.079 ( 0.984 15.154 -5.561) 16.172 4.340 ( 3.943 -2.766 6.381) 7.995 4.474 ( 2.907 -6.026 -0.618) 6.719 4.617 ( -2.354 1.463 6.449) 7.019 4.933 ( 0.538 3.229 -12.260) 12.690 5.043 ( -4.753 4.880 -15.041) 16.512 5.165 ( -2.888 -11.695 3.453) 12.532 5.475 ( -1.951 7.450 5.429) 9.422 5.664 ( -2.397 -1.661 -1.102) 3.117 5.768 ( 6.935 -4.625 -4.771) 9.605 5.827 ( 1.660 1.667 6.003) 6.447 5.960 ( 2.363 -4.855 -2.263) 5.855 6.117 ( 2.818 -1.371 -5.727) 6.529 6.231 ( -3.079 -10.461 2.153) 11.115 6.251 ( -3.659 -5.145 -3.793) 7.365 6.424 ( 4.717 -2.821 0.865) 5.564 6.504 ( 8.233 0.324 -4.867) 9.570 6.560 ( -0.009 -5.595 -0.618) 5.629 6.614 ( -7.447 -1.746 -1.479) 7.791 6.777 ( 3.750 -2.013 -7.753) 8.845 6.985 ( -2.651 -5.216 1.482) 6.036 7.110 ( 5.479 0.458 -7.195) 9.055 7.290 ( -0.812 -1.457 1.935) 2.555 7.637 ( -4.041 -4.209 0.592) 5.865 7.833 ( -5.788 1.662 13.245) 14.550 7.890 ( 5.319 -3.230 3.276) 7.032 8.163 ( -0.714 2.512 1.256) 2.898 8.283 ( -1.168 0.261 0.548) 1.316 8.319 ( -2.535 -3.143 -1.239) 4.224 8.443 ( 0.573 -2.407 4.399) 5.047 8.580 ( -2.156 1.959 2.749) 4.005 8.940 ( 6.078 -0.523 3.435) 7.001 9.045 ( 5.144 -4.968 5.290) 8.895 9.318 ( -2.316 3.839 -0.996) 4.593 9.537 ( -4.223 -10.512 0.086) 11.329 9.648 ( 5.091 -6.021 -9.766) 12.552 10.138 ( -6.152 -13.970 9.860) 18.172 10.310 ( 3.793 -6.256 -4.650) 8.668 10.612 ( 8.566 -4.712 4.407) 10.724 10.928 ( -13.880 5.670 -14.298) 20.717 11.508 ( -2.819 -0.304 8.163) 8.641 11.979 ( 1.944 -1.927 3.675) 4.582 12.006 ( 3.486 -3.310 0.517) 4.835 12.076 ( -2.072 0.581 -12.450) 12.635 12.489 ( 2.675 5.404 5.817) 8.378 12.653 ( 0.272 -0.481 1.026) 1.165 12.809 ( 0.344 -4.096 8.386) 9.340 12.988 ( 7.236 2.559 2.578) 8.097 13.292 ( -4.527 -0.020 -5.066) 6.794 13.379 ( -1.399 -5.224 -6.376) 8.361 14.350 ( -9.589 -5.164 4.196) 11.671 14.611 ( 10.578 3.496 -5.967) 12.638 17.390 ( 2.131 -2.167 2.232) 3.771 17.603 ( -2.964 4.968 -6.795) 8.924 20.998 ( -1.005 -1.023 1.240) 1.896 21.045 ( 4.836 -0.399 -0.153) 4.855 22.763 ( -3.957 -1.152 6.299) 7.527 22.988 ( -0.599 -1.338 -3.090) 3.420 23.508 ( -2.077 10.842 5.595) 12.376 23.806 ( 3.676 9.268 -4.476) 10.929 25.628 ( -1.067 -4.830 4.913) 6.972 25.880 ( 2.468 -1.805 -3.616) 4.735 26.218 ( 2.176 -2.199 6.099) 6.839 26.621 ( -0.521 -3.109 -11.538) 11.961 27.874 ( -13.877 -2.537 6.207) 15.413 28.048 ( 5.891 -1.469 -1.730) 6.313 ======================= Grid point 134 (58/117) ======================= q-point: (-0.10 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.539 ( 20.106 19.341 13.630) 31.050 1.843 ( 17.490 32.977 22.870) 43.777 2.518 ( 14.303 7.856 -17.768) 24.125 2.650 ( 1.252 37.605 31.455) 49.042 3.210 ( 11.385 19.701 -25.850) 34.438 3.421 ( -2.123 16.852 3.826) 17.411 3.769 ( -15.303 13.827 -0.418) 20.629 4.401 ( 0.245 1.706 15.047) 15.145 4.575 ( -2.679 -2.725 11.779) 12.384 4.664 ( 5.962 -6.751 -9.654) 13.203 4.900 ( 5.548 9.759 -23.567) 26.104 4.955 ( 0.331 -5.540 -5.215) 7.616 5.207 ( -4.895 -6.251 -5.130) 9.452 5.391 ( -1.372 3.117 5.046) 6.088 5.600 ( -5.831 -1.647 3.206) 6.855 5.719 ( -2.347 3.843 4.331) 6.248 5.874 ( -11.990 -1.268 -6.739) 13.813 6.058 ( 9.314 -4.147 -1.304) 10.279 6.158 ( -7.658 -2.948 0.241) 8.209 6.211 ( 1.545 -2.914 -9.415) 9.976 6.324 ( 0.329 -4.382 5.287) 6.875 6.461 ( -6.395 -1.725 0.219) 6.628 6.538 ( 1.204 -4.916 -3.203) 5.989 6.609 ( -0.528 -7.641 -1.433) 7.792 6.680 ( 8.739 -4.828 -6.216) 11.761 6.886 ( 4.129 -3.924 -6.418) 8.581 7.075 ( 5.362 -5.426 1.770) 7.831 7.182 ( 4.986 -3.532 -3.418) 7.002 7.351 ( 4.669 -1.772 -0.553) 5.024 7.655 ( 0.683 -3.538 6.782) 7.680 7.798 ( -0.901 0.590 13.738) 13.780 7.940 ( 0.222 1.103 0.027) 1.125 8.127 ( -1.485 6.876 -0.607) 7.061 8.206 ( -3.972 3.938 -5.584) 7.903 8.349 ( 5.672 -2.020 -1.956) 6.330 8.560 ( 2.095 -1.349 2.772) 3.727 8.595 ( 8.892 -3.159 5.296) 10.820 8.935 ( 2.817 0.480 -0.321) 2.876 9.236 ( -0.821 1.076 -4.477) 4.677 9.397 ( 15.259 -4.590 17.809) 23.897 9.544 ( -4.519 -5.674 0.810) 7.299 9.686 ( -2.666 -1.955 -2.151) 3.944 10.123 ( -8.640 0.767 -0.650) 8.698 10.335 ( -4.344 -9.303 0.205) 10.270 10.565 ( -11.445 -1.544 -6.765) 13.384 10.816 ( 3.001 -3.732 6.795) 8.313 11.711 ( 15.239 -1.926 -5.948) 16.471 11.867 ( -12.999 4.102 -2.894) 13.935 11.972 ( -1.668 -1.029 -0.612) 2.053 12.164 ( 4.205 -4.950 -4.623) 7.972 12.507 ( -1.766 1.584 -1.729) 2.936 12.536 ( -4.923 7.404 6.182) 10.829 12.830 ( -4.255 -3.515 3.164) 6.361 13.067 ( 1.155 -0.374 7.820) 7.914 13.173 ( -5.949 0.053 -5.818) 8.321 13.417 ( 2.485 -2.806 -4.801) 6.091 14.374 ( 5.597 -5.410 -2.891) 8.304 14.753 ( 7.987 1.684 1.847) 8.369 17.409 ( -3.114 -0.480 -0.746) 3.238 17.479 ( -2.584 2.151 -1.284) 3.599 21.071 ( 8.799 0.751 -1.210) 8.913 21.524 ( 32.504 -18.480 -4.759) 37.691 22.744 ( 2.884 0.798 4.729) 5.596 23.057 ( 6.136 -2.308 -2.436) 6.994 23.386 ( 0.432 10.502 2.260) 10.752 23.790 ( 3.532 7.432 -2.931) 8.735 25.537 ( -15.040 -2.601 4.062) 15.795 25.835 ( -12.011 1.098 -0.559) 12.074 26.140 ( -11.258 4.185 10.156) 15.729 26.439 ( -11.453 0.848 -7.444) 13.686 27.879 ( 13.615 -1.853 -4.416) 14.433 28.197 ( 6.987 -2.614 4.368) 8.644 ======================= Grid point 138 (59/117) ======================= q-point: ( 0.30 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.221 ( 29.584 0.000 10.446) 31.374 2.700 ( 10.656 0.000 -16.544) 19.679 2.978 ( 2.273 0.000 0.264) 2.288 3.018 ( 2.879 0.000 11.284) 11.646 3.645 ( 3.102 0.000 -6.363) 7.079 3.763 ( 3.262 0.000 -0.169) 3.266 4.044 ( 19.818 0.000 4.066) 20.231 4.466 ( -9.247 -0.000 6.915) 11.547 4.520 ( -0.359 -0.000 2.853) 2.875 4.638 ( -4.512 -0.000 -10.287) 11.233 4.925 ( -2.892 -0.000 -3.760) 4.743 5.072 ( 6.586 0.000 3.256) 7.347 5.126 ( 4.093 0.000 -1.276) 4.288 5.289 ( -7.974 -0.000 -2.666) 8.408 5.435 ( -4.417 -0.000 -2.424) 5.038 5.472 ( -0.634 -0.000 -0.970) 1.159 5.884 ( 7.571 0.000 15.011) 16.813 5.987 ( -1.773 -0.000 -2.940) 3.433 6.020 ( 8.126 0.000 1.240) 8.220 6.149 ( 2.726 0.000 -1.323) 3.030 6.248 ( -1.350 -0.000 -7.474) 7.595 6.428 ( -1.161 -0.000 9.537) 9.608 6.441 ( -3.440 -0.000 8.381) 9.059 6.592 ( -1.007 -0.000 -15.385) 15.417 7.180 ( -1.153 -0.000 10.174) 10.239 7.292 ( 9.608 0.000 -4.604) 10.654 7.394 ( -3.778 -0.000 0.660) 3.835 7.621 ( -14.972 -0.000 2.898) 15.250 7.658 ( -3.698 -0.000 -11.159) 11.755 7.787 ( -9.291 -0.000 6.454) 11.312 7.932 ( 0.519 0.000 -6.042) 6.064 8.001 ( -1.862 -0.000 -0.788) 2.022 8.105 ( -2.544 -0.000 0.347) 2.568 8.350 ( -10.998 -0.000 -7.666) 13.406 8.351 ( -11.400 -0.000 5.589) 12.696 8.600 ( 0.253 0.000 -1.577) 1.598 9.062 ( -19.155 -0.000 -3.373) 19.449 9.125 ( -4.070 -0.000 -1.872) 4.480 9.359 ( 1.960 0.000 3.689) 4.177 9.412 ( 6.366 0.000 -5.124) 8.172 9.612 ( -6.259 -0.000 -4.445) 7.677 9.637 ( -19.826 -0.000 2.091) 19.936 9.867 ( 6.450 0.000 9.851) 11.775 9.978 ( -12.221 -0.000 2.055) 12.393 10.181 ( 10.533 0.000 7.023) 12.659 10.667 ( 1.323 0.000 -3.625) 3.859 11.075 ( 18.736 0.000 2.805) 18.945 11.096 ( 27.288 0.000 -2.476) 27.400 11.911 ( -2.024 -0.000 -2.888) 3.527 12.016 ( 0.813 0.000 5.494) 5.553 12.323 ( -9.382 -0.000 -9.264) 13.185 12.672 ( -3.905 -0.000 6.459) 7.547 12.874 ( 0.714 0.000 3.306) 3.382 13.236 ( -5.037 -0.000 -3.704) 6.252 13.311 ( 5.641 0.000 19.283) 20.091 13.445 ( -5.623 -0.000 -21.013) 21.752 14.570 ( -11.781 -0.000 -0.328) 11.785 14.994 ( -3.457 -0.000 1.166) 3.648 17.237 ( -2.700 -0.000 -3.727) 4.602 17.381 ( 7.466 0.000 3.935) 8.440 21.620 ( -2.240 -0.000 -5.508) 5.946 21.982 ( -9.648 -0.000 7.648) 12.311 23.081 ( -8.680 -0.000 5.494) 10.273 23.353 ( 0.995 0.000 -12.244) 12.284 23.823 ( -0.974 -0.000 6.243) 6.319 24.089 ( 3.907 0.000 -0.032) 3.907 24.803 ( 10.416 0.000 -2.583) 10.731 25.067 ( 9.101 0.000 -0.879) 9.143 25.815 ( 0.142 0.000 1.301) 1.308 26.146 ( 1.812 0.000 0.120) 1.816 28.280 ( -6.516 -0.000 -1.695) 6.733 28.481 ( -6.923 -0.000 1.931) 7.187 ======================= Grid point 139 (60/117) ======================= q-point: (-0.60 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( 2.760 11.854 3.117) 12.564 2.804 ( 6.703 -6.207 -9.898) 13.469 3.042 ( 4.980 5.735 -4.554) 8.856 3.369 ( 29.458 -2.032 8.238) 30.656 3.794 ( 9.506 -2.045 -10.050) 13.983 3.936 ( 12.667 3.823 8.096) 15.512 4.307 ( -2.572 3.571 11.921) 12.707 4.394 ( 13.288 -5.177 5.338) 15.227 4.478 ( -3.681 -0.352 0.861) 3.796 4.586 ( -5.236 -3.522 -6.206) 8.850 4.763 ( -12.409 -2.505 -0.319) 12.664 5.080 ( -5.884 3.709 -9.191) 11.526 5.173 ( -0.066 -1.515 -4.869) 5.100 5.241 ( -1.818 -3.844 -0.842) 4.335 5.373 ( -1.216 0.813 -3.223) 3.540 5.458 ( 1.059 1.386 0.712) 1.884 5.905 ( 2.873 6.358 5.258) 8.737 6.021 ( 2.399 1.269 3.696) 4.585 6.054 ( -0.186 -1.564 7.784) 7.942 6.164 ( -3.763 2.356 -3.305) 5.535 6.223 ( 0.811 0.828 0.778) 1.396 6.434 ( 2.630 -0.229 4.362) 5.099 6.478 ( 4.246 -1.944 7.482) 8.820 6.591 ( 0.726 -1.132 -11.835) 11.911 7.123 ( -4.131 5.945 5.285) 8.963 7.247 ( -18.924 -0.626 -2.699) 19.126 7.311 ( -2.576 3.141 -1.941) 4.502 7.426 ( 1.427 5.415 0.025) 5.600 7.533 ( -7.765 0.656 -3.673) 8.615 7.677 ( -3.082 5.166 5.264) 7.994 7.888 ( -1.751 4.194 -3.597) 5.796 7.909 ( -2.507 0.495 -4.072) 4.807 8.158 ( -4.589 -14.731 -0.797) 15.450 8.192 ( -3.809 -2.195 -2.380) 4.999 8.262 ( -5.862 -7.316 -4.082) 10.225 8.572 ( -4.793 -1.002 -6.278) 7.961 8.783 ( -8.235 -0.518 2.544) 8.635 9.021 ( -8.293 1.546 -0.835) 8.478 9.213 ( -18.990 1.223 5.187) 19.723 9.271 ( -11.687 -3.424 3.348) 12.630 9.430 ( -4.168 4.099 -0.833) 5.905 9.564 ( -0.883 -5.761 -3.048) 6.577 9.878 ( -3.753 1.943 5.850) 7.216 9.941 ( 1.434 -3.034 -4.932) 5.965 10.451 ( 16.929 -1.085 15.263) 22.820 10.645 ( -2.866 1.151 -1.627) 3.491 11.451 ( 20.442 1.648 9.115) 22.443 11.619 ( 28.032 -0.219 -6.918) 28.873 11.857 ( 2.462 2.852 -8.878) 9.644 12.055 ( 1.450 2.762 0.452) 3.152 12.163 ( -8.379 -5.992 -6.509) 12.185 12.625 ( -0.876 2.497 4.066) 4.851 12.852 ( -6.193 -3.175 2.953) 7.559 13.083 ( -11.036 -2.898 -2.776) 11.743 13.280 ( -10.236 0.687 -10.494) 14.675 13.395 ( 1.771 0.278 15.518) 15.621 14.430 ( -3.000 -0.270 -7.544) 8.123 14.909 ( -6.638 -0.821 4.662) 8.153 17.204 ( -1.113 -0.868 -3.181) 3.480 17.525 ( 8.621 1.483 2.843) 9.198 21.524 ( -8.963 -1.116 -2.827) 9.464 21.775 ( -13.266 0.911 3.257) 13.690 22.926 ( -9.203 -1.708 4.538) 10.403 23.313 ( -4.967 -0.847 -7.593) 9.113 23.822 ( 0.755 0.779 3.500) 3.664 24.128 ( 3.291 5.024 -1.625) 6.222 24.986 ( 11.652 1.994 2.494) 12.082 25.291 ( 12.499 -3.048 -1.527) 12.955 25.863 ( 4.907 -0.586 -0.592) 4.977 26.205 ( 4.409 -0.339 -0.174) 4.425 28.153 ( -7.211 -0.422 -2.785) 7.741 28.334 ( -9.823 -1.146 3.138) 10.376 ======================= Grid point 140 (61/117) ======================= q-point: (-0.50 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( 2.901 22.876 -1.316) 23.096 3.001 ( 1.145 10.350 6.504) 12.278 3.099 ( 14.729 -5.417 -10.261) 18.751 3.777 ( -10.877 5.470 1.660) 12.288 3.927 ( 23.089 -6.660 3.735) 24.319 4.052 ( 11.284 13.653 5.353) 18.503 4.161 ( -10.223 10.744 1.890) 14.950 4.411 ( -5.350 -9.894 -4.908) 12.272 4.585 ( -5.584 2.385 -1.048) 6.162 4.607 ( 8.325 -6.238 -0.438) 10.412 4.728 ( 4.058 -12.091 2.861) 13.071 4.845 ( -8.766 5.457 -13.766) 17.209 5.178 ( 0.520 -0.137 6.487) 6.510 5.298 ( 2.811 -12.025 -5.857) 13.668 5.353 ( -1.387 -0.977 -1.700) 2.401 5.530 ( 8.702 3.611 2.385) 9.719 5.881 ( -2.539 6.833 8.718) 11.364 6.042 ( -2.331 1.362 0.765) 2.806 6.083 ( 6.642 3.113 -3.328) 8.055 6.147 ( 4.804 -1.108 4.375) 6.591 6.240 ( 4.156 3.659 5.813) 8.028 6.470 ( 1.692 1.553 4.241) 4.823 6.513 ( -2.431 2.189 5.319) 6.245 6.607 ( -2.730 -2.004 -8.768) 9.399 6.853 ( -8.924 7.539 -7.147) 13.695 7.078 ( -2.936 6.434 -3.469) 7.877 7.128 ( -9.256 7.840 -0.076) 12.130 7.342 ( -8.512 12.928 -0.406) 15.484 7.371 ( -3.818 -2.209 -2.631) 5.136 7.577 ( -3.730 0.549 1.627) 4.106 7.846 ( -4.782 -3.098 0.282) 5.704 7.915 ( 5.118 -2.042 -0.526) 5.535 8.150 ( -4.407 -2.330 -1.911) 5.339 8.207 ( -4.253 -9.127 -6.978) 12.251 8.257 ( -2.857 -9.173 0.874) 9.648 8.502 ( -3.145 -2.846 -4.894) 6.477 8.745 ( -14.398 4.089 9.857) 17.921 8.796 ( -0.191 -9.214 3.802) 9.970 8.887 ( -15.134 -3.575 7.424) 17.232 9.251 ( 1.858 -4.779 -8.545) 9.965 9.286 ( -7.885 0.953 -0.805) 7.983 9.651 ( 3.026 -2.586 -7.857) 8.808 9.775 ( -2.108 1.830 0.962) 2.952 9.958 ( -5.594 -8.375 5.547) 11.498 10.553 ( -4.431 1.959 1.850) 5.186 10.787 ( 15.417 -2.245 15.619) 22.061 11.653 ( 3.202 -0.951 3.454) 4.805 11.895 ( 3.623 6.130 -6.495) 9.637 11.955 ( 3.819 -2.892 -7.839) 9.187 12.144 ( 8.307 -2.378 -13.614) 16.124 12.237 ( 16.442 -0.299 5.427) 17.317 12.526 ( -8.722 3.848 -4.901) 10.720 12.715 ( -7.760 -4.039 3.269) 9.338 12.939 ( -9.060 -4.995 2.586) 10.664 13.168 ( -0.757 -1.536 2.785) 3.269 13.391 ( -2.582 -0.035 8.644) 9.021 14.437 ( 4.362 1.097 -13.827) 14.540 14.768 ( -11.016 -0.979 8.731) 14.091 17.214 ( 1.128 -1.596 -0.934) 2.166 17.655 ( 7.653 2.949 0.026) 8.202 21.320 ( -14.451 -1.985 0.237) 14.589 21.493 ( -16.770 0.866 -0.456) 16.798 22.810 ( -5.696 -2.202 2.957) 6.785 23.195 ( -8.177 -0.985 -4.025) 9.167 23.827 ( 1.319 3.330 3.104) 4.740 24.114 ( 2.904 8.846 -2.995) 9.780 25.192 ( 11.084 -1.236 6.113) 12.719 25.538 ( 11.651 -2.144 -2.434) 12.095 25.990 ( 7.953 -0.482 -1.103) 8.044 26.304 ( 5.564 -1.463 -1.775) 6.021 28.037 ( -5.468 -0.261 -3.486) 6.490 28.167 ( -11.035 -3.184 3.996) 12.160 ======================= Grid point 141 (62/117) ======================= q-point: (-0.40 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 1.888 25.795 8.308) 27.166 2.840 ( -1.590 21.684 11.270) 24.489 3.078 ( -13.984 18.402 -7.926) 24.434 3.683 ( 2.714 -5.575 -3.097) 6.931 3.918 ( -0.844 0.922 1.466) 1.926 4.094 ( 8.083 16.794 0.351) 18.641 4.288 ( 4.165 0.870 -8.312) 9.338 4.356 ( 0.833 -1.220 -2.922) 3.274 4.618 ( 5.369 1.699 -2.443) 6.139 4.669 ( 1.622 0.605 -9.637) 9.791 4.744 ( -1.858 -3.907 -3.029) 5.281 4.860 ( -2.228 -4.915 5.104) 7.428 5.185 ( -2.697 -1.916 13.195) 13.604 5.386 ( 4.120 -5.527 2.665) 7.391 5.521 ( 2.088 -14.961 -2.704) 15.346 5.670 ( 13.585 7.488 1.301) 15.566 5.764 ( -4.711 1.122 8.593) 9.864 5.965 ( -2.538 4.221 -0.018) 4.926 6.125 ( 1.613 7.665 -2.240) 8.147 6.208 ( -0.174 -0.123 2.166) 2.177 6.331 ( 5.726 3.127 -1.656) 6.731 6.385 ( -4.301 1.221 -1.669) 4.773 6.457 ( -0.712 3.207 2.416) 4.078 6.568 ( 2.890 4.509 -0.271) 5.363 6.720 ( -0.686 7.603 -17.136) 18.760 6.856 ( -5.636 12.315 -0.733) 13.563 7.015 ( -2.157 -0.314 -8.804) 9.070 7.091 ( -6.798 3.269 2.331) 7.895 7.292 ( -3.796 0.749 1.869) 4.297 7.563 ( -2.793 -5.300 -0.689) 6.030 7.810 ( -0.493 0.273 5.405) 5.434 8.006 ( -3.877 -1.681 4.069) 5.866 8.110 ( -1.237 -7.763 0.060) 7.862 8.163 ( -5.582 -2.156 -1.091) 6.082 8.267 ( -1.534 -4.394 6.519) 8.010 8.498 ( -2.609 1.259 2.138) 3.601 8.602 ( 0.956 -5.155 1.552) 5.468 8.657 ( -8.588 -3.343 5.444) 10.703 9.016 ( 2.326 -18.018 -4.171) 18.640 9.146 ( -6.203 -0.839 4.946) 7.978 9.336 ( 3.084 -3.683 -11.723) 12.669 9.587 ( -4.739 1.917 -6.935) 8.616 9.884 ( -2.012 -9.048 6.513) 11.329 9.967 ( 4.557 -8.184 0.402) 9.376 10.481 ( -0.956 1.349 4.501) 4.795 11.019 ( 6.289 -1.365 5.563) 8.507 11.718 ( 1.117 -1.974 -0.151) 2.273 11.869 ( -1.269 -3.543 5.019) 6.273 11.908 ( -17.078 1.123 -12.594) 21.249 12.087 ( 2.355 0.335 -8.376) 8.708 12.497 ( 4.199 -2.657 -1.574) 5.213 12.560 ( 9.257 -0.283 6.978) 11.596 12.701 ( 4.734 2.815 4.289) 6.981 12.890 ( 0.900 -4.002 0.499) 4.132 13.221 ( 1.543 -3.007 1.356) 3.642 13.345 ( -2.567 -1.464 -0.206) 2.962 14.513 ( -5.090 1.308 1.280) 5.409 14.551 ( -2.476 0.445 -3.818) 4.572 17.273 ( 3.335 -1.746 2.335) 4.430 17.730 ( 3.942 3.882 -4.174) 6.930 21.089 ( -11.838 -2.032 1.559) 12.111 21.188 ( -14.403 0.915 -1.756) 14.538 22.764 ( -2.116 -1.720 2.974) 4.035 23.054 ( -7.246 -0.353 -2.715) 7.746 23.799 ( 0.649 7.017 4.551) 8.389 24.062 ( 2.108 10.337 -3.913) 11.251 25.398 ( 7.121 -4.860 7.528) 11.445 25.733 ( 7.903 -1.621 -3.830) 8.931 26.126 ( 6.450 0.687 1.109) 6.581 26.428 ( 5.209 -4.149 -5.373) 8.557 27.967 ( -3.614 -0.890 -1.153) 3.896 28.010 ( -8.761 -3.192 2.312) 9.607 ======================= Grid point 142 (63/117) ======================= q-point: (-0.30 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( 8.034 25.217 18.223) 32.133 2.557 ( 2.884 34.287 12.223) 36.514 2.722 ( -2.593 14.084 -6.914) 15.903 3.571 ( -2.563 11.770 -16.776) 20.653 3.956 ( -10.082 13.179 3.858) 17.036 4.096 ( 0.550 10.718 -1.337) 10.815 4.178 ( -1.305 1.440 -0.666) 2.054 4.381 ( 3.876 0.877 -3.254) 5.136 4.545 ( 2.048 21.239 1.288) 21.377 4.616 ( -4.978 -0.975 -4.716) 6.926 4.836 ( 0.863 -6.054 -4.635) 7.674 4.916 ( 2.330 -10.101 2.031) 10.563 5.236 ( 1.562 0.060 11.669) 11.773 5.508 ( -8.016 -6.394 4.353) 11.139 5.558 ( 6.445 -5.036 5.961) 10.121 5.639 ( -4.956 -4.074 0.935) 6.484 5.895 ( 6.273 7.425 -5.992) 11.419 5.968 ( 6.893 -5.962 -0.567) 9.131 6.066 ( -2.858 1.482 -0.357) 3.239 6.093 ( -6.191 7.439 -3.931) 10.446 6.292 ( 1.632 -1.022 -4.893) 5.258 6.375 ( -1.428 5.120 -0.101) 5.316 6.491 ( 5.328 -1.369 -4.340) 7.007 6.602 ( 3.574 4.241 0.315) 5.555 6.617 ( -5.186 5.519 -2.330) 7.923 6.762 ( 5.135 0.901 -11.001) 12.174 6.924 ( -5.998 -1.847 1.180) 6.386 7.127 ( 7.676 0.848 -8.680) 11.618 7.262 ( -0.009 -0.923 4.214) 4.314 7.530 ( -5.007 -4.491 -3.804) 7.727 7.843 ( 0.209 -2.062 12.108) 12.284 7.893 ( 0.728 4.393 7.229) 8.490 8.108 ( -4.636 -8.367 3.321) 10.126 8.244 ( -0.169 -3.293 -3.074) 4.508 8.278 ( 2.874 -1.007 4.740) 5.634 8.402 ( -2.740 -0.536 4.313) 5.138 8.593 ( -2.555 -1.764 0.804) 3.207 8.829 ( 10.932 -9.304 7.418) 16.158 8.993 ( -6.320 -2.722 -1.288) 7.001 9.280 ( 3.587 -12.809 1.531) 13.389 9.388 ( -1.447 -1.525 -2.027) 2.920 9.549 ( 4.265 -1.770 -21.856) 22.338 9.859 ( -8.776 -13.030 14.404) 21.313 10.182 ( 4.246 -7.493 -1.891) 8.817 10.538 ( 6.801 -1.993 7.477) 10.302 11.009 ( -9.940 2.677 -11.904) 15.737 11.495 ( -7.946 -0.913 6.257) 10.155 11.906 ( 2.840 -5.493 -1.594) 6.386 11.933 ( 4.166 -3.384 2.297) 5.838 12.101 ( -1.692 1.245 -7.195) 7.495 12.567 ( 1.430 1.056 -0.751) 1.930 12.647 ( 4.674 -0.016 1.442) 4.892 12.741 ( 0.026 -1.156 14.817) 14.863 13.015 ( 5.054 -0.734 0.101) 5.108 13.222 ( -5.700 -4.868 -4.799) 8.901 13.355 ( 2.663 1.113 -6.317) 6.945 14.254 ( -13.526 -4.230 8.184) 16.365 14.688 ( 11.041 3.947 -8.116) 14.260 17.355 ( 3.302 -1.342 4.822) 5.996 17.692 ( -3.829 4.067 -7.953) 9.718 20.982 ( -0.698 -0.647 1.261) 1.580 21.042 ( 1.663 0.068 -0.840) 1.864 22.754 ( -0.778 -0.120 4.717) 4.782 22.967 ( -1.737 -0.760 -3.279) 3.788 23.721 ( -0.044 10.551 5.227) 11.775 23.993 ( 1.503 9.671 -3.880) 10.528 25.521 ( -0.749 -6.020 6.670) 9.016 25.837 ( 1.460 -2.501 -3.855) 4.821 26.196 ( 1.289 0.024 3.821) 4.032 26.532 ( -0.298 -5.599 -9.518) 11.047 27.841 ( -7.150 -1.046 4.865) 8.711 28.019 ( 4.231 -1.420 -2.137) 4.948 ======================= Grid point 143 (64/117) ======================= q-point: (-0.20 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.923 ( 10.419 20.415 12.198) 25.964 2.436 ( 16.436 30.440 21.690) 40.832 2.695 ( 11.868 10.620 -12.722) 20.383 3.332 ( -12.795 25.659 -14.876) 32.301 3.563 ( -0.666 16.202 3.833) 16.662 3.836 ( -0.279 20.823 -0.449) 20.830 4.128 ( -5.577 15.635 -2.225) 16.748 4.332 ( -4.271 -2.804 7.314) 8.921 4.531 ( -1.915 -3.684 -6.174) 7.441 4.572 ( 3.670 2.249 2.999) 5.246 4.849 ( -0.632 -2.488 -2.189) 3.374 5.041 ( -0.097 -8.283 -3.591) 9.029 5.171 ( 1.859 12.528 0.562) 12.677 5.409 ( -7.245 -3.981 6.037) 10.236 5.640 ( 0.736 0.703 7.756) 7.823 5.761 ( -1.316 -1.511 2.714) 3.373 5.867 ( -6.683 1.094 -7.702) 10.256 5.910 ( -0.952 -8.500 0.820) 8.592 6.087 ( 2.608 -2.122 -1.901) 3.863 6.130 ( 2.696 -2.524 -9.423) 10.121 6.264 ( 1.127 4.115 -2.134) 4.771 6.373 ( -4.344 -7.035 1.374) 8.381 6.483 ( -5.759 0.490 3.363) 6.687 6.548 ( 1.533 -0.040 -1.910) 2.450 6.658 ( 7.373 1.877 -5.475) 9.374 6.856 ( 4.994 0.076 -9.344) 10.595 6.939 ( 5.232 -5.362 -0.924) 7.548 7.204 ( 4.314 1.813 -4.922) 6.791 7.315 ( 2.521 -2.886 2.042) 4.342 7.531 ( -0.222 -6.575 -1.364) 6.719 7.834 ( 0.602 2.141 14.246) 14.418 7.945 ( 0.613 0.168 1.447) 1.581 8.187 ( 4.707 -1.798 0.412) 5.056 8.214 ( 0.018 -2.088 -3.450) 4.032 8.342 ( 3.567 1.945 2.744) 4.903 8.455 ( 4.269 -5.162 4.602) 8.127 8.600 ( 2.505 -0.361 0.633) 2.609 8.920 ( -1.325 -2.893 -0.881) 3.302 9.148 ( 7.725 -9.408 8.227) 14.692 9.377 ( 4.240 1.172 3.359) 5.535 9.425 ( 3.103 -6.265 -3.960) 8.035 9.622 ( -1.391 -3.866 -6.897) 8.028 9.930 ( 1.327 -14.524 -5.201) 15.484 10.214 ( -6.570 -5.674 9.024) 12.522 10.630 ( -17.914 5.439 -5.726) 19.577 10.721 ( 4.137 -4.727 10.024) 11.830 11.652 ( 16.087 -4.033 -3.234) 16.897 11.934 ( -9.662 2.000 -4.104) 10.686 11.967 ( -2.368 0.160 2.263) 3.279 12.065 ( 3.915 -4.725 -8.204) 10.245 12.533 ( -4.646 1.376 -3.966) 6.262 12.674 ( 0.032 5.630 9.957) 11.439 12.759 ( -4.833 -3.302 6.416) 8.685 13.024 ( -2.180 -3.682 -1.107) 4.420 13.171 ( -5.284 -0.534 -0.673) 5.354 13.367 ( 3.844 -1.710 -2.037) 4.675 14.251 ( 6.187 -6.786 -2.904) 9.632 14.806 ( 6.114 3.516 -0.055) 7.053 17.402 ( -0.363 -0.217 3.431) 3.457 17.530 ( -7.043 2.974 -5.766) 9.576 21.086 ( 10.970 0.693 0.399) 10.999 21.288 ( 20.348 -7.337 -1.501) 21.683 22.761 ( 2.915 0.966 4.170) 5.179 23.011 ( 4.893 -2.334 -2.981) 6.187 23.614 ( 0.697 12.370 3.547) 12.888 23.933 ( 1.487 7.520 -2.451) 8.048 25.473 ( -11.291 -3.925 4.591) 12.805 25.811 ( -7.858 -2.807 -2.023) 8.586 26.171 ( -4.512 0.139 6.131) 7.614 26.441 ( -11.742 -1.180 -8.935) 14.802 27.851 ( 8.525 -1.015 -1.022) 8.646 28.143 ( 6.410 -2.765 2.181) 7.314 ======================= Grid point 144 (65/117) ======================= q-point: (-0.10 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( 1.927 7.482 -6.142) 9.870 2.412 ( -22.104 23.394 7.873) 33.134 2.539 ( 21.935 32.519 14.257) 41.736 3.176 ( 20.140 8.276 -3.522) 22.057 3.452 ( -11.399 12.948 -14.704) 22.667 3.713 ( 16.230 14.569 -2.272) 21.928 4.043 ( 16.216 23.519 10.411) 30.406 4.323 ( 1.673 -1.995 5.815) 6.371 4.469 ( -7.445 -8.729 0.676) 11.493 4.606 ( -0.163 -0.690 -1.344) 1.519 4.944 ( 4.583 -3.258 -3.014) 6.380 5.067 ( -0.336 -4.668 1.102) 4.808 5.104 ( -0.662 5.611 -6.304) 8.465 5.360 ( -4.175 -4.446 5.451) 8.180 5.501 ( -5.013 8.419 7.380) 12.267 5.608 ( -14.834 5.601 -6.297) 17.061 5.763 ( 0.695 -1.685 3.405) 3.862 5.993 ( -5.248 0.234 -5.685) 7.740 6.116 ( -0.078 -14.320 -3.734) 14.799 6.186 ( 2.070 1.595 -6.340) 6.857 6.310 ( -5.398 -3.894 1.656) 6.859 6.330 ( -2.704 -11.190 -0.511) 11.524 6.370 ( -2.932 5.003 5.964) 8.318 6.631 ( 4.236 -2.218 -1.568) 5.032 6.754 ( 2.238 -2.144 -4.647) 5.586 6.915 ( 2.438 0.029 -8.128) 8.486 7.213 ( 16.605 -6.852 2.114) 18.087 7.327 ( 11.695 -0.223 -9.725) 15.212 7.369 ( -2.524 -6.272 4.010) 7.861 7.631 ( 5.641 -4.867 -2.927) 8.004 7.868 ( 6.349 4.416 14.322) 16.276 7.947 ( 0.713 -0.792 -2.132) 2.384 8.143 ( -1.662 5.386 -1.666) 5.878 8.261 ( 3.404 6.033 -0.485) 6.944 8.431 ( 3.695 -0.040 -2.859) 4.672 8.580 ( 1.587 -3.054 -0.286) 3.454 8.731 ( 9.860 -4.318 5.542) 12.107 8.976 ( 2.314 -5.000 0.797) 5.567 9.271 ( 5.242 1.479 -2.064) 5.824 9.536 ( 3.947 -2.450 -10.914) 11.861 9.558 ( 5.672 -6.708 15.787) 18.066 9.625 ( 3.309 -3.418 -1.555) 5.005 9.998 ( -4.890 -2.246 3.210) 6.266 10.162 ( -8.179 -5.544 4.952) 11.053 10.367 ( -4.623 -6.297 -3.204) 8.443 10.799 ( -0.170 -0.819 11.048) 11.080 11.559 ( -24.541 5.383 -1.180) 25.152 11.860 ( -4.026 3.308 -11.699) 12.807 12.034 ( 9.768 -3.932 -0.209) 10.532 12.142 ( -2.897 -3.019 0.741) 4.249 12.353 ( -6.859 1.531 -1.851) 7.267 12.575 ( -5.693 -0.326 -3.969) 6.948 12.719 ( 1.947 -0.467 1.315) 2.395 13.042 ( -3.781 0.207 7.885) 8.747 13.097 ( 0.540 -3.255 -3.730) 4.981 13.516 ( 8.321 0.326 0.262) 8.332 14.491 ( 11.909 -5.408 -6.121) 14.441 14.875 ( 4.505 0.124 4.995) 6.727 17.320 ( -5.741 0.252 -2.728) 6.361 17.463 ( -0.975 0.119 2.170) 2.382 21.307 ( 13.990 3.036 -1.380) 14.382 21.756 ( 14.073 -16.169 0.538) 21.442 22.869 ( 7.961 -0.664 1.193) 8.077 23.188 ( 12.117 -4.161 -5.331) 13.876 23.538 ( 4.164 11.320 0.062) 12.062 23.898 ( 1.578 5.522 -0.048) 5.743 25.147 ( -25.629 2.761 5.733) 26.407 25.602 ( -13.380 1.829 0.154) 13.505 26.067 ( -4.076 3.182 5.337) 7.431 26.271 ( -6.724 -2.365 -5.734) 9.148 28.110 ( 14.363 -4.947 -6.558) 16.546 28.282 ( 5.348 -2.680 5.483) 8.114 ======================= Grid point 149 (66/117) ======================= q-point: (-0.60 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( 6.323 0.000 4.973) 8.044 2.917 ( 13.492 0.000 -14.333) 19.684 3.096 ( 0.149 0.000 4.991) 4.993 3.839 ( 21.456 0.000 3.480) 21.736 3.997 ( 11.177 0.000 -15.755) 19.317 4.077 ( -13.709 -0.000 15.381) 20.604 4.218 ( -6.314 -0.000 13.648) 15.038 4.423 ( -2.863 -0.000 2.093) 3.546 4.536 ( -0.652 -0.000 -5.134) 5.175 4.577 ( 7.296 0.000 1.559) 7.461 4.581 ( 8.236 0.000 2.398) 8.578 4.900 ( -9.949 -0.000 -18.683) 21.167 5.136 ( -3.289 -0.000 -8.486) 9.101 5.194 ( 0.206 0.000 0.863) 0.887 5.368 ( 0.070 0.000 -4.623) 4.623 5.552 ( 7.955 0.000 4.575) 9.176 5.999 ( -4.128 -0.000 5.192) 6.633 6.044 ( -5.808 -0.000 8.074) 9.946 6.087 ( 9.603 0.000 -5.671) 11.152 6.123 ( 5.714 0.000 5.709) 8.077 6.266 ( 4.418 0.000 7.348) 8.574 6.462 ( 2.191 0.000 1.637) 2.735 6.539 ( -5.043 -0.000 5.903) 7.764 6.593 ( 0.205 0.000 -9.530) 9.532 6.934 ( -7.531 -0.000 -2.388) 7.900 7.050 ( -7.248 -0.000 -5.388) 9.031 7.247 ( -2.734 -0.000 -0.375) 2.759 7.467 ( -0.792 -0.000 4.629) 4.697 7.563 ( 1.032 0.000 0.196) 1.051 7.658 ( -5.946 -0.000 1.367) 6.101 7.770 ( -6.485 -0.000 2.912) 7.109 7.882 ( -5.959 -0.000 -4.248) 7.318 8.022 ( 4.294 0.000 5.807) 7.223 8.034 ( -12.368 -0.000 -12.752) 17.764 8.208 ( 4.497 0.000 -7.037) 8.351 8.469 ( -4.724 -0.000 -3.642) 5.965 8.693 ( -2.165 -0.000 2.306) 3.163 8.820 ( -21.169 -0.000 16.345) 26.745 8.843 ( -13.098 -0.000 1.478) 13.181 9.194 ( 2.902 0.000 -8.838) 9.303 9.300 ( -8.891 -0.000 0.342) 8.898 9.620 ( 5.743 0.000 -10.223) 11.725 9.798 ( -4.663 -0.000 2.916) 5.500 9.867 ( -6.808 -0.000 4.653) 8.246 10.576 ( -4.615 -0.000 1.972) 5.018 10.765 ( 15.977 0.000 15.843) 22.500 11.647 ( 2.750 0.000 2.081) 3.449 11.879 ( -7.094 -0.000 -1.035) 7.170 12.049 ( 8.178 0.000 -13.833) 16.070 12.065 ( 11.659 0.000 -11.287) 16.227 12.239 ( 19.445 0.000 4.423) 19.941 12.578 ( -20.386 -0.000 -3.561) 20.695 12.664 ( 2.994 0.000 0.637) 3.061 12.875 ( -9.038 -0.000 0.950) 9.088 13.158 ( -1.275 -0.000 5.720) 5.861 13.391 ( -3.434 -0.000 9.846) 10.428 14.450 ( 5.265 0.000 -15.131) 16.021 14.759 ( -10.629 -0.000 9.606) 14.327 17.198 ( 1.289 0.000 -0.770) 1.501 17.684 ( 7.659 0.000 -0.132) 7.660 21.300 ( -14.303 -0.000 -0.738) 14.322 21.503 ( -17.034 -0.000 0.811) 17.053 22.789 ( -5.057 -0.000 2.746) 5.754 23.185 ( -7.708 -0.000 -3.675) 8.539 23.861 ( 2.398 0.000 2.232) 3.275 24.207 ( 2.617 0.000 -2.796) 3.830 25.175 ( 8.624 0.000 6.886) 11.036 25.516 ( 12.826 0.000 -2.883) 13.146 25.986 ( 8.617 0.000 -2.209) 8.896 26.289 ( 4.700 0.000 -0.943) 4.794 28.035 ( -5.115 -0.000 -3.658) 6.288 28.136 ( -11.247 -0.000 4.317) 12.047 ======================= Grid point 151 (67/117) ======================= q-point: (-0.50 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( 1.462 20.255 5.953) 21.162 3.018 ( -4.373 -1.473 7.479) 8.787 3.337 ( 17.634 -4.975 -9.637) 20.702 3.611 ( -15.183 14.416 8.646) 22.652 4.010 ( -11.288 3.879 9.991) 15.565 4.109 ( 3.889 -5.997 -4.905) 8.669 4.246 ( 6.173 -11.992 -9.728) 16.630 4.467 ( 10.209 13.357 3.813) 17.239 4.563 ( 0.789 -3.940 -2.476) 4.720 4.623 ( 0.230 -1.522 -5.105) 5.332 4.738 ( 5.776 0.040 -0.726) 5.821 4.875 ( 3.643 5.306 -13.989) 15.398 5.111 ( -2.697 -6.410 -1.444) 7.102 5.174 ( -4.816 -9.312 -5.735) 11.949 5.397 ( 5.239 -0.644 2.018) 5.651 5.759 ( 11.608 1.414 7.553) 13.921 5.853 ( -6.364 4.062 7.856) 10.896 5.946 ( -5.387 -2.798 5.892) 8.459 6.204 ( -0.331 0.629 1.532) 1.689 6.261 ( 6.977 2.844 -7.498) 10.630 6.359 ( 3.737 0.752 1.642) 4.151 6.401 ( -2.470 -0.343 5.136) 5.710 6.502 ( -0.199 0.108 6.543) 6.547 6.565 ( 0.698 1.039 -11.694) 11.761 6.906 ( 2.012 3.755 -0.098) 4.262 6.956 ( -2.950 -1.302 -5.321) 6.222 7.192 ( -1.128 10.095 -1.996) 10.352 7.323 ( -8.447 18.258 0.139) 20.118 7.380 ( -3.164 10.911 0.152) 11.361 7.540 ( -2.404 3.552 0.882) 4.379 7.752 ( -0.983 -4.392 6.102) 7.582 7.868 ( -10.239 -14.801 -0.362) 18.001 7.923 ( 0.886 -10.235 -4.276) 11.127 8.154 ( 4.059 -2.785 2.754) 5.640 8.240 ( 0.172 6.570 -1.725) 6.795 8.439 ( 0.621 -7.954 -1.684) 8.154 8.553 ( -9.145 -0.718 13.246) 16.112 8.603 ( -12.855 -0.787 2.373) 13.095 8.722 ( 1.114 -8.576 -0.627) 8.670 9.142 ( -8.278 0.069 3.687) 9.062 9.276 ( 4.455 -2.021 -14.328) 15.140 9.617 ( -3.533 0.951 -7.929) 8.732 9.745 ( -8.528 -4.225 11.320) 14.789 9.857 ( 8.565 -2.924 -5.231) 10.454 10.512 ( -1.226 1.218 4.588) 4.902 10.997 ( 7.255 -0.695 6.056) 9.476 11.686 ( 2.400 -0.948 -3.587) 4.419 11.797 ( -1.241 -2.454 6.569) 7.121 11.925 ( -24.148 0.279 -8.555) 25.620 12.111 ( 2.732 1.333 -7.348) 7.952 12.426 ( 2.492 -2.947 -1.174) 4.034 12.582 ( 10.830 1.657 4.835) 11.975 12.750 ( 3.869 1.785 2.256) 4.821 12.808 ( 6.043 -3.610 -2.561) 7.491 13.193 ( 1.739 -0.279 4.808) 5.120 13.316 ( -3.746 -1.088 0.242) 3.908 14.519 ( -16.855 0.027 13.240) 21.434 14.576 ( 9.861 0.996 -14.976) 17.959 17.250 ( 3.928 -0.556 3.195) 5.094 17.782 ( 3.536 1.428 -4.591) 5.969 21.061 ( -10.857 -0.756 0.709) 10.906 21.202 ( -14.466 0.416 -0.578) 14.483 22.743 ( -0.942 -0.535 2.587) 2.804 23.050 ( -6.629 -0.066 -2.617) 7.127 23.897 ( 2.438 2.710 3.390) 4.977 24.215 ( 1.068 4.538 -3.986) 6.134 25.319 ( 5.250 -2.576 8.873) 10.627 25.709 ( 7.798 -0.698 -3.698) 8.659 26.141 ( 8.020 0.634 -1.735) 8.230 26.363 ( 2.558 -2.068 -3.277) 4.643 27.949 ( -8.940 -0.633 4.179) 9.889 27.977 ( -1.976 -0.650 -2.994) 3.646 ======================= Grid point 152 (68/117) ======================= q-point: (-0.40 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( 5.736 23.017 13.232) 27.162 2.936 ( -0.903 6.568 0.866) 6.686 3.171 ( -0.039 27.328 5.818) 27.940 3.698 ( 0.651 -0.483 -3.315) 3.413 3.846 ( -4.367 -8.508 7.692) 12.273 4.108 ( -7.165 -6.326 -10.473) 14.178 4.390 ( -6.137 11.160 -11.259) 17.000 4.416 ( 3.595 -2.347 -8.439) 9.469 4.603 ( -5.421 1.023 0.478) 5.537 4.706 ( 3.228 -2.204 -0.962) 4.025 4.759 ( 4.966 -0.720 0.260) 5.025 4.876 ( 6.246 3.774 -4.557) 8.604 5.099 ( 1.088 -5.862 2.037) 6.301 5.309 ( 1.551 -12.785 -3.004) 13.224 5.540 ( 6.753 -0.039 7.405) 10.022 5.668 ( -7.118 3.350 7.919) 11.162 5.877 ( 2.417 -2.968 4.856) 6.183 5.960 ( -8.597 -5.794 2.363) 10.633 6.132 ( 5.216 8.068 -2.420) 9.908 6.271 ( 2.245 7.842 -6.509) 10.436 6.306 ( -5.952 3.386 -0.415) 6.860 6.465 ( -0.549 1.825 1.687) 2.545 6.478 ( 4.768 -1.075 0.272) 4.895 6.638 ( 4.844 0.521 -7.103) 8.613 6.801 ( -10.412 7.454 3.066) 13.167 6.886 ( -3.309 -0.219 0.841) 3.422 7.005 ( 0.603 23.428 -6.817) 24.407 7.159 ( 9.278 6.509 -9.308) 14.665 7.315 ( 1.861 5.737 4.454) 7.498 7.487 ( -2.741 -0.120 -0.094) 2.745 7.786 ( 0.716 -3.701 9.410) 10.137 7.880 ( -3.599 -12.609 2.466) 13.343 8.014 ( 0.407 4.464 1.002) 4.594 8.138 ( 1.089 -7.267 -4.031) 8.381 8.287 ( 3.742 1.649 6.538) 7.711 8.416 ( -4.513 1.244 4.050) 6.190 8.507 ( -2.803 -6.297 1.855) 7.138 8.616 ( 5.928 -12.129 4.400) 14.198 8.845 ( -2.425 -12.273 -1.754) 12.633 9.070 ( 0.937 -4.845 6.732) 8.347 9.349 ( 2.491 -1.952 -10.565) 11.029 9.570 ( 1.774 2.020 -17.609) 17.813 9.669 ( -6.296 -6.491 11.883) 14.933 10.031 ( 3.211 -6.993 -1.754) 7.893 10.536 ( 4.939 1.125 8.275) 9.702 11.038 ( -4.978 0.513 -9.020) 10.316 11.481 ( -14.299 -0.358 4.338) 14.947 11.794 ( 3.554 -5.242 -4.857) 7.981 11.879 ( 5.187 -2.107 6.907) 8.891 12.117 ( -1.853 0.431 -4.761) 5.127 12.513 ( 2.711 -4.146 -0.617) 4.992 12.673 ( 4.999 2.114 1.581) 5.653 12.775 ( 1.271 3.013 10.432) 10.932 12.955 ( 2.090 -4.374 -1.927) 5.217 13.162 ( -7.412 -1.637 -2.400) 7.961 13.374 ( 8.683 0.584 -8.143) 11.918 14.197 ( -17.392 -1.682 12.438) 21.447 14.752 ( 11.152 2.437 -8.870) 14.457 17.338 ( 4.216 -0.495 6.677) 7.912 17.755 ( -4.383 2.325 -8.658) 9.979 20.973 ( 0.936 -0.352 1.487) 1.793 21.045 ( -0.715 0.126 -1.116) 1.331 22.753 ( 1.075 -0.001 3.915) 4.060 22.959 ( -2.805 -0.198 -3.406) 4.417 23.892 ( 1.645 6.557 4.724) 8.247 24.160 ( -0.312 6.915 -4.614) 8.319 25.411 ( -0.366 -4.802 8.717) 9.959 25.791 ( 0.071 -1.987 -3.887) 4.366 26.219 ( 1.707 2.249 0.999) 2.995 26.420 ( -0.493 -5.542 -6.970) 8.918 27.828 ( -4.458 -0.425 4.061) 6.045 27.996 ( 3.197 -0.872 -2.231) 3.995 ======================= Grid point 153 (69/117) ======================= q-point: (-0.30 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.333 ( 3.857 21.562 11.344) 24.667 2.901 ( 4.708 9.796 -5.700) 12.273 3.017 ( 12.233 28.311 13.932) 33.841 3.594 ( -3.882 5.736 -16.597) 17.984 3.840 ( -3.566 -0.729 9.262) 9.951 4.049 ( -9.314 -4.112 -2.046) 10.385 4.095 ( -6.030 6.901 -7.954) 12.135 4.338 ( -9.306 4.614 -3.387) 10.925 4.499 ( -3.259 -2.915 -7.522) 8.701 4.786 ( 7.047 2.989 -0.402) 7.665 4.893 ( 3.352 -1.555 7.335) 8.213 4.915 ( 1.925 6.074 -4.304) 7.689 5.219 ( -0.075 -9.142 3.402) 9.754 5.377 ( -0.587 3.470 3.264) 4.800 5.534 ( -4.649 -3.591 1.660) 6.104 5.671 ( 6.486 -2.177 8.756) 11.112 5.780 ( -11.062 -4.376 3.871) 12.510 6.017 ( 3.457 -5.866 0.518) 6.829 6.077 ( -9.277 8.385 -9.203) 15.526 6.219 ( 0.154 -3.630 -4.126) 5.498 6.261 ( 8.862 13.408 0.140) 16.073 6.409 ( -2.624 4.489 2.823) 5.917 6.487 ( -5.745 2.437 4.347) 7.605 6.596 ( -0.047 2.949 -1.454) 3.289 6.707 ( 3.689 0.764 -4.165) 5.616 6.841 ( 3.004 -3.274 -6.462) 7.842 6.961 ( 8.599 12.614 -6.909) 16.758 7.203 ( -1.421 -0.087 -3.536) 3.811 7.311 ( 2.651 4.486 2.811) 5.920 7.465 ( 1.714 -0.404 -0.697) 1.894 7.843 ( 1.113 -1.554 6.739) 7.005 7.960 ( -2.026 0.980 1.321) 2.610 8.045 ( 10.696 -9.543 -0.813) 14.358 8.229 ( 2.069 0.125 0.467) 2.125 8.343 ( 3.968 -1.006 -0.142) 4.096 8.413 ( 3.046 0.060 6.314) 7.010 8.556 ( 2.627 -3.779 -0.548) 4.635 8.792 ( -2.220 -10.778 0.013) 11.004 8.949 ( 7.041 -9.802 12.693) 17.514 9.252 ( 7.364 -9.709 -3.946) 12.809 9.399 ( 2.779 -0.497 -4.391) 5.221 9.578 ( -0.698 -0.487 -6.927) 6.980 9.714 ( 5.171 -6.699 -6.343) 10.576 10.067 ( -7.408 -8.981 7.251) 13.716 10.667 ( 7.963 -0.349 11.923) 14.341 10.728 ( -20.437 3.951 -2.709) 20.991 11.563 ( 14.482 -4.823 -2.109) 15.409 11.911 ( 3.828 -3.817 -1.381) 5.580 11.968 ( -4.895 -0.073 -0.826) 4.965 12.014 ( -1.866 -0.764 -7.482) 7.749 12.553 ( -2.866 0.133 -3.944) 4.878 12.711 ( -3.190 -0.439 1.100) 3.402 12.745 ( -0.187 1.269 13.292) 13.354 12.953 ( -10.062 -3.223 -6.837) 12.585 13.136 ( 6.953 -2.741 4.257) 8.601 13.368 ( -5.683 1.523 0.618) 5.916 14.131 ( 7.022 -5.208 -1.935) 8.954 14.875 ( 5.279 3.253 -1.173) 6.311 17.402 ( 1.614 0.204 6.998) 7.185 17.585 ( -9.474 2.482 -8.840) 13.193 21.099 ( 12.513 0.716 1.666) 12.643 21.195 ( 14.512 -3.002 -1.905) 14.941 22.780 ( 2.592 0.993 4.352) 5.162 22.969 ( 3.382 -1.897 -3.865) 5.475 23.838 ( 1.120 10.029 4.510) 11.054 24.077 ( -0.725 6.987 -4.008) 8.088 25.391 ( -7.984 -4.263 6.728) 11.277 25.743 ( -8.151 -3.752 -2.821) 9.406 26.182 ( -3.075 1.439 2.408) 4.162 26.391 ( -7.888 -3.675 -7.028) 11.186 27.838 ( 5.605 -0.474 0.525) 5.649 28.096 ( 5.929 -1.977 0.754) 6.295 ======================= Grid point 154 (70/117) ======================= q-point: (-0.20 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( -7.467 14.003 -3.344) 16.218 2.758 ( -9.737 12.941 3.685) 16.609 3.091 ( 20.001 24.130 12.502) 33.743 3.431 ( -0.408 10.672 -15.480) 18.807 3.706 ( -9.408 15.863 -1.559) 18.509 3.843 ( -6.549 -0.274 6.422) 9.176 4.168 ( 0.755 -11.856 -6.109) 13.358 4.253 ( 12.004 6.074 -2.777) 13.737 4.476 ( -0.020 -0.083 -1.705) 1.707 4.786 ( 3.548 14.640 0.511) 15.072 4.902 ( 6.016 -0.735 0.047) 6.061 5.006 ( 1.030 -6.096 -0.778) 6.231 5.200 ( -8.413 2.524 10.165) 13.434 5.274 ( -2.028 1.272 4.057) 4.711 5.554 ( -5.475 -3.545 3.080) 7.212 5.656 ( -3.771 -4.774 1.095) 6.182 5.796 ( -1.737 -9.906 3.140) 10.536 5.814 ( -7.643 10.356 0.678) 12.889 6.005 ( -7.378 -2.737 -4.471) 9.051 6.189 ( -3.701 -3.127 -4.850) 6.855 6.252 ( 1.478 7.270 -1.624) 7.594 6.361 ( -0.288 3.303 -0.395) 3.339 6.459 ( 1.903 1.625 10.139) 10.443 6.613 ( 7.225 4.095 -4.766) 9.576 6.766 ( 0.427 3.363 -3.034) 4.549 6.945 ( 3.863 1.672 -10.004) 10.853 7.090 ( 14.729 -4.396 -0.299) 15.374 7.224 ( 1.002 -5.082 -1.343) 5.352 7.352 ( 7.582 0.744 -4.820) 9.015 7.551 ( 6.587 -1.716 0.329) 6.815 7.912 ( 5.645 -0.841 3.304) 6.595 7.928 ( -1.271 -0.779 -0.315) 1.523 8.233 ( 1.213 3.920 1.997) 4.563 8.307 ( 8.426 -2.287 -5.286) 10.206 8.426 ( 2.612 -2.259 0.614) 3.508 8.490 ( 3.557 -3.076 2.111) 5.155 8.685 ( 9.275 -0.556 4.193) 10.194 8.858 ( 1.007 -7.174 -0.513) 7.262 9.204 ( 7.940 -10.078 9.741) 16.108 9.452 ( 4.777 -1.916 1.241) 5.294 9.480 ( 7.362 -3.747 -12.866) 15.290 9.566 ( 0.601 -1.423 -3.995) 4.283 9.897 ( 3.996 -6.398 -1.866) 7.771 10.006 ( -7.278 -9.828 8.391) 14.831 10.359 ( -14.746 3.032 4.009) 15.579 10.799 ( 4.966 0.885 12.826) 13.782 11.640 ( -23.236 2.917 -0.428) 23.422 11.888 ( 7.873 -1.722 -12.127) 14.561 11.972 ( 1.708 -1.417 -1.357) 2.601 12.089 ( 3.796 -2.285 -2.298) 4.991 12.404 ( -10.090 3.658 -4.102) 11.490 12.515 ( -11.716 -4.067 -3.558) 12.902 12.751 ( 1.458 2.140 11.076) 11.374 12.974 ( 3.569 -7.368 -2.706) 8.623 13.060 ( -7.456 0.448 2.737) 7.956 13.513 ( 12.824 -1.151 3.406) 13.319 14.390 ( 13.638 -4.626 -7.891) 16.421 14.893 ( 0.929 1.722 4.548) 4.951 17.343 ( -6.799 1.974 -3.310) 7.816 17.465 ( -1.551 -0.008 2.455) 2.904 21.363 ( 16.567 2.510 1.273) 16.804 21.527 ( 13.794 -7.950 -1.969) 16.042 22.857 ( 5.731 -0.499 3.972) 6.991 23.111 ( 9.834 -3.759 -5.208) 11.746 23.763 ( 2.401 11.281 2.357) 11.772 24.004 ( -0.209 5.572 -1.824) 5.866 25.180 ( -18.730 0.746 4.337) 19.240 25.580 ( -12.488 -3.421 -0.697) 12.967 26.109 ( -3.733 1.116 4.390) 5.869 26.238 ( -8.881 -1.180 -6.520) 11.080 28.027 ( 12.079 -3.495 -3.595) 13.078 28.232 ( 6.230 -2.339 3.632) 7.581 ======================= Grid point 155 (71/117) ======================= q-point: (-0.10 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( -6.931 10.274 -13.707) 18.479 2.403 ( -6.331 19.595 9.735) 22.777 3.226 ( 7.341 10.198 3.644) 13.083 3.278 ( -5.593 21.794 -4.611) 22.968 3.442 ( 3.331 3.066 4.945) 6.704 3.807 ( -0.256 -5.809 -6.104) 8.430 4.202 ( -8.629 -12.197 -1.656) 15.032 4.432 ( 10.221 15.664 -2.802) 18.913 4.523 ( 0.327 -4.094 -0.454) 4.132 4.785 ( 8.996 13.294 4.499) 16.671 4.954 ( -3.255 -5.536 -3.702) 7.413 5.031 ( 0.779 3.738 4.154) 5.643 5.100 ( 3.898 -0.183 -1.761) 4.281 5.298 ( 2.851 -2.764 11.920) 12.564 5.382 ( -7.157 6.144 -4.694) 10.536 5.640 ( 0.597 8.175 13.588) 15.869 5.712 ( -1.094 -4.511 3.788) 5.992 5.830 ( -9.055 -17.971 1.688) 20.194 5.933 ( -2.411 -4.271 -4.811) 6.870 6.129 ( -7.941 -1.361 -7.041) 10.700 6.214 ( -0.890 1.002 0.877) 1.602 6.311 ( 1.692 7.401 -3.487) 8.354 6.473 ( 4.089 2.836 4.986) 7.044 6.680 ( -1.167 1.502 -4.101) 4.520 6.775 ( 6.984 0.611 -0.204) 7.014 6.969 ( 2.663 1.673 -8.430) 8.998 7.229 ( -1.165 -3.688 2.304) 4.502 7.435 ( 12.216 -5.379 -2.481) 13.576 7.569 ( 12.820 0.070 -8.848) 15.577 7.757 ( 12.166 -5.642 -0.141) 13.411 7.927 ( 0.078 -1.025 -2.398) 2.609 8.051 ( 5.889 -2.170 -5.469) 8.325 8.237 ( 7.774 7.492 5.517) 12.124 8.427 ( 8.278 4.366 2.420) 9.667 8.461 ( 1.013 -0.571 -4.436) 4.586 8.565 ( 0.819 -2.994 0.834) 3.214 8.871 ( 8.018 -1.193 6.141) 10.170 8.953 ( 2.729 -4.537 -1.062) 5.400 9.405 ( 5.822 -2.510 0.916) 6.406 9.520 ( 2.158 3.691 -1.938) 4.694 9.576 ( 3.635 -12.054 5.491) 13.735 9.709 ( 4.260 -3.429 -5.116) 7.489 9.912 ( -5.806 -8.032 7.211) 12.256 9.947 ( -5.158 2.845 2.360) 6.346 10.290 ( 4.247 -7.693 -2.503) 9.136 10.829 ( -1.927 2.536 5.756) 6.578 11.116 ( -27.481 5.066 4.886) 28.368 11.604 ( -25.883 3.643 -5.511) 26.713 11.955 ( -11.381 0.678 -1.291) 11.474 12.133 ( 0.463 1.427 4.918) 5.142 12.382 ( 8.902 -3.674 0.798) 9.664 12.549 ( 7.768 -4.341 -14.910) 17.364 12.791 ( 3.613 -0.180 2.124) 4.195 12.972 ( -3.400 -1.048 4.831) 6.000 13.115 ( 4.705 -3.799 -0.366) 6.058 13.668 ( 5.127 3.985 -0.381) 6.505 14.647 ( 10.270 -3.882 -4.774) 11.973 14.939 ( 3.684 -2.045 4.627) 6.258 17.222 ( -4.675 0.006 -1.970) 5.073 17.440 ( -1.931 0.183 1.898) 2.714 21.590 ( 11.807 5.373 -2.216) 13.160 21.794 ( 6.046 -10.562 2.869) 12.504 22.974 ( 5.090 -2.054 1.905) 5.810 23.374 ( 12.802 -5.392 -6.514) 15.343 23.739 ( 6.636 8.801 -0.381) 11.029 23.958 ( 0.155 4.080 1.407) 4.319 24.739 ( -23.951 6.063 3.508) 24.954 25.394 ( -10.096 -0.811 -0.485) 10.140 26.021 ( -4.571 2.092 4.441) 6.708 26.142 ( -3.706 -3.269 -4.675) 6.802 28.281 ( 10.547 -4.985 -4.609) 12.543 28.356 ( 4.743 -1.560 4.396) 6.652 ======================= Grid point 161 (72/117) ======================= q-point: ( 0.50 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.726 ( 3.792 0.000 8.470) 9.280 2.948 ( 0.603 0.000 7.368) 7.393 3.481 ( -0.523 -0.000 1.010) 1.137 3.627 ( 6.651 0.000 6.485) 9.289 3.818 ( -11.057 0.000 9.713) 14.717 4.010 ( -10.641 0.000 -12.443) 16.373 4.326 ( 6.389 0.000 -9.864) 11.752 4.461 ( -7.578 0.000 -11.668) 13.913 4.659 ( 2.694 0.000 7.649) 8.110 4.682 ( 6.262 0.000 -0.647) 6.295 4.772 ( -4.825 0.000 -1.768) 5.139 4.990 ( 0.639 0.000 -9.552) 9.573 5.069 ( 4.625 0.000 -15.185) 15.873 5.080 ( 9.237 -0.000 -4.853) 10.434 5.525 ( 9.676 0.000 10.738) 14.454 5.716 ( -6.915 0.000 10.823) 12.843 5.845 ( -4.245 0.000 8.170) 9.207 5.883 ( -6.283 -0.000 0.029) 6.283 6.188 ( -0.947 0.000 -2.308) 2.495 6.346 ( -3.441 -0.000 -4.722) 5.843 6.369 ( 6.105 0.000 -5.555) 8.254 6.452 ( 1.918 0.000 5.901) 6.205 6.481 ( -0.561 0.000 4.125) 4.163 6.641 ( 6.798 0.000 -11.247) 13.142 6.857 ( -8.275 0.000 4.449) 9.396 6.886 ( -8.551 0.000 4.057) 9.464 7.327 ( 8.836 0.000 -3.443) 9.483 7.350 ( 0.247 -0.000 -2.848) 2.858 7.403 ( 0.028 0.000 -0.285) 0.286 7.552 ( 1.454 0.000 -0.191) 1.466 7.689 ( -3.102 -0.000 1.103) 3.292 7.709 ( 0.742 0.000 10.131) 10.158 7.896 ( 6.149 0.000 -3.107) 6.890 8.145 ( -7.939 0.000 -5.156) 9.467 8.339 ( 2.036 0.000 3.951) 4.445 8.378 ( 6.687 0.000 0.017) 6.687 8.432 ( -4.792 0.000 9.147) 10.326 8.475 ( -1.458 0.000 2.915) 3.259 8.706 ( 1.939 0.000 2.356) 3.051 9.035 ( -2.226 0.000 6.637) 7.001 9.328 ( 3.366 0.000 -12.826) 13.260 9.592 ( 1.753 0.000 -16.383) 16.477 9.606 ( -5.020 0.000 10.566) 11.698 9.956 ( 2.317 0.000 -2.145) 3.157 10.552 ( 4.516 0.000 8.125) 9.295 11.040 ( -2.912 0.000 -7.868) 8.389 11.480 ( -17.709 0.000 3.514) 18.055 11.736 ( 4.391 0.000 -4.851) 6.543 11.857 ( 5.894 0.000 8.015) 9.948 12.120 ( -2.443 0.000 -4.016) 4.701 12.467 ( 3.492 0.000 0.573) 3.538 12.700 ( 3.862 0.000 1.571) 4.170 12.815 ( 8.536 -0.000 8.399) 11.975 12.898 ( -4.928 0.000 -4.335) 6.563 13.146 ( -8.059 0.000 -0.999) 8.121 13.379 ( 11.491 0.000 -8.976) 14.581 14.182 ( -18.949 0.000 14.153) 23.651 14.776 ( 11.187 0.000 -9.030) 14.376 17.333 ( 4.549 0.000 7.339) 8.635 17.778 ( -4.569 0.000 -8.901) 10.005 20.969 ( 1.675 0.000 1.605) 2.319 21.046 ( -1.599 0.000 -1.175) 1.984 22.753 ( 1.687 0.000 3.699) 4.066 22.957 ( -3.216 0.000 -3.474) 4.734 23.958 ( 2.312 0.000 4.533) 5.089 24.232 ( -1.054 0.000 -5.304) 5.408 25.359 ( -0.127 0.000 9.827) 9.828 25.770 ( -0.607 0.000 -3.879) 3.926 26.259 ( 3.783 0.000 -0.914) 3.892 26.347 ( -2.340 0.000 -5.188) 5.691 27.824 ( -3.720 0.000 3.798) 5.316 27.987 ( 2.861 0.000 -2.232) 3.629 ======================= Grid point 163 (73/117) ======================= q-point: (-0.40 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.717 ( 0.278 15.711 9.666) 18.449 3.019 ( 2.452 0.848 -2.143) 3.365 3.455 ( 4.161 12.913 10.410) 17.100 3.628 ( -6.120 -4.654 6.409) 10.009 3.710 ( -1.203 2.320 -5.117) 5.746 3.843 ( -6.302 -10.606 -8.443) 14.949 4.270 ( -7.284 1.739 -5.023) 9.017 4.424 ( 3.103 -0.819 -7.531) 8.186 4.553 ( -7.347 9.700 -1.906) 12.317 4.753 ( 0.634 -2.891 10.011) 10.440 4.791 ( 2.812 -3.747 4.173) 6.274 5.022 ( 1.770 1.978 -11.271) 11.580 5.152 ( 8.200 2.959 -16.348) 18.527 5.315 ( 7.632 -7.530 -8.099) 13.437 5.555 ( -16.187 3.188 1.032) 16.530 5.656 ( -3.592 -3.505 8.916) 10.231 5.729 ( 2.828 2.186 12.767) 13.258 5.850 ( 1.521 -8.071 8.235) 11.631 6.135 ( -7.469 -0.089 -6.846) 10.133 6.251 ( -0.492 3.447 -4.021) 5.319 6.415 ( 0.309 1.722 6.417) 6.652 6.436 ( -4.899 0.019 7.140) 8.659 6.587 ( 5.584 -2.239 -7.487) 9.605 6.634 ( -7.459 6.732 3.895) 10.776 6.718 ( -0.920 1.217 -1.437) 2.096 6.777 ( 3.840 -3.320 -4.811) 6.994 7.291 ( 2.469 14.850 0.554) 15.064 7.356 ( -0.262 9.750 0.993) 9.804 7.437 ( 3.398 9.719 1.224) 10.368 7.532 ( 6.153 10.397 -3.735) 12.645 7.744 ( 0.350 -11.496 2.475) 11.765 7.865 ( 12.812 -6.260 -0.276) 14.262 7.975 ( -6.728 0.221 -3.017) 7.377 8.091 ( 4.918 -13.675 -5.702) 15.610 8.364 ( -2.488 1.232 -0.903) 2.919 8.411 ( 0.626 0.124 5.505) 5.542 8.490 ( 9.774 -1.942 3.014) 10.411 8.591 ( 5.990 -6.319 1.920) 8.916 8.798 ( 5.431 -4.738 13.773) 15.544 9.117 ( 9.071 -3.401 -0.727) 9.715 9.383 ( 3.246 -0.636 -10.146) 10.671 9.570 ( -0.313 -0.488 6.160) 6.187 9.652 ( 5.671 -0.920 -17.412) 18.335 9.922 ( -7.675 -4.435 4.967) 10.161 10.679 ( 8.541 0.811 12.235) 14.943 10.782 ( -20.188 1.479 -0.993) 20.267 11.486 ( 12.917 -2.416 -1.388) 13.214 11.844 ( 6.147 -2.190 -2.533) 7.000 11.969 ( 3.993 0.147 -2.867) 4.918 12.001 ( -9.351 -0.588 -3.014) 9.843 12.539 ( 2.177 -0.864 2.640) 3.530 12.722 ( -9.733 0.695 -7.867) 12.534 12.761 ( 2.352 0.718 6.001) 6.485 12.902 ( -15.240 -1.806 -4.450) 15.979 13.091 ( 16.176 -1.419 7.713) 17.977 13.400 ( -12.525 1.106 2.578) 12.835 14.061 ( 7.713 -1.854 -1.118) 8.011 14.921 ( 5.135 1.282 -1.549) 5.515 17.406 ( 2.606 0.160 8.937) 9.310 17.620 ( -10.503 0.954 -10.349) 14.776 21.114 ( 13.442 0.796 2.289) 13.658 21.154 ( 12.155 -1.355 -2.158) 12.419 22.796 ( 2.724 0.494 5.108) 5.810 22.942 ( 2.003 -0.791 -5.030) 5.471 23.978 ( 1.474 3.902 5.129) 6.612 24.181 ( -2.099 3.105 -5.830) 6.931 25.325 ( -5.773 -2.044 8.965) 10.857 25.685 ( -9.090 -1.791 -3.677) 9.968 26.231 ( -3.538 3.505 -1.010) 5.081 26.310 ( -5.041 -4.429 -4.148) 7.889 27.832 ( 4.376 -0.143 1.096) 4.514 28.069 ( 5.685 -0.709 0.122) 5.730 ======================= Grid point 164 (74/117) ======================= q-point: (-0.30 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.414 ( -13.897 15.362 -0.411) 20.719 2.921 ( -8.207 4.521 -1.042) 9.428 3.447 ( -2.420 6.633 -2.077) 7.360 3.536 ( 1.795 2.215 -5.938) 6.587 3.690 ( -4.281 -3.124 9.326) 10.727 3.930 ( 1.140 -4.680 0.639) 4.859 4.201 ( -0.560 22.190 3.563) 22.482 4.343 ( 4.621 -0.367 -4.445) 6.422 4.527 ( 10.626 4.602 -4.584) 12.454 4.752 ( -8.313 -10.575 13.147) 18.809 4.884 ( 2.583 -3.049 1.759) 4.366 4.946 ( -2.980 1.063 -9.108) 9.642 5.177 ( -3.557 0.158 -8.803) 9.496 5.354 ( -3.221 -2.654 -1.783) 4.539 5.455 ( 3.256 -2.705 -8.506) 9.501 5.658 ( -1.848 -0.876 9.963) 10.171 5.717 ( -2.632 3.784 8.620) 9.775 5.864 ( -8.897 -4.953 -0.793) 10.213 5.969 ( -6.156 0.351 0.559) 6.191 6.208 ( -4.824 4.247 -5.451) 8.427 6.347 ( -9.524 -1.972 5.113) 10.988 6.367 ( 0.706 -2.671 6.765) 7.307 6.484 ( 0.744 2.097 7.367) 7.695 6.720 ( 7.332 2.910 -5.690) 9.726 6.849 ( 13.356 2.141 -2.757) 13.805 6.947 ( 10.760 4.631 -6.189) 13.249 7.157 ( -2.552 2.481 3.353) 4.890 7.242 ( 5.586 16.057 -1.020) 17.031 7.410 ( 3.177 4.842 -3.699) 6.871 7.599 ( 8.944 6.638 -1.470) 11.234 7.849 ( 3.379 -5.670 0.867) 6.657 7.904 ( -1.616 -1.612 -1.444) 2.701 8.192 ( 12.175 -7.825 -5.280) 15.406 8.267 ( 3.660 -1.964 -1.898) 4.567 8.342 ( -0.099 -6.188 -2.895) 6.833 8.410 ( -2.512 -5.965 0.840) 6.527 8.707 ( 10.577 1.125 2.487) 10.924 8.749 ( 9.073 -1.594 2.734) 9.609 8.998 ( 7.451 -8.216 15.155) 18.780 9.385 ( 15.245 -4.782 -10.727) 19.245 9.426 ( 0.746 -1.362 -9.383) 9.511 9.592 ( 3.145 2.903 2.382) 4.898 9.794 ( 4.964 -7.234 -4.857) 10.028 9.821 ( -6.661 -5.044 6.829) 10.791 10.421 ( -16.657 2.738 8.643) 18.964 10.827 ( 7.120 1.686 12.900) 14.831 11.678 ( -21.613 1.253 0.337) 21.652 11.813 ( 14.747 -4.305 -9.658) 18.146 11.962 ( 3.092 -0.799 -2.194) 3.875 12.060 ( 1.969 -0.520 -7.426) 7.700 12.451 ( -15.223 -2.185 -0.938) 15.408 12.486 ( -7.109 4.380 -7.074) 10.944 12.772 ( 0.214 -0.842 12.824) 12.853 12.831 ( 2.236 -5.726 -5.349) 8.148 13.077 ( -12.751 1.123 4.574) 13.593 13.475 ( 17.656 -2.310 6.830) 19.071 14.321 ( 15.427 -2.399 -8.913) 17.977 14.931 ( -1.586 1.780 3.901) 4.572 17.388 ( -7.224 2.411 -3.837) 8.528 17.459 ( -2.088 -0.690 2.909) 3.646 21.393 ( 16.424 0.070 1.240) 16.471 21.433 ( 14.779 -1.789 -1.461) 14.959 22.852 ( 3.661 0.071 5.422) 6.543 23.047 ( 8.240 -2.610 -6.035) 10.542 23.948 ( 1.115 7.176 4.348) 8.464 24.104 ( -1.614 4.281 -4.704) 6.561 25.186 ( -12.243 0.158 6.051) 13.658 25.497 ( -13.519 -4.329 -2.348) 14.388 26.129 ( -4.357 1.320 -0.120) 4.554 26.212 ( -8.125 -1.674 -2.779) 8.749 27.977 ( 10.119 -1.717 -1.976) 10.452 28.196 ( 6.830 -1.309 2.499) 7.389 ======================= Grid point 165 (75/117) ======================= q-point: (-0.20 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( -7.407 11.361 -6.661) 15.110 2.706 ( -7.063 10.210 2.098) 12.592 3.181 ( -18.555 -4.425 -3.957) 19.481 3.626 ( -17.804 -0.109 -0.551) 17.813 3.689 ( 15.934 14.341 8.642) 23.113 3.744 ( 1.673 5.291 -0.746) 5.599 4.065 ( -0.133 5.672 -3.761) 6.807 4.425 ( -1.213 -4.645 0.089) 4.801 4.686 ( -3.376 0.870 -4.047) 5.341 4.744 ( -3.355 -8.493 10.637) 14.020 4.938 ( 9.128 0.970 -4.673) 10.300 4.977 ( 3.085 -3.807 -0.165) 4.903 5.142 ( 4.673 6.862 -0.606) 8.324 5.318 ( -3.652 -2.156 -0.577) 4.280 5.498 ( -4.923 -4.205 -5.262) 8.343 5.567 ( 2.144 8.035 -0.561) 8.335 5.639 ( -6.221 -6.865 5.140) 10.595 5.797 ( -0.475 -0.996 5.330) 5.443 5.884 ( -3.039 4.191 5.914) 7.860 6.091 ( -5.162 -1.140 -7.777) 9.404 6.215 ( -7.105 -2.541 5.250) 9.192 6.410 ( 0.054 0.827 4.290) 4.369 6.524 ( 3.595 0.486 6.222) 7.202 6.778 ( -1.904 9.092 0.568) 9.307 6.857 ( 7.512 6.190 -5.964) 11.416 7.024 ( 6.457 9.410 -5.326) 12.594 7.279 ( 5.852 3.714 1.492) 7.090 7.320 ( 11.132 -3.484 -3.817) 12.273 7.531 ( 11.949 -3.253 -6.078) 13.795 7.727 ( 11.498 3.384 -0.159) 11.987 7.910 ( 0.787 -0.654 -3.331) 3.485 7.994 ( 6.595 -3.563 -5.578) 9.344 8.306 ( 3.066 -0.440 2.096) 3.740 8.391 ( -0.674 -5.209 0.030) 5.252 8.418 ( 7.457 -4.820 -3.515) 9.550 8.491 ( 2.397 -6.318 0.364) 6.767 8.859 ( 8.510 -0.291 -0.147) 8.516 8.949 ( 11.935 3.967 2.743) 12.873 9.234 ( 7.659 -11.266 7.819) 15.707 9.429 ( -1.389 -3.416 -5.784) 6.860 9.612 ( 0.666 1.441 2.296) 2.791 9.674 ( 8.323 2.315 -5.122) 10.043 9.744 ( -1.998 -8.580 2.963) 9.295 9.980 ( 4.723 -1.071 1.437) 5.052 10.192 ( -4.083 -1.334 7.409) 8.564 10.878 ( -1.857 2.249 4.322) 5.214 11.191 ( -27.243 2.805 5.100) 27.857 11.664 ( -27.245 2.543 -5.492) 27.909 11.955 ( -3.938 0.081 -2.998) 4.950 12.220 ( 3.497 5.063 2.095) 6.500 12.287 ( 5.989 -5.255 -6.434) 10.241 12.489 ( 7.787 -0.763 -6.871) 10.413 12.765 ( -0.956 -2.582 9.182) 9.586 12.945 ( -4.039 -1.676 4.105) 5.998 12.996 ( 6.803 -7.477 -4.087) 10.904 13.740 ( 9.579 2.796 1.026) 10.032 14.593 ( 12.220 -1.757 -7.260) 14.322 14.902 ( 0.274 -1.465 6.018) 6.200 17.238 ( -5.655 1.361 -3.778) 6.936 17.442 ( -1.673 -0.059 3.537) 3.914 21.635 ( 5.910 -5.104 -2.842) 8.310 21.690 ( 15.291 3.733 2.802) 15.988 22.932 ( 3.499 -1.986 4.427) 5.982 23.268 ( 11.744 -5.063 -6.663) 14.420 23.903 ( 2.102 7.562 2.791) 8.330 24.041 ( -0.627 4.239 -1.711) 4.614 24.865 ( -19.104 6.688 2.245) 20.364 25.327 ( -10.288 -5.740 -0.649) 11.799 26.052 ( -4.373 0.958 5.399) 7.013 26.091 ( -4.807 -1.840 -6.160) 8.028 28.196 ( 10.709 -3.551 -3.576) 11.836 28.330 ( 6.009 -1.091 3.738) 7.160 ======================= Grid point 166 (76/117) ======================= q-point: (-0.10 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( 5.513 8.759 -2.556) 10.661 2.509 ( -0.629 12.095 1.646) 12.223 2.950 ( -11.544 -4.753 0.138) 12.485 3.212 ( -19.146 3.400 1.388) 19.495 3.767 ( -3.007 -3.011 -5.559) 7.001 3.913 ( 11.852 0.417 -2.100) 12.044 3.988 ( 2.311 10.996 1.163) 11.297 4.461 ( -9.994 4.526 -3.849) 11.627 4.482 ( 3.431 -3.900 -1.960) 5.552 4.741 ( -7.398 -12.658 11.014) 18.338 5.026 ( -2.352 -0.933 -0.928) 2.695 5.115 ( 6.037 3.745 1.931) 7.362 5.163 ( 4.284 4.849 -2.953) 7.113 5.278 ( -3.874 -5.773 3.833) 7.939 5.404 ( -0.265 3.808 -4.723) 6.072 5.633 ( 3.508 -3.326 5.628) 7.419 5.663 ( 0.739 -4.684 -2.957) 5.588 5.775 ( -0.244 8.862 9.720) 13.155 5.869 ( 2.609 -6.244 2.282) 7.141 5.981 ( -6.458 2.230 -6.974) 9.763 6.153 ( -4.423 -5.024 4.752) 8.209 6.371 ( -0.706 3.009 4.308) 5.302 6.566 ( 1.276 6.215 4.774) 7.940 6.675 ( 0.648 1.211 -2.409) 2.773 6.848 ( -3.464 3.819 -5.165) 7.298 7.152 ( 11.727 5.839 -1.547) 13.191 7.299 ( 5.450 4.854 -1.679) 7.489 7.539 ( 6.472 -3.898 -4.921) 9.016 7.740 ( 7.358 -3.847 -7.675) 11.307 7.910 ( 6.204 0.820 1.783) 6.507 7.923 ( 1.077 0.428 -7.657) 7.744 8.099 ( 4.166 -0.794 -9.040) 9.985 8.407 ( 2.606 -3.671 0.361) 4.516 8.450 ( 3.722 -3.978 6.544) 8.514 8.578 ( 4.905 -0.764 -0.729) 5.017 8.612 ( 7.194 -4.953 1.839) 8.926 9.049 ( 12.294 3.834 4.532) 13.652 9.084 ( 11.582 5.414 -2.002) 12.941 9.438 ( -1.267 -3.688 2.267) 4.510 9.452 ( -7.677 -6.876 2.471) 10.598 9.553 ( -0.489 -10.788 -5.686) 12.205 9.660 ( 1.937 3.603 6.812) 7.946 9.875 ( 3.338 2.401 -0.630) 4.160 9.964 ( 0.991 1.856 7.549) 7.837 10.345 ( 5.384 -5.838 -1.899) 8.165 10.603 ( -14.040 2.901 -8.059) 16.446 10.876 ( -9.123 1.494 7.675) 12.015 11.090 ( -31.042 1.726 -2.495) 31.190 11.825 ( -4.837 4.465 0.829) 6.635 12.152 ( -1.626 3.666 7.716) 8.696 12.499 ( 5.969 -2.890 2.628) 7.134 12.670 ( 8.036 -1.982 -10.009) 12.988 12.822 ( 2.372 -4.134 -2.246) 5.269 12.926 ( 0.660 -3.137 3.834) 4.998 13.177 ( 6.224 -4.132 -0.812) 7.515 13.754 ( -1.392 6.573 -2.565) 7.192 14.769 ( 5.953 -1.102 -0.797) 6.106 14.984 ( 4.080 -3.231 1.563) 5.434 17.162 ( -1.608 0.092 -0.196) 1.623 17.402 ( -2.563 0.430 0.502) 2.647 21.722 ( 0.716 -2.544 -3.511) 4.395 21.887 ( 8.993 2.343 4.283) 10.233 23.026 ( 3.973 -3.659 0.232) 5.406 23.507 ( 7.977 -5.318 -5.250) 10.931 23.898 ( 2.833 3.091 3.233) 5.295 23.985 ( -2.490 3.119 3.209) 5.121 24.449 ( -14.701 10.371 -2.424) 18.154 25.232 ( -5.207 -3.481 -0.908) 6.329 25.959 ( -3.942 1.495 3.937) 5.769 26.074 ( -0.481 -2.741 -3.110) 4.174 28.394 ( 6.816 -3.092 -2.921) 8.034 28.423 ( 3.321 -0.476 3.025) 4.517 ======================= Grid point 173 (77/117) ======================= q-point: ( 0.60 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.601 ( -18.864 -0.000 2.360) 19.011 2.954 ( -8.443 -0.000 -4.508) 9.571 3.458 ( -0.074 -0.000 3.201) 3.202 3.495 ( -16.594 -0.000 -10.656) 19.721 3.669 ( 1.994 0.000 3.601) 4.116 4.003 ( 17.735 0.000 10.424) 20.571 4.290 ( 5.930 0.000 -0.556) 5.956 4.496 ( -4.853 -0.000 0.605) 4.890 4.529 ( 7.248 0.000 -2.051) 7.532 4.705 ( -10.707 -0.000 3.203) 11.176 4.777 ( 1.449 0.000 12.781) 12.863 4.946 ( -6.028 -0.000 -8.080) 10.080 5.212 ( -0.437 -0.000 -18.403) 18.408 5.300 ( -3.391 -0.000 -13.652) 14.067 5.416 ( 5.366 0.000 -9.020) 10.495 5.646 ( 0.549 0.000 12.408) 12.421 5.778 ( -4.932 -0.000 3.362) 5.969 5.797 ( -1.643 -0.000 13.568) 13.668 5.967 ( -8.717 -0.000 -2.363) 9.032 6.296 ( -7.118 -0.000 -3.707) 8.026 6.306 ( -12.191 -0.000 3.637) 12.722 6.335 ( 4.238 0.000 8.208) 9.238 6.433 ( -5.701 -0.000 5.460) 7.894 6.741 ( 5.264 0.000 -5.949) 7.943 6.875 ( 17.348 0.000 -0.145) 17.348 6.969 ( 15.662 0.000 -6.295) 16.879 7.263 ( -7.571 -0.000 10.796) 13.186 7.470 ( 2.760 0.000 -5.098) 5.797 7.587 ( -0.362 -0.000 -0.178) 0.403 7.640 ( 4.559 0.000 1.830) 4.913 7.760 ( 8.285 0.000 1.411) 8.404 7.884 ( -1.475 -0.000 -2.603) 2.992 8.066 ( 11.598 0.000 -12.594) 17.121 8.143 ( 10.419 0.000 -1.469) 10.522 8.299 ( -3.164 -0.000 -6.056) 6.833 8.353 ( -3.808 -0.000 2.103) 4.350 8.714 ( 8.625 0.000 -1.851) 8.822 8.748 ( 13.735 0.000 6.168) 15.056 8.927 ( 9.664 0.000 17.440) 19.939 9.332 ( 16.174 0.000 -10.103) 19.070 9.413 ( 0.418 0.000 -10.850) 10.858 9.638 ( 6.880 0.000 8.839) 11.201 9.682 ( -4.895 -0.000 0.378) 4.909 9.791 ( 1.162 0.000 -5.015) 5.148 10.450 ( -16.818 -0.000 10.250) 19.695 10.847 ( 7.416 0.000 12.627) 14.643 11.692 ( -22.094 -0.000 0.008) 22.094 11.763 ( 17.148 0.000 -8.460) 19.121 11.949 ( 5.584 0.000 -2.127) 5.975 12.059 ( 0.770 0.000 -8.973) 9.005 12.430 ( -15.258 -0.000 0.228) 15.260 12.544 ( -7.032 -0.000 -7.947) 10.611 12.720 ( 2.967 0.000 -5.285) 6.061 12.799 ( -0.901 -0.000 10.793) 10.831 13.091 ( -16.567 -0.000 5.594) 17.486 13.448 ( 20.325 0.000 8.280) 21.946 14.298 ( 16.087 0.000 -9.186) 18.525 14.950 ( -2.293 -0.000 3.645) 4.307 17.422 ( -10.070 -0.000 -9.318) 13.719 17.442 ( 0.461 0.000 8.389) 8.402 21.383 ( 12.854 0.000 -3.661) 13.365 21.428 ( 18.647 0.000 3.743) 19.019 22.855 ( 2.800 0.000 6.230) 6.831 23.020 ( 7.678 0.000 -6.842) 10.284 24.021 ( 0.685 0.000 5.175) 5.220 24.149 ( -2.217 -0.000 -6.095) 6.486 25.188 ( -8.742 -0.000 7.868) 11.761 25.448 ( -15.081 -0.000 -3.926) 15.584 26.153 ( -6.030 -0.000 -7.313) 9.479 26.184 ( -6.217 -0.000 4.248) 7.530 27.960 ( 9.383 0.000 -1.475) 9.498 28.183 ( 7.040 0.000 2.139) 7.358 ======================= Grid point 175 (78/117) ======================= q-point: (-0.30 0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -12.488 6.429 -0.882) 14.073 2.798 ( -6.591 0.816 -1.826) 6.888 3.144 ( -19.821 0.331 -2.128) 19.938 3.477 ( -4.291 -7.598 -2.162) 8.990 3.726 ( 3.012 -0.407 -2.993) 4.265 4.073 ( -9.228 17.841 4.311) 20.543 4.303 ( -2.653 -0.261 2.105) 3.397 4.333 ( -1.673 1.847 2.905) 3.828 4.477 ( -4.513 -4.184 10.597) 12.254 4.739 ( -1.313 -0.336 2.351) 2.714 4.843 ( 5.035 -8.191 3.454) 10.216 5.039 ( 11.165 3.442 -6.166) 13.211 5.187 ( -4.957 -4.090 -10.268) 12.114 5.251 ( 2.657 0.258 -13.488) 13.750 5.497 ( 4.374 2.252 -9.404) 10.613 5.581 ( -6.857 1.105 2.344) 7.330 5.678 ( -5.864 3.373 8.018) 10.491 5.750 ( -2.464 -3.455 9.473) 10.380 5.927 ( 2.330 -0.342 4.457) 5.041 6.110 ( -7.083 2.591 -4.219) 8.642 6.156 ( -7.165 -2.395 4.662) 8.877 6.369 ( -0.344 -0.871 0.473) 1.049 6.471 ( 3.585 -5.192 4.912) 7.996 6.831 ( 3.816 -0.287 -3.977) 5.519 7.086 ( -3.058 9.689 6.260) 11.934 7.209 ( 13.726 -0.147 0.897) 13.756 7.251 ( 14.412 2.265 -3.052) 14.905 7.469 ( 1.717 14.646 1.104) 14.787 7.515 ( 6.273 1.717 -3.563) 7.416 7.796 ( 7.249 -2.121 -1.151) 7.640 7.910 ( 3.832 0.367 -3.273) 5.053 7.929 ( 10.999 0.215 -1.355) 11.084 8.216 ( -3.876 -8.514 -4.136) 10.228 8.282 ( 5.655 -4.794 -8.518) 11.293 8.312 ( -1.141 -3.654 2.475) 4.558 8.380 ( 9.697 -2.179 -1.434) 10.042 8.875 ( 10.614 1.147 -3.020) 11.094 8.976 ( 11.349 -2.005 2.846) 11.871 9.130 ( 10.851 0.648 9.405) 14.375 9.381 ( -3.236 -1.731 -4.945) 6.158 9.559 ( -8.245 -3.284 3.923) 9.703 9.626 ( 12.038 -2.868 -8.737) 15.148 9.785 ( 10.860 5.916 3.737) 12.920 9.917 ( 9.415 -4.217 -3.010) 10.746 10.208 ( -9.941 1.206 15.556) 18.501 10.910 ( -2.406 0.915 2.988) 3.944 11.227 ( -26.912 0.947 4.607) 27.320 11.699 ( -28.427 0.946 -4.609) 28.814 11.981 ( 0.218 2.482 -2.969) 3.876 12.133 ( 13.155 -6.049 -9.196) 17.153 12.355 ( 3.818 4.325 -7.296) 9.301 12.507 ( 5.767 1.614 0.116) 5.989 12.707 ( -8.598 -2.471 16.799) 19.033 12.858 ( 7.785 -4.939 -4.438) 10.232 12.924 ( -3.627 -0.751 0.185) 3.708 13.771 ( 13.440 0.637 2.442) 13.675 14.573 ( 14.275 -0.414 -9.033) 16.899 14.886 ( -3.443 -0.287 6.800) 7.628 17.262 ( -6.265 0.866 -5.836) 8.606 17.439 ( -1.484 -0.164 5.480) 5.680 21.568 ( 6.771 -1.659 -4.227) 8.152 21.746 ( 16.106 1.553 4.707) 16.851 22.906 ( 2.176 -0.634 5.139) 5.617 23.194 ( 10.227 -2.185 -6.914) 12.537 24.012 ( -0.187 3.223 4.741) 5.736 24.103 ( -1.474 1.714 -4.239) 4.804 24.995 ( -11.741 6.217 3.511) 13.741 25.196 ( -13.318 -6.627 -2.548) 15.092 26.057 ( -3.587 -0.138 -4.043) 5.406 26.074 ( -6.116 -0.166 3.325) 6.964 28.149 ( 10.544 -1.257 -3.066) 11.053 28.315 ( 6.753 -0.391 3.419) 7.580 ======================= Grid point 176 (79/117) ======================= q-point: (-0.20 0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( -2.166 4.287 2.384) 5.362 2.688 ( -4.578 4.360 -2.824) 6.924 2.836 ( -13.691 -3.545 0.380) 14.147 3.324 ( -14.078 4.673 2.588) 15.057 3.691 ( -8.097 -0.762 -4.507) 9.298 3.871 ( 1.728 -0.217 -1.664) 2.409 4.242 ( -8.325 -1.877 0.106) 8.535 4.367 ( 1.528 -9.891 -0.956) 10.054 4.444 ( 0.335 4.308 12.298) 13.035 4.609 ( -2.180 6.283 -3.423) 7.480 4.980 ( -1.246 -1.930 -0.738) 2.413 5.114 ( -5.800 -7.631 -0.239) 9.588 5.170 ( 5.108 1.816 0.669) 5.462 5.350 ( 6.802 1.030 -9.844) 12.010 5.469 ( -4.701 -4.385 2.218) 6.801 5.498 ( 0.726 4.918 -6.082) 7.855 5.639 ( 3.547 1.088 -1.233) 3.910 5.768 ( -2.320 -5.653 9.914) 11.646 5.893 ( -4.360 2.131 8.307) 9.621 6.026 ( -0.548 2.092 -5.496) 5.906 6.095 ( -1.665 0.939 3.233) 3.756 6.402 ( 1.966 -0.674 -1.653) 2.656 6.586 ( 3.846 -3.865 2.402) 5.958 6.760 ( -8.505 4.305 6.200) 11.371 6.995 ( 1.699 11.008 -3.870) 11.791 7.331 ( 2.669 9.517 1.967) 10.078 7.383 ( 9.076 5.051 -0.677) 10.409 7.501 ( 9.523 0.108 -1.014) 9.577 7.664 ( 6.896 -2.368 -5.131) 8.916 7.928 ( 0.683 1.640 -5.202) 5.497 7.978 ( 11.532 3.577 -2.312) 12.294 8.100 ( 5.064 0.724 -8.604) 10.010 8.260 ( 0.718 -11.447 2.098) 11.659 8.337 ( 1.164 -5.277 3.992) 6.718 8.463 ( 4.462 -8.938 -0.382) 9.997 8.560 ( 9.115 -1.040 -0.756) 9.205 9.094 ( 15.032 1.349 -1.857) 15.206 9.171 ( 4.772 0.375 1.022) 4.895 9.308 ( 7.157 -4.645 -2.304) 8.837 9.348 ( -4.367 -3.499 2.442) 6.105 9.467 ( 0.873 -0.860 -4.060) 4.241 9.712 ( -2.854 1.286 6.774) 7.462 9.948 ( 10.866 5.541 0.177) 12.199 10.035 ( -0.631 4.049 10.023) 10.829 10.223 ( 9.498 -6.553 1.164) 11.598 10.648 ( -17.418 1.637 -11.536) 20.956 10.899 ( -10.737 0.872 8.935) 13.996 11.117 ( -32.226 0.913 -1.808) 32.290 11.920 ( -1.829 5.087 0.840) 5.471 12.273 ( -2.217 7.224 1.588) 7.721 12.408 ( 7.061 -4.964 -3.320) 9.247 12.666 ( 8.610 1.703 1.609) 8.923 12.700 ( 2.886 -8.181 -0.832) 8.715 12.881 ( -2.285 -1.502 6.091) 6.676 13.067 ( 8.523 -6.215 -4.922) 11.640 13.869 ( 0.210 4.530 -3.041) 5.460 14.773 ( 7.759 1.397 -1.996) 8.132 14.910 ( 3.880 -4.043 2.804) 6.266 17.176 ( -1.960 1.011 -1.586) 2.717 17.405 ( -2.396 -0.052 1.835) 3.018 21.657 ( 1.563 -2.656 -4.725) 5.641 21.963 ( 10.043 3.658 6.332) 12.423 22.962 ( 2.481 -2.501 1.429) 3.802 23.393 ( 7.690 -5.344 -5.896) 11.066 23.965 ( -1.678 3.290 4.513) 5.832 24.042 ( -4.148 2.286 0.348) 4.749 24.676 ( -10.649 12.371 -2.491) 16.512 25.112 ( -5.250 -8.588 -1.017) 10.117 25.981 ( -3.788 0.816 5.238) 6.515 26.030 ( -0.315 -1.667 -4.130) 4.465 28.340 ( 8.633 -2.073 -3.428) 9.517 28.421 ( 4.009 -0.018 3.628) 5.407 ======================= Grid point 177 (80/117) ======================= q-point: (-0.10 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( -2.230 -1.718 11.321) 11.665 2.587 ( 0.587 2.282 -10.675) 10.932 2.651 ( -16.891 -8.103 -6.511) 19.833 3.115 ( 4.052 11.307 7.268) 14.039 3.484 ( -15.693 -3.822 1.639) 16.234 3.999 ( 8.968 -0.847 -0.669) 9.033 4.141 ( -6.949 -11.472 0.981) 13.449 4.334 ( -11.582 -4.811 -5.262) 13.601 4.479 ( 6.731 1.936 -1.714) 7.211 4.714 ( 12.744 2.224 0.241) 12.939 4.933 ( -3.840 -1.400 1.132) 4.241 5.093 ( -4.143 -4.658 5.737) 8.471 5.143 ( -2.984 1.387 4.540) 5.607 5.319 ( -1.118 6.162 -2.696) 6.818 5.480 ( 2.451 3.708 -3.301) 5.537 5.594 ( 0.235 -7.274 -4.893) 8.769 5.699 ( 5.481 -0.566 2.469) 6.038 5.767 ( -3.505 -7.773 9.238) 12.572 5.885 ( 2.751 -0.776 0.297) 2.873 5.971 ( -0.451 4.940 -3.973) 6.355 6.069 ( -0.941 0.072 2.067) 2.272 6.418 ( 2.074 4.515 1.747) 5.267 6.552 ( -9.946 1.630 2.712) 10.437 6.683 ( 2.962 -1.346 -0.461) 3.286 6.869 ( -2.240 11.012 -2.936) 11.614 7.237 ( -5.628 4.492 1.808) 7.425 7.495 ( 8.522 4.650 -0.104) 9.708 7.655 ( 7.102 1.110 -4.360) 8.407 7.767 ( 2.189 -1.981 -5.551) 6.288 7.887 ( -3.541 0.235 -4.552) 5.772 7.993 ( -2.519 3.848 -2.348) 5.164 8.158 ( 0.542 2.033 -9.494) 9.724 8.390 ( 1.375 -6.342 1.799) 6.734 8.447 ( 2.768 -6.502 3.958) 8.100 8.565 ( -1.795 -6.407 3.863) 7.694 8.769 ( 9.918 -1.776 -1.171) 10.144 9.048 ( -16.153 -6.512 1.422) 17.474 9.287 ( 6.207 2.600 6.159) 9.122 9.306 ( -13.727 -4.437 -0.871) 14.452 9.464 ( 15.114 5.050 -1.554) 16.012 9.581 ( 9.378 3.154 -2.207) 10.137 9.685 ( 3.480 -2.325 -0.011) 4.185 9.963 ( -2.716 6.665 2.499) 7.619 10.068 ( 9.921 2.232 1.748) 10.318 10.293 ( -8.656 1.796 5.495) 10.409 10.640 ( -3.294 -1.528 -4.495) 5.779 10.662 ( 6.041 -1.982 -1.715) 6.585 10.713 ( -7.374 -0.140 -0.466) 7.390 11.841 ( -0.233 5.905 2.023) 6.246 12.154 ( -3.938 5.636 9.968) 12.110 12.494 ( -2.571 -5.487 -2.685) 6.628 12.715 ( -2.060 0.351 -0.898) 2.275 12.851 ( 4.746 -5.023 -3.504) 7.748 12.960 ( 7.897 -3.260 2.925) 9.030 13.250 ( 5.996 -3.857 -2.704) 7.625 13.740 ( -6.587 6.275 -3.508) 9.750 14.826 ( -0.335 1.784 1.559) 2.392 15.029 ( 3.827 -2.354 -0.904) 4.583 17.173 ( 2.452 0.446 1.597) 2.961 17.363 ( -1.984 0.400 -1.069) 2.289 21.680 ( -1.282 -2.596 -4.833) 5.633 22.041 ( 2.544 4.758 7.524) 9.258 23.058 ( 4.587 -4.607 -3.416) 7.344 23.552 ( 3.766 -6.169 -4.981) 8.778 23.851 ( -14.093 3.171 6.011) 15.646 23.907 ( -3.495 -0.067 3.952) 5.277 24.473 ( 3.328 12.189 -5.161) 13.648 25.151 ( 1.614 -5.892 -1.292) 6.244 25.928 ( -1.325 1.540 4.713) 5.133 26.063 ( 1.977 -1.968 -2.805) 3.956 28.445 ( -0.739 1.083 2.099) 2.475 28.482 ( 4.548 -1.264 -1.987) 5.122 ======================= Grid point 185 (81/117) ======================= q-point: (-0.30 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.119 ( -6.716 -0.000 6.799) 9.557 2.693 ( -6.574 -0.000 -8.212) 10.519 2.835 ( -13.933 -0.000 2.730) 14.197 3.345 ( -5.879 -0.000 3.264) 6.724 3.719 ( -5.572 -0.000 -5.366) 7.736 3.892 ( -8.595 -0.000 -0.055) 8.595 4.149 ( -15.435 -0.000 8.792) 17.763 4.246 ( 2.580 0.000 -4.551) 5.232 4.500 ( -7.823 -0.000 1.517) 7.969 4.826 ( 3.212 0.000 -1.873) 3.718 4.914 ( 15.948 0.000 10.702) 19.206 4.990 ( -8.065 -0.000 -8.508) 11.723 5.177 ( 4.274 0.000 -2.000) 4.719 5.280 ( -2.215 -0.000 -10.253) 10.490 5.512 ( -6.660 -0.000 0.983) 6.732 5.535 ( 0.920 0.000 -4.193) 4.293 5.671 ( 5.622 0.000 -2.357) 6.096 5.691 ( -3.483 -0.000 10.376) 10.945 5.902 ( -8.599 -0.000 10.584) 13.637 6.055 ( 2.442 0.000 -4.325) 4.966 6.127 ( 1.060 0.000 1.497) 1.835 6.389 ( 3.543 0.000 -8.692) 9.386 6.520 ( 3.917 0.000 5.215) 6.522 6.802 ( -7.378 -0.000 6.669) 9.946 7.107 ( 2.292 0.000 -2.779) 3.603 7.414 ( 3.273 0.000 2.375) 4.044 7.471 ( 10.376 0.000 2.815) 10.752 7.521 ( 0.005 0.000 -1.733) 1.733 7.678 ( 8.802 0.000 -3.844) 9.605 7.956 ( 9.834 0.000 -2.741) 10.209 8.013 ( 5.861 0.000 -0.812) 5.917 8.085 ( -1.822 -0.000 -7.582) 7.798 8.131 ( 7.458 0.000 0.071) 7.459 8.289 ( 2.126 0.000 5.909) 6.280 8.330 ( 2.107 0.000 -4.946) 5.377 8.550 ( 9.985 0.000 1.023) 10.037 9.099 ( 10.836 0.000 -2.027) 11.024 9.170 ( 11.899 0.000 -7.180) 13.897 9.237 ( -10.098 -0.000 2.380) 10.375 9.347 ( 10.442 0.000 1.222) 10.513 9.459 ( 2.432 0.000 -3.938) 4.629 9.720 ( -1.800 -0.000 5.661) 5.940 10.052 ( 9.081 0.000 1.657) 9.231 10.085 ( 13.208 0.000 -2.886) 13.520 10.111 ( -1.135 -0.000 16.684) 16.722 10.664 ( -18.332 -0.000 -13.289) 22.642 10.908 ( -10.986 -0.000 9.680) 14.642 11.125 ( -32.594 -0.000 -1.414) 32.625 11.988 ( -0.348 -0.000 2.232) 2.259 12.281 ( 6.061 0.000 -14.388) 15.613 12.487 ( -9.930 -0.000 17.283) 19.932 12.528 ( 9.822 0.000 -9.262) 13.500 12.702 ( 10.494 0.000 7.357) 12.816 12.866 ( -2.997 -0.000 5.419) 6.193 12.990 ( 9.348 0.000 -8.286) 12.492 13.914 ( 1.296 0.000 -3.121) 3.379 14.804 ( 11.672 0.000 -6.869) 13.543 14.853 ( 0.077 0.000 7.604) 7.604 17.188 ( -1.958 -0.000 -2.467) 3.149 17.404 ( -2.443 -0.000 2.685) 3.630 21.632 ( 2.050 0.000 -5.740) 6.095 22.001 ( 10.235 0.000 8.270) 13.159 22.937 ( 1.889 0.000 1.423) 2.365 23.335 ( 6.817 0.000 -6.217) 9.226 24.002 ( -3.333 -0.000 6.226) 7.062 24.063 ( -4.212 -0.000 -2.257) 4.779 24.900 ( -10.454 -0.000 -6.331) 12.221 24.924 ( -3.590 -0.000 2.820) 4.565 25.990 ( -3.666 -0.000 6.795) 7.721 26.013 ( -0.424 -0.000 -5.429) 5.446 28.320 ( 9.113 0.000 -3.521) 9.770 28.421 ( 4.424 0.000 3.758) 5.805 ======================= Grid point 186 (82/117) ======================= q-point: (-0.20 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( -6.080 -0.797 18.362) 19.359 2.479 ( -19.497 -4.998 -24.843) 31.973 2.666 ( -2.717 2.033 -4.291) 5.471 3.255 ( -3.210 2.276 16.333) 16.801 3.553 ( -7.169 7.607 6.314) 12.212 3.844 ( -18.826 -7.369 10.044) 22.574 3.975 ( 12.806 -3.610 -0.120) 13.306 4.217 ( -13.770 -9.268 -20.947) 26.726 4.468 ( 8.340 0.121 3.194) 8.931 4.829 ( 3.549 5.462 -3.849) 7.567 4.921 ( 0.037 -1.912 -5.828) 6.134 5.107 ( 0.008 7.765 0.255) 7.769 5.194 ( 2.169 3.186 5.539) 6.748 5.382 ( 5.787 -9.579 -0.284) 11.196 5.392 ( -2.617 -1.004 -0.613) 2.870 5.542 ( -4.584 0.100 2.452) 5.200 5.625 ( -1.515 -2.569 5.869) 6.583 5.746 ( 4.201 1.932 -6.586) 8.047 5.840 ( 1.003 -2.451 8.088) 8.511 6.028 ( -3.344 1.665 -2.164) 4.316 6.120 ( -1.022 2.645 0.847) 2.959 6.422 ( -3.530 -1.863 -10.479) 11.213 6.588 ( 0.479 0.399 3.779) 3.830 6.681 ( -0.069 1.279 6.561) 6.685 7.093 ( -0.953 7.615 -6.260) 9.904 7.322 ( -6.818 3.698 2.478) 8.143 7.565 ( 4.035 1.801 -0.526) 4.450 7.637 ( 5.517 -1.990 4.370) 7.314 7.808 ( 8.744 4.933 -6.641) 12.037 7.912 ( -5.715 0.710 -4.640) 7.396 8.079 ( -0.985 5.246 4.969) 7.292 8.171 ( 1.451 -0.032 -6.541) 6.700 8.227 ( 4.280 -7.161 -3.310) 8.976 8.357 ( 3.991 -2.584 2.349) 5.303 8.402 ( -1.211 -8.784 5.740) 10.563 8.732 ( 6.291 -1.435 0.939) 6.520 8.953 ( -14.339 -2.631 -3.219) 14.930 9.247 ( -9.979 -1.466 -3.590) 10.706 9.310 ( 6.006 0.393 4.765) 7.677 9.491 ( 10.064 -0.455 -7.481) 12.549 9.630 ( 12.571 1.397 -1.301) 12.715 9.715 ( 8.000 2.368 2.736) 8.780 10.097 ( -1.722 5.398 0.382) 5.679 10.112 ( 4.007 2.442 4.215) 6.307 10.278 ( -2.346 -2.880 9.898) 10.571 10.588 ( 8.428 -2.054 -8.784) 12.345 10.645 ( -10.116 -0.381 -2.489) 10.425 10.737 ( -6.633 1.372 5.165) 8.518 11.958 ( -0.689 4.910 4.612) 6.772 12.275 ( -4.312 5.017 1.324) 6.747 12.367 ( -4.258 -5.538 -0.978) 7.054 12.703 ( 4.488 -2.371 -5.869) 7.759 12.756 ( -2.743 -2.295 1.399) 3.841 12.955 ( 11.330 1.570 11.457) 16.189 13.161 ( 7.396 -4.004 -7.641) 11.363 13.833 ( -7.119 2.692 -4.657) 8.922 14.860 ( 0.224 1.372 3.552) 3.814 14.983 ( 6.537 -1.818 -2.858) 7.363 17.189 ( 2.441 0.780 0.961) 2.737 17.363 ( -1.978 -0.191 -0.417) 2.030 21.645 ( -0.310 -0.891 -7.040) 7.102 22.112 ( 2.280 2.101 12.329) 12.713 22.994 ( 4.034 -1.662 -3.755) 5.756 23.437 ( 3.159 -3.991 -5.876) 7.774 23.904 ( -8.845 1.225 7.114) 11.417 23.920 ( -9.573 1.084 0.081) 9.635 24.726 ( 1.947 12.616 -4.992) 13.707 24.990 ( 2.130 -10.021 -0.723) 10.270 25.949 ( -1.218 0.542 6.731) 6.862 26.034 ( 2.425 -0.848 -4.174) 4.901 28.459 ( 2.584 0.341 0.266) 2.620 28.465 ( 3.585 -0.396 -0.152) 3.610 ======================= Grid point 187 (83/117) ======================= q-point: (-0.10 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( -14.270 -1.329 0.488) 14.340 2.171 ( -14.506 -13.199 -7.407) 20.965 2.711 ( 8.559 0.515 -10.911) 13.877 3.136 ( -13.614 -0.731 16.488) 21.395 3.392 ( 1.164 4.933 10.344) 11.519 3.685 ( -14.753 -17.202 3.315) 22.903 4.054 ( -10.064 -14.378 -16.114) 23.826 4.357 ( 23.152 3.884 3.879) 23.794 4.634 ( 7.861 0.585 4.380) 9.018 4.824 ( 0.808 5.602 -4.483) 7.221 4.906 ( -11.423 -1.371 -1.829) 11.650 5.012 ( 6.317 1.798 -4.455) 7.937 5.246 ( 2.931 5.624 9.444) 11.376 5.260 ( -6.533 2.315 1.692) 7.134 5.431 ( -7.185 -3.566 5.676) 9.826 5.532 ( -0.100 -4.855 -1.326) 5.034 5.648 ( -1.808 -2.289 4.377) 5.260 5.811 ( 2.923 -2.881 -6.417) 7.617 5.974 ( 4.648 -1.731 -2.416) 5.517 5.993 ( 6.626 1.482 -1.972) 7.071 6.059 ( -1.916 0.306 2.191) 2.927 6.290 ( -9.203 -3.568 -7.092) 12.154 6.579 ( 3.884 7.450 3.488) 9.097 6.738 ( 3.165 1.441 -2.465) 4.263 6.935 ( -3.110 12.599 -2.218) 13.165 7.155 ( -7.578 4.399 -1.295) 8.857 7.613 ( 1.293 -1.013 -1.097) 1.975 7.672 ( -3.551 1.610 5.084) 6.407 7.780 ( -8.108 -0.841 -1.933) 8.378 7.890 ( 4.189 6.722 -5.116) 9.429 7.969 ( -1.937 4.552 0.320) 4.957 8.122 ( -4.017 1.250 -9.006) 9.940 8.306 ( -3.229 -5.802 -1.340) 6.774 8.420 ( -8.203 -5.487 3.865) 10.599 8.464 ( 0.767 -5.117 3.406) 6.194 8.585 ( -14.177 -5.430 4.705) 15.894 8.832 ( -5.944 -6.874 -3.545) 9.754 9.180 ( 4.121 1.352 0.748) 4.401 9.388 ( 1.482 0.785 2.527) 3.033 9.572 ( -6.355 -1.725 -5.301) 8.454 9.710 ( 0.914 5.436 6.195) 8.293 9.878 ( -14.026 5.537 2.472) 15.281 9.898 ( 7.733 2.007 -4.855) 9.349 10.055 ( -1.323 2.589 1.703) 3.370 10.364 ( 18.691 0.935 3.487) 19.037 10.613 ( 0.089 2.232 -3.585) 4.224 10.832 ( 14.494 -0.929 5.632) 15.578 10.949 ( 25.867 -3.280 -0.121) 26.075 11.915 ( 2.505 4.505 -0.081) 5.155 12.128 ( -6.463 6.240 9.904) 13.372 12.332 ( -6.692 -7.026 -6.295) 11.566 12.648 ( -4.312 -0.310 -0.124) 4.325 12.843 ( 1.173 -6.109 -5.879) 8.559 13.120 ( 7.404 2.519 4.304) 8.927 13.302 ( 3.933 -3.808 -1.051) 5.575 13.649 ( -8.229 4.069 -3.465) 9.812 14.797 ( -5.328 3.311 -0.028) 6.273 15.061 ( 0.627 -0.575 0.071) 0.854 17.252 ( 4.957 0.947 2.258) 5.529 17.342 ( -0.335 -0.015 -1.871) 1.901 21.627 ( -2.212 -0.884 -7.866) 8.218 22.061 ( -5.795 3.566 13.384) 15.014 23.109 ( 5.935 -3.370 -6.819) 9.648 23.521 ( 0.240 -6.802 -5.723) 8.893 23.618 ( -15.463 5.365 0.455) 16.373 23.798 ( -7.260 -2.998 6.169) 9.988 24.718 ( 10.362 12.093 -1.312) 15.979 25.175 ( 8.442 -7.887 -1.100) 11.605 25.941 ( 0.603 0.997 6.041) 6.152 26.101 ( 4.022 -1.168 -3.476) 5.443 28.397 ( -6.005 1.311 2.082) 6.490 28.550 ( 3.358 0.973 -2.247) 4.155 ======================= Grid point 196 (84/117) ======================= q-point: (-0.20 -0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.935 ( -3.682 -0.000 29.380) 29.610 1.978 ( -27.745 -0.000 -39.712) 48.444 2.719 ( 7.774 0.000 -11.896) 14.211 3.153 ( -9.541 -0.000 32.669) 34.034 3.398 ( -21.831 -0.000 5.418) 22.494 3.570 ( -6.512 -0.000 3.346) 7.321 3.859 ( -10.716 -0.000 -18.919) 21.743 4.380 ( 27.828 0.000 7.504) 28.822 4.637 ( 8.250 0.000 3.273) 8.876 4.858 ( -4.552 -0.000 -5.386) 7.052 4.945 ( 2.616 0.000 -8.215) 8.622 5.027 ( -1.393 -0.000 -8.386) 8.501 5.290 ( -6.289 -0.000 -1.610) 6.492 5.351 ( -9.358 -0.000 13.049) 16.058 5.384 ( -3.310 -0.000 8.842) 9.441 5.439 ( 8.933 0.000 0.742) 8.964 5.633 ( -0.507 -0.000 5.156) 5.181 5.775 ( -2.663 -0.000 -13.761) 14.016 5.946 ( 9.134 0.000 1.819) 9.313 6.008 ( 6.080 0.000 -0.009) 6.080 6.054 ( -7.325 -0.000 1.237) 7.429 6.278 ( -5.082 -0.000 -7.518) 9.075 6.632 ( 2.178 0.000 0.828) 2.330 6.767 ( 6.376 0.000 -0.878) 6.436 7.094 ( -2.650 -0.000 -8.044) 8.469 7.190 ( -8.578 -0.000 1.125) 8.652 7.594 ( -0.839 -0.000 -2.655) 2.785 7.695 ( -0.002 -0.000 8.294) 8.294 7.760 ( -9.166 -0.000 1.659) 9.315 7.976 ( 5.092 0.000 -9.015) 10.354 8.054 ( -7.529 -0.000 -1.504) 7.678 8.183 ( -4.520 -0.000 -11.812) 12.647 8.204 ( 3.276 0.000 6.149) 6.967 8.300 ( -4.176 -0.000 13.646) 14.271 8.402 ( 2.244 0.000 0.401) 2.279 8.538 ( -19.998 -0.000 1.577) 20.060 8.751 ( -6.318 -0.000 -3.992) 7.474 9.197 ( 4.810 0.000 0.139) 4.812 9.393 ( 2.485 0.000 5.227) 5.788 9.555 ( -5.389 -0.000 -12.619) 13.721 9.769 ( 2.472 0.000 8.316) 8.675 9.901 ( 1.235 0.000 -9.314) 9.396 9.949 ( -21.956 -0.000 8.016) 23.374 10.092 ( 10.006 0.000 -1.575) 10.130 10.369 ( 18.795 0.000 4.909) 19.426 10.633 ( 1.444 0.000 -2.921) 3.258 10.832 ( 12.227 0.000 7.010) 14.094 10.912 ( 26.998 0.000 0.864) 27.012 11.978 ( 0.029 0.000 4.472) 4.473 12.201 ( -6.933 -0.000 -15.869) 17.317 12.241 ( -5.187 -0.000 13.447) 14.413 12.644 ( -4.830 -0.000 0.600) 4.867 12.771 ( 1.807 0.000 -6.659) 6.900 13.182 ( 10.205 0.000 13.493) 16.917 13.227 ( 2.664 0.000 -9.149) 9.529 13.691 ( -8.762 -0.000 -4.482) 9.842 14.831 ( -4.202 -0.000 0.196) 4.206 15.053 ( 1.497 0.000 -0.326) 1.532 17.269 ( 5.305 0.000 2.686) 5.946 17.336 ( -0.668 -0.000 -2.284) 2.380 21.620 ( -1.535 -0.000 -9.545) 9.668 22.098 ( -6.137 -0.000 16.989) 18.064 23.078 ( 6.416 0.000 -7.451) 9.833 23.442 ( 0.534 0.000 -6.909) 6.929 23.683 ( -14.821 -0.000 -1.910) 14.944 23.759 ( -9.471 -0.000 8.147) 12.493 24.941 ( 12.298 0.000 -6.650) 13.981 25.000 ( 6.521 0.000 3.938) 7.618 25.950 ( 0.267 0.000 7.379) 7.384 26.089 ( 4.204 0.000 -4.260) 5.985 28.411 ( -5.896 -0.000 2.625) 6.454 28.560 ( 4.716 0.000 -2.853) 5.512 ======================= Grid point 197 (85/117) ======================= q-point: (-0.10 -0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( -22.498 -1.789 -32.411) 39.495 1.931 ( -7.291 -9.869 26.816) 29.490 2.826 ( -1.574 3.580 14.016) 14.552 2.992 ( -1.032 1.586 4.569) 4.945 3.187 ( -8.516 -12.091 -3.343) 15.162 3.331 ( -16.468 -12.035 -19.276) 28.064 3.752 ( -15.435 -7.471 13.453) 21.795 4.635 ( -9.711 -1.257 3.090) 10.268 4.711 ( 1.003 3.750 2.344) 4.535 4.815 ( -1.624 8.088 2.640) 8.662 4.939 ( 9.722 -0.216 -0.232) 9.728 5.071 ( 0.328 -1.233 -11.155) 11.228 5.196 ( 7.525 4.481 -2.669) 9.156 5.268 ( -2.883 1.397 2.101) 3.831 5.358 ( 6.486 -2.227 2.939) 7.461 5.569 ( -6.014 1.785 -3.758) 7.313 5.623 ( 9.602 -1.713 4.177) 10.611 5.713 ( -2.353 -7.137 0.689) 7.546 5.965 ( -2.197 -0.780 -4.649) 5.201 6.070 ( 5.121 -0.827 -2.722) 5.858 6.211 ( 5.050 4.539 -1.401) 6.934 6.262 ( 10.114 -0.257 -4.221) 10.962 6.671 ( 2.080 0.490 -1.996) 2.925 6.839 ( 3.702 5.319 -4.454) 7.863 6.986 ( -3.353 8.759 -0.793) 9.412 7.056 ( -5.504 1.358 -4.075) 6.982 7.508 ( -12.993 1.638 -2.937) 13.421 7.547 ( -11.661 -2.258 3.618) 12.416 7.642 ( -5.989 -0.194 4.130) 7.278 7.869 ( -6.808 2.938 0.911) 7.470 8.021 ( -1.597 1.583 -8.210) 8.513 8.081 ( -3.619 -3.913 -4.220) 6.798 8.162 ( -0.864 6.836 0.129) 6.891 8.243 ( -6.950 0.609 5.999) 9.201 8.406 ( -0.981 -12.702 3.629) 13.246 8.433 ( -1.183 -2.255 4.214) 4.923 8.697 ( -2.907 -3.677 -0.420) 4.705 9.200 ( -11.808 1.346 0.321) 11.889 9.365 ( -1.763 2.909 0.044) 3.402 9.417 ( -2.742 -1.919 2.049) 3.924 9.655 ( -8.742 0.707 1.315) 8.868 9.759 ( -7.283 3.384 -2.378) 8.375 9.833 ( 0.481 -0.413 4.667) 4.710 10.261 ( 4.579 2.676 2.068) 5.692 10.677 ( 12.011 5.254 2.758) 13.397 10.761 ( 14.200 -1.690 0.664) 14.315 11.117 ( 19.074 -0.874 7.091) 20.368 11.430 ( 27.123 -2.099 -4.084) 27.509 11.964 ( -2.924 0.388 5.098) 5.890 12.051 ( -5.556 1.248 -9.491) 11.068 12.211 ( 2.227 -0.711 3.379) 4.109 12.590 ( -1.808 1.307 -2.545) 3.384 12.755 ( -5.016 -5.071 -6.264) 9.493 13.200 ( -2.832 2.339 -3.888) 5.349 13.346 ( 4.443 -1.482 8.663) 9.848 13.546 ( -5.090 1.667 -3.278) 6.279 14.713 ( -6.957 3.008 -2.962) 8.137 15.023 ( -4.941 0.143 2.465) 5.524 17.329 ( 1.053 0.734 -2.493) 2.804 17.372 ( 4.774 -0.162 2.622) 5.449 21.564 ( -4.170 0.332 -12.071) 12.775 21.920 ( -13.866 1.817 17.127) 22.111 23.199 ( 6.500 -0.370 -7.500) 9.931 23.390 ( -12.948 3.902 -4.342) 14.203 23.451 ( -3.131 -3.908 -7.880) 9.336 23.618 ( -8.329 -4.540 7.517) 12.103 25.061 ( 13.545 12.100 4.571) 18.728 25.296 ( 14.400 -9.278 -0.666) 17.143 25.969 ( 1.342 -0.159 7.553) 7.673 26.176 ( 5.639 -0.705 -4.692) 7.370 28.261 ( -9.951 0.651 0.519) 9.986 28.623 ( 3.315 2.235 -1.991) 4.466 ======================= Grid point 207 (86/117) ======================= q-point: (-0.10 -0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( -13.217 -0.000 -5.078) 14.159 1.635 ( -21.417 -0.000 31.427) 38.030 2.726 ( -34.394 -0.000 42.294) 54.514 2.783 ( -13.194 -0.000 -11.773) 17.682 2.896 ( -14.293 -0.000 -32.288) 35.310 3.188 ( 10.862 0.000 -4.351) 11.701 3.395 ( -8.515 -0.000 4.815) 9.782 4.478 ( -4.420 -0.000 1.316) 4.612 4.624 ( -11.470 -0.000 22.314) 25.090 4.872 ( -4.768 -0.000 -24.301) 24.764 4.886 ( 7.138 0.000 -5.914) 9.270 5.219 ( 6.354 0.000 -8.064) 10.266 5.250 ( 0.889 0.000 5.860) 5.927 5.385 ( 0.482 0.000 -13.195) 13.204 5.477 ( -1.004 -0.000 7.491) 7.558 5.663 ( 16.205 0.000 -2.495) 16.396 5.688 ( 11.134 0.000 0.962) 11.176 5.757 ( 1.814 0.000 -1.625) 2.435 6.032 ( 13.732 0.000 2.619) 13.979 6.133 ( 1.986 0.000 0.420) 2.030 6.280 ( 3.295 0.000 -1.464) 3.605 6.456 ( 6.553 0.000 -6.405) 9.163 6.707 ( 1.460 0.000 -7.687) 7.824 6.892 ( -1.077 -0.000 -8.339) 8.408 6.935 ( -6.348 -0.000 3.102) 7.066 7.032 ( 0.404 0.000 -5.503) 5.518 7.207 ( -15.392 -0.000 4.067) 15.920 7.337 ( -9.863 -0.000 -11.006) 14.779 7.550 ( -4.016 -0.000 8.196) 9.127 7.779 ( -5.913 -0.000 0.933) 5.986 7.891 ( -6.686 -0.000 -4.386) 7.996 8.082 ( 0.565 0.000 -3.651) 3.695 8.120 ( -6.972 -0.000 11.437) 13.394 8.224 ( -4.877 -0.000 6.204) 7.892 8.274 ( 0.165 0.000 4.509) 4.512 8.435 ( 3.406 0.000 0.509) 3.444 8.640 ( -1.579 -0.000 -0.107) 1.583 8.864 ( -21.807 -0.000 2.613) 21.963 9.355 ( -4.060 -0.000 3.941) 5.659 9.425 ( 3.068 0.000 2.321) 3.847 9.510 ( -15.564 -0.000 -0.491) 15.572 9.663 ( 8.579 0.000 1.701) 8.746 9.967 ( 10.531 0.000 3.153) 10.992 10.260 ( -4.468 -0.000 7.959) 9.128 10.847 ( 0.912 0.000 -1.190) 1.499 10.961 ( 7.694 0.000 5.238) 9.308 11.500 ( 21.396 0.000 1.843) 21.475 11.748 ( 6.889 0.000 -15.689) 17.135 11.908 ( -0.637 -0.000 -0.778) 1.005 12.055 ( 11.121 0.000 1.499) 11.221 12.378 ( 13.245 0.000 3.330) 13.657 12.522 ( -15.816 -0.000 -7.789) 17.630 12.619 ( 2.094 0.000 -2.511) 3.269 13.095 ( -8.407 -0.000 -1.387) 8.521 13.399 ( 0.359 0.000 6.469) 6.479 13.514 ( 0.882 0.000 -3.345) 3.459 14.606 ( -6.089 -0.000 -5.114) 7.952 14.885 ( -10.600 -0.000 4.725) 11.605 17.345 ( 0.982 0.000 -1.902) 2.141 17.453 ( 3.351 0.000 2.049) 3.928 21.440 ( -9.719 -0.000 -16.957) 19.545 21.630 ( -20.099 -0.000 15.467) 25.361 23.193 ( -10.022 -0.000 -3.815) 10.724 23.320 ( 6.875 0.000 -8.637) 11.039 23.339 ( -7.197 -0.000 -10.166) 12.456 23.459 ( -6.360 -0.000 6.449) 9.058 25.391 ( 15.567 0.000 11.273) 19.220 25.527 ( 15.156 0.000 0.891) 15.182 26.003 ( 2.457 0.000 10.097) 10.392 26.290 ( 8.034 0.000 -5.581) 9.782 28.081 ( -8.943 -0.000 -2.886) 9.397 28.703 ( 3.598 0.000 -3.455) 4.988 ======================= Grid point 208 (87/117) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 62 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( 1.288 0.000 -28.830) 28.859 1.579 ( -1.288 -0.000 28.830) 28.859 1.792 ( 11.160 0.000 -38.766) 40.341 1.792 ( -11.160 -0.000 38.766) 40.341 3.225 ( -10.047 -0.000 -59.074) 59.922 3.225 ( 10.047 0.000 59.074) 59.922 3.672 ( -4.186 -0.000 -2.038) 4.656 3.672 ( 4.186 0.000 2.038) 4.656 4.622 ( -7.630 -0.000 -1.581) 7.792 4.622 ( 7.630 0.000 1.581) 7.792 4.973 ( 2.406 0.000 -20.389) 20.531 4.973 ( -2.406 -0.000 20.389) 20.531 5.429 ( 12.022 0.000 -8.316) 14.618 5.429 ( -12.022 -0.000 8.316) 14.618 5.576 ( 6.027 0.000 -5.678) 8.281 5.576 ( -6.027 -0.000 5.678) 8.281 6.063 ( -11.310 -0.000 -5.033) 12.379 6.063 ( 11.310 0.000 5.033) 12.379 6.265 ( 5.746 0.000 -10.870) 12.295 6.265 ( -5.746 -0.000 10.870) 12.295 6.362 ( -0.420 -0.000 -4.437) 4.457 6.362 ( 0.420 0.000 4.437) 4.457 6.490 ( -3.864 -0.000 -10.986) 11.646 6.490 ( 3.864 0.000 10.986) 11.646 6.902 ( -0.029 -0.000 -2.699) 2.699 6.902 ( 0.029 0.000 2.699) 2.699 7.262 ( 2.013 0.000 -5.083) 5.467 7.262 ( -2.013 -0.000 5.083) 5.467 7.593 ( -1.362 -0.000 -1.055) 1.723 7.593 ( 1.362 0.000 1.055) 1.723 7.865 ( -3.709 -0.000 -13.128) 13.641 7.865 ( 3.709 0.000 13.128) 13.641 8.177 ( 3.184 0.000 -1.566) 3.548 8.177 ( -3.184 -0.000 1.566) 3.548 8.496 ( 11.416 0.000 -16.375) 19.961 8.496 ( -11.416 -0.000 16.375) 19.961 8.513 ( 1.095 0.000 -6.123) 6.220 8.513 ( -1.095 -0.000 6.123) 6.220 9.233 ( 0.561 0.000 -6.452) 6.476 9.233 ( -0.561 -0.000 6.452) 6.476 9.860 ( -8.002 -0.000 -13.715) 15.878 9.860 ( 8.002 0.000 13.715) 15.878 10.308 ( 10.830 0.000 -16.877) 20.053 10.308 ( -10.830 -0.000 16.877) 20.053 10.708 ( -1.583 -0.000 -2.762) 3.183 10.708 ( 1.583 0.000 2.762) 3.183 11.762 ( 4.353 0.000 -12.119) 12.877 11.762 ( -4.353 -0.000 12.119) 12.877 12.073 ( -3.403 -0.000 -2.267) 4.089 12.073 ( 3.403 0.000 2.267) 4.089 12.506 ( -1.336 -0.000 -5.185) 5.354 12.506 ( 1.336 0.000 5.185) 5.354 13.012 ( 1.748 0.000 -4.359) 4.696 13.012 ( -1.748 -0.000 4.359) 4.696 13.289 ( -0.446 -0.000 -9.839) 9.849 13.289 ( 0.446 0.000 9.839) 9.849 14.538 ( -9.836 -0.000 2.748) 10.212 14.538 ( 9.836 0.000 -2.748) 10.212 17.441 ( -3.006 -0.000 -1.876) 3.543 17.441 ( 3.006 0.000 1.876) 3.543 21.067 ( -14.195 -0.000 1.419) 14.266 21.067 ( 14.195 0.000 -1.419) 14.266 22.972 ( 4.304 0.000 -3.044) 5.272 22.972 ( -4.304 -0.000 3.044) 5.272 23.382 ( 6.079 0.000 -6.710) 9.055 23.382 ( -6.079 -0.000 6.710) 9.055 25.821 ( 4.377 0.000 -4.559) 6.320 25.821 ( -4.377 -0.000 4.559) 6.320 26.459 ( -1.666 -0.000 -1.629) 2.330 26.459 ( 1.666 0.000 1.629) 2.330 28.066 ( -21.010 -0.000 0.819) 21.026 28.066 ( 21.010 0.000 -0.819) 21.026 ======================= Grid point 210 (88/117) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( -4.254 -1.334 -2.474) 5.099 1.889 ( 16.485 -14.889 20.677) 30.348 1.915 ( 18.344 -6.456 0.235) 19.448 2.149 ( 20.590 -12.666 -25.074) 34.829 3.153 ( 4.916 -9.879 -16.500) 19.850 3.469 ( -2.262 -5.597 33.087) 33.633 3.632 ( 4.168 -5.697 14.821) 16.416 3.689 ( 2.222 -10.277 -24.699) 26.844 4.608 ( 4.270 2.667 -5.801) 7.681 4.739 ( 3.960 5.805 4.454) 8.320 4.951 ( -2.306 3.933 3.156) 5.545 4.976 ( 0.827 1.329 2.101) 2.620 5.235 ( -6.562 -2.282 5.191) 8.672 5.506 ( -0.292 -0.083 -4.372) 4.383 5.560 ( 2.736 -1.117 4.888) 5.712 5.694 ( -2.944 0.229 -13.854) 14.165 5.818 ( -3.753 2.629 -2.979) 5.465 5.921 ( -14.782 -1.327 5.707) 15.901 6.228 ( -6.267 2.535 0.404) 6.772 6.288 ( 0.807 7.453 -0.081) 7.497 6.342 ( -2.511 -1.226 -2.371) 3.665 6.401 ( -1.180 -3.700 0.319) 3.896 6.549 ( 9.642 1.894 -5.997) 11.512 6.635 ( 9.501 -0.428 12.533) 15.733 6.801 ( -5.984 6.984 -0.813) 9.233 6.913 ( 2.349 0.814 -2.892) 3.814 7.149 ( -1.684 6.931 2.269) 7.485 7.219 ( 1.716 6.276 -6.446) 9.158 7.628 ( 4.541 5.071 6.428) 9.362 7.680 ( 6.437 1.624 -7.015) 9.659 7.851 ( -2.618 -10.779 -8.028) 13.693 7.954 ( 0.169 -6.025 10.822) 12.387 8.098 ( -1.874 4.413 1.925) 5.167 8.208 ( -1.032 1.002 9.036) 9.150 8.333 ( -1.143 -0.546 5.592) 5.733 8.505 ( -0.999 -6.537 -2.476) 7.061 8.618 ( 7.555 -0.309 -3.754) 8.442 8.798 ( 13.577 -2.030 -15.949) 21.044 9.234 ( 4.201 5.876 -0.184) 7.225 9.381 ( 11.997 -6.031 -7.794) 15.526 9.654 ( -10.401 1.970 -3.901) 11.282 9.797 ( -13.251 -1.567 10.319) 16.868 10.203 ( 0.077 10.098 3.008) 10.537 10.423 ( -0.980 -2.853 -3.464) 4.594 10.659 ( 3.141 8.486 4.191) 9.972 10.834 ( 6.763 -6.525 1.791) 9.567 11.705 ( -4.319 -0.444 4.414) 6.191 11.733 ( -7.869 -1.662 -1.806) 8.243 11.963 ( -6.016 0.720 -3.426) 6.961 12.172 ( 9.319 1.094 -1.203) 9.460 12.406 ( -10.120 -0.507 -5.086) 11.337 12.514 ( -1.665 -3.312 4.754) 6.029 12.856 ( -12.644 1.391 -5.688) 13.934 13.015 ( 0.710 -2.158 -4.352) 4.910 13.329 ( 0.998 1.445 11.745) 11.876 13.367 ( 8.122 1.556 -1.234) 8.361 14.443 ( 0.945 2.610 1.522) 3.165 14.750 ( 12.626 0.657 -2.176) 12.829 17.380 ( -3.388 0.298 -1.262) 3.628 17.484 ( 1.088 -0.350 1.211) 1.666 21.042 ( 8.080 -0.707 0.880) 8.158 21.502 ( 31.938 4.933 -15.051) 35.650 22.930 ( 0.596 1.879 7.526) 7.780 23.071 ( 7.313 1.854 0.192) 7.547 23.306 ( -4.883 -4.616 5.330) 8.577 23.518 ( 6.184 -5.990 -6.190) 10.604 25.666 ( -12.487 1.868 3.456) 13.090 25.791 ( -8.748 -0.005 -2.185) 9.017 26.299 ( -12.505 1.860 2.015) 12.802 26.357 ( -9.364 -1.877 1.206) 9.626 27.887 ( 3.224 -0.060 3.370) 4.665 28.396 ( 13.096 3.625 8.922) 16.255 ======================= Grid point 211 (89/117) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( -19.822 -10.784 -15.638) 27.455 2.312 ( 10.658 -18.250 26.189) 33.653 2.403 ( 21.424 -13.347 -9.785) 27.072 2.616 ( 14.749 -11.269 -1.421) 18.616 3.195 ( -13.266 -4.529 -3.775) 14.517 3.548 ( 15.630 -7.556 2.010) 17.476 4.069 ( 22.790 -22.713 -40.539) 51.756 4.120 ( 25.810 -14.495 37.656) 47.898 4.557 ( -2.387 7.184 -1.888) 7.802 4.673 ( -2.375 4.086 4.509) 6.532 4.848 ( -3.131 6.520 -0.329) 7.240 4.928 ( -4.417 3.689 5.844) 8.202 5.202 ( 2.827 4.529 0.152) 5.341 5.419 ( -16.124 2.810 -3.609) 16.760 5.531 ( -1.887 -0.129 3.694) 4.150 5.631 ( -10.373 -0.602 1.935) 10.569 5.702 ( 6.253 -7.143 1.228) 9.572 5.909 ( 2.451 -3.894 -11.183) 12.093 6.045 ( -9.363 6.331 0.089) 11.303 6.149 ( -7.735 4.689 -3.201) 9.595 6.305 ( -3.861 -1.411 -5.087) 6.541 6.331 ( -8.740 -1.456 1.574) 8.999 6.632 ( 3.202 5.715 -0.179) 6.553 6.677 ( 2.535 6.732 -0.236) 7.197 6.785 ( 5.212 2.566 8.092) 9.962 6.897 ( 0.679 8.857 -2.407) 9.204 7.207 ( 11.313 0.035 -0.699) 11.335 7.328 ( 16.725 1.336 -3.611) 17.162 7.621 ( 1.229 6.755 5.480) 8.784 7.744 ( 3.493 6.089 0.379) 7.030 7.912 ( -2.444 -4.987 -2.527) 6.101 7.952 ( -0.616 -0.822 4.154) 4.279 8.110 ( 1.430 -4.946 0.924) 5.230 8.195 ( 1.522 -1.730 10.776) 11.020 8.384 ( 2.902 -1.140 -0.066) 3.119 8.552 ( 0.489 -3.253 -2.648) 4.223 8.748 ( 6.424 0.204 -5.531) 8.479 9.030 ( 12.337 -2.427 -5.732) 13.818 9.292 ( 7.415 4.967 2.968) 9.405 9.479 ( -5.397 3.435 -2.529) 6.879 9.598 ( -1.135 -0.045 -0.675) 1.321 9.676 ( 4.691 -7.134 -6.453) 10.702 10.053 ( -2.508 13.265 -6.326) 14.909 10.334 ( -6.956 0.226 1.086) 7.043 10.626 ( -1.449 9.734 7.243) 12.219 10.985 ( 1.076 -3.771 8.211) 9.100 11.478 ( -17.381 -2.527 2.890) 17.799 11.608 ( -11.650 -5.399 -0.797) 12.865 12.004 ( 10.571 2.099 -8.120) 13.494 12.153 ( -14.145 -0.013 -3.997) 14.699 12.344 ( 8.407 2.206 1.956) 8.909 12.447 ( -10.943 -0.990 -4.158) 11.749 12.695 ( -1.167 -3.244 -0.287) 3.459 13.061 ( 1.146 -1.919 1.717) 2.819 13.308 ( -0.589 2.369 10.155) 10.444 13.484 ( 5.966 1.673 -2.424) 6.653 14.506 ( 8.942 4.772 -1.581) 10.258 14.935 ( 8.261 0.796 -0.349) 8.307 17.313 ( -3.104 1.216 0.271) 3.345 17.481 ( -1.843 -0.396 -0.124) 1.890 21.251 ( 11.195 -2.210 3.096) 11.823 21.920 ( 22.720 12.460 -16.620) 30.784 22.975 ( 3.971 -0.229 10.367) 11.104 23.176 ( 7.848 3.442 -1.642) 8.725 23.342 ( 1.689 -8.584 1.934) 8.960 23.694 ( 5.744 -7.865 -5.317) 11.097 25.300 ( -22.941 5.523 4.484) 24.019 25.571 ( -14.719 -4.393 3.155) 15.681 26.137 ( -5.485 -0.467 3.607) 6.581 26.225 ( -6.074 0.150 -2.388) 6.528 28.065 ( 13.597 1.515 -2.587) 13.923 28.491 ( 3.329 4.611 7.248) 9.213 ======================= Grid point 212 (90/117) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 1.485 -18.819 -0.821) 18.895 2.504 ( -6.130 -8.259 22.711) 24.932 2.705 ( -7.105 -12.594 -18.226) 23.265 2.975 ( 21.236 -15.949 5.006) 27.026 3.332 ( 17.320 -9.171 -2.075) 19.708 3.759 ( -0.986 -0.828 -10.726) 10.803 4.221 ( -8.236 -3.637 -0.890) 9.047 4.565 ( -5.705 12.301 5.395) 14.594 4.640 ( -1.550 4.462 2.720) 5.451 4.775 ( 17.535 -14.472 22.135) 31.731 4.870 ( 5.988 -7.459 -2.283) 9.834 4.934 ( 14.186 -8.312 -16.349) 23.187 5.033 ( -9.345 10.058 -3.022) 14.058 5.244 ( 3.311 1.478 1.560) 3.947 5.438 ( -2.978 -5.092 1.128) 6.005 5.678 ( 0.668 -6.155 -0.055) 6.191 5.807 ( -4.732 3.162 -4.283) 7.123 5.854 ( 2.736 -3.628 4.270) 6.236 5.934 ( -2.907 -1.028 -5.385) 6.205 6.019 ( -3.835 -0.742 -3.065) 4.965 6.139 ( -6.268 5.596 -2.037) 8.646 6.217 ( -4.663 0.587 -3.367) 5.781 6.609 ( 0.448 8.337 2.235) 8.643 6.685 ( 1.518 0.126 0.253) 1.544 6.762 ( -2.745 5.310 1.464) 6.155 6.896 ( 9.244 5.043 1.122) 10.590 7.437 ( 13.258 2.431 -1.699) 13.586 7.533 ( -2.379 7.868 8.880) 12.100 7.687 ( -1.556 5.983 6.440) 8.927 7.732 ( 22.716 1.263 -3.039) 22.953 7.863 ( -1.939 0.946 -2.737) 3.485 7.989 ( 2.137 1.826 -3.549) 4.528 8.219 ( 5.467 -6.889 3.422) 9.436 8.311 ( 6.872 -3.450 -0.519) 7.707 8.462 ( 1.984 -6.266 6.414) 9.183 8.586 ( 2.476 -0.862 -0.547) 2.678 8.835 ( 3.214 -1.651 -5.093) 6.244 9.201 ( 0.720 3.886 3.784) 5.472 9.381 ( 5.056 -0.742 -4.125) 6.568 9.429 ( 7.896 1.599 0.803) 8.097 9.647 ( 9.095 2.830 -4.153) 10.392 9.812 ( 1.664 -5.312 -4.132) 6.933 9.877 ( -1.870 12.528 -5.256) 13.714 10.179 ( -10.226 3.045 3.993) 11.392 10.474 ( -3.030 7.395 4.567) 9.205 10.833 ( -19.006 0.959 -2.306) 19.169 11.221 ( -14.657 -3.543 7.996) 17.067 11.393 ( -20.646 -4.267 -2.987) 21.293 11.924 ( -10.245 -1.603 1.578) 10.489 12.149 ( 6.676 1.878 -7.593) 10.283 12.328 ( 3.605 2.731 -9.360) 10.396 12.489 ( 10.194 2.419 2.610) 10.798 12.762 ( 0.264 -6.796 3.609) 7.699 13.069 ( -1.941 -0.337 5.815) 6.139 13.321 ( 3.796 2.037 9.329) 10.276 13.533 ( 0.933 0.309 -6.064) 6.143 14.637 ( 10.598 5.324 -3.803) 12.455 15.031 ( 3.417 0.695 1.148) 3.671 17.253 ( -1.859 1.707 2.048) 3.250 17.430 ( -4.072 -0.638 -1.616) 4.427 21.459 ( 8.014 -4.244 1.459) 9.185 22.063 ( 9.885 13.997 -6.177) 18.215 23.045 ( 0.317 -3.985 7.609) 8.596 23.340 ( 14.499 5.153 -5.460) 16.327 23.496 ( 5.168 -9.703 -0.940) 11.033 23.850 ( 4.312 -5.492 -3.652) 7.880 24.840 ( -22.056 4.121 6.421) 23.338 25.375 ( -11.824 -4.347 2.373) 12.820 26.056 ( -4.073 0.896 0.122) 4.172 26.134 ( -3.407 0.564 -0.775) 3.539 28.273 ( 11.462 3.188 -3.524) 12.408 28.491 ( 0.912 2.668 4.311) 5.151 ======================= Grid point 213 (91/117) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( 23.641 -14.881 9.540) 29.519 2.451 ( -5.165 -5.966 9.867) 12.634 2.695 ( -4.515 -10.937 -11.960) 16.824 3.326 ( -5.538 7.579 -2.114) 9.622 3.498 ( -1.970 -3.419 -10.247) 10.980 3.837 ( 18.769 -11.954 9.514) 24.201 4.149 ( -15.261 14.737 1.431) 21.264 4.244 ( -2.356 -11.402 -1.032) 11.688 4.576 ( -3.968 4.704 2.694) 6.717 4.869 ( 0.330 -0.342 -7.996) 8.010 4.975 ( 7.590 -0.837 0.429) 7.648 5.037 ( -0.158 -1.283 -3.503) 3.734 5.193 ( 4.182 -8.647 10.032) 13.889 5.315 ( -1.318 1.387 7.664) 7.900 5.503 ( -3.800 -3.882 -4.822) 7.263 5.598 ( -3.741 -1.363 -6.802) 7.882 5.793 ( -3.953 6.377 2.414) 7.882 5.860 ( -1.284 -1.610 1.825) 2.752 5.905 ( 0.362 4.218 -3.043) 5.213 5.950 ( 3.154 0.756 -3.373) 4.679 6.190 ( 5.810 -7.386 -5.459) 10.868 6.273 ( 7.270 -8.353 5.014) 12.156 6.541 ( -0.817 3.867 0.997) 4.077 6.662 ( -2.362 4.873 -3.465) 6.429 6.695 ( 0.754 2.032 0.633) 2.258 7.077 ( 13.088 0.890 -0.835) 13.145 7.391 ( -3.250 6.315 12.411) 14.299 7.611 ( -2.079 4.008 4.067) 6.077 7.637 ( 9.334 2.391 -2.375) 9.923 7.819 ( -1.930 0.997 -3.082) 3.771 7.946 ( 4.897 4.948 -4.723) 8.413 8.000 ( 2.271 1.529 -1.125) 2.959 8.414 ( 8.093 -3.774 -0.081) 8.930 8.503 ( 0.797 -3.249 2.386) 4.109 8.579 ( 10.295 -3.782 -0.824) 10.999 8.713 ( 9.904 -0.835 2.143) 10.168 8.935 ( 6.096 -6.118 -1.233) 8.725 9.131 ( 1.445 1.282 3.461) 3.964 9.418 ( 1.589 1.154 -2.003) 2.805 9.658 ( -3.369 2.869 0.292) 4.435 9.669 ( -1.175 6.060 -1.566) 6.368 9.748 ( 3.464 2.087 -2.048) 4.533 9.793 ( -5.447 -0.473 2.266) 5.919 10.076 ( 7.290 2.914 0.036) 7.850 10.395 ( -13.476 3.108 -2.896) 14.130 10.477 ( -0.202 2.092 0.516) 2.164 10.962 ( -18.382 -2.938 2.562) 18.790 10.973 ( -25.679 -1.320 -3.343) 25.930 11.823 ( -2.089 0.214 2.649) 3.380 12.215 ( 3.013 1.947 -2.907) 4.617 12.452 ( 9.037 -0.345 -7.605) 11.816 12.649 ( 8.852 2.094 0.461) 9.108 12.815 ( -1.253 -5.701 4.412) 7.317 13.011 ( -4.396 0.786 5.629) 7.186 13.395 ( 5.527 2.947 9.336) 11.243 13.513 ( -3.070 -2.058 -8.906) 9.643 14.759 ( 7.699 3.965 -3.314) 9.273 15.057 ( 0.137 0.030 1.400) 1.407 17.222 ( 0.056 1.560 2.867) 3.264 17.357 ( -4.193 -0.913 -2.437) 4.934 21.618 ( 4.343 -4.950 -0.663) 6.619 22.051 ( 3.172 10.153 0.289) 10.641 23.081 ( -0.433 -3.117 3.219) 4.502 23.503 ( 6.799 2.296 -0.839) 7.225 23.737 ( 13.000 -6.372 -7.630) 16.365 23.945 ( 2.154 -2.605 -1.663) 3.767 24.446 ( -18.252 3.412 7.249) 19.934 25.240 ( -6.767 -2.661 1.188) 7.368 25.979 ( -2.681 1.483 -0.709) 3.144 26.086 ( -1.707 0.134 0.076) 1.714 28.402 ( 6.646 3.287 -2.468) 7.815 28.488 ( -0.046 0.220 2.412) 2.423 ======================= Grid point 214 (92/117) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.158 ( 0.000 -0.000 0.000) 0.000 2.438 ( -0.000 0.000 0.000) 0.000 2.859 ( 0.000 -0.000 0.000) 0.000 2.881 ( -0.000 0.000 0.000) 0.000 3.603 ( -0.000 0.000 -0.000) 0.000 3.886 ( -0.000 0.000 0.000) 0.000 4.133 ( -0.000 0.000 0.000) 0.000 4.263 ( -0.000 0.000 0.000) 0.000 4.645 ( -0.000 0.000 0.000) 0.000 4.730 ( -0.000 -0.000 0.000) 0.000 5.014 ( -0.000 0.000 0.000) 0.000 5.154 ( -0.000 0.000 0.000) 0.000 5.200 ( 0.000 -0.000 -0.000) 0.000 5.311 ( -0.000 0.000 0.000) 0.000 5.443 ( -0.000 -0.000 -0.000) 0.000 5.543 ( -0.000 0.000 0.000) 0.000 5.780 ( -0.000 -0.000 0.000) 0.000 5.839 ( -0.000 0.000 0.000) 0.000 5.843 ( 0.000 -0.000 -0.000) 0.000 5.982 ( -0.000 0.000 0.000) 0.000 6.355 ( -0.000 -0.000 -0.000) 0.000 6.409 ( -0.000 0.000 0.000) 0.000 6.480 ( -0.000 -0.000 0.000) 0.000 6.597 ( -0.000 0.000 -0.000) 0.000 6.702 ( -0.000 0.000 -0.000) 0.000 7.268 ( -0.000 0.000 0.000) 0.000 7.305 ( -0.000 0.000 -0.000) 0.000 7.546 ( -0.000 0.000 0.000) 0.000 7.734 ( -0.000 0.000 -0.000) 0.000 7.762 ( -0.000 0.000 0.000) 0.000 7.972 ( -0.000 0.000 0.000) 0.000 8.002 ( -0.000 0.000 -0.000) 0.000 8.505 ( 0.000 0.000 0.000) 0.000 8.555 ( -0.000 0.000 -0.000) 0.000 8.675 ( 0.000 0.000 0.000) 0.000 8.759 ( -0.000 0.000 0.000) 0.000 9.204 ( -0.000 0.000 0.000) 0.000 9.289 ( 0.000 -0.000 0.000) 0.000 9.374 ( -0.000 0.000 0.000) 0.000 9.423 ( -0.000 0.000 0.000) 0.000 9.465 ( 0.000 -0.000 -0.000) 0.000 9.787 ( -0.000 0.000 0.000) 0.000 9.927 ( -0.000 0.000 0.000) 0.000 9.992 ( -0.000 0.000 0.000) 0.000 10.371 ( -0.000 0.000 0.000) 0.000 10.568 ( -0.000 0.000 -0.000) 0.000 10.661 ( -0.000 0.000 -0.000) 0.000 10.709 ( 0.000 0.000 0.000) 0.000 11.812 ( -0.000 0.000 -0.000) 0.000 12.229 ( -0.000 0.000 0.000) 0.000 12.550 ( -0.000 0.000 0.000) 0.000 12.730 ( 0.000 0.000 0.000) 0.000 12.840 ( 0.000 0.000 -0.000) 0.000 12.946 ( -0.000 0.000 0.000) 0.000 13.457 ( -0.000 -0.000 -0.000) 0.000 13.468 ( 0.000 0.000 0.000) 0.000 14.813 ( -0.000 0.000 0.000) 0.000 15.055 ( -0.000 0.000 0.000) 0.000 17.220 ( -0.000 0.000 0.000) 0.000 17.316 ( -0.000 0.000 0.000) 0.000 21.688 ( -0.000 0.000 0.000) 0.000 22.022 ( -0.000 0.000 0.000) 0.000 23.094 ( -0.000 0.000 0.000) 0.000 23.550 ( 0.000 0.000 0.000) 0.000 23.966 ( -0.000 0.000 0.000) 0.000 23.990 ( -0.000 0.000 0.000) 0.000 24.178 ( -0.000 0.000 0.000) 0.000 25.192 ( -0.000 0.000 0.000) 0.000 25.945 ( -0.000 0.000 -0.000) 0.000 26.070 ( -0.000 0.000 0.000) 0.000 28.447 ( -0.000 -0.000 0.000) 0.000 28.487 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 221 (93/117) ======================= q-point: ( 0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( -27.027 -0.000 -3.632) 27.270 2.167 ( 16.039 0.000 6.664) 17.368 2.236 ( 20.884 0.000 15.081) 25.760 2.508 ( 20.769 0.000 -12.732) 24.361 3.149 ( -17.025 -0.000 0.257) 17.027 3.479 ( 23.823 0.000 -2.199) 23.924 3.825 ( 23.376 0.000 -49.198) 54.469 3.970 ( 26.061 0.000 45.546) 52.474 4.633 ( -1.059 -0.000 -6.001) 6.094 4.734 ( -7.537 -0.000 7.301) 10.493 4.929 ( -2.081 -0.000 17.734) 17.856 4.939 ( -3.567 -0.000 -8.814) 9.509 5.232 ( 2.127 0.000 3.367) 3.983 5.442 ( -6.621 -0.000 -7.707) 10.160 5.579 ( -6.143 -0.000 8.720) 10.666 5.592 ( -5.721 -0.000 -4.892) 7.528 5.685 ( -2.792 -0.000 0.349) 2.814 5.840 ( 2.803 0.000 -11.647) 11.979 6.130 ( -6.046 -0.000 1.216) 6.167 6.199 ( -16.411 -0.000 -8.754) 18.600 6.283 ( -4.066 -0.000 -2.625) 4.840 6.287 ( -4.895 -0.000 5.952) 7.706 6.674 ( 2.955 0.000 -3.974) 4.953 6.774 ( 0.960 0.000 7.696) 7.756 6.806 ( 6.155 0.000 6.025) 8.613 7.000 ( 3.178 0.000 -2.446) 4.010 7.212 ( 8.777 0.000 2.107) 9.026 7.344 ( 12.818 0.000 -7.499) 14.850 7.740 ( -0.275 -0.000 -6.025) 6.032 7.776 ( 3.539 0.000 1.027) 3.685 7.805 ( 7.325 0.000 -0.103) 7.326 7.922 ( -1.858 -0.000 9.096) 9.284 8.104 ( -0.561 -0.000 5.963) 5.989 8.178 ( -0.833 -0.000 15.707) 15.729 8.399 ( 3.956 0.000 -2.838) 4.868 8.467 ( 0.995 0.000 -6.674) 6.747 8.753 ( 6.728 0.000 -8.091) 10.522 9.004 ( 11.444 0.000 -5.699) 12.785 9.379 ( 8.040 0.000 1.256) 8.137 9.461 ( -2.259 -0.000 -0.515) 2.317 9.588 ( 4.177 0.000 -5.679) 7.050 9.617 ( -3.848 -0.000 -0.758) 3.922 10.202 ( -5.218 -0.000 -7.352) 9.015 10.323 ( -5.122 -0.000 1.408) 5.312 10.783 ( -5.837 -0.000 4.109) 7.138 10.897 ( 9.015 0.000 10.732) 14.016 11.450 ( -18.616 -0.000 7.479) 20.062 11.550 ( -12.619 -0.000 -5.023) 13.582 12.027 ( 10.658 0.000 -9.462) 14.252 12.151 ( -15.456 -0.000 -5.351) 16.356 12.379 ( 9.664 0.000 4.434) 10.633 12.419 ( -5.700 -0.000 -1.174) 5.820 12.664 ( -6.832 -0.000 -5.219) 8.598 13.040 ( 2.274 0.000 2.938) 3.715 13.332 ( -1.129 -0.000 12.118) 12.171 13.502 ( 5.310 0.000 -3.263) 6.233 14.556 ( 8.680 0.000 -0.702) 8.708 14.943 ( 8.094 0.000 -0.228) 8.097 17.326 ( -2.830 -0.000 -0.209) 2.837 17.479 ( -1.653 -0.000 -0.134) 1.658 21.229 ( 10.742 0.000 3.675) 11.353 22.062 ( 24.651 0.000 -24.494) 34.750 22.975 ( 1.037 0.000 12.621) 12.663 23.212 ( 6.565 0.000 2.220) 6.930 23.256 ( 3.491 0.000 -0.693) 3.560 23.593 ( 6.618 0.000 -4.593) 8.055 25.443 ( -13.846 -0.000 1.403) 13.917 25.444 ( -25.056 -0.000 10.829) 27.296 26.130 ( -5.698 -0.000 8.022) 9.840 26.226 ( -4.804 -0.000 -7.954) 9.292 28.081 ( 14.525 0.000 -3.470) 14.934 28.540 ( 1.673 0.000 9.310) 9.459 ======================= Grid point 222 (94/117) ======================= q-point: ( 0.20 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.938 ( -4.744 -15.771 13.143) 21.071 2.399 ( 5.574 -1.647 15.425) 16.484 2.539 ( -10.789 -3.770 -7.686) 13.773 2.730 ( 26.545 -8.478 15.514) 31.893 3.238 ( 21.769 -1.466 -17.193) 27.778 3.727 ( 6.578 -1.836 -19.293) 20.466 4.129 ( -6.847 -4.406 -12.074) 14.563 4.455 ( 13.820 -8.331 36.863) 40.240 4.672 ( 9.704 0.939 0.304) 9.754 4.775 ( 12.405 -0.544 -11.026) 16.606 4.828 ( -7.909 6.252 3.160) 10.565 4.908 ( 3.335 0.337 0.527) 3.393 5.187 ( -10.047 4.412 0.075) 10.974 5.240 ( -1.645 -1.864 0.875) 2.635 5.426 ( -4.215 1.446 1.020) 4.572 5.606 ( 4.280 0.144 -7.078) 8.273 5.750 ( 2.372 -3.222 3.522) 5.331 5.872 ( -2.385 -3.648 -7.481) 8.658 5.885 ( -8.586 2.191 -4.061) 9.747 6.022 ( -5.491 0.384 -0.507) 5.527 6.191 ( -5.584 0.817 1.021) 5.735 6.221 ( -3.720 -0.414 -3.893) 5.400 6.682 ( -0.527 -0.144 -2.708) 2.763 6.782 ( 2.089 4.793 5.246) 7.407 6.829 ( -2.176 2.963 4.984) 6.193 7.019 ( 4.622 5.048 1.435) 6.993 7.440 ( 12.525 -1.077 -0.373) 12.577 7.671 ( 12.609 3.979 1.200) 13.277 7.721 ( 5.941 3.215 -4.615) 8.182 7.839 ( 6.170 3.043 1.219) 6.987 7.866 ( -3.282 -0.158 1.859) 3.775 7.932 ( 2.662 -5.402 4.576) 7.564 8.159 ( 8.566 0.293 3.993) 9.456 8.231 ( 4.429 -3.237 11.528) 12.767 8.411 ( -0.040 1.228 -1.512) 1.949 8.516 ( 0.829 -5.200 -4.140) 6.698 8.816 ( 1.448 -0.313 -9.002) 9.123 9.200 ( 6.284 -1.892 1.270) 6.685 9.378 ( -1.379 0.811 -0.021) 1.600 9.509 ( 4.031 4.309 -4.370) 7.342 9.665 ( 0.736 -3.625 1.177) 3.881 9.702 ( 14.522 -0.889 -3.264) 14.911 10.081 ( -3.247 5.904 -10.781) 12.713 10.212 ( -8.711 0.775 5.407) 10.282 10.599 ( -8.559 3.968 5.880) 11.117 10.848 ( -18.479 0.432 -2.956) 18.719 11.187 ( -11.017 0.232 14.589) 18.283 11.311 ( -16.510 -3.634 -6.550) 18.130 11.904 ( -8.877 -0.278 0.041) 8.881 12.150 ( 3.016 -0.863 -10.690) 11.141 12.417 ( 6.784 5.146 -9.422) 12.699 12.514 ( 7.918 -0.049 5.189) 9.467 12.634 ( -0.536 -5.318 -0.319) 5.354 13.063 ( -0.848 -0.177 7.052) 7.105 13.348 ( 2.944 0.814 12.991) 13.345 13.541 ( -0.441 0.191 -7.010) 7.026 14.716 ( 9.755 2.330 -2.899) 10.440 15.037 ( 2.323 0.022 1.375) 2.699 17.281 ( -1.591 0.913 1.527) 2.387 17.424 ( -4.205 -0.094 -1.614) 4.505 21.403 ( 7.337 -1.495 2.851) 8.012 22.304 ( 9.167 8.436 -14.493) 19.112 22.977 ( -1.290 -2.106 7.615) 8.006 23.333 ( 3.362 -6.007 2.147) 7.211 23.418 ( 14.633 2.446 -4.627) 15.541 23.745 ( 7.566 -3.731 -3.395) 9.093 24.979 ( -19.957 8.246 10.760) 24.126 25.251 ( -12.768 -7.323 2.318) 14.901 26.058 ( -3.831 -0.190 4.837) 6.173 26.150 ( -2.985 0.578 -6.518) 7.192 28.320 ( 11.917 1.370 -4.797) 12.919 28.530 ( -1.649 1.107 5.807) 6.138 ======================= Grid point 223 (95/117) ======================= q-point: ( 0.30 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( 29.272 -18.996 21.270) 40.867 2.340 ( -6.221 -5.541 10.040) 13.047 2.574 ( 4.766 -0.500 -12.806) 13.673 3.294 ( 22.476 -5.991 8.638) 24.812 3.605 ( 4.275 5.747 -6.775) 9.859 3.665 ( 0.893 -1.306 -11.036) 11.149 4.023 ( -3.153 -10.874 -3.177) 11.759 4.386 ( -20.548 6.463 1.703) 21.608 4.643 ( -4.398 1.295 8.174) 9.372 4.821 ( -3.244 -3.563 3.300) 5.840 4.882 ( 4.466 -5.373 -2.422) 7.395 4.934 ( 5.890 -4.134 -2.110) 7.499 5.177 ( 3.468 2.680 1.944) 4.795 5.362 ( -3.998 2.018 5.374) 6.995 5.443 ( 11.921 -0.380 -5.272) 13.040 5.564 ( -6.364 1.269 -4.714) 8.021 5.776 ( 2.300 -3.882 -2.240) 5.038 5.840 ( -3.936 -2.840 -1.269) 5.017 5.957 ( 3.637 0.956 -3.662) 5.249 6.000 ( 5.680 -1.687 2.012) 6.257 6.127 ( 1.010 0.271 -6.800) 6.880 6.147 ( -0.761 -1.089 -0.383) 1.383 6.662 ( -2.053 2.327 -2.278) 3.850 6.728 ( 0.171 5.237 0.253) 5.246 6.787 ( 1.906 5.802 7.563) 9.721 7.121 ( 10.636 3.199 2.126) 11.309 7.568 ( -4.395 10.575 10.106) 15.274 7.597 ( 1.181 -2.318 1.378) 2.944 7.761 ( 4.086 7.386 -0.790) 8.478 7.842 ( -0.817 0.856 -3.549) 3.741 7.978 ( 2.066 -2.165 3.464) 4.578 8.059 ( 6.231 2.594 -3.843) 7.767 8.312 ( 6.362 -4.078 0.178) 7.559 8.415 ( -0.379 -4.295 3.801) 5.748 8.486 ( 11.312 -4.621 -0.540) 12.231 8.645 ( 11.502 -5.294 0.338) 12.667 8.843 ( 2.421 -3.168 -5.168) 6.527 9.152 ( -5.912 0.286 2.864) 6.576 9.428 ( -0.134 -0.222 -1.570) 1.591 9.571 ( 4.174 -3.540 -3.070) 6.275 9.688 ( -0.030 -2.419 7.134) 7.533 9.861 ( -6.111 5.075 -1.550) 8.094 9.930 ( -6.373 8.742 -1.354) 10.903 10.135 ( 12.444 2.810 -5.636) 13.947 10.437 ( -19.345 1.446 -1.896) 19.492 10.512 ( 1.197 0.398 5.277) 5.426 10.931 ( -16.769 0.236 0.754) 16.788 10.961 ( -22.802 -0.140 -4.219) 23.190 11.848 ( 1.093 2.253 7.334) 7.749 12.227 ( 3.248 -1.718 -7.250) 8.128 12.453 ( 4.116 2.331 -4.260) 6.366 12.669 ( 0.287 -3.240 1.140) 3.447 12.716 ( 9.952 -1.779 -4.773) 11.179 13.019 ( -4.384 0.337 7.644) 8.818 13.429 ( 4.341 1.250 8.991) 10.062 13.490 ( -3.561 -1.069 -5.357) 6.521 14.836 ( 6.208 3.620 -2.940) 7.765 15.039 ( -2.305 -1.604 1.857) 3.367 17.258 ( 0.258 1.938 1.967) 2.773 17.342 ( -4.424 -0.752 -1.960) 4.897 21.532 ( 4.377 -3.355 0.835) 5.578 22.270 ( -0.215 10.843 -2.557) 11.142 23.007 ( 0.940 -3.710 -0.458) 3.855 23.434 ( -0.254 -8.030 2.067) 8.296 23.688 ( 16.334 0.631 -5.891) 17.376 23.896 ( 5.867 -1.678 -1.818) 6.368 24.598 ( -12.840 10.503 8.302) 18.550 25.138 ( -7.541 -7.431 1.462) 10.687 25.992 ( -3.818 0.054 3.572) 5.228 26.098 ( -1.481 0.815 -4.537) 4.842 28.458 ( 4.580 2.255 -2.221) 5.567 28.492 ( -1.123 0.068 1.917) 2.222 ======================= Grid point 224 (96/117) ======================= q-point: ( 0.40 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.105 ( 19.312 -6.210 9.561) 22.426 2.383 ( 7.099 -7.602 1.140) 10.464 2.659 ( 7.704 -0.834 -5.697) 9.618 3.194 ( -14.927 15.465 0.987) 21.516 3.544 ( 4.778 -1.896 -2.001) 5.516 3.953 ( -8.057 1.291 0.514) 8.176 4.119 ( 16.342 -9.139 6.861) 19.941 4.173 ( 2.835 -1.039 -2.299) 3.794 4.559 ( 0.854 -3.245 -2.392) 4.121 4.753 ( -10.128 0.422 -2.442) 10.426 5.045 ( 5.732 -4.145 -5.077) 8.707 5.095 ( 4.040 -4.945 2.469) 6.847 5.149 ( -6.556 -1.903 10.732) 12.719 5.301 ( 2.513 2.169 -1.544) 3.661 5.384 ( -4.418 1.040 -3.560) 5.768 5.559 ( -2.250 -1.800 -0.815) 2.995 5.789 ( 0.281 -0.966 -3.705) 3.840 5.859 ( 1.004 2.577 1.953) 3.386 5.942 ( -1.468 6.953 -0.560) 7.128 5.991 ( 1.202 0.876 -8.048) 8.185 6.213 ( 5.356 -5.135 -10.983) 13.254 6.329 ( 5.049 -9.804 9.840) 14.780 6.573 ( -1.590 6.233 -0.516) 6.454 6.716 ( -0.308 2.156 6.387) 6.748 6.772 ( 5.341 11.518 -3.145) 13.080 7.283 ( 6.464 1.648 0.509) 6.691 7.397 ( -4.189 8.215 6.886) 11.509 7.561 ( -3.803 0.865 0.302) 3.912 7.748 ( -5.630 0.382 -3.232) 6.503 7.792 ( 1.681 4.483 -0.152) 4.790 7.985 ( -4.140 -0.676 6.163) 7.455 8.026 ( -1.634 4.219 -2.818) 5.330 8.447 ( -1.768 -5.066 -0.058) 5.366 8.481 ( 2.590 -7.627 -2.287) 8.373 8.612 ( 0.029 -5.951 -0.942) 6.026 8.729 ( -9.066 -2.206 2.462) 9.650 9.072 ( 16.461 -7.649 0.824) 18.170 9.237 ( 5.797 -6.386 2.732) 9.047 9.378 ( -3.371 1.957 0.306) 3.910 9.445 ( -15.194 1.432 -3.912) 15.754 9.554 ( -13.772 3.618 0.833) 14.263 9.799 ( 5.410 0.622 -7.063) 8.918 9.891 ( 8.727 0.811 6.709) 11.038 10.115 ( -4.264 8.195 -1.325) 9.332 10.356 ( -6.459 -1.030 7.759) 10.148 10.584 ( -14.608 0.993 -5.924) 15.795 10.644 ( 13.453 -1.507 -2.868) 13.838 10.744 ( 6.653 3.169 -1.032) 7.441 11.850 ( 1.326 3.863 4.565) 6.125 12.239 ( -1.408 0.504 -0.188) 1.507 12.483 ( -4.624 -5.129 2.675) 7.406 12.732 ( 3.887 -0.760 -3.418) 5.232 12.859 ( 4.503 1.695 -8.063) 9.390 12.934 ( -2.902 -0.778 2.821) 4.122 13.376 ( -7.156 -4.513 -10.150) 13.213 13.539 ( 5.333 3.440 13.328) 14.762 14.829 ( -4.292 1.586 1.545) 4.830 15.029 ( -0.690 -2.479 -0.889) 2.723 17.227 ( -2.165 0.547 -2.774) 3.561 17.321 ( 2.171 0.514 2.400) 3.277 21.628 ( 1.907 -4.404 -0.164) 4.801 22.122 ( -5.234 8.151 0.944) 9.733 23.066 ( 2.039 -2.436 -4.453) 5.470 23.470 ( -4.681 -7.506 2.373) 9.159 23.922 ( 5.009 -2.264 -0.418) 5.513 23.987 ( 4.655 1.317 -1.279) 5.004 24.354 ( 1.068 13.098 3.342) 13.559 25.132 ( -0.299 -5.931 -0.014) 5.938 25.938 ( -2.270 -0.591 3.630) 4.322 26.077 ( 0.331 0.619 -3.492) 3.561 28.424 ( -4.601 -1.495 1.964) 5.221 28.510 ( 0.920 1.557 -2.356) 2.970 ======================= Grid point 225 (97/117) ======================= q-point: (-0.50 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( -14.486 11.214 -6.666) 19.494 2.579 ( 7.349 6.474 -3.974) 10.570 2.890 ( 2.722 4.572 6.088) 8.086 3.130 ( 24.661 -5.678 7.067) 26.274 3.639 ( 0.384 6.182 4.149) 7.455 3.880 ( 4.589 -9.721 -0.094) 10.750 4.096 ( -8.490 12.547 -8.080) 17.170 4.388 ( 7.617 3.436 2.548) 8.736 4.522 ( -4.272 -1.337 -3.986) 5.993 4.809 ( 8.407 -10.399 2.791) 13.660 4.986 ( -7.830 4.581 4.372) 10.070 5.050 ( -5.940 0.207 7.226) 9.356 5.242 ( 4.643 -6.442 -6.892) 10.514 5.320 ( -0.996 2.423 -1.322) 2.934 5.404 ( 4.722 -8.743 -3.921) 10.683 5.559 ( -1.553 -4.684 2.394) 5.485 5.810 ( 0.674 2.755 -1.010) 3.011 5.853 ( 3.497 2.501 2.774) 5.116 5.883 ( 1.971 2.355 -4.036) 5.072 5.973 ( -1.672 1.804 -5.058) 5.625 6.288 ( -1.757 0.178 -3.745) 4.141 6.443 ( -2.731 5.181 -0.290) 5.864 6.533 ( 5.013 -1.928 7.257) 9.029 6.656 ( 0.535 5.899 8.048) 9.993 6.714 ( -1.683 9.630 -7.032) 12.042 7.113 ( -14.262 5.569 3.091) 15.620 7.354 ( 0.014 2.226 -7.511) 7.834 7.516 ( -5.694 -3.617 -3.742) 7.714 7.616 ( -4.358 -0.831 1.603) 4.717 7.806 ( 0.266 -0.772 1.855) 2.027 7.873 ( -6.761 -1.781 4.853) 8.511 7.968 ( -4.416 -1.400 1.982) 5.039 8.419 ( -6.716 -2.958 -0.313) 7.345 8.511 ( -2.410 -2.846 1.833) 4.156 8.580 ( -5.770 -4.499 -1.004) 7.385 8.671 ( -7.918 -4.902 -2.745) 9.709 9.016 ( -9.894 1.568 1.819) 10.181 9.150 ( -11.783 2.890 -2.559) 12.399 9.402 ( -4.424 -0.312 0.862) 4.518 9.414 ( 4.147 -11.022 4.824) 12.726 9.594 ( 11.628 -5.289 -4.206) 13.449 9.813 ( 0.585 2.520 -5.491) 6.070 9.837 ( -13.446 3.297 2.249) 14.026 10.042 ( -4.701 -0.004 3.194) 5.683 10.353 ( 6.424 -0.291 0.309) 6.438 10.449 ( 8.732 -0.813 1.276) 8.862 11.000 ( 22.518 1.716 -3.011) 22.783 11.031 ( 23.766 3.284 1.526) 24.040 11.840 ( 1.637 1.993 1.815) 3.154 12.192 ( -3.650 -0.142 3.948) 5.379 12.397 ( -10.170 -5.951 4.270) 12.533 12.654 ( -9.202 2.855 -0.615) 9.655 12.906 ( 3.684 3.349 -10.710) 11.811 12.975 ( 3.361 -2.937 -4.009) 6.000 13.300 ( -6.509 -6.695 -8.453) 12.596 13.582 ( 2.510 4.626 11.940) 13.049 14.693 ( -10.543 -2.663 4.529) 11.779 15.036 ( -1.277 -1.950 -1.877) 2.993 17.198 ( -0.605 -0.935 -3.223) 3.410 17.381 ( 4.850 1.616 2.404) 5.649 21.667 ( -1.834 -1.575 1.148) 2.676 21.946 ( -8.573 0.901 -0.725) 8.650 23.109 ( 1.462 -0.240 -6.915) 7.072 23.402 ( -11.077 -6.955 4.188) 13.734 23.883 ( -5.149 7.572 3.405) 9.770 23.971 ( -2.103 0.585 3.839) 4.416 24.489 ( 20.364 6.835 -4.709) 21.991 25.234 ( 6.294 -3.303 -1.083) 7.190 25.939 ( 0.765 -2.230 4.300) 4.904 26.093 ( 2.295 0.641 -3.416) 4.165 28.338 ( -7.633 -3.119 1.813) 8.442 28.485 ( -2.400 -0.108 -2.106) 3.195 ======================= Grid point 226 (98/117) ======================= q-point: (-0.40 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( -3.433 17.190 1.740) 17.615 2.664 ( 10.883 7.471 -12.414) 18.121 2.921 ( 3.464 8.174 18.885) 20.868 3.342 ( -0.875 20.366 1.821) 20.466 3.615 ( -17.294 19.592 -14.497) 29.885 3.722 ( 13.987 -4.713 4.434) 15.411 4.166 ( 4.467 -14.445 -0.213) 15.122 4.425 ( 1.325 6.002 -2.831) 6.767 4.584 ( -1.594 -1.624 -4.125) 4.711 4.782 ( -2.233 -5.614 8.284) 10.253 4.865 ( -3.413 -2.092 0.065) 4.004 5.084 ( 0.984 -1.596 2.166) 2.865 5.185 ( -5.401 12.449 6.157) 14.901 5.311 ( -2.942 8.934 -13.306) 16.295 5.545 ( 0.698 -3.424 -5.738) 6.718 5.655 ( 5.758 -5.109 10.103) 12.702 5.785 ( 1.735 -9.058 -0.494) 9.235 5.866 ( -4.167 5.349 -2.816) 7.342 5.913 ( 1.487 2.011 -1.533) 2.933 5.976 ( 8.323 -0.123 5.727) 10.104 6.172 ( -1.227 5.230 2.858) 6.085 6.253 ( -5.792 9.457 -1.634) 11.210 6.580 ( 1.678 5.594 -3.747) 6.939 6.646 ( 0.520 -4.153 -0.966) 4.296 6.683 ( 0.373 -2.204 10.846) 11.074 6.856 ( -10.306 1.375 -2.280) 10.644 7.355 ( -8.054 -4.503 -2.907) 9.674 7.394 ( -1.171 -6.202 -6.830) 9.300 7.575 ( -8.908 -4.776 -7.101) 12.353 7.717 ( -13.904 -1.262 3.189) 14.321 7.840 ( 3.261 -1.148 3.251) 4.745 7.935 ( -0.903 -2.860 4.120) 5.096 8.329 ( -4.006 0.803 0.402) 4.105 8.347 ( -9.472 2.301 2.045) 9.959 8.554 ( -2.850 -3.189 0.976) 4.387 8.571 ( -4.456 1.749 -5.906) 7.603 8.885 ( -6.953 4.039 1.424) 8.166 9.064 ( -0.791 -8.997 -7.130) 11.507 9.336 ( -4.077 -2.773 4.908) 6.957 9.480 ( -14.941 1.138 3.236) 15.330 9.559 ( -4.854 -11.955 7.416) 14.882 9.617 ( -2.040 -1.730 -1.299) 2.973 9.921 ( -4.251 2.090 5.880) 7.551 10.082 ( 12.214 -7.100 -6.330) 15.481 10.383 ( 3.348 -0.544 -8.352) 9.014 10.813 ( 18.424 -1.189 5.908) 19.385 11.306 ( 16.072 4.839 -5.353) 17.617 11.472 ( 24.587 3.798 1.411) 24.919 11.929 ( 7.908 -2.144 1.197) 8.280 12.112 ( -6.052 -0.250 7.086) 9.322 12.284 ( -4.954 -3.737 4.285) 7.542 12.451 ( -10.077 0.003 -3.541) 10.681 12.873 ( -1.630 4.263 -4.303) 6.272 13.062 ( 3.317 -1.232 -6.633) 7.518 13.250 ( -5.044 -5.790 -7.260) 10.568 13.556 ( -2.018 3.083 8.369) 9.144 14.530 ( -11.750 -5.281 4.595) 13.677 15.008 ( -3.802 -1.561 -1.013) 4.233 17.221 ( 1.878 -1.504 -1.776) 2.990 17.453 ( 4.518 1.819 0.834) 4.941 21.555 ( -8.553 4.883 0.641) 9.870 21.820 ( -11.321 -10.091 0.662) 15.180 23.099 ( -2.264 1.215 -9.436) 9.780 23.231 ( -13.300 -5.828 6.523) 15.918 23.706 ( -3.173 11.795 1.218) 12.275 23.920 ( -2.924 1.938 4.550) 5.745 24.837 ( 23.229 3.134 -3.634) 23.719 25.407 ( 10.299 -1.033 -1.336) 10.436 26.013 ( 3.841 -3.184 4.902) 6.995 26.140 ( 4.056 0.903 -4.380) 6.038 28.207 ( -10.619 -3.371 1.921) 11.306 28.436 ( -4.165 -2.838 -2.596) 5.670 ======================= Grid point 227 (99/117) ======================= q-point: (-0.30 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 12.476 13.764 14.978) 23.863 2.675 ( -9.657 13.709 1.684) 16.853 2.717 ( -7.062 17.483 4.579) 19.404 2.980 ( -13.149 26.237 -17.116) 33.974 3.358 ( 11.260 13.729 3.203) 18.042 3.748 ( -5.527 11.667 -1.930) 13.054 4.302 ( -4.180 -2.885 -7.588) 9.131 4.397 ( -2.263 -8.293 -1.282) 8.691 4.531 ( -14.549 12.637 0.289) 19.273 4.670 ( 0.956 1.468 -1.958) 2.627 4.806 ( -9.745 13.967 8.295) 18.943 4.858 ( -2.285 -0.731 -1.705) 2.943 5.096 ( 2.860 -1.049 1.887) 3.583 5.375 ( 15.854 -0.474 -0.785) 15.880 5.572 ( 4.435 1.382 -2.352) 5.207 5.724 ( 1.818 7.868 -1.891) 8.294 5.829 ( -0.243 1.363 -1.883) 2.338 5.907 ( 5.288 -2.850 2.684) 6.580 5.961 ( 1.756 -3.205 0.300) 3.667 6.078 ( -1.676 0.187 3.914) 4.262 6.225 ( 9.063 -12.469 6.576) 16.759 6.275 ( 6.252 -3.970 3.718) 8.287 6.542 ( -3.236 3.125 -8.714) 9.807 6.629 ( -5.165 -0.861 5.074) 7.292 6.705 ( -6.564 -4.256 -1.474) 7.961 6.743 ( 1.044 -6.144 2.606) 6.755 7.216 ( -9.212 0.472 2.639) 9.594 7.256 ( -19.931 -6.454 -2.303) 21.076 7.504 ( 0.761 -5.954 -5.429) 8.093 7.610 ( -4.601 -4.916 -3.853) 7.757 7.929 ( 3.009 -0.631 -0.964) 3.222 7.964 ( 3.404 -1.031 3.826) 5.224 8.227 ( -2.566 2.908 1.841) 4.293 8.242 ( -2.965 3.707 -5.693) 7.412 8.443 ( -4.101 3.464 -4.132) 6.774 8.538 ( -2.388 -2.968 2.631) 4.629 8.749 ( -6.762 -0.303 2.192) 7.115 9.055 ( -8.561 -1.819 0.187) 8.754 9.230 ( -8.843 -0.572 -0.483) 8.874 9.370 ( 1.751 -6.397 3.272) 7.396 9.563 ( 0.951 -4.619 0.801) 4.783 9.750 ( 2.591 -13.059 7.465) 15.263 9.795 ( -7.356 0.735 5.624) 9.289 10.303 ( 7.562 -3.029 -2.436) 8.502 10.484 ( 4.377 -4.132 -8.144) 10.127 11.017 ( 2.224 0.073 -6.091) 6.485 11.538 ( 15.234 3.650 0.844) 15.688 11.727 ( 9.476 6.149 -3.744) 11.900 11.945 ( -10.071 -4.101 7.040) 12.953 12.130 ( 5.782 -2.802 1.009) 6.504 12.327 ( -1.142 0.873 -0.414) 1.496 12.437 ( 16.425 -1.785 6.725) 17.838 12.773 ( -4.315 3.994 -2.282) 6.307 13.094 ( 0.243 0.784 -1.875) 2.047 13.242 ( -0.379 -4.520 -7.425) 8.701 13.462 ( -7.075 0.146 3.205) 7.769 14.396 ( -8.776 -5.935 1.846) 10.754 14.917 ( -7.968 -0.842 1.080) 8.085 17.287 ( 3.753 -1.321 0.066) 3.979 17.501 ( 2.459 1.731 -0.934) 3.149 21.312 ( -12.593 3.880 -2.018) 13.331 21.666 ( -19.439 -12.314 6.998) 24.052 22.971 ( -8.394 -1.040 -5.380) 10.025 23.114 ( -6.049 -2.707 -0.144) 6.629 23.554 ( -0.032 12.796 -1.899) 12.936 23.825 ( -4.395 5.209 5.946) 9.045 25.246 ( 23.166 -0.381 -1.923) 23.249 25.608 ( 10.819 -0.374 -0.076) 10.826 26.129 ( 5.535 -1.705 5.070) 7.697 26.225 ( 7.052 0.381 -6.584) 9.655 28.030 ( -11.350 -1.899 0.804) 11.536 28.385 ( -6.217 -5.744 -3.565) 9.184 ======================= Grid point 228 (100/117) ======================= q-point: (-0.20 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.684 ( 3.429 10.047 11.222) 15.448 2.147 ( -24.924 17.298 12.166) 32.687 2.362 ( -6.776 26.568 -12.259) 30.034 2.495 ( -12.908 21.909 0.504) 25.433 3.442 ( 9.142 16.561 -0.959) 18.941 3.649 ( 7.912 12.844 -6.798) 16.546 3.919 ( -9.596 21.739 -34.474) 41.870 4.059 ( -8.045 27.245 35.363) 45.360 4.516 ( -2.836 -6.022 5.791) 8.823 4.609 ( -4.418 -5.223 -5.802) 8.970 4.816 ( 1.810 -6.952 9.263) 11.722 4.904 ( 0.822 -7.656 -13.360) 15.420 5.233 ( 9.787 -2.481 -6.196) 11.846 5.531 ( -0.845 2.388 -2.490) 3.552 5.651 ( -4.393 7.396 -0.463) 8.614 5.722 ( 12.578 3.892 8.532) 15.689 5.743 ( -3.808 -3.648 8.112) 9.675 5.956 ( 7.153 1.773 -4.893) 8.846 6.122 ( -1.507 -8.839 -1.841) 9.154 6.134 ( 7.834 -7.176 2.023) 10.815 6.379 ( 1.429 1.427 1.462) 2.493 6.427 ( 1.988 -1.758 3.144) 4.115 6.514 ( -9.247 -1.059 5.123) 10.624 6.552 ( 0.739 -11.017 -5.163) 12.190 6.645 ( -1.618 -5.241 -2.604) 6.071 6.801 ( -2.615 -8.058 0.301) 8.477 7.048 ( -4.416 -4.872 2.504) 7.037 7.118 ( -5.606 -1.254 2.302) 6.188 7.523 ( -2.444 -5.054 -7.745) 9.566 7.583 ( -5.806 -7.772 2.561) 10.033 7.963 ( 2.407 -1.142 2.830) 3.886 8.040 ( 3.227 4.796 1.036) 5.873 8.163 ( -0.295 6.308 1.456) 6.481 8.192 ( 0.421 0.820 -9.959) 10.002 8.361 ( 0.421 2.320 -6.433) 6.852 8.548 ( -2.412 -3.901 3.309) 5.656 8.650 ( -1.691 2.823 -1.766) 3.735 8.870 ( -9.293 4.165 11.095) 15.060 9.144 ( -2.949 -3.090 2.160) 4.786 9.409 ( -11.612 -3.853 1.936) 12.387 9.604 ( 5.587 -3.927 4.632) 8.252 9.805 ( 5.281 -5.173 -5.289) 9.090 9.957 ( 7.906 -9.977 3.862) 13.303 10.448 ( 0.142 -1.161 -3.071) 3.286 10.532 ( 2.351 -3.370 -3.541) 5.424 10.914 ( -9.569 1.795 -4.163) 10.589 11.722 ( 3.363 0.782 -5.352) 6.369 11.768 ( 3.345 1.495 3.485) 5.056 11.940 ( 6.879 -1.374 3.306) 7.755 12.130 ( -5.600 -3.124 -0.014) 6.413 12.434 ( 9.553 2.067 4.076) 10.590 12.612 ( -1.447 5.853 -3.317) 6.882 12.818 ( 14.924 -2.158 5.587) 16.081 13.073 ( -0.302 2.879 5.900) 6.572 13.276 ( -1.476 -3.781 -9.952) 10.748 13.322 ( -8.526 -2.324 -0.156) 8.839 14.364 ( 0.544 -4.727 -1.723) 5.060 14.733 ( -13.133 -0.756 3.308) 13.564 17.373 ( 4.598 -0.296 1.356) 4.803 17.501 ( -0.689 1.512 -2.027) 2.621 21.068 ( -9.273 1.824 -1.086) 9.513 21.360 ( -24.816 -8.198 7.825) 27.282 22.888 ( -1.548 -2.022 -5.324) 5.902 23.021 ( -6.889 -2.564 -0.200) 7.353 23.471 ( 4.294 11.360 -5.201) 13.212 23.669 ( -6.046 8.189 7.080) 12.399 25.621 ( 15.056 -2.357 -2.702) 15.477 25.777 ( 5.545 -1.616 3.579) 6.795 26.269 ( 8.844 -1.364 6.754) 11.212 26.372 ( 8.417 -0.585 -8.601) 12.049 27.888 ( -2.502 0.119 -3.577) 4.367 28.285 ( -12.591 -6.709 -3.582) 14.709 ======================= Grid point 229 (101/117) ======================= q-point: (-0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( 1.561 10.205 -25.842) 27.828 1.646 ( -1.561 10.205 25.842) 27.828 2.095 ( 5.745 24.177 -33.215) 41.482 2.095 ( -5.745 24.177 33.215) 41.482 3.432 ( -8.209 19.548 -44.035) 48.873 3.432 ( 8.209 19.548 44.035) 48.873 3.776 ( 5.007 11.750 -10.041) 16.247 3.776 ( -5.007 11.750 10.041) 16.247 4.560 ( -5.817 -5.465 -2.887) 8.488 4.560 ( 5.817 -5.465 2.887) 8.488 4.934 ( -1.522 -4.401 -16.278) 16.931 4.934 ( 1.522 -4.401 16.278) 16.931 5.452 ( 10.722 0.852 -8.352) 13.618 5.452 ( -10.722 0.852 8.352) 13.618 5.562 ( 2.884 1.040 -9.715) 10.188 5.562 ( -2.884 1.040 9.715) 10.188 6.023 ( -10.649 -3.741 -4.886) 12.299 6.023 ( 10.649 -3.741 4.886) 12.299 6.222 ( 7.991 -3.998 -11.704) 14.725 6.222 ( -7.991 -3.998 11.704) 14.725 6.374 ( -2.055 0.338 -1.671) 2.671 6.374 ( 2.055 0.338 1.671) 2.671 6.489 ( -4.738 -0.042 -7.419) 8.803 6.489 ( 4.738 -0.042 7.419) 8.803 6.824 ( -1.347 -8.848 -0.393) 8.959 6.824 ( 1.347 -8.848 0.393) 8.959 7.099 ( 1.297 -8.192 -2.873) 8.778 7.099 ( -1.297 -8.192 2.873) 8.778 7.561 ( 2.186 -4.727 -11.085) 12.248 7.561 ( -2.186 -4.727 11.085) 12.248 8.005 ( -1.111 6.768 -10.278) 12.356 8.005 ( 1.111 6.768 10.278) 12.356 8.135 ( -4.262 0.299 -1.482) 4.522 8.135 ( 4.262 0.299 1.482) 4.522 8.464 ( 9.029 -1.521 -10.332) 13.805 8.464 ( -9.029 -1.521 10.332) 13.805 8.653 ( 7.804 8.531 -12.366) 16.929 8.653 ( -7.804 8.531 12.366) 16.929 9.212 ( -6.166 -1.988 -3.983) 7.606 9.212 ( 6.166 -1.988 3.983) 7.606 9.833 ( -8.927 -5.377 -8.760) 13.613 9.833 ( 8.927 -5.377 8.760) 13.613 10.249 ( -4.963 -2.867 -7.506) 9.445 10.249 ( 4.963 -2.867 7.506) 9.445 10.715 ( -6.837 -0.208 -2.978) 7.460 10.715 ( 6.837 -0.208 2.978) 7.460 11.765 ( 4.152 0.141 -12.916) 13.568 11.765 ( -4.152 0.141 12.916) 13.568 12.069 ( -4.031 -0.680 -2.301) 4.691 12.069 ( 4.031 -0.680 2.301) 4.691 12.532 ( -2.080 2.436 -6.437) 7.190 12.532 ( 2.080 2.436 6.437) 7.190 13.025 ( 4.152 1.564 -4.939) 6.639 13.025 ( -4.152 1.564 4.939) 6.639 13.259 ( -0.056 -3.017 -8.662) 9.172 13.259 ( 0.056 -3.017 8.662) 9.172 14.511 ( -3.875 -2.269 -0.371) 4.506 14.511 ( 3.875 -2.269 0.371) 4.506 17.447 ( -3.295 0.720 -1.912) 3.877 17.447 ( 3.295 0.720 1.912) 3.877 21.051 ( -10.791 -1.300 0.735) 10.894 21.051 ( 10.791 -1.300 -0.735) 10.894 22.938 ( 2.087 -2.574 -4.204) 5.353 22.938 ( -2.087 -2.574 4.204) 5.353 23.474 ( 5.620 8.293 -7.673) 12.619 23.474 ( -5.620 8.293 7.673) 12.619 25.807 ( 3.537 -1.458 -5.115) 6.388 25.807 ( -3.537 -1.458 5.115) 6.388 26.438 ( -3.608 -2.027 -6.921) 8.064 26.438 ( 3.608 -2.027 6.921) 8.064 28.037 ( -17.512 -2.502 2.121) 17.816 28.037 ( 17.512 -2.502 -2.121) 17.816 ======================= Grid point 233 (102/117) ======================= q-point: ( 0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.183 ( 33.947 0.000 31.240) 46.134 2.279 ( -6.608 -0.000 9.987) 11.975 2.598 ( 9.810 0.000 -16.408) 19.117 3.200 ( 27.432 0.000 20.367) 34.166 3.681 ( 25.555 0.000 -18.229) 31.390 3.709 ( -6.831 -0.000 -15.748) 17.165 3.861 ( -14.338 -0.000 -3.313) 14.716 4.387 ( -19.502 -0.000 14.250) 24.153 4.715 ( -1.934 -0.000 4.340) 4.752 4.788 ( -13.023 -0.000 -4.707) 13.847 4.846 ( 2.757 0.000 -5.257) 5.937 4.858 ( 7.199 0.000 5.796) 9.242 5.201 ( 0.923 0.000 1.647) 1.888 5.403 ( -0.321 -0.000 1.910) 1.937 5.415 ( 14.805 0.000 -1.042) 14.841 5.651 ( -4.976 -0.000 -4.393) 6.638 5.722 ( -0.411 -0.000 -3.460) 3.485 5.775 ( -0.713 -0.000 -7.462) 7.496 5.944 ( 9.411 0.000 12.201) 15.409 5.967 ( 1.751 0.000 -3.203) 3.651 6.140 ( -1.144 -0.000 -13.564) 13.612 6.165 ( -2.019 -0.000 -0.119) 2.023 6.654 ( -1.452 -0.000 -0.552) 1.554 6.797 ( -2.779 -0.000 7.813) 8.293 6.862 ( 4.114 0.000 0.800) 4.191 7.162 ( 8.803 0.000 3.511) 9.477 7.564 ( 2.260 0.000 0.518) 2.319 7.733 ( -7.491 -0.000 10.611) 12.989 7.809 ( 2.524 0.000 -2.693) 3.691 7.861 ( 0.818 0.000 -4.505) 4.579 7.951 ( 2.697 0.000 6.596) 7.126 8.034 ( 12.565 0.000 -1.453) 12.648 8.284 ( 3.544 0.000 6.518) 7.419 8.409 ( 2.064 0.000 4.694) 5.128 8.424 ( 1.079 0.000 -5.965) 6.062 8.570 ( 17.896 0.000 -2.549) 18.077 8.810 ( 0.879 0.000 -9.412) 9.453 9.148 ( -7.770 -0.000 4.314) 8.887 9.424 ( 1.670 0.000 -0.031) 1.671 9.541 ( -1.735 -0.000 -8.159) 8.341 9.661 ( 4.780 0.000 10.988) 11.982 9.914 ( -6.892 -0.000 -4.855) 8.431 10.019 ( -11.216 -0.000 4.984) 12.273 10.168 ( 19.209 0.000 -10.859) 22.066 10.457 ( -17.874 -0.000 -1.915) 17.976 10.500 ( -4.788 -0.000 8.701) 9.931 10.947 ( -18.749 -0.000 -0.646) 18.760 10.958 ( -17.789 -0.000 -3.703) 18.170 11.882 ( 3.804 0.000 11.050) 11.687 12.190 ( 3.223 0.000 -14.227) 14.588 12.520 ( -3.550 -0.000 14.426) 14.856 12.583 ( 4.612 0.000 -15.714) 16.377 12.714 ( 11.513 0.000 -5.865) 12.921 13.024 ( -4.084 -0.000 9.173) 10.041 13.453 ( 6.686 0.000 15.920) 17.267 13.466 ( -6.825 -0.000 -11.558) 13.423 14.878 ( 6.890 0.000 -3.617) 7.781 15.016 ( -4.607 -0.000 2.904) 5.446 17.282 ( 1.219 0.000 2.510) 2.790 17.331 ( -5.476 -0.000 -2.667) 6.091 21.498 ( 4.192 0.000 1.521) 4.460 22.394 ( -2.235 -0.000 -4.830) 5.322 22.967 ( 1.733 0.000 -2.137) 2.751 23.329 ( -0.129 -0.000 3.519) 3.522 23.700 ( 14.627 0.000 -3.446) 15.028 23.882 ( 8.564 0.000 -2.540) 8.933 24.747 ( -11.455 -0.000 10.268) 15.383 25.023 ( -7.683 -0.000 0.063) 7.684 25.991 ( -3.943 -0.000 4.516) 5.995 26.107 ( -1.625 -0.000 -5.777) 6.001 28.486 ( -3.847 -0.000 3.635) 5.293 28.487 ( 6.005 0.000 -4.023) 7.228 ======================= Grid point 234 (103/117) ======================= q-point: ( 0.30 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( 36.675 -7.916 22.219) 43.605 2.282 ( 3.669 -1.800 -4.126) 5.807 2.740 ( 9.481 4.933 -10.781) 15.181 3.413 ( -14.156 5.278 6.919) 16.617 3.591 ( 1.435 5.041 1.432) 5.434 3.823 ( 15.184 -7.622 3.162) 17.282 3.958 ( -8.700 -4.015 2.264) 9.845 4.170 ( 11.502 -4.727 -13.494) 18.350 4.545 ( -8.256 3.973 -2.163) 9.414 4.748 ( -1.066 -2.727 5.845) 6.537 4.942 ( 5.832 -2.483 -4.213) 7.611 4.965 ( 2.172 -4.262 4.614) 6.646 5.197 ( -1.582 2.409 5.814) 6.489 5.396 ( 1.727 5.345 -0.963) 5.699 5.424 ( -11.295 1.265 -4.263) 12.138 5.517 ( -2.324 -2.105 -0.046) 3.136 5.752 ( 2.159 -1.886 -4.799) 5.590 5.844 ( 4.893 -2.042 -6.415) 8.323 6.026 ( 2.859 3.125 -3.654) 5.594 6.087 ( 0.856 5.497 -6.732) 8.733 6.155 ( 3.599 -5.370 10.035) 11.937 6.166 ( 3.797 -2.491 -8.866) 9.961 6.628 ( -2.220 -0.395 0.848) 2.409 6.747 ( -1.806 1.638 7.896) 8.263 6.956 ( 8.929 5.457 -1.551) 10.579 7.326 ( 8.671 1.924 3.514) 9.552 7.555 ( -3.791 1.659 -0.375) 4.156 7.567 ( -5.904 4.645 10.157) 12.633 7.759 ( -5.755 0.656 -6.934) 9.035 7.900 ( 2.478 2.320 -0.362) 3.414 7.946 ( -3.619 0.552 8.455) 9.214 8.145 ( -2.116 4.905 1.139) 5.462 8.314 ( -3.692 -5.714 -2.723) 7.328 8.348 ( -4.721 -4.590 0.632) 6.615 8.482 ( 0.946 -5.771 -4.874) 7.613 8.705 ( -9.900 -0.227 3.704) 10.573 8.968 ( 17.109 -2.847 -3.548) 17.703 9.126 ( 3.862 -3.937 2.321) 5.983 9.411 ( -1.202 1.432 -0.099) 1.872 9.452 ( -12.706 -0.648 -5.812) 13.987 9.584 ( -17.986 0.428 2.006) 18.103 9.798 ( 8.590 -0.221 -0.018) 8.592 9.944 ( 4.640 2.391 5.226) 7.387 10.249 ( -4.500 4.567 -3.150) 7.143 10.339 ( -13.125 -0.807 11.033) 17.165 10.595 ( -16.512 0.215 -8.053) 18.373 10.616 ( 24.122 -0.999 -6.057) 24.891 10.801 ( 4.736 1.905 -0.218) 5.110 11.943 ( 2.790 4.481 10.203) 11.487 12.212 ( -1.835 -3.048 -8.912) 9.596 12.419 ( -7.972 -0.865 12.811) 15.114 12.699 ( 7.959 -1.677 -12.796) 15.162 12.887 ( 7.232 0.714 -9.859) 12.247 12.932 ( -5.855 0.560 7.803) 9.772 13.301 ( -10.793 -2.557 -13.590) 17.542 13.588 ( 6.774 1.375 16.394) 17.792 14.867 ( -8.964 1.880 3.749) 9.897 14.975 ( 1.076 -2.410 -2.772) 3.827 17.235 ( -4.150 0.205 -2.915) 5.076 17.332 ( 4.034 0.437 2.379) 4.704 21.563 ( 1.911 -1.847 0.395) 2.687 22.263 ( -8.383 4.727 0.795) 9.657 23.024 ( 3.605 -1.310 -8.025) 8.894 23.328 ( -3.818 -5.077 4.152) 7.589 23.910 ( 7.502 0.166 0.923) 7.560 24.009 ( 5.522 0.695 -1.541) 5.775 24.598 ( 1.237 10.084 4.726) 11.205 24.987 ( -0.516 -7.426 -0.734) 7.480 25.929 ( -3.143 -0.278 4.597) 5.576 26.087 ( 0.162 0.300 -4.524) 4.537 28.402 ( -5.925 -0.610 2.056) 6.301 28.533 ( -0.036 0.648 -2.690) 2.767 ======================= Grid point 235 (104/117) ======================= q-point: (-0.60 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( -2.784 10.609 -9.115) 14.261 2.597 ( 15.673 -7.305 4.490) 17.865 2.862 ( 11.475 2.544 -1.536) 11.853 3.221 ( 6.869 7.247 10.866) 14.758 3.624 ( 6.822 -3.812 0.660) 7.842 3.829 ( -0.895 -0.047 1.212) 1.507 4.243 ( 6.453 0.024 -0.618) 6.483 4.387 ( 13.078 -1.361 4.771) 13.987 4.501 ( -0.563 -7.587 -3.610) 8.420 4.648 ( -3.231 6.416 -4.493) 8.473 4.957 ( -6.277 -5.819 11.112) 14.026 5.105 ( 5.395 -5.453 -7.180) 10.506 5.140 ( -4.010 4.842 5.552) 8.387 5.258 ( -4.973 -6.106 -4.253) 8.950 5.396 ( -0.807 3.914 2.147) 4.536 5.476 ( -1.336 -1.751 -0.483) 2.254 5.825 ( 5.140 0.860 -10.392) 11.626 5.923 ( 2.305 1.632 1.209) 3.072 5.991 ( -0.516 3.009 -8.919) 9.428 6.005 ( -0.766 6.767 -2.715) 7.332 6.261 ( 2.996 -2.755 -5.313) 6.693 6.305 ( 5.431 -9.557 2.332) 11.237 6.585 ( -1.865 1.187 2.694) 3.485 6.714 ( -2.479 -0.017 9.727) 10.038 7.016 ( 6.329 14.693 -5.223) 16.829 7.296 ( -9.483 11.480 6.078) 16.083 7.423 ( -2.511 3.845 -1.048) 4.711 7.490 ( -5.312 -0.051 -1.829) 5.618 7.618 ( -8.413 0.393 -3.632) 9.172 7.813 ( -3.738 3.197 2.142) 5.365 7.868 ( -5.654 0.510 5.866) 8.163 7.978 ( -7.899 3.842 3.909) 9.614 8.309 ( -5.281 -8.502 -0.863) 10.045 8.364 ( -3.488 -12.729 -0.152) 13.199 8.474 ( -8.232 -3.411 1.477) 9.032 8.550 ( -4.811 -6.219 -3.485) 8.601 9.048 ( -16.632 1.873 2.805) 16.971 9.144 ( -6.533 -3.351 1.024) 7.413 9.307 ( 3.942 -0.481 -2.248) 4.563 9.393 ( -4.550 -0.918 -0.197) 4.646 9.502 ( 11.018 -3.989 -5.882) 13.112 9.774 ( -13.278 -3.481 1.803) 13.845 9.949 ( -7.542 6.243 -0.006) 9.791 10.065 ( -9.180 1.171 5.000) 10.519 10.368 ( 15.587 0.865 7.138) 17.165 10.452 ( 4.543 1.118 -8.794) 9.961 11.030 ( 20.801 1.167 -3.323) 21.097 11.080 ( 26.571 1.728 1.075) 26.649 11.905 ( -1.478 4.712 4.766) 6.863 12.185 ( -3.368 -2.604 -0.038) 4.257 12.278 ( -10.833 -3.857 8.690) 14.414 12.737 ( -7.479 5.242 0.479) 9.146 12.893 ( 5.737 -3.772 -8.977) 11.302 12.957 ( 1.045 0.803 -10.790) 10.870 13.156 ( -8.486 -7.393 -9.788) 14.915 13.667 ( 2.822 3.558 14.403) 15.102 14.659 ( -13.115 -0.983 5.858) 14.397 14.994 ( -0.959 -1.962 -2.755) 3.516 17.184 ( -1.356 -0.571 -2.115) 2.577 17.414 ( 5.623 1.524 1.154) 5.939 21.599 ( -1.098 -3.510 0.380) 3.698 22.030 ( -11.877 5.144 0.643) 12.959 23.088 ( 2.316 -1.314 -9.627) 9.989 23.268 ( -9.487 -5.944 5.191) 12.340 23.964 ( 0.385 1.050 4.235) 4.380 24.030 ( -0.775 4.733 1.275) 4.963 24.659 ( 15.894 9.673 -1.156) 18.642 25.122 ( 6.606 -7.654 -1.772) 10.265 25.904 ( -0.414 -1.257 5.126) 5.294 26.104 ( 2.482 0.456 -3.820) 4.579 28.289 ( -8.079 -1.864 1.165) 8.373 28.484 ( -4.418 -0.005 -1.770) 4.759 ======================= Grid point 236 (105/117) ======================= q-point: (-0.50 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.001 ( 0.278 18.707 -2.226) 18.841 2.770 ( 8.877 2.417 -3.489) 9.839 3.027 ( 7.326 3.299 9.335) 12.316 3.566 ( 23.185 -3.575 3.757) 23.758 3.773 ( 4.479 17.181 -0.894) 17.778 3.833 ( 2.108 -10.984 -3.778) 11.805 4.067 ( -10.508 18.918 -6.670) 22.645 4.479 ( 6.106 -3.851 -2.737) 7.720 4.595 ( 3.520 0.540 5.445) 6.506 4.758 ( -11.392 3.778 5.055) 13.023 4.872 ( -3.677 -2.632 -2.237) 5.045 4.930 ( -3.402 -7.349 8.169) 11.503 5.231 ( 2.777 -12.323 -7.493) 14.687 5.327 ( 0.123 0.441 2.936) 2.972 5.395 ( 4.449 -11.876 -1.141) 12.733 5.484 ( -0.239 1.952 4.653) 5.052 5.868 ( 2.735 5.744 -7.391) 9.752 5.925 ( -0.431 0.775 -6.010) 6.075 5.952 ( 1.647 2.341 1.675) 3.316 5.999 ( 5.603 3.670 -4.242) 7.929 6.301 ( 0.786 3.116 1.549) 3.567 6.474 ( 1.140 2.409 -0.237) 2.676 6.547 ( -0.522 0.248 1.415) 1.528 6.648 ( -3.962 -1.255 9.715) 10.567 6.850 ( -3.287 20.209 -4.122) 20.885 6.970 ( -8.773 11.206 -0.525) 14.241 7.277 ( -13.063 -2.457 -1.306) 13.356 7.355 ( -1.987 2.801 -5.324) 6.335 7.493 ( -10.741 -3.274 -2.131) 11.429 7.706 ( -8.920 1.058 1.477) 9.103 7.829 ( 2.532 0.283 2.814) 3.796 7.875 ( -1.440 -3.517 2.701) 4.662 8.276 ( -6.295 -4.808 4.192) 8.962 8.347 ( -6.713 -4.195 0.904) 7.967 8.440 ( -4.113 -8.578 -0.937) 9.559 8.525 ( -3.108 -5.346 -2.493) 6.667 8.894 ( -3.000 -6.323 -2.905) 7.577 8.977 ( -10.748 3.127 -0.104) 11.194 9.293 ( -5.648 -1.796 3.209) 6.740 9.343 ( -2.446 -5.315 -0.507) 5.873 9.466 ( -13.664 -3.162 7.327) 15.824 9.672 ( -9.186 3.177 -0.149) 9.721 9.914 ( 8.909 -7.321 -5.618) 12.827 9.925 ( -5.824 -1.827 2.831) 6.728 10.440 ( 5.325 4.808 -10.606) 12.805 10.788 ( 18.035 -1.305 9.812) 20.573 11.392 ( 19.121 3.635 -7.476) 20.850 11.539 ( 25.156 3.168 2.472) 25.475 11.871 ( -0.425 -2.420 5.328) 5.867 12.121 ( -8.148 -1.264 6.281) 10.365 12.179 ( -0.040 -4.556 1.182) 4.707 12.505 ( -10.298 4.942 -5.081) 12.501 12.899 ( -5.311 -2.483 -1.140) 5.973 13.045 ( 7.132 0.154 -10.878) 13.008 13.109 ( -5.113 -7.694 -6.519) 11.306 13.632 ( -3.557 3.907 9.926) 11.244 14.446 ( -12.636 -3.249 4.808) 13.905 14.978 ( -2.609 -1.337 -0.683) 3.010 17.196 ( 1.807 -1.076 -0.118) 2.107 17.495 ( 5.106 2.262 -0.966) 5.667 21.573 ( -6.523 -3.809 2.080) 7.835 21.744 ( -15.253 2.699 -1.574) 15.570 23.095 ( -5.967 -1.575 -7.765) 9.919 23.127 ( -7.864 -4.246 3.862) 9.736 23.931 ( -1.210 10.171 0.738) 10.269 23.947 ( -0.778 1.664 5.124) 5.443 24.925 ( 20.472 5.331 -2.032) 21.252 25.340 ( 9.942 -5.561 -1.628) 11.507 25.953 ( 3.409 -2.586 5.411) 6.898 26.158 ( 4.391 0.859 -3.936) 5.959 28.150 ( -9.606 -2.391 0.555) 9.915 28.388 ( -6.732 -1.973 -1.298) 7.134 ======================= Grid point 237 (106/117) ======================= q-point: (-0.40 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( 12.082 19.618 9.336) 24.859 2.877 ( 2.689 7.376 -7.471) 10.837 3.018 ( -1.493 13.484 17.905) 22.464 3.479 ( -15.392 22.533 -18.735) 33.101 3.723 ( 12.148 21.843 0.739) 25.004 3.920 ( 3.852 3.864 2.011) 5.815 4.091 ( 4.905 -13.735 -3.476) 14.993 4.292 ( -10.122 0.076 -6.472) 12.014 4.535 ( -4.598 -2.070 -6.013) 7.848 4.696 ( 0.130 -0.006 8.078) 8.079 4.842 ( -1.930 -2.863 3.611) 4.996 5.010 ( -3.016 0.007 0.207) 3.023 5.350 ( 2.298 14.772 3.562) 15.368 5.385 ( 7.481 -1.611 3.652) 8.479 5.496 ( 5.018 -9.130 -3.415) 10.964 5.647 ( 2.543 -20.802 -0.381) 20.961 5.831 ( 4.543 9.366 2.503) 10.706 5.870 ( -0.311 4.551 -4.499) 6.407 5.975 ( 1.015 2.729 -1.367) 3.217 6.113 ( 7.267 0.404 0.270) 7.283 6.251 ( -6.682 15.360 -0.140) 16.751 6.260 ( 3.904 6.269 4.220) 8.506 6.577 ( -0.059 -5.849 -3.153) 6.645 6.629 ( -5.695 -1.321 5.488) 8.018 6.682 ( -2.456 5.171 2.977) 6.452 6.728 ( -7.612 8.251 0.156) 11.227 7.107 ( -14.798 -6.896 -4.327) 16.889 7.221 ( -8.940 -0.180 0.638) 8.964 7.399 ( 0.749 -3.560 -4.207) 5.562 7.569 ( -6.249 -0.261 -3.068) 6.966 7.904 ( 1.231 -2.101 2.561) 3.534 7.932 ( 6.179 -1.823 -0.916) 6.507 8.200 ( -5.402 -3.633 2.636) 7.023 8.298 ( -2.050 -0.486 -0.681) 2.214 8.410 ( -5.023 -4.778 -1.131) 7.024 8.521 ( -2.836 -2.130 1.483) 3.844 8.747 ( -10.145 1.308 -0.960) 10.274 8.947 ( -1.943 -8.287 -6.834) 10.915 9.214 ( -7.449 -3.063 11.403) 13.960 9.297 ( -5.410 -0.411 -0.771) 5.480 9.370 ( -3.197 -11.761 6.143) 13.648 9.588 ( 0.145 -3.922 -4.599) 6.046 9.784 ( -7.592 -1.724 5.684) 9.639 10.175 ( 6.937 -10.119 -3.629) 12.794 10.491 ( 5.291 3.786 -5.009) 8.211 11.008 ( 3.555 -0.715 -2.419) 4.359 11.615 ( 12.159 4.078 -0.224) 12.827 11.809 ( 1.602 -0.099 -7.766) 7.930 11.870 ( -0.403 -0.938 8.264) 8.327 12.053 ( -2.723 -4.709 0.514) 5.464 12.362 ( 1.711 2.158 -0.966) 2.919 12.395 ( 18.902 -1.943 5.819) 19.873 12.812 ( -6.274 -0.818 1.097) 6.421 13.067 ( -3.473 -4.600 -5.283) 7.819 13.171 ( 5.408 -0.495 -4.466) 7.031 13.489 ( -9.201 1.960 4.156) 10.285 14.294 ( -7.757 -4.325 -0.219) 8.884 14.909 ( -6.419 0.121 2.729) 6.976 17.265 ( 4.655 -0.831 2.299) 5.258 17.545 ( 2.965 2.587 -3.319) 5.148 21.390 ( -14.254 3.722 -0.633) 14.745 21.470 ( -16.930 -7.566 2.053) 18.657 22.936 ( -8.924 -2.231 0.654) 9.222 23.071 ( -4.863 -1.858 -4.785) 7.071 23.811 ( 0.665 12.886 -1.834) 13.033 23.908 ( -1.421 3.799 5.906) 7.165 25.261 ( 19.841 1.366 -1.308) 19.931 25.564 ( 9.199 -3.986 0.354) 10.032 26.077 ( 6.405 -3.097 5.228) 8.829 26.238 ( 5.808 0.766 -5.197) 7.831 27.997 ( -8.936 -1.446 -0.743) 9.083 28.285 ( -8.164 -4.407 -0.876) 9.319 ======================= Grid point 238 (107/117) ======================= q-point: (-0.30 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 8.929 18.702 12.263) 24.080 2.522 ( -22.194 19.709 -0.720) 29.690 2.801 ( -3.769 20.655 20.263) 29.179 2.982 ( -10.797 26.027 -24.422) 37.288 3.763 ( 12.284 16.587 -0.221) 20.642 3.910 ( 8.159 12.409 -8.156) 16.943 4.174 ( 0.502 -3.921 -3.420) 5.227 4.368 ( 2.701 -4.267 -0.186) 5.054 4.500 ( -1.012 4.258 3.734) 5.753 4.705 ( -9.805 1.147 0.211) 9.874 4.750 ( 1.806 8.683 -6.294) 10.875 4.823 ( -3.496 9.651 7.321) 12.608 5.251 ( 6.422 9.703 -3.964) 12.293 5.549 ( 2.949 -2.093 -5.265) 6.387 5.607 ( -0.374 -5.445 10.852) 12.148 5.810 ( -1.788 2.228 -0.537) 2.906 5.874 ( 5.816 4.092 -3.205) 7.800 5.896 ( 0.865 -12.684 2.724) 13.002 5.965 ( -0.870 -0.034 1.209) 1.489 6.044 ( 2.262 3.917 -0.922) 4.616 6.234 ( 3.325 -6.536 -1.001) 7.402 6.391 ( 8.019 -2.477 0.784) 8.429 6.459 ( -10.530 -0.686 5.476) 11.889 6.558 ( -4.448 -0.499 3.511) 5.689 6.578 ( -1.077 4.744 -3.354) 5.909 6.676 ( -3.251 -4.869 0.858) 5.917 6.948 ( -3.591 -4.990 -2.053) 6.481 7.127 ( -5.444 1.097 3.017) 6.320 7.423 ( -3.276 -5.738 4.749) 8.137 7.471 ( -4.783 -2.063 -9.230) 10.598 7.948 ( 2.626 -0.688 5.141) 5.813 8.067 ( 4.239 -0.874 -5.285) 6.832 8.185 ( -0.183 -3.382 1.391) 3.661 8.235 ( -1.891 1.591 -5.491) 6.021 8.416 ( -0.787 -2.202 -3.838) 4.494 8.443 ( -4.572 -0.806 3.747) 5.966 8.661 ( 1.077 -1.782 -3.571) 4.134 8.907 ( -6.993 -1.063 6.474) 9.589 9.116 ( -3.106 -0.469 6.437) 7.162 9.288 ( -4.602 -7.059 -2.265) 8.726 9.465 ( -1.392 -11.342 4.988) 12.468 9.564 ( -7.191 -11.343 -2.203) 13.610 9.876 ( 14.313 -3.877 -1.506) 14.905 10.346 ( -0.550 -9.463 -0.263) 9.483 10.538 ( 4.947 3.183 2.393) 6.351 10.931 ( -9.934 0.650 -9.623) 13.846 11.706 ( -1.663 -2.658 -7.811) 8.417 11.790 ( 1.211 0.663 5.916) 6.075 11.924 ( 5.369 -0.220 3.147) 6.228 12.068 ( 0.307 -2.735 -1.036) 2.940 12.463 ( 7.449 0.653 1.114) 7.560 12.692 ( -6.434 1.111 1.314) 6.661 12.788 ( 20.203 -0.389 6.453) 21.212 13.073 ( 0.114 -4.226 0.810) 4.304 13.228 ( -0.446 0.598 -3.294) 3.378 13.294 ( -10.738 -0.676 -1.598) 10.877 14.284 ( 3.711 -3.245 -5.670) 7.513 14.732 ( -13.083 0.752 6.079) 14.446 17.373 ( 6.269 0.294 4.095) 7.494 17.541 ( -0.570 2.433 -4.938) 5.534 21.108 ( -11.326 2.156 -1.604) 11.641 21.221 ( -17.470 -5.794 3.743) 18.782 22.855 ( -1.735 -1.387 -1.404) 2.628 22.980 ( -6.385 -1.723 -2.049) 6.924 23.713 ( 2.812 12.914 -4.700) 14.028 23.819 ( -3.121 7.345 6.726) 10.437 25.578 ( 13.875 -2.107 -2.563) 14.266 25.727 ( 4.155 -3.470 3.728) 6.573 26.235 ( 7.467 -2.349 6.590) 10.233 26.345 ( 5.249 -1.713 -7.115) 9.006 27.890 ( -1.834 0.053 -3.699) 4.129 28.165 ( -11.000 -5.396 0.415) 12.259 ======================= Grid point 239 (108/117) ======================= q-point: (-0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 107 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.955 ( -4.487 20.089 -19.258) 28.188 1.955 ( 4.487 20.089 19.258) 28.188 2.584 ( -1.773 25.168 -29.436) 38.769 2.584 ( 1.773 25.168 29.436) 38.769 3.803 ( -1.561 15.713 -4.066) 16.306 3.803 ( 1.561 15.713 4.066) 16.306 4.189 ( 13.234 25.586 -28.859) 40.776 4.189 ( -13.234 25.586 28.859) 40.776 4.463 ( -7.097 -1.427 -6.394) 9.658 4.463 ( 7.097 -1.427 6.394) 9.658 4.813 ( -2.276 -6.283 -8.813) 11.060 4.813 ( 2.276 -6.283 8.813) 11.060 5.418 ( 10.438 -2.676 -12.997) 16.883 5.418 ( -10.438 -2.676 12.997) 16.883 5.663 ( -4.838 6.417 -4.336) 9.132 5.663 ( 4.838 6.417 4.336) 9.132 5.958 ( -3.705 -2.010 -3.788) 5.667 5.958 ( 3.705 -2.010 3.788) 5.667 6.101 ( 6.144 -8.827 -9.402) 14.286 6.101 ( -6.144 -8.827 9.402) 14.286 6.330 ( 3.225 -4.422 -4.765) 7.257 6.330 ( -3.225 -4.422 4.765) 7.257 6.500 ( -1.826 0.929 -3.211) 3.809 6.500 ( 1.826 0.929 3.211) 3.809 6.636 ( -0.621 -6.875 -4.152) 8.055 6.636 ( 0.621 -6.875 4.152) 8.055 7.018 ( 2.036 -1.865 -1.397) 3.095 7.018 ( -2.036 -1.865 1.397) 3.095 7.448 ( 0.201 -5.536 -10.742) 12.086 7.448 ( -0.201 -5.536 10.742) 12.086 8.030 ( -2.133 -0.358 -7.771) 8.067 8.030 ( 2.133 -0.358 7.771) 8.067 8.214 ( -0.491 2.996 -4.969) 5.823 8.214 ( 0.491 2.996 4.969) 5.823 8.420 ( 3.062 -2.931 -6.898) 8.096 8.420 ( -3.062 -2.931 6.898) 8.096 8.764 ( 8.467 2.489 -14.055) 16.596 8.764 ( -8.467 2.489 14.055) 16.596 9.169 ( -7.543 -2.185 -8.370) 11.478 9.169 ( 7.543 -2.185 8.370) 11.478 9.620 ( -3.616 -14.363 -2.920) 15.096 9.620 ( 3.616 -14.363 2.920) 15.096 10.221 ( -16.824 -2.847 0.680) 17.077 10.221 ( 16.824 -2.847 -0.680) 17.077 10.703 ( -11.307 -0.030 -5.461) 12.557 10.703 ( 11.307 -0.030 5.461) 12.557 11.753 ( 4.436 -1.791 -13.368) 14.198 11.753 ( -4.436 -1.791 13.368) 14.198 12.051 ( -5.012 -0.808 -1.797) 5.385 12.051 ( 5.012 -0.808 1.797) 5.385 12.574 ( -2.204 1.327 -4.735) 5.389 12.574 ( 2.204 1.327 4.735) 5.389 13.073 ( 2.470 2.969 -4.993) 6.313 13.073 ( -2.470 2.969 4.993) 6.313 13.179 ( 3.623 -4.820 -3.395) 6.919 13.179 ( -3.623 -4.820 3.395) 6.919 14.473 ( 9.642 -1.171 -5.522) 11.172 14.473 ( -9.642 -1.171 5.522) 11.172 17.469 ( -3.917 1.528 -4.995) 6.529 17.469 ( 3.917 1.528 4.995) 6.529 21.028 ( -4.127 -0.968 -0.011) 4.239 21.028 ( 4.127 -0.968 0.011) 4.239 22.894 ( 0.287 -1.779 -5.168) 5.473 22.894 ( -0.287 -1.779 5.168) 5.473 23.663 ( 4.027 10.559 -7.775) 13.717 23.663 ( -4.027 10.559 7.775) 13.717 25.765 ( 2.594 -2.850 -6.504) 7.559 25.765 ( -2.594 -2.850 6.504) 7.559 26.386 ( -3.461 -3.138 -9.331) 10.435 26.386 ( 3.461 -3.138 9.331) 10.435 27.987 ( -1.963 -2.413 -0.403) 3.136 27.987 ( 1.963 -2.413 0.403) 3.136 ======================= Grid point 245 (109/117) ======================= q-point: ( 0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.351 ( 3.318 0.000 -14.070) 14.456 2.473 ( 21.990 0.000 11.639) 24.880 2.929 ( 8.871 0.000 -4.610) 9.997 3.281 ( -0.394 -0.000 9.837) 9.845 3.585 ( 0.486 0.000 2.470) 2.518 3.823 ( 6.803 0.000 4.770) 8.309 4.175 ( 17.989 0.000 5.536) 18.822 4.376 ( 9.007 0.000 -10.631) 13.934 4.461 ( -1.429 -0.000 -2.344) 2.745 4.737 ( -0.550 -0.000 9.143) 9.160 4.914 ( -5.095 -0.000 9.334) 10.634 5.056 ( 4.309 0.000 -6.554) 7.844 5.153 ( -12.521 -0.000 -9.909) 15.968 5.187 ( -2.604 -0.000 3.379) 4.266 5.452 ( -1.253 -0.000 3.381) 3.606 5.470 ( -0.340 -0.000 1.154) 1.204 5.845 ( 8.829 0.000 -11.570) 14.554 5.905 ( 3.805 0.000 -7.062) 8.022 6.034 ( -4.570 -0.000 -6.488) 7.936 6.155 ( 0.117 0.000 -0.188) 0.221 6.179 ( 3.418 0.000 10.782) 11.311 6.196 ( 4.871 0.000 -15.323) 16.079 6.579 ( -2.726 -0.000 1.060) 2.925 6.701 ( -4.362 -0.000 12.671) 13.401 7.170 ( 10.455 0.000 -6.292) 12.203 7.425 ( -5.857 -0.000 6.471) 8.728 7.478 ( -4.985 -0.000 3.657) 6.183 7.509 ( 1.520 0.000 2.775) 3.164 7.586 ( -12.828 -0.000 -7.523) 14.871 7.824 ( -8.025 -0.000 6.587) 10.382 8.001 ( 3.696 0.000 1.036) 3.838 8.104 ( -10.539 -0.000 -3.552) 11.121 8.117 ( -10.561 -0.000 13.532) 17.166 8.145 ( -6.481 -0.000 -6.259) 9.010 8.454 ( -1.403 -0.000 -8.588) 8.702 8.475 ( -12.285 -0.000 5.682) 13.536 9.070 ( -16.837 -0.000 1.477) 16.902 9.102 ( -3.826 -0.000 0.202) 3.831 9.314 ( 7.358 0.000 -3.969) 8.360 9.377 ( -2.245 -0.000 -1.166) 2.530 9.459 ( 5.088 0.000 -4.944) 7.094 9.733 ( -17.444 -0.000 4.328) 17.973 10.033 ( -1.043 -0.000 3.485) 3.638 10.062 ( -17.208 -0.000 1.889) 17.311 10.376 ( 20.100 0.000 11.715) 23.265 10.469 ( 1.786 0.000 -14.257) 14.369 11.042 ( 19.598 0.000 -2.959) 19.820 11.097 ( 27.992 0.000 0.719) 28.001 11.984 ( -3.136 -0.000 10.243) 10.713 12.108 ( -5.727 -0.000 -8.993) 10.662 12.263 ( -8.642 -0.000 13.925) 16.389 12.828 ( -6.032 -0.000 7.221) 9.409 12.831 ( 5.825 0.000 -8.292) 10.133 12.956 ( -1.384 -0.000 -19.284) 19.333 13.069 ( -7.593 -0.000 -11.412) 13.707 13.703 ( 2.896 0.000 15.230) 15.503 14.650 ( -14.208 -0.000 6.523) 15.633 14.973 ( -0.446 -0.000 -3.243) 3.274 17.178 ( -1.657 -0.000 -1.415) 2.179 17.431 ( 5.896 0.000 0.445) 5.913 21.563 ( -1.177 -0.000 0.344) 1.226 22.087 ( -13.102 -0.000 0.988) 13.139 23.074 ( 2.659 0.000 -11.026) 11.342 23.205 ( -7.943 -0.000 5.838) 9.857 23.974 ( 0.091 0.000 6.070) 6.070 24.080 ( 2.258 0.000 -1.353) 2.632 24.796 ( 12.817 0.000 2.445) 13.048 25.004 ( 7.263 0.000 -4.121) 8.350 25.892 ( -0.769 -0.000 5.152) 5.209 26.109 ( 2.518 0.000 -3.691) 4.468 28.270 ( -8.200 -0.000 0.911) 8.250 28.484 ( -5.173 -0.000 -1.642) 5.427 ======================= Grid point 246 (110/117) ======================= q-point: (-0.60 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( 5.898 13.908 -8.641) 17.404 2.724 ( 6.791 -5.785 3.936) 9.750 3.086 ( 10.518 2.797 3.446) 11.416 3.474 ( 14.747 -4.844 -0.499) 15.530 3.670 ( 6.090 -3.459 0.774) 7.046 4.084 ( 18.631 11.485 3.635) 22.186 4.341 ( 3.967 1.138 -3.712) 5.551 4.422 ( -3.769 2.545 -4.194) 6.186 4.603 ( 10.310 -4.587 10.601) 15.483 4.651 ( -4.811 3.811 0.577) 6.165 4.803 ( -7.339 -3.397 12.149) 14.594 4.925 ( -14.134 -6.209 -4.499) 16.080 5.084 ( -6.320 -0.953 -1.497) 6.565 5.187 ( 3.040 -4.393 -5.657) 7.781 5.372 ( -4.507 2.037 3.055) 5.813 5.517 ( 5.815 0.509 3.991) 7.071 5.924 ( -2.948 0.475 -7.217) 7.810 5.954 ( 5.120 2.529 -6.415) 8.588 5.990 ( 2.769 -0.069 -7.460) 7.957 6.120 ( 4.622 8.688 -2.493) 10.152 6.266 ( 3.653 -2.640 0.061) 4.507 6.371 ( 8.906 -8.796 -4.307) 13.237 6.536 ( -2.748 -0.897 1.229) 3.141 6.646 ( -3.104 -1.185 9.137) 9.722 7.153 ( -12.145 6.720 -1.997) 14.023 7.185 ( -15.181 5.134 1.259) 16.075 7.350 ( -4.233 7.844 0.373) 8.921 7.422 ( 0.483 2.196 -2.282) 3.203 7.529 ( -2.382 7.926 0.332) 8.283 7.749 ( -1.722 -1.935 -1.304) 2.901 7.835 ( -6.916 6.676 5.702) 11.176 7.882 ( -5.808 5.644 0.444) 8.111 8.110 ( -6.946 -12.682 1.902) 14.584 8.166 ( -0.476 -13.798 1.094) 13.849 8.294 ( -9.436 -2.853 3.898) 10.601 8.432 ( -2.169 -3.151 -5.907) 7.037 8.835 ( -8.518 -0.537 1.480) 8.662 8.998 ( -7.787 -0.192 -0.319) 7.796 9.270 ( -5.792 -0.526 2.995) 6.542 9.333 ( -3.971 2.081 -7.005) 8.317 9.407 ( -14.021 -2.174 7.724) 16.154 9.647 ( -3.240 -4.407 2.849) 6.168 9.813 ( -1.215 -1.341 -3.574) 4.006 9.943 ( -7.663 1.489 -0.968) 7.866 10.518 ( 4.923 2.405 -10.589) 11.923 10.767 ( 18.265 -0.695 12.126) 21.935 11.437 ( 22.554 1.059 -9.433) 24.470 11.588 ( 24.771 1.470 3.812) 25.106 11.861 ( -7.358 1.070 7.461) 10.534 12.023 ( -6.807 -4.833 -2.100) 8.608 12.169 ( -0.226 0.484 7.745) 7.763 12.625 ( -11.753 6.988 -7.452) 15.573 12.792 ( -7.387 -7.334 -0.294) 10.414 12.986 ( 0.070 -3.324 -3.372) 4.736 13.067 ( 6.298 0.719 -13.636) 15.037 13.686 ( -5.208 1.454 9.748) 11.147 14.405 ( -13.124 -0.988 4.904) 14.045 14.961 ( -1.075 -0.427 -0.222) 1.178 17.181 ( 1.848 -0.406 1.322) 2.308 17.530 ( 5.357 1.021 -2.346) 5.937 21.506 ( -6.748 -2.009 1.153) 7.134 21.807 ( -16.506 2.185 -0.609) 16.661 23.046 ( -10.640 -1.909 5.835) 12.284 23.087 ( -0.935 -0.747 -10.287) 10.357 23.965 ( -0.482 0.648 7.606) 7.649 24.086 ( 1.080 4.439 -2.299) 5.114 25.033 ( 16.584 5.302 1.044) 17.442 25.215 ( 11.099 -6.253 -4.121) 13.389 25.920 ( 3.116 -0.864 5.363) 6.262 26.170 ( 4.486 0.312 -3.090) 5.456 28.118 ( -8.896 -0.848 -0.245) 8.940 28.362 ( -8.104 -0.689 -0.591) 8.155 ======================= Grid point 247 (111/117) ======================= q-point: (-0.50 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( 13.643 21.512 4.378) 25.847 2.942 ( 10.631 -2.424 -4.075) 11.640 3.206 ( 5.030 5.927 11.862) 14.182 3.704 ( 1.512 -1.258 -8.969) 9.182 3.851 ( 8.655 -6.931 -7.265) 13.256 4.044 ( -8.983 15.726 -8.473) 19.995 4.183 ( 10.951 20.682 4.552) 23.841 4.333 ( -19.879 -0.157 -1.207) 19.916 4.504 ( -6.595 -1.559 -4.800) 8.304 4.711 ( -1.272 0.401 9.588) 9.680 4.802 ( 1.045 -1.623 7.509) 7.753 4.888 ( 6.554 -8.371 7.123) 12.797 5.116 ( 1.377 -15.500 -7.482) 17.266 5.308 ( 0.842 -12.571 1.206) 12.657 5.344 ( 2.604 -2.494 3.034) 4.712 5.655 ( 11.415 6.344 7.266) 14.944 5.908 ( -0.097 0.084 -9.559) 9.560 5.938 ( -0.870 2.992 -4.429) 5.415 6.053 ( 6.096 3.600 -1.019) 7.153 6.164 ( 5.750 5.225 -4.326) 8.893 6.357 ( 3.890 -1.398 4.056) 5.791 6.497 ( -0.584 0.644 -2.528) 2.673 6.552 ( -3.369 -2.956 6.859) 8.194 6.596 ( 2.040 6.591 -1.675) 7.100 6.785 ( -15.345 7.546 4.062) 17.575 6.907 ( -11.981 0.879 -6.866) 13.837 7.160 ( -4.877 17.231 2.827) 18.130 7.285 ( -6.697 10.719 -4.349) 13.366 7.398 ( -0.616 4.665 1.173) 4.850 7.597 ( -6.771 3.308 -1.660) 7.716 7.848 ( 2.199 -3.523 1.966) 4.595 7.886 ( 3.576 -3.743 -2.287) 5.659 8.104 ( -5.625 -6.778 0.996) 8.865 8.193 ( -6.359 -9.925 4.017) 12.454 8.291 ( -0.266 -8.942 1.195) 9.026 8.432 ( -0.726 -3.945 -1.271) 4.207 8.759 ( -6.101 -4.205 -3.284) 8.105 8.819 ( -8.891 -0.099 -1.495) 9.017 9.161 ( -7.298 -2.001 11.317) 13.614 9.187 ( -7.571 -5.529 2.592) 9.727 9.321 ( -3.423 1.606 -2.645) 4.614 9.515 ( -7.055 -4.289 1.639) 8.417 9.775 ( -7.386 0.925 -1.667) 7.628 9.970 ( 5.242 -9.355 -3.755) 11.362 10.570 ( 4.391 3.387 -2.567) 6.111 10.996 ( 4.670 -0.416 1.098) 4.815 11.675 ( 0.906 1.157 -1.500) 2.099 11.764 ( 3.389 -1.019 -5.341) 6.407 11.895 ( 5.942 0.985 2.738) 6.617 11.967 ( -2.818 -3.647 0.594) 4.647 12.363 ( 19.352 -0.784 5.933) 20.256 12.413 ( -1.800 2.547 -2.128) 3.775 12.743 ( -5.410 -5.250 1.515) 7.690 12.962 ( -4.700 -4.580 -3.193) 7.298 13.205 ( 9.113 2.433 -2.898) 9.868 13.517 ( -12.041 0.772 2.644) 12.352 14.233 ( -6.695 -1.988 -2.731) 7.499 14.919 ( -4.617 0.693 4.457) 6.455 17.254 ( 5.540 -0.346 4.655) 7.244 17.590 ( 3.048 1.874 -5.447) 6.517 21.352 ( -13.328 -3.651 2.447) 14.034 21.465 ( -17.980 2.587 -2.005) 18.276 22.897 ( -7.292 -1.532 4.334) 8.620 23.040 ( -4.378 -1.190 -7.888) 9.100 23.961 ( 0.829 2.676 7.589) 8.089 24.037 ( 0.904 8.448 -3.830) 9.320 25.293 ( 15.843 2.097 -0.195) 15.982 25.466 ( 9.739 -5.604 -1.475) 11.333 26.027 ( 6.622 -1.857 4.557) 8.250 26.250 ( 4.662 0.370 -2.912) 5.510 27.976 ( -7.247 -0.723 -1.719) 7.483 28.219 ( -9.103 -2.299 0.592) 9.408 ======================= Grid point 248 (112/117) ======================= q-point: (-0.40 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.371 ( 10.744 21.648 10.726) 26.441 2.862 ( -14.923 14.741 -8.301) 22.558 3.185 ( 3.649 17.268 18.785) 25.776 3.461 ( -9.487 22.706 -19.106) 31.155 3.912 ( 3.531 -7.286 3.538) 8.836 4.042 ( 5.089 -2.814 -5.201) 7.802 4.118 ( 3.356 6.900 -8.887) 11.741 4.286 ( 5.733 1.592 1.132) 6.057 4.453 ( 3.033 -3.029 -3.456) 5.507 4.719 ( -6.603 3.270 4.368) 8.566 4.784 ( 3.872 -3.081 5.554) 7.439 4.972 ( -4.033 -2.479 2.733) 5.466 5.331 ( 1.921 -16.377 -5.280) 17.314 5.444 ( -2.390 -18.997 1.621) 19.216 5.481 ( 6.572 1.972 3.128) 7.541 5.738 ( 6.689 14.241 3.102) 16.036 5.876 ( -2.457 3.068 2.138) 4.475 5.948 ( 6.527 -0.077 -3.170) 7.257 6.047 ( -0.576 5.970 -2.651) 6.558 6.219 ( 3.934 0.534 -4.523) 6.019 6.300 ( -9.580 14.827 -2.381) 17.813 6.415 ( 3.066 5.014 -0.310) 5.885 6.448 ( -7.257 3.604 8.342) 11.629 6.538 ( -2.380 0.823 -0.096) 2.520 6.619 ( -0.675 1.918 6.720) 7.020 6.779 ( 2.247 9.565 -6.189) 11.612 6.891 ( -5.614 4.051 -0.412) 6.935 7.155 ( -5.012 2.652 2.073) 6.038 7.360 ( -1.698 -0.236 3.192) 3.623 7.469 ( -4.364 1.834 -5.322) 7.122 7.926 ( 3.518 -1.685 3.204) 5.048 8.012 ( 5.296 -5.920 -4.478) 9.118 8.074 ( -3.594 -5.782 -2.416) 7.224 8.202 ( -4.923 -7.433 2.614) 9.290 8.320 ( 0.319 -1.846 0.099) 1.876 8.497 ( -0.838 1.193 -0.879) 1.702 8.587 ( -3.144 -4.881 -2.990) 6.530 8.818 ( -3.902 -8.103 -0.917) 9.040 9.069 ( -5.091 -4.135 18.599) 19.722 9.169 ( -4.418 -7.492 -5.164) 10.115 9.267 ( -0.897 -3.453 1.139) 3.745 9.423 ( -9.962 -5.031 -4.573) 12.061 9.788 ( 9.104 -4.200 -4.784) 11.109 10.119 ( -1.608 -12.326 3.014) 12.791 10.614 ( 4.957 3.753 6.859) 9.258 10.945 ( -8.280 0.758 -11.257) 13.995 11.635 ( -2.484 -4.026 -7.293) 8.693 11.778 ( -5.975 -1.848 3.677) 7.255 11.931 ( 5.899 1.083 0.762) 6.046 12.034 ( 4.078 -1.074 -0.157) 4.220 12.465 ( 6.357 -0.158 2.204) 6.730 12.668 ( -3.867 -2.447 2.003) 4.995 12.787 ( 18.960 -0.397 6.652) 20.098 12.953 ( -0.774 -6.467 -2.134) 6.854 13.270 ( -5.726 1.003 -4.631) 7.432 13.287 ( -7.351 1.114 4.339) 8.608 14.243 ( 7.464 -1.101 -11.107) 13.427 14.759 ( -12.654 1.729 8.797) 15.508 17.382 ( 7.716 0.585 7.358) 10.678 17.587 ( -0.866 2.197 -7.892) 8.237 21.131 ( -13.062 -2.106 0.658) 13.247 21.152 ( -13.046 0.729 -0.079) 13.067 22.834 ( -1.133 -0.743 2.269) 2.643 22.953 ( -5.623 -1.060 -4.612) 7.349 23.935 ( 1.066 7.888 3.453) 8.676 23.960 ( 0.237 8.493 -1.591) 8.644 25.540 ( 11.196 -1.613 -1.992) 11.486 25.648 ( 4.401 -4.523 2.237) 6.695 26.184 ( 7.520 -2.513 3.475) 8.657 26.317 ( 2.252 -1.137 -3.001) 3.920 27.890 ( -1.536 -0.024 -3.709) 4.015 28.081 ( -9.381 -3.205 2.182) 10.151 ======================= Grid point 249 (113/117) ======================= q-point: (-0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( -8.664 21.410 -17.646) 29.066 2.368 ( 8.664 21.410 17.646) 29.066 3.065 ( -5.575 24.447 -25.114) 35.489 3.065 ( 5.575 24.447 25.114) 35.489 4.034 ( 1.739 5.285 -2.602) 6.143 4.034 ( -1.739 5.285 2.602) 6.143 4.274 ( 1.469 -3.488 -6.029) 7.118 4.274 ( -1.469 -3.488 6.029) 7.118 4.570 ( -6.153 -0.367 -0.005) 6.164 4.570 ( 6.153 -0.367 0.005) 6.164 4.866 ( -1.110 6.065 -6.919) 9.268 4.866 ( 1.110 6.065 6.919) 9.268 5.447 ( -1.206 4.613 -7.993) 9.307 5.447 ( 1.206 4.613 7.993) 9.307 5.629 ( -8.520 -10.053 -0.438) 13.186 5.629 ( 8.520 -10.053 0.438) 13.186 5.920 ( -5.781 4.803 -3.686) 8.371 5.920 ( 5.781 4.803 3.686) 8.371 6.072 ( -3.807 4.274 -5.377) 7.854 6.072 ( 3.807 4.274 5.377) 7.854 6.274 ( 5.851 0.220 -7.804) 9.756 6.274 ( -5.851 0.220 7.804) 9.756 6.483 ( 4.085 -1.297 -5.751) 7.172 6.483 ( -4.085 -1.297 5.751) 7.172 6.629 ( -2.802 5.146 -1.800) 6.129 6.629 ( 2.802 5.146 1.800) 6.129 6.996 ( 4.283 -0.676 -3.653) 5.670 6.996 ( -4.283 -0.676 3.653) 5.670 7.382 ( -2.840 -0.768 -6.948) 7.545 7.382 ( 2.840 -0.768 6.948) 7.545 8.021 ( -5.050 -1.015 -3.904) 6.464 8.021 ( 5.050 -1.015 3.904) 6.464 8.178 ( 0.042 -6.488 -1.510) 6.662 8.178 ( -0.042 -6.488 1.510) 6.662 8.382 ( -0.751 -0.450 -4.478) 4.563 8.382 ( 0.751 -0.450 4.478) 4.563 8.752 ( 8.996 -3.649 -11.611) 15.135 8.752 ( -8.996 -3.649 11.611) 15.135 9.122 ( -4.593 -3.618 -13.662) 14.860 9.122 ( 4.593 -3.618 13.662) 14.860 9.361 ( -1.572 -10.386 -2.630) 10.829 9.361 ( 1.572 -10.386 2.630) 10.829 10.090 ( 8.577 -9.642 -5.212) 13.918 10.090 ( -8.577 -9.642 5.212) 13.918 10.732 ( -10.959 2.498 -11.222) 15.884 10.732 ( 10.959 2.498 11.222) 15.884 11.695 ( 5.210 -3.750 -11.335) 13.026 11.695 ( -5.210 -3.750 11.335) 13.026 12.043 ( -2.209 -0.213 -2.174) 3.106 12.043 ( 2.209 -0.213 2.174) 3.106 12.581 ( -2.387 -0.353 -3.887) 4.575 12.581 ( 2.387 -0.353 3.887) 4.575 13.052 ( -1.477 -5.423 -9.609) 11.132 13.052 ( 1.477 -5.423 9.609) 11.132 13.152 ( 2.072 2.138 -9.371) 9.833 13.152 ( -2.072 2.138 9.371) 9.833 14.472 ( 16.124 0.874 -10.793) 19.423 14.472 ( -16.124 0.874 10.793) 19.423 17.503 ( -5.184 1.782 -8.370) 10.005 17.503 ( 5.184 1.782 8.370) 10.005 21.015 ( 1.519 -0.370 -1.545) 2.198 21.015 ( -1.519 -0.370 1.545) 2.198 22.870 ( -1.594 -0.854 -5.238) 5.541 22.870 ( 1.594 -0.854 5.238) 5.541 23.865 ( 1.305 9.881 -7.144) 12.263 23.865 ( -1.305 9.881 7.144) 12.263 25.700 ( 1.622 -3.613 -8.327) 9.221 25.700 ( -1.622 -3.613 8.327) 9.221 26.325 ( -2.176 -2.969 -8.077) 8.877 26.325 ( 2.176 -2.969 8.077) 8.877 27.948 ( 6.368 -1.609 -4.103) 7.744 27.948 ( -6.368 -1.609 4.103) 7.744 ======================= Grid point 257 (114/117) ======================= q-point: (-0.60 0.40 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( 21.970 0.000 -6.407) 22.885 2.787 ( 5.456 0.000 8.769) 10.328 3.265 ( 5.293 0.000 9.657) 11.012 3.667 ( 11.388 0.000 -13.865) 17.942 3.785 ( 7.033 0.000 -6.868) 9.830 4.292 ( -16.659 -0.000 1.743) 16.750 4.312 ( -9.476 -0.000 -14.682) 17.475 4.421 ( -13.732 -0.000 6.667) 15.265 4.540 ( -3.462 -0.000 -4.156) 5.409 4.578 ( 15.731 0.000 11.502) 19.488 4.776 ( 5.965 0.000 16.183) 17.248 4.819 ( 2.971 0.000 8.103) 8.630 4.968 ( -4.564 -0.000 -5.625) 7.244 5.174 ( -0.852 -0.000 -2.333) 2.484 5.324 ( 0.953 0.000 0.525) 1.088 5.695 ( 12.957 0.000 7.508) 14.975 5.900 ( 0.516 0.000 -10.473) 10.486 5.988 ( -2.429 -0.000 -4.346) 4.979 6.082 ( 6.968 0.000 -6.167) 9.305 6.281 ( -1.594 -0.000 -6.387) 6.582 6.291 ( 7.188 0.000 5.710) 9.180 6.444 ( 3.818 0.000 6.845) 7.837 6.518 ( 1.044 0.000 -5.230) 5.333 6.650 ( 2.411 0.000 2.070) 3.178 6.858 ( -15.367 -0.000 0.300) 15.370 6.904 ( -14.410 -0.000 -3.733) 14.886 7.333 ( -2.690 -0.000 6.256) 6.810 7.523 ( 2.936 0.000 -7.041) 7.628 7.624 ( -0.312 -0.000 3.028) 3.044 7.698 ( -5.976 -0.000 -3.181) 6.770 7.759 ( -5.407 -0.000 -2.996) 6.182 7.814 ( -1.970 -0.000 7.166) 7.432 7.864 ( -4.452 -0.000 -2.578) 5.145 8.089 ( -9.696 -0.000 0.401) 9.704 8.163 ( 5.549 0.000 6.298) 8.394 8.398 ( -0.342 -0.000 -2.603) 2.626 8.708 ( -5.480 -0.000 -0.460) 5.499 8.835 ( -11.476 -0.000 -2.137) 11.673 9.123 ( -9.236 -0.000 0.562) 9.253 9.151 ( -8.057 -0.000 13.470) 15.696 9.362 ( 0.159 0.000 -12.768) 12.769 9.444 ( -11.052 -0.000 11.642) 16.053 9.791 ( -8.175 -0.000 -4.191) 9.186 9.871 ( 4.249 0.000 -3.422) 5.456 10.604 ( 3.804 0.000 -1.836) 4.224 10.993 ( 5.262 0.000 2.631) 5.883 11.673 ( -8.752 -0.000 -0.733) 8.783 11.769 ( 11.138 0.000 -9.473) 14.622 11.903 ( 5.640 0.000 3.482) 6.628 11.928 ( -1.593 -0.000 1.247) 2.023 12.357 ( 20.757 0.000 5.573) 21.492 12.447 ( -6.648 -0.000 -2.042) 6.954 12.674 ( -2.840 -0.000 0.305) 2.856 12.915 ( -4.695 -0.000 -0.839) 4.770 13.232 ( 9.789 0.000 -2.142) 10.020 13.523 ( -13.243 -0.000 1.580) 13.337 14.214 ( -6.273 -0.000 -3.763) 7.315 14.927 ( -3.899 -0.000 5.156) 6.464 17.251 ( 5.916 0.000 5.596) 8.143 17.610 ( 3.008 0.000 -6.245) 6.931 21.316 ( -12.761 -0.000 2.137) 12.939 21.491 ( -18.783 -0.000 -1.862) 18.875 22.882 ( -6.434 -0.000 5.564) 8.506 23.028 ( -4.152 -0.000 -8.956) 9.871 23.987 ( 1.791 0.000 7.905) 8.105 24.125 ( 0.725 0.000 -4.429) 4.488 25.336 ( 13.199 0.000 6.710) 14.806 25.384 ( 11.284 0.000 -8.676) 14.234 26.009 ( 6.609 0.000 4.538) 8.017 26.253 ( 4.226 0.000 -2.267) 4.795 27.969 ( -6.655 -0.000 -2.064) 6.968 28.197 ( -9.384 -0.000 1.073) 9.445 ======================= Grid point 259 (115/117) ======================= q-point: (-0.50 0.40 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.767 ( 6.874 16.950 8.424) 20.137 3.058 ( -2.094 3.546 -10.572) 11.346 3.324 ( 11.802 -3.173 16.940) 20.888 3.777 ( 2.096 10.165 -2.839) 10.760 3.917 ( 5.213 -3.670 -13.436) 14.871 3.952 ( -12.734 10.990 -17.281) 24.116 4.072 ( -1.716 -8.367 3.535) 9.244 4.313 ( -6.848 -5.901 2.247) 9.315 4.541 ( 9.429 11.059 -0.030) 14.533 4.756 ( 3.662 1.118 8.354) 9.189 4.808 ( -2.972 4.153 5.131) 7.240 4.850 ( -5.779 -6.077 7.826) 11.470 4.996 ( 1.917 -14.089 -7.337) 16.000 5.167 ( -4.671 -8.415 3.629) 10.286 5.499 ( 15.277 0.258 4.973) 16.068 5.887 ( -1.504 -1.372 -8.826) 9.058 5.911 ( -3.646 3.724 -1.789) 5.510 5.950 ( 10.927 0.416 7.297) 13.147 6.111 ( -0.168 0.863 -10.607) 10.643 6.233 ( 0.124 1.554 -6.547) 6.730 6.342 ( -7.615 -1.297 7.436) 10.723 6.480 ( 2.348 -0.107 4.926) 5.458 6.529 ( -8.109 1.263 8.437) 11.771 6.561 ( 1.392 0.682 -1.981) 2.515 6.798 ( 4.645 -0.686 -5.835) 7.490 6.827 ( 7.560 7.689 -7.118) 12.921 7.222 ( -6.280 15.295 3.587) 16.919 7.352 ( -9.914 18.548 1.976) 21.123 7.433 ( -1.805 10.029 4.002) 10.948 7.533 ( -3.033 3.933 -3.186) 5.901 7.814 ( 0.017 -13.300 -4.367) 13.999 7.888 ( 4.785 -2.740 4.326) 7.008 7.943 ( -5.994 -15.080 6.321) 17.415 8.009 ( 1.139 -3.906 -10.441) 11.205 8.297 ( 5.010 -1.320 3.861) 6.461 8.415 ( 2.121 -5.259 0.336) 5.681 8.579 ( -11.377 2.345 -2.562) 11.895 8.658 ( -5.104 -6.053 -2.882) 8.426 9.015 ( -7.175 -1.112 21.632) 22.818 9.041 ( -3.585 -3.882 -6.726) 8.553 9.280 ( -3.598 2.479 0.436) 4.391 9.343 ( -6.522 -3.542 -6.821) 10.080 9.735 ( 3.639 -1.247 -6.015) 7.140 9.932 ( -1.235 -5.656 4.184) 7.143 10.665 ( 4.322 1.374 8.242) 9.407 10.958 ( -7.204 0.417 -10.171) 12.471 11.573 ( -2.186 -1.888 -6.792) 7.381 11.742 ( -8.670 -1.284 1.285) 8.859 11.961 ( 4.744 1.653 -2.220) 5.492 12.011 ( 4.620 -1.383 0.921) 4.910 12.464 ( 5.905 0.054 7.538) 9.576 12.624 ( -2.007 -1.499 -2.197) 3.332 12.777 ( 19.766 -0.276 5.651) 20.560 12.859 ( -1.240 -2.760 -0.348) 3.046 13.258 ( -14.426 -0.602 -5.666) 15.510 13.325 ( -1.389 1.253 6.992) 7.238 14.233 ( 9.960 -0.106 -14.486) 17.580 14.786 ( -12.400 0.868 10.152) 16.050 17.392 ( 8.536 0.287 9.290) 12.619 17.619 ( -1.170 0.873 -9.534) 9.645 21.096 ( -10.650 -0.925 2.223) 10.919 21.172 ( -14.536 0.616 -2.045) 14.692 22.825 ( -0.609 -0.212 4.563) 4.608 22.939 ( -4.978 -0.373 -6.478) 8.178 24.026 ( 2.572 2.357 7.539) 8.307 24.102 ( -0.515 4.202 -5.889) 7.253 25.526 ( 8.470 0.332 2.112) 8.735 25.567 ( 6.081 -3.266 -2.679) 7.405 26.149 ( 7.538 -0.955 2.955) 8.152 26.302 ( 0.747 -0.420 -1.749) 1.948 27.890 ( -1.478 -0.018 -3.733) 4.015 28.040 ( -8.476 -1.066 2.843) 9.004 ======================= Grid point 260 (116/117) ======================= q-point: (-0.40 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 107 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.749 ( -7.980 16.803 -14.148) 23.371 2.749 ( 7.980 16.803 14.148) 23.371 3.505 ( -9.187 19.056 -17.403) 27.393 3.505 ( 9.187 19.056 17.403) 27.393 3.940 ( -6.541 -8.332 -3.666) 11.209 3.940 ( 6.541 -8.332 3.666) 11.209 4.256 ( 6.510 -3.843 -6.864) 10.211 4.256 ( -6.510 -3.843 6.864) 10.211 4.617 ( -3.172 6.437 -0.973) 7.242 4.617 ( 3.172 6.437 0.973) 7.242 4.830 ( -3.252 -4.491 -1.652) 5.786 4.830 ( 3.252 -4.491 1.652) 5.786 5.205 ( 1.213 -17.097 -5.748) 18.078 5.205 ( -1.213 -17.097 5.748) 18.078 5.703 ( -9.833 6.504 -5.522) 13.018 5.703 ( 9.833 6.504 5.522) 13.018 5.979 ( -5.803 -3.960 -3.087) 7.674 5.979 ( 5.803 -3.960 3.087) 7.674 6.166 ( -7.207 5.688 -1.810) 9.358 6.166 ( 7.207 5.688 1.810) 9.358 6.334 ( 10.127 1.990 -8.908) 13.633 6.334 ( -10.127 1.990 8.908) 13.633 6.521 ( -2.297 3.865 -2.342) 5.069 6.521 ( 2.297 3.865 2.342) 5.069 6.848 ( -6.767 15.306 0.540) 16.744 6.848 ( 6.767 15.306 -0.540) 16.744 7.011 ( 11.139 6.427 -4.854) 13.745 7.011 ( -11.139 6.427 4.854) 13.745 7.425 ( -4.063 4.624 -4.810) 7.812 7.425 ( 4.063 4.624 4.810) 7.812 7.952 ( -2.561 -8.128 -0.669) 8.549 7.952 ( 2.561 -8.128 0.669) 8.549 8.032 ( -3.112 -6.207 -2.087) 7.251 8.032 ( 3.112 -6.207 2.087) 7.251 8.384 ( -5.477 -0.021 -3.104) 6.295 8.384 ( 5.477 -0.021 3.104) 6.295 8.621 ( 0.759 -8.776 -3.054) 9.323 8.621 ( -0.759 -8.776 3.054) 9.323 9.017 ( -2.691 -5.193 -15.921) 16.962 9.017 ( 2.691 -5.193 15.921) 16.962 9.262 ( -0.540 -1.228 -10.822) 10.905 9.262 ( 0.540 -1.228 10.822) 10.905 9.909 ( 8.403 -7.629 -8.686) 14.292 9.909 ( -8.403 -7.629 8.686) 14.292 10.777 ( -9.100 1.787 -13.070) 16.026 10.777 ( 9.100 1.787 13.070) 16.026 11.626 ( 5.593 -2.988 -8.564) 10.656 11.626 ( -5.593 -2.988 8.564) 10.656 12.036 ( 1.257 -0.446 -4.535) 4.727 12.036 ( -1.257 -0.446 4.535) 4.727 12.572 ( -2.936 -0.432 -6.678) 7.308 12.572 ( 2.936 -0.432 6.678) 7.308 12.955 ( 2.136 -3.898 -3.600) 5.720 12.955 ( -2.136 -3.898 3.600) 5.720 13.183 ( 8.817 0.921 -7.158) 11.394 13.183 ( -8.817 0.921 7.158) 11.394 14.496 ( 17.953 1.266 -13.778) 22.666 14.496 ( -17.953 1.266 13.778) 22.666 17.533 ( -6.138 1.192 -10.553) 12.266 17.533 ( 6.138 1.192 10.553) 12.266 21.011 ( -1.339 -0.085 -1.811) 2.254 21.011 ( 1.339 -0.085 1.811) 2.254 22.859 ( -2.863 -0.295 -5.244) 5.982 22.859 ( 2.863 -0.295 5.244) 5.982 24.027 ( -1.214 6.266 -6.940) 9.429 24.027 ( 1.214 6.266 6.940) 9.429 25.635 ( 0.570 -2.772 -10.128) 10.516 25.635 ( -0.570 -2.772 10.128) 10.516 26.278 ( -2.518 -1.736 -4.702) 5.609 26.278 ( 2.518 -1.736 4.702) 5.609 27.924 ( 5.085 -0.821 -4.196) 6.644 27.924 ( -5.085 -0.821 4.196) 6.644 ======================= Grid point 271 (117/117) ======================= q-point: ( 0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 9.55e-07 9.55e-07 9.55e-07 9.55e-07 Number of triplets: 61 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.939 ( -7.120 0.000 -8.682) 11.228 2.939 ( 7.120 0.000 8.682) 11.228 3.656 ( -18.193 0.000 -16.700) 24.695 3.656 ( 18.193 0.000 16.700) 24.695 3.945 ( 2.423 -0.000 -19.758) 19.907 3.945 ( -2.423 0.000 19.758) 19.907 4.128 ( 10.924 0.000 -16.992) 20.201 4.128 ( -10.924 0.000 16.992) 20.201 4.725 ( -2.124 0.000 -1.679) 2.707 4.725 ( 2.124 0.000 1.679) 2.707 4.792 ( 3.865 -0.000 -4.403) 5.859 4.792 ( -3.865 -0.000 4.403) 5.859 4.994 ( -9.078 -0.000 1.973) 9.290 4.994 ( 9.078 0.000 -1.973) 9.290 5.784 ( -11.862 0.000 -10.374) 15.758 5.784 ( 11.862 0.000 10.374) 15.758 5.902 ( -0.742 -0.000 -3.203) 3.288 5.902 ( 0.742 0.000 3.203) 3.288 6.221 ( 4.164 0.000 -2.582) 4.899 6.221 ( -4.164 0.000 2.582) 4.899 6.344 ( 12.511 0.000 -10.426) 16.286 6.344 ( -12.511 0.000 10.426) 16.286 6.555 ( -2.582 0.000 -2.124) 3.343 6.555 ( 2.582 0.000 2.124) 3.343 6.929 ( -3.903 -0.000 1.011) 4.032 6.929 ( 3.903 0.000 -1.011) 4.032 7.270 ( -3.372 0.000 -2.297) 4.080 7.270 ( 3.372 -0.000 2.297) 4.080 7.508 ( 0.394 -0.000 -4.600) 4.617 7.508 ( -0.394 -0.000 4.600) 4.617 7.773 ( 4.425 0.000 -6.236) 7.646 7.773 ( -4.425 0.000 6.236) 7.646 7.966 ( -3.962 0.000 -11.003) 11.694 7.966 ( 3.962 0.000 11.003) 11.694 8.372 ( 0.646 0.000 -0.680) 0.938 8.372 ( -0.646 0.000 0.680) 0.938 8.522 ( -4.654 0.000 -0.576) 4.690 8.522 ( 4.654 -0.000 0.576) 4.690 8.966 ( -0.828 0.000 -17.996) 18.016 8.966 ( 0.828 0.000 17.997) 18.016 9.256 ( 0.081 0.000 -13.472) 13.472 9.256 ( -0.081 0.000 13.472) 13.472 9.831 ( 6.839 0.000 -8.780) 11.129 9.831 ( -6.839 0.000 8.780) 11.129 10.795 ( -8.522 0.000 -13.039) 15.577 10.795 ( 8.522 0.000 13.039) 15.577 11.594 ( 5.742 0.000 -7.064) 9.104 11.594 ( -5.742 0.000 7.064) 9.104 12.031 ( 2.128 0.000 -5.442) 5.843 12.031 ( -2.128 0.000 5.442) 5.843 12.567 ( -3.537 0.000 -8.807) 9.491 12.567 ( 3.537 0.000 8.807) 9.491 12.915 ( -7.584 0.000 1.297) 7.694 12.915 ( 7.584 0.000 -1.297) 7.694 13.191 ( 11.360 0.000 -6.809) 13.244 13.191 ( -11.360 0.000 6.809) 13.244 14.510 ( 18.471 0.000 -14.662) 23.582 14.510 ( -18.471 0.000 14.662) 23.582 17.545 ( -6.474 0.000 -11.288) 13.013 17.545 ( 6.474 0.000 11.288) 13.013 21.011 ( -2.313 0.000 -1.956) 3.029 21.011 ( 2.313 0.000 1.956) 3.029 22.856 ( -3.274 0.000 -5.280) 6.213 22.856 ( 3.274 0.000 5.280) 6.213 24.090 ( -2.241 0.000 -7.011) 7.361 24.090 ( 2.241 0.000 7.011) 7.361 25.606 ( 0.066 0.000 -10.950) 10.950 25.606 ( -0.066 0.000 10.950) 10.950 26.261 ( -4.631 0.000 -1.817) 4.975 26.261 ( 4.631 0.000 1.817) 4.975 27.916 ( 4.575 0.000 -4.140) 6.170 27.916 ( -4.575 0.000 4.140) 6.170 =================== 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 3/28800 10.0 920.092 1966.828 557.080 0.000 191.573 0.000 3/28800 20.0 274.478 392.640 260.319 0.000 48.675 0.000 3/28800 30.0 102.943 150.105 112.787 0.000 17.966 0.000 3/28800 40.0 51.742 74.900 58.462 0.000 8.517 0.000 3/28800 50.0 31.513 44.568 35.662 0.000 4.839 0.000 3/28800 60.0 21.708 29.949 24.452 0.000 3.115 0.000 3/28800 70.0 16.239 21.904 18.185 0.000 2.190 0.000 3/28800 80.0 12.873 17.015 14.323 0.000 1.641 0.000 3/28800 90.0 10.644 13.811 11.761 0.000 1.288 0.000 3/28800 100.0 9.082 11.583 9.962 0.000 1.049 0.000 3/28800 110.0 7.938 9.961 8.641 0.000 0.877 0.000 3/28800 120.0 7.068 8.734 7.635 0.000 0.750 0.000 3/28800 130.0 6.387 7.778 6.846 0.000 0.653 0.000 3/28800 140.0 5.839 7.014 6.211 0.000 0.577 0.000 3/28800 150.0 5.389 6.389 5.690 0.000 0.515 0.000 3/28800 160.0 5.013 5.871 5.255 0.000 0.465 0.000 3/28800 170.0 4.693 5.433 4.886 0.000 0.422 0.000 3/28800 180.0 4.418 5.059 4.569 0.000 0.387 0.000 3/28800 190.0 4.179 4.735 4.294 0.000 0.356 0.000 3/28800 200.0 3.968 4.452 4.052 0.000 0.330 0.000 3/28800 210.0 3.781 4.203 3.838 0.000 0.307 0.000 3/28800 220.0 3.613 3.982 3.648 0.000 0.287 0.000 3/28800 230.0 3.462 3.784 3.476 0.000 0.269 0.000 3/28800 240.0 3.326 3.606 3.322 0.000 0.253 0.000 3/28800 250.0 3.201 3.445 3.181 0.000 0.238 0.000 3/28800 260.0 3.086 3.299 3.053 0.000 0.226 0.000 3/28800 270.0 2.981 3.165 2.935 0.000 0.214 0.000 3/28800 280.0 2.883 3.042 2.826 0.000 0.203 0.000 3/28800 290.0 2.793 2.929 2.726 0.000 0.193 0.000 3/28800 300.0 2.709 2.825 2.633 0.000 0.184 0.000 3/28800 310.0 2.630 2.728 2.547 0.000 0.176 0.000 3/28800 320.0 2.556 2.637 2.466 0.000 0.169 0.000 3/28800 330.0 2.486 2.553 2.391 0.000 0.162 0.000 3/28800 340.0 2.421 2.474 2.320 0.000 0.155 0.000 3/28800 350.0 2.359 2.401 2.253 0.000 0.149 0.000 3/28800 360.0 2.300 2.331 2.191 0.000 0.143 0.000 3/28800 370.0 2.244 2.266 2.132 0.000 0.138 0.000 3/28800 380.0 2.191 2.204 2.076 0.000 0.133 0.000 3/28800 390.0 2.141 2.146 2.023 0.000 0.129 0.000 3/28800 400.0 2.093 2.091 1.973 0.000 0.125 0.000 3/28800 410.0 2.047 2.039 1.925 0.000 0.121 0.000 3/28800 420.0 2.004 1.989 1.879 0.000 0.117 0.000 3/28800 430.0 1.962 1.942 1.836 0.000 0.113 0.000 3/28800 440.0 1.922 1.897 1.795 0.000 0.110 0.000 3/28800 450.0 1.883 1.854 1.755 0.000 0.107 0.000 3/28800 460.0 1.846 1.813 1.718 0.000 0.104 0.000 3/28800 470.0 1.811 1.774 1.682 0.000 0.101 0.000 3/28800 480.0 1.776 1.737 1.647 0.000 0.098 0.000 3/28800 490.0 1.744 1.701 1.614 0.000 0.096 0.000 3/28800 500.0 1.712 1.666 1.582 0.000 0.093 0.000 3/28800 510.0 1.681 1.633 1.551 0.000 0.091 0.000 3/28800 520.0 1.652 1.602 1.522 0.000 0.089 0.000 3/28800 530.0 1.623 1.571 1.494 0.000 0.087 0.000 3/28800 540.0 1.596 1.542 1.466 0.000 0.085 0.000 3/28800 550.0 1.569 1.514 1.440 0.000 0.083 0.000 3/28800 560.0 1.543 1.486 1.415 0.000 0.081 0.000 3/28800 570.0 1.519 1.460 1.390 0.000 0.079 0.000 3/28800 580.0 1.494 1.435 1.367 0.000 0.077 0.000 3/28800 590.0 1.471 1.410 1.344 0.000 0.076 0.000 3/28800 600.0 1.448 1.387 1.322 0.000 0.074 0.000 3/28800 610.0 1.426 1.364 1.300 0.000 0.073 0.000 3/28800 620.0 1.405 1.342 1.280 0.000 0.071 0.000 3/28800 630.0 1.384 1.321 1.260 0.000 0.070 0.000 3/28800 640.0 1.364 1.300 1.240 0.000 0.069 0.000 3/28800 650.0 1.345 1.280 1.222 0.000 0.067 0.000 3/28800 660.0 1.326 1.260 1.203 0.000 0.066 0.000 3/28800 670.0 1.307 1.242 1.186 0.000 0.065 0.000 3/28800 680.0 1.289 1.223 1.168 0.000 0.064 0.000 3/28800 690.0 1.272 1.206 1.152 0.000 0.063 0.000 3/28800 700.0 1.255 1.188 1.135 0.000 0.062 0.000 3/28800 710.0 1.238 1.172 1.120 0.000 0.061 0.000 3/28800 720.0 1.222 1.155 1.104 0.000 0.060 0.000 3/28800 730.0 1.206 1.139 1.089 0.000 0.059 0.000 3/28800 740.0 1.191 1.124 1.075 0.000 0.058 0.000 3/28800 750.0 1.176 1.109 1.061 0.000 0.057 0.000 3/28800 760.0 1.161 1.095 1.047 0.000 0.056 0.000 3/28800 770.0 1.147 1.080 1.033 0.000 0.055 0.000 3/28800 780.0 1.133 1.066 1.020 0.000 0.054 0.000 3/28800 790.0 1.119 1.053 1.008 0.000 0.054 0.000 3/28800 800.0 1.106 1.040 0.995 0.000 0.053 0.000 3/28800 810.0 1.093 1.027 0.983 0.000 0.052 0.000 3/28800 820.0 1.080 1.014 0.971 0.000 0.051 0.000 3/28800 830.0 1.068 1.002 0.960 0.000 0.051 0.000 3/28800 840.0 1.056 0.990 0.948 0.000 0.050 0.000 3/28800 850.0 1.044 0.979 0.937 0.000 0.049 0.000 3/28800 860.0 1.032 0.967 0.927 0.000 0.049 0.000 3/28800 870.0 1.021 0.956 0.916 0.000 0.048 0.000 3/28800 880.0 1.010 0.945 0.906 0.000 0.047 0.000 3/28800 890.0 0.999 0.935 0.896 0.000 0.047 0.000 3/28800 900.0 0.988 0.924 0.886 0.000 0.046 0.000 3/28800 910.0 0.978 0.914 0.876 0.000 0.046 0.000 3/28800 920.0 0.968 0.904 0.867 0.000 0.045 0.000 3/28800 930.0 0.958 0.895 0.857 0.000 0.045 0.000 3/28800 940.0 0.948 0.885 0.848 0.000 0.044 0.000 3/28800 950.0 0.938 0.876 0.840 0.000 0.043 0.000 3/28800 960.0 0.929 0.867 0.831 0.000 0.043 0.000 3/28800 970.0 0.920 0.858 0.822 0.000 0.042 0.000 3/28800 980.0 0.911 0.849 0.814 0.000 0.042 0.000 3/28800 990.0 0.902 0.840 0.806 0.000 0.042 0.000 3/28800 1000.0 0.893 0.832 0.798 0.000 0.041 0.000 3/28800 Thermal conductivity related properties were written into "kappa-m10104.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:00:55]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|