----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 17:45:48]------------------------- Compiled with OpenMP support (max 32 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: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.989131810268110 0.000000000000000 0.000000000000000 b 0.000000000000000 9.835673979999999 0.000000000000000 c -0.328700089470065 0.000000000000000 8.914532030605130 Atomic positions (fractional): *1 Ca 0.56741846419999 0.05555199624250 0.16695944652998 40.078 *2 Ca 0.75195577050037 0.92169193021507 0.49552625633888 40.078 *3 Ca 0.91271981188002 0.75000000000000 0.80216538050843 40.078 4 Ca 0.43258153580001 0.55555199624250 0.83304055347002 40.078 5 Ca 0.24804422949963 0.42169193021507 0.50447374366112 40.078 *6 Ca 0.93127326760814 0.42170567735775 0.83096784386400 40.078 7 Ca 0.93127326760814 0.07829432264225 0.83096784386400 40.078 8 Ca 0.06872673239186 0.57829432264225 0.16903215613600 40.078 9 Ca 0.75195577050037 0.57830806978493 0.49552625633888 40.078 10 Ca 0.06872673239186 0.92170567735775 0.16903215613600 40.078 11 Ca 0.24804422949963 0.07830806978493 0.50447374366112 40.078 12 Ca 0.43258153580001 0.94444800375750 0.83304055347002 40.078 13 Ca 0.08728018811998 0.25000000000000 0.19783461949157 40.078 14 Ca 0.56741846419999 0.44444800375750 0.16695944652998 40.078 *15 Nb 0.72039577198424 0.25000000000000 0.43893601524801 92.906 16 Nb 0.27960422801576 0.75000000000000 0.56106398475199 92.906 *17 Si 0.67625810466664 0.75000000000000 0.06032654565856 28.085 *18 Si 0.54045111424915 0.25000000000000 0.72248473441631 28.085 19 Si 0.32374189533336 0.25000000000000 0.93967345434144 28.085 20 Si 0.45954888575085 0.75000000000000 0.27751526558369 28.085 *21 N 0.76843468348406 0.59925293035806 0.98038458820438 14.007 *22 N 0.75604065980724 0.75000000000000 0.25877781239010 14.007 *23 N 0.88539020571891 0.09702558278436 0.34160620193390 14.007 *24 N 0.63323788673722 0.39187867818837 0.63038704304451 14.007 *25 N 0.43960542220030 0.25000000000000 0.33157804691816 14.007 *26 N 0.37771590521867 0.75000000000000 0.08254058445952 14.007 27 N 0.63323788673722 0.10812132181163 0.63038704304451 14.007 28 N 0.36676211326278 0.60812132181163 0.36961295695549 14.007 29 N 0.62228409478133 0.25000000000000 0.91745941554048 14.007 30 N 0.11460979428109 0.90297441721564 0.65839379806610 14.007 31 N 0.24395934019276 0.25000000000000 0.74122218760990 14.007 32 N 0.36676211326278 0.89187867818837 0.36961295695549 14.007 33 N 0.23156531651594 0.40074706964194 0.01961541179562 14.007 34 N 0.56039457779970 0.75000000000000 0.66842195308184 14.007 35 N 0.11460979428109 0.59702558278436 0.65839379806610 14.007 36 N 0.88539020571891 0.40297441721564 0.34160620193390 14.007 37 N 0.76843468348406 0.90074706964194 0.98038458820438 14.007 38 N 0.23156531651594 0.09925293035806 0.01961541179562 14.007 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.989131810268110 0.000000000000000 0.000000000000000 b 0.000000000000000 9.835673979999999 0.000000000000000 c -0.328700089470065 0.000000000000000 8.914532030605130 Atomic positions (fractional): *1 Ca 0.56741846419999 0.05555199624250 0.16695944652998 40.078 > 1 *2 Ca 0.75195577050037 0.92169193021507 0.49552625633888 40.078 > 2 *3 Ca 0.91271981188002 0.75000000000000 0.80216538050843 40.078 > 3 4 Ca 0.43258153580001 0.55555199624250 0.83304055347002 40.078 > 4 5 Ca 0.24804422949963 0.42169193021507 0.50447374366112 40.078 > 5 *6 Ca 0.93127326760814 0.42170567735775 0.83096784386400 40.078 > 6 7 Ca 0.93127326760814 0.07829432264225 0.83096784386400 40.078 > 7 8 Ca 0.06872673239186 0.57829432264225 0.16903215613600 40.078 > 8 9 Ca 0.75195577050037 0.57830806978493 0.49552625633888 40.078 > 9 10 Ca 0.06872673239186 0.92170567735775 0.16903215613600 40.078 > 10 11 Ca 0.24804422949963 0.07830806978493 0.50447374366112 40.078 > 11 12 Ca 0.43258153580001 0.94444800375750 0.83304055347002 40.078 > 12 13 Ca 0.08728018811998 0.25000000000000 0.19783461949157 40.078 > 13 14 Ca 0.56741846419999 0.44444800375750 0.16695944652998 40.078 > 14 *15 Nb 0.72039577198424 0.25000000000000 0.43893601524801 92.906 > 15 16 Nb 0.27960422801576 0.75000000000000 0.56106398475199 92.906 > 16 *17 Si 0.67625810466664 0.75000000000000 0.06032654565856 28.085 > 17 *18 Si 0.54045111424915 0.25000000000000 0.72248473441631 28.085 > 18 19 Si 0.32374189533336 0.25000000000000 0.93967345434144 28.085 > 19 20 Si 0.45954888575085 0.75000000000000 0.27751526558369 28.085 > 20 *21 N 0.76843468348406 0.59925293035806 0.98038458820438 14.007 > 21 *22 N 0.75604065980724 0.75000000000000 0.25877781239010 14.007 > 22 *23 N 0.88539020571891 0.09702558278436 0.34160620193390 14.007 > 23 *24 N 0.63323788673722 0.39187867818837 0.63038704304451 14.007 > 24 *25 N 0.43960542220030 0.25000000000000 0.33157804691816 14.007 > 25 *26 N 0.37771590521867 0.75000000000000 0.08254058445952 14.007 > 26 27 N 0.63323788673722 0.10812132181163 0.63038704304451 14.007 > 27 28 N 0.36676211326278 0.60812132181163 0.36961295695549 14.007 > 28 29 N 0.62228409478133 0.25000000000000 0.91745941554048 14.007 > 29 30 N 0.11460979428109 0.90297441721564 0.65839379806610 14.007 > 30 31 N 0.24395934019276 0.25000000000000 0.74122218760990 14.007 > 31 32 N 0.36676211326278 0.89187867818837 0.36961295695549 14.007 > 32 33 N 0.23156531651594 0.40074706964194 0.01961541179562 14.007 > 33 34 N 0.56039457779970 0.75000000000000 0.66842195308184 14.007 > 34 35 N 0.11460979428109 0.59702558278436 0.65839379806610 14.007 > 35 36 N 0.88539020571891 0.40297441721564 0.34160620193390 14.007 > 36 37 N 0.76843468348406 0.90074706964194 0.98038458820438 14.007 > 37 38 N 0.23156531651594 0.09925293035806 0.01961541179562 14.007 > 38 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.978263620536220 0.000000000000000 0.000000000000000 b 0.000000000000000 9.835673979999999 0.000000000000000 c -0.328700089470065 0.000000000000000 8.914532030605130 Atomic positions (fractional): *1 Ca 0.28370923210000 0.05555199624250 0.16695944652998 40.078 > 1 2 Ca 0.78370923210000 0.05555199624250 0.16695944652998 40.078 > 1 *3 Ca 0.37597788525019 0.92169193021507 0.49552625633888 40.078 > 2 4 Ca 0.87597788525019 0.92169193021507 0.49552625633888 40.078 > 2 *5 Ca 0.45635990594001 0.75000000000000 0.80216538050843 40.078 > 3 6 Ca 0.95635990594001 0.75000000000000 0.80216538050843 40.078 > 3 7 Ca 0.21629076790000 0.55555199624250 0.83304055347002 40.078 > 4 8 Ca 0.71629076790000 0.55555199624250 0.83304055347002 40.078 > 4 9 Ca 0.12402211474981 0.42169193021507 0.50447374366112 40.078 > 5 10 Ca 0.62402211474981 0.42169193021507 0.50447374366112 40.078 > 5 *11 Ca 0.46563663380407 0.42170567735775 0.83096784386400 40.078 > 6 12 Ca 0.96563663380407 0.42170567735775 0.83096784386400 40.078 > 6 13 Ca 0.46563663380407 0.07829432264225 0.83096784386400 40.078 > 7 14 Ca 0.96563663380407 0.07829432264225 0.83096784386400 40.078 > 7 15 Ca 0.03436336619593 0.57829432264225 0.16903215613600 40.078 > 8 16 Ca 0.53436336619593 0.57829432264225 0.16903215613600 40.078 > 8 17 Ca 0.37597788525019 0.57830806978493 0.49552625633888 40.078 > 9 18 Ca 0.87597788525019 0.57830806978493 0.49552625633888 40.078 > 9 19 Ca 0.03436336619593 0.92170567735775 0.16903215613600 40.078 > 10 20 Ca 0.53436336619593 0.92170567735775 0.16903215613600 40.078 > 10 21 Ca 0.12402211474981 0.07830806978493 0.50447374366112 40.078 > 11 22 Ca 0.62402211474981 0.07830806978493 0.50447374366112 40.078 > 11 23 Ca 0.21629076790000 0.94444800375750 0.83304055347002 40.078 > 12 24 Ca 0.71629076790000 0.94444800375750 0.83304055347002 40.078 > 12 25 Ca 0.04364009405999 0.25000000000000 0.19783461949157 40.078 > 13 26 Ca 0.54364009405999 0.25000000000000 0.19783461949157 40.078 > 13 27 Ca 0.28370923210000 0.44444800375750 0.16695944652998 40.078 > 14 28 Ca 0.78370923210000 0.44444800375750 0.16695944652998 40.078 > 14 *29 Nb 0.36019788599212 0.25000000000000 0.43893601524801 92.906 > 15 30 Nb 0.86019788599212 0.25000000000000 0.43893601524801 92.906 > 15 31 Nb 0.13980211400788 0.75000000000000 0.56106398475199 92.906 > 16 32 Nb 0.63980211400788 0.75000000000000 0.56106398475199 92.906 > 16 *33 Si 0.33812905233332 0.75000000000000 0.06032654565856 28.085 > 17 34 Si 0.83812905233332 0.75000000000000 0.06032654565856 28.085 > 17 *35 Si 0.27022555712457 0.25000000000000 0.72248473441631 28.085 > 18 36 Si 0.77022555712457 0.25000000000000 0.72248473441631 28.085 > 18 37 Si 0.16187094766668 0.25000000000000 0.93967345434144 28.085 > 19 38 Si 0.66187094766668 0.25000000000000 0.93967345434144 28.085 > 19 39 Si 0.22977444287543 0.75000000000000 0.27751526558369 28.085 > 20 40 Si 0.72977444287543 0.75000000000000 0.27751526558369 28.085 > 20 *41 N 0.38421734174203 0.59925293035806 0.98038458820438 14.007 > 21 42 N 0.88421734174203 0.59925293035806 0.98038458820438 14.007 > 21 *43 N 0.37802032990362 0.75000000000000 0.25877781239010 14.007 > 22 44 N 0.87802032990362 0.75000000000000 0.25877781239010 14.007 > 22 *45 N 0.44269510285945 0.09702558278436 0.34160620193390 14.007 > 23 46 N 0.94269510285945 0.09702558278436 0.34160620193390 14.007 > 23 *47 N 0.31661894336861 0.39187867818837 0.63038704304451 14.007 > 24 48 N 0.81661894336861 0.39187867818837 0.63038704304451 14.007 > 24 *49 N 0.21980271110015 0.25000000000000 0.33157804691816 14.007 > 25 50 N 0.71980271110015 0.25000000000000 0.33157804691816 14.007 > 25 *51 N 0.18885795260933 0.75000000000000 0.08254058445952 14.007 > 26 52 N 0.68885795260933 0.75000000000000 0.08254058445952 14.007 > 26 53 N 0.31661894336861 0.10812132181163 0.63038704304451 14.007 > 27 54 N 0.81661894336861 0.10812132181163 0.63038704304451 14.007 > 27 55 N 0.18338105663139 0.60812132181163 0.36961295695549 14.007 > 28 56 N 0.68338105663139 0.60812132181163 0.36961295695549 14.007 > 28 57 N 0.31114204739067 0.25000000000000 0.91745941554048 14.007 > 29 58 N 0.81114204739067 0.25000000000000 0.91745941554048 14.007 > 29 59 N 0.05730489714055 0.90297441721564 0.65839379806610 14.007 > 30 60 N 0.55730489714055 0.90297441721564 0.65839379806610 14.007 > 30 61 N 0.12197967009638 0.25000000000000 0.74122218760990 14.007 > 31 62 N 0.62197967009638 0.25000000000000 0.74122218760990 14.007 > 31 63 N 0.18338105663139 0.89187867818837 0.36961295695549 14.007 > 32 64 N 0.68338105663139 0.89187867818837 0.36961295695549 14.007 > 32 65 N 0.11578265825797 0.40074706964194 0.01961541179562 14.007 > 33 66 N 0.61578265825797 0.40074706964194 0.01961541179562 14.007 > 33 67 N 0.28019728889985 0.75000000000000 0.66842195308184 14.007 > 34 68 N 0.78019728889985 0.75000000000000 0.66842195308184 14.007 > 34 69 N 0.05730489714055 0.59702558278436 0.65839379806610 14.007 > 35 70 N 0.55730489714055 0.59702558278436 0.65839379806610 14.007 > 35 71 N 0.44269510285945 0.40297441721564 0.34160620193390 14.007 > 36 72 N 0.94269510285945 0.40297441721564 0.34160620193390 14.007 > 36 73 N 0.38421734174203 0.90074706964194 0.98038458820438 14.007 > 37 74 N 0.88421734174203 0.90074706964194 0.98038458820438 14.007 > 37 75 N 0.11578265825797 0.09925293035806 0.01961541179562 14.007 > 38 76 N 0.61578265825797 0.09925293035806 0.01961541179562 14.007 > 38 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.7805444 0.0000000 -0.2207822 0.0000000 6.2733422 0.0000000 -0.2207252 0.0000000 5.7803940 -------------------------- Born effective charges -------------------------- 1 Ca 1.9338325 0.0769711 0.2635938 0.0696920 2.5842038 0.0458525 0.1172331 0.0126035 2.6891043 2 Ca 2.4399230 0.2211312 0.1353904 0.1166601 2.8075079 0.0055477 -0.0469572 0.1160502 1.9317606 3 Ca 2.8205701 0.0000000 -0.4461538 0.0000000 1.8081263 0.0000000 -0.2933865 0.0000000 2.4599772 4 Ca 1.9338325 -0.0769711 0.2635938 -0.0696920 2.5842038 -0.0458525 0.1172331 -0.0126035 2.6891043 5 Ca 2.4399230 -0.2211312 0.1353904 -0.1166601 2.8075079 -0.0055477 -0.0469572 -0.1160502 1.9317606 6 Ca 2.7468708 -0.0070847 -0.1251315 0.0450070 2.5273970 0.0369532 0.2451507 0.0471845 2.3560098 7 Ca 2.7468708 0.0070847 -0.1251315 -0.0450070 2.5273970 -0.0369532 0.2451507 -0.0471845 2.3560098 8 Ca 2.7468708 -0.0070847 -0.1251315 0.0450070 2.5273970 0.0369532 0.2451507 0.0471845 2.3560098 9 Ca 2.4399230 -0.2211312 0.1353904 -0.1166601 2.8075079 -0.0055477 -0.0469572 -0.1160502 1.9317606 10 Ca 2.7468708 0.0070847 -0.1251315 -0.0450070 2.5273970 -0.0369532 0.2451507 -0.0471845 2.3560098 11 Ca 2.4399230 0.2211312 0.1353904 0.1166601 2.8075079 0.0055477 -0.0469572 0.1160502 1.9317606 12 Ca 1.9338325 0.0769711 0.2635938 0.0696920 2.5842038 0.0458525 0.1172331 0.0126035 2.6891043 13 Ca 2.8205701 0.0000000 -0.4461538 0.0000000 1.8081263 0.0000000 -0.2933865 0.0000000 2.4599772 14 Ca 1.9338325 -0.0769711 0.2635938 -0.0696920 2.5842038 -0.0458525 0.1172331 -0.0126035 2.6891043 15 Nb 3.4335484 0.0000000 -0.9506574 0.0000000 4.7043710 0.0000000 -0.9359166 0.0000000 3.1820418 16 Nb 3.4335484 0.0000000 -0.9506574 0.0000000 4.7043710 0.0000000 -0.9359166 0.0000000 3.1820418 17 Si 2.2539765 0.0000000 -0.7100078 0.0000000 2.7496516 0.0000000 -0.8887654 0.0000000 2.9838949 18 Si 2.2201217 0.0000000 -0.7785238 0.0000000 1.8770051 0.0000000 -0.8788840 0.0000000 3.2202220 19 Si 2.2539765 0.0000000 -0.7100078 0.0000000 2.7496516 0.0000000 -0.8887654 0.0000000 2.9838949 20 Si 2.2201217 0.0000000 -0.7785238 0.0000000 1.8770051 0.0000000 -0.8788840 0.0000000 3.2202220 21 N -2.5909868 0.3656759 0.3051418 0.3690997 -3.1951955 -0.4902545 0.2069937 -0.4026681 -3.0545472 22 N -2.9987326 0.0000000 0.1278159 0.0000000 -2.3892096 0.0000000 0.3541626 0.0000000 -3.2091295 23 N -2.9913896 0.7107833 0.7124849 0.8149986 -3.7307776 -0.6060114 0.5106385 -0.4392618 -2.3593816 24 N -2.0750592 -0.0836409 0.4974266 -0.2239250 -3.3168305 -0.1458635 0.5005101 -0.1179259 -3.1668950 25 N -3.5682505 0.0000000 -1.0788022 0.0000000 -1.9692627 0.0000000 -0.6672104 0.0000000 -2.2062654 26 N -3.0876153 0.0000000 0.2585171 0.0000000 -2.1332920 0.0000000 0.2428625 0.0000000 -3.2228428 27 N -2.0750592 0.0836409 0.4974266 0.2239250 -3.3168305 0.1458635 0.5005101 0.1179259 -3.1668950 28 N -2.0750592 -0.0836409 0.4974266 -0.2239250 -3.3168305 -0.1458635 0.5005101 -0.1179259 -3.1668950 29 N -3.0876153 0.0000000 0.2585171 0.0000000 -2.1332920 0.0000000 0.2428625 0.0000000 -3.2228428 30 N -2.9913896 0.7107833 0.7124849 0.8149986 -3.7307776 -0.6060114 0.5106385 -0.4392618 -2.3593816 31 N -2.9987326 0.0000000 0.1278159 0.0000000 -2.3892096 0.0000000 0.3541626 0.0000000 -3.2091295 32 N -2.0750592 0.0836409 0.4974266 0.2239250 -3.3168305 0.1458635 0.5005101 0.1179259 -3.1668950 33 N -2.5909868 0.3656759 0.3051418 0.3690997 -3.1951955 -0.4902545 0.2069937 -0.4026681 -3.0545472 34 N -3.5682505 0.0000000 -1.0788022 0.0000000 -1.9692627 0.0000000 -0.6672104 0.0000000 -2.2062654 35 N -2.9913896 -0.7107833 0.7124849 -0.8149986 -3.7307776 0.6060114 0.5106385 0.4392618 -2.3593816 36 N -2.9913896 -0.7107833 0.7124849 -0.8149986 -3.7307776 0.6060114 0.5106385 0.4392618 -2.3593816 37 N -2.5909868 -0.3656759 0.3051418 -0.3690997 -3.1951955 0.4902545 0.2069937 0.4026681 -3.0545472 38 N -2.5909868 -0.3656759 0.3051418 -0.3690997 -3.1951955 0.4902545 0.2069937 0.4026681 -3.0545472 ---------------------------------------------------------------------------- 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: 228/228 Permutation basis: 13110/13110 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3412 Number of blocks in projector: 3412 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: 820 Use submatrix version of eigh solver. (1) Block: 500 / 820 (2) Block: 250 / 500 (2) 225 eigenvectors found. (2) Block: 500 / 500 (2) 227 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 475 eigenvectors found. (1) Block: 820 / 820 (1) 301 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 19 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 448 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 448 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 448 Use standard eigh solver. Tree of FC basis block matrices: - (3412, 3324), data: False |-- (448, 435), data: True |-- (448, 435), data: True |-- (448, 435), data: True |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 12), data: (500, 24) @ (24, 12) |-- (250, 238), data: True |-- (250, 238), data: True |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 12), data: (500, 24) @ (24, 12) |-- (250, 238), data: True |-- (250, 238), data: True |-- (820, 795), data: False |-- (820, 19), data: (820, 44) @ (44, 19) |-- (320, 301), data: True |-- (500, 475), data: False |-- (500, 23), data: (500, 48) @ (48, 23) |-- (250, 227), data: True |-- (250, 225), data: True ----- Solver_atoms: 1 -- 76 / 76 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 1200 - Time: 0.602 Solver_block: 200 / 1200 - Time: 0.514 Solver_block: 300 / 1200 - Time: 0.517 Solver_block: 400 / 1200 - Time: 0.517 Solver_block: 500 / 1200 - Time: 0.516 Solver_block: 600 / 1200 - Time: 0.517 Solver_block: 700 / 1200 - Time: 0.517 Solver_block: 800 / 1200 - Time: 0.518 Solver_block: 900 / 1200 - Time: 0.519 Solver_block: 1000 / 1200 - Time: 0.518 Solver_block: 1100 / 1200 - Time: 0.517 Solver_block: 1200 / 1200 - Time: 0.517 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 6.454 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 228/228 Permutation basis: 13110/13110 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3412 Number of blocks in projector: 3412 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: 820 Use submatrix version of eigh solver. (1) Block: 500 / 820 (2) Block: 250 / 500 (2) 225 eigenvectors found. (2) Block: 500 / 500 (2) 227 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 23 eigenvectors found. (1) 475 eigenvectors found. (1) Block: 820 / 820 (1) 301 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 19 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 448 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 448 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 448 Use standard eigh solver. Tree of FC basis block matrices: - (3412, 3324), data: False |-- (448, 435), data: True |-- (448, 435), data: True |-- (448, 435), data: True |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 12), data: (500, 24) @ (24, 12) |-- (250, 238), data: True |-- (250, 238), data: True |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 12), data: (500, 24) @ (24, 12) |-- (250, 238), data: True |-- (250, 238), data: True |-- (820, 795), data: False |-- (820, 19), data: (820, 44) @ (44, 19) |-- (320, 301), data: True |-- (500, 475), data: False |-- (500, 23), data: (500, 48) @ (48, 23) |-- (250, 227), data: True |-- (250, 225), 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 17:46:33]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 17:46:33]------------------------- Compiled with OpenMP support (max 32 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: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.989131810268110 0.000000000000000 0.000000000000000 b 0.000000000000000 9.835673979999999 0.000000000000000 c -0.328700089470065 0.000000000000000 8.914532030605130 Atomic positions (fractional): 1 Ca 0.56741846419999 0.05555199624250 0.16695944652998 40.078 2 Ca 0.75195577050037 0.92169193021507 0.49552625633888 40.078 3 Ca 0.91271981188002 0.75000000000000 0.80216538050843 40.078 4 Ca 0.43258153580001 0.55555199624250 0.83304055347002 40.078 5 Ca 0.24804422949963 0.42169193021507 0.50447374366112 40.078 6 Ca 0.93127326760814 0.42170567735775 0.83096784386400 40.078 7 Ca 0.93127326760814 0.07829432264225 0.83096784386400 40.078 8 Ca 0.06872673239186 0.57829432264225 0.16903215613600 40.078 9 Ca 0.75195577050037 0.57830806978493 0.49552625633888 40.078 10 Ca 0.06872673239186 0.92170567735775 0.16903215613600 40.078 11 Ca 0.24804422949963 0.07830806978493 0.50447374366112 40.078 12 Ca 0.43258153580001 0.94444800375750 0.83304055347002 40.078 13 Ca 0.08728018811998 0.25000000000000 0.19783461949157 40.078 14 Ca 0.56741846419999 0.44444800375750 0.16695944652998 40.078 15 Nb 0.72039577198424 0.25000000000000 0.43893601524801 92.906 16 Nb 0.27960422801576 0.75000000000000 0.56106398475199 92.906 17 Si 0.67625810466664 0.75000000000000 0.06032654565856 28.085 18 Si 0.54045111424915 0.25000000000000 0.72248473441631 28.085 19 Si 0.32374189533336 0.25000000000000 0.93967345434144 28.085 20 Si 0.45954888575085 0.75000000000000 0.27751526558369 28.085 21 N 0.76843468348406 0.59925293035806 0.98038458820438 14.007 22 N 0.75604065980724 0.75000000000000 0.25877781239010 14.007 23 N 0.88539020571891 0.09702558278436 0.34160620193390 14.007 24 N 0.63323788673722 0.39187867818837 0.63038704304451 14.007 25 N 0.43960542220030 0.25000000000000 0.33157804691816 14.007 26 N 0.37771590521867 0.75000000000000 0.08254058445952 14.007 27 N 0.63323788673722 0.10812132181163 0.63038704304451 14.007 28 N 0.36676211326278 0.60812132181163 0.36961295695549 14.007 29 N 0.62228409478133 0.25000000000000 0.91745941554048 14.007 30 N 0.11460979428109 0.90297441721564 0.65839379806610 14.007 31 N 0.24395934019276 0.25000000000000 0.74122218760990 14.007 32 N 0.36676211326278 0.89187867818837 0.36961295695549 14.007 33 N 0.23156531651594 0.40074706964194 0.01961541179562 14.007 34 N 0.56039457779970 0.75000000000000 0.66842195308184 14.007 35 N 0.11460979428109 0.59702558278436 0.65839379806610 14.007 36 N 0.88539020571891 0.40297441721564 0.34160620193390 14.007 37 N 0.76843468348406 0.90074706964194 0.98038458820438 14.007 38 N 0.23156531651594 0.09925293035806 0.01961541179562 14.007 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.978263620536220 0.000000000000000 0.000000000000000 b 0.000000000000000 9.835673979999999 0.000000000000000 c -0.328700089470065 0.000000000000000 8.914532030605130 Atomic positions (fractional): 1 Ca 0.28370923210000 0.05555199624250 0.16695944652998 40.078 > 1 2 Ca 0.78370923210000 0.05555199624250 0.16695944652998 40.078 > 1 3 Ca 0.37597788525019 0.92169193021507 0.49552625633888 40.078 > 3 4 Ca 0.87597788525019 0.92169193021507 0.49552625633888 40.078 > 3 5 Ca 0.45635990594001 0.75000000000000 0.80216538050843 40.078 > 5 6 Ca 0.95635990594001 0.75000000000000 0.80216538050843 40.078 > 5 7 Ca 0.21629076790000 0.55555199624250 0.83304055347002 40.078 > 7 8 Ca 0.71629076790000 0.55555199624250 0.83304055347002 40.078 > 7 9 Ca 0.12402211474981 0.42169193021507 0.50447374366112 40.078 > 9 10 Ca 0.62402211474981 0.42169193021507 0.50447374366112 40.078 > 9 11 Ca 0.46563663380407 0.42170567735775 0.83096784386400 40.078 > 11 12 Ca 0.96563663380407 0.42170567735775 0.83096784386400 40.078 > 11 13 Ca 0.46563663380407 0.07829432264225 0.83096784386400 40.078 > 13 14 Ca 0.96563663380407 0.07829432264225 0.83096784386400 40.078 > 13 15 Ca 0.03436336619593 0.57829432264225 0.16903215613600 40.078 > 15 16 Ca 0.53436336619593 0.57829432264225 0.16903215613600 40.078 > 15 17 Ca 0.37597788525019 0.57830806978493 0.49552625633888 40.078 > 17 18 Ca 0.87597788525019 0.57830806978493 0.49552625633888 40.078 > 17 19 Ca 0.03436336619593 0.92170567735775 0.16903215613600 40.078 > 19 20 Ca 0.53436336619593 0.92170567735775 0.16903215613600 40.078 > 19 21 Ca 0.12402211474981 0.07830806978493 0.50447374366112 40.078 > 21 22 Ca 0.62402211474981 0.07830806978493 0.50447374366112 40.078 > 21 23 Ca 0.21629076790000 0.94444800375750 0.83304055347002 40.078 > 23 24 Ca 0.71629076790000 0.94444800375750 0.83304055347002 40.078 > 23 25 Ca 0.04364009405999 0.25000000000000 0.19783461949157 40.078 > 25 26 Ca 0.54364009405999 0.25000000000000 0.19783461949157 40.078 > 25 27 Ca 0.28370923210000 0.44444800375750 0.16695944652998 40.078 > 27 28 Ca 0.78370923210000 0.44444800375750 0.16695944652998 40.078 > 27 29 Nb 0.36019788599212 0.25000000000000 0.43893601524801 92.906 > 29 30 Nb 0.86019788599212 0.25000000000000 0.43893601524801 92.906 > 29 31 Nb 0.13980211400788 0.75000000000000 0.56106398475199 92.906 > 31 32 Nb 0.63980211400788 0.75000000000000 0.56106398475199 92.906 > 31 33 Si 0.33812905233332 0.75000000000000 0.06032654565856 28.085 > 33 34 Si 0.83812905233332 0.75000000000000 0.06032654565856 28.085 > 33 35 Si 0.27022555712457 0.25000000000000 0.72248473441631 28.085 > 35 36 Si 0.77022555712457 0.25000000000000 0.72248473441631 28.085 > 35 37 Si 0.16187094766668 0.25000000000000 0.93967345434144 28.085 > 37 38 Si 0.66187094766668 0.25000000000000 0.93967345434144 28.085 > 37 39 Si 0.22977444287543 0.75000000000000 0.27751526558369 28.085 > 39 40 Si 0.72977444287543 0.75000000000000 0.27751526558369 28.085 > 39 41 N 0.38421734174203 0.59925293035806 0.98038458820438 14.007 > 41 42 N 0.88421734174203 0.59925293035806 0.98038458820438 14.007 > 41 43 N 0.37802032990362 0.75000000000000 0.25877781239010 14.007 > 43 44 N 0.87802032990362 0.75000000000000 0.25877781239010 14.007 > 43 45 N 0.44269510285945 0.09702558278436 0.34160620193390 14.007 > 45 46 N 0.94269510285945 0.09702558278436 0.34160620193390 14.007 > 45 47 N 0.31661894336861 0.39187867818837 0.63038704304451 14.007 > 47 48 N 0.81661894336861 0.39187867818837 0.63038704304451 14.007 > 47 49 N 0.21980271110015 0.25000000000000 0.33157804691816 14.007 > 49 50 N 0.71980271110015 0.25000000000000 0.33157804691816 14.007 > 49 51 N 0.18885795260933 0.75000000000000 0.08254058445952 14.007 > 51 52 N 0.68885795260933 0.75000000000000 0.08254058445952 14.007 > 51 53 N 0.31661894336861 0.10812132181163 0.63038704304451 14.007 > 53 54 N 0.81661894336861 0.10812132181163 0.63038704304451 14.007 > 53 55 N 0.18338105663139 0.60812132181163 0.36961295695549 14.007 > 55 56 N 0.68338105663139 0.60812132181163 0.36961295695549 14.007 > 55 57 N 0.31114204739067 0.25000000000000 0.91745941554048 14.007 > 57 58 N 0.81114204739067 0.25000000000000 0.91745941554048 14.007 > 57 59 N 0.05730489714055 0.90297441721564 0.65839379806610 14.007 > 59 60 N 0.55730489714055 0.90297441721564 0.65839379806610 14.007 > 59 61 N 0.12197967009638 0.25000000000000 0.74122218760990 14.007 > 61 62 N 0.62197967009638 0.25000000000000 0.74122218760990 14.007 > 61 63 N 0.18338105663139 0.89187867818837 0.36961295695549 14.007 > 63 64 N 0.68338105663139 0.89187867818837 0.36961295695549 14.007 > 63 65 N 0.11578265825797 0.40074706964194 0.01961541179562 14.007 > 65 66 N 0.61578265825797 0.40074706964194 0.01961541179562 14.007 > 65 67 N 0.28019728889985 0.75000000000000 0.66842195308184 14.007 > 67 68 N 0.78019728889985 0.75000000000000 0.66842195308184 14.007 > 67 69 N 0.05730489714055 0.59702558278436 0.65839379806610 14.007 > 69 70 N 0.55730489714055 0.59702558278436 0.65839379806610 14.007 > 69 71 N 0.44269510285945 0.40297441721564 0.34160620193390 14.007 > 71 72 N 0.94269510285945 0.40297441721564 0.34160620193390 14.007 > 71 73 N 0.38421734174203 0.90074706964194 0.98038458820438 14.007 > 73 74 N 0.88421734174203 0.90074706964194 0.98038458820438 14.007 > 73 75 N 0.11578265825797 0.09925293035806 0.01961541179562 14.007 > 75 76 N 0.61578265825797 0.09925293035806 0.01961541179562 14.007 > 75 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.7805444 0.0000000 -0.2207822 0.0000000 6.2733422 0.0000000 -0.2207252 0.0000000 5.7803940 -------------------------- Born effective charges -------------------------- 1 Ca 1.9338325 0.0769711 0.2635938 0.0696920 2.5842038 0.0458525 0.1172331 0.0126035 2.6891043 2 Ca 2.4399230 0.2211312 0.1353904 0.1166601 2.8075079 0.0055477 -0.0469572 0.1160502 1.9317606 3 Ca 2.8205701 0.0000000 -0.4461538 0.0000000 1.8081263 0.0000000 -0.2933865 0.0000000 2.4599772 4 Ca 1.9338325 -0.0769711 0.2635938 -0.0696920 2.5842038 -0.0458525 0.1172331 -0.0126035 2.6891043 5 Ca 2.4399230 -0.2211312 0.1353904 -0.1166601 2.8075079 -0.0055477 -0.0469572 -0.1160502 1.9317606 6 Ca 2.7468708 -0.0070847 -0.1251315 0.0450070 2.5273970 0.0369532 0.2451507 0.0471845 2.3560098 7 Ca 2.7468708 0.0070847 -0.1251315 -0.0450070 2.5273970 -0.0369532 0.2451507 -0.0471845 2.3560098 8 Ca 2.7468708 -0.0070847 -0.1251315 0.0450070 2.5273970 0.0369532 0.2451507 0.0471845 2.3560098 9 Ca 2.4399230 -0.2211312 0.1353904 -0.1166601 2.8075079 -0.0055477 -0.0469572 -0.1160502 1.9317606 10 Ca 2.7468708 0.0070847 -0.1251315 -0.0450070 2.5273970 -0.0369532 0.2451507 -0.0471845 2.3560098 11 Ca 2.4399230 0.2211312 0.1353904 0.1166601 2.8075079 0.0055477 -0.0469572 0.1160502 1.9317606 12 Ca 1.9338325 0.0769711 0.2635938 0.0696920 2.5842038 0.0458525 0.1172331 0.0126035 2.6891043 13 Ca 2.8205701 0.0000000 -0.4461538 0.0000000 1.8081263 0.0000000 -0.2933865 0.0000000 2.4599772 14 Ca 1.9338325 -0.0769711 0.2635938 -0.0696920 2.5842038 -0.0458525 0.1172331 -0.0126035 2.6891043 15 Nb 3.4335484 0.0000000 -0.9506574 0.0000000 4.7043710 0.0000000 -0.9359166 0.0000000 3.1820418 16 Nb 3.4335484 0.0000000 -0.9506574 0.0000000 4.7043710 0.0000000 -0.9359166 0.0000000 3.1820418 17 Si 2.2539765 0.0000000 -0.7100078 0.0000000 2.7496516 0.0000000 -0.8887654 0.0000000 2.9838949 18 Si 2.2201217 0.0000000 -0.7785238 0.0000000 1.8770051 0.0000000 -0.8788840 0.0000000 3.2202220 19 Si 2.2539765 0.0000000 -0.7100078 0.0000000 2.7496516 0.0000000 -0.8887654 0.0000000 2.9838949 20 Si 2.2201217 0.0000000 -0.7785238 0.0000000 1.8770051 0.0000000 -0.8788840 0.0000000 3.2202220 21 N -2.5909868 0.3656759 0.3051418 0.3690997 -3.1951955 -0.4902545 0.2069937 -0.4026681 -3.0545472 22 N -2.9987326 0.0000000 0.1278159 0.0000000 -2.3892096 0.0000000 0.3541626 0.0000000 -3.2091295 23 N -2.9913896 0.7107833 0.7124849 0.8149986 -3.7307776 -0.6060114 0.5106385 -0.4392618 -2.3593816 24 N -2.0750592 -0.0836409 0.4974266 -0.2239250 -3.3168305 -0.1458635 0.5005101 -0.1179259 -3.1668950 25 N -3.5682505 0.0000000 -1.0788022 0.0000000 -1.9692627 0.0000000 -0.6672104 0.0000000 -2.2062654 26 N -3.0876153 0.0000000 0.2585171 0.0000000 -2.1332920 0.0000000 0.2428625 0.0000000 -3.2228428 27 N -2.0750592 0.0836409 0.4974266 0.2239250 -3.3168305 0.1458635 0.5005101 0.1179259 -3.1668950 28 N -2.0750592 -0.0836409 0.4974266 -0.2239250 -3.3168305 -0.1458635 0.5005101 -0.1179259 -3.1668950 29 N -3.0876153 0.0000000 0.2585171 0.0000000 -2.1332920 0.0000000 0.2428625 0.0000000 -3.2228428 30 N -2.9913896 0.7107833 0.7124849 0.8149986 -3.7307776 -0.6060114 0.5106385 -0.4392618 -2.3593816 31 N -2.9987326 0.0000000 0.1278159 0.0000000 -2.3892096 0.0000000 0.3541626 0.0000000 -3.2091295 32 N -2.0750592 0.0836409 0.4974266 0.2239250 -3.3168305 0.1458635 0.5005101 0.1179259 -3.1668950 33 N -2.5909868 0.3656759 0.3051418 0.3690997 -3.1951955 -0.4902545 0.2069937 -0.4026681 -3.0545472 34 N -3.5682505 0.0000000 -1.0788022 0.0000000 -1.9692627 0.0000000 -0.6672104 0.0000000 -2.2062654 35 N -2.9913896 -0.7107833 0.7124849 -0.8149986 -3.7307776 0.6060114 0.5106385 0.4392618 -2.3593816 36 N -2.9913896 -0.7107833 0.7124849 -0.8149986 -3.7307776 0.6060114 0.5106385 0.4392618 -2.3593816 37 N -2.5909868 -0.3656759 0.3051418 -0.3690997 -3.1951955 0.4902545 0.2069937 0.4026681 -3.0545472 38 N -2.5909868 -0.3656759 0.3051418 -0.3690997 -3.1951955 0.4902545 0.2069937 0.4026681 -3.0545472 ---------------------------------------------------------------------------- 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[ 3, 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[ 11, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] Computing fc3[ 29, 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[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] Computing fc3[ 35, 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[ 41, 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[ 43, 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[ 45, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0004 0.0000 0.0100] [ 0.0004 0.0000 -0.0100] Computing fc3[ 47, 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] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (zx) 0.00000001 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 17:47:04]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 17:47:05]------------------------- Compiled with OpenMP support (max 32 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: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.989131810268110 0.000000000000000 0.000000000000000 b 0.000000000000000 9.835673979999999 0.000000000000000 c -0.328700089470065 0.000000000000000 8.914532030605130 Atomic positions (fractional): 1 Ca 0.56741846419999 0.05555199624250 0.16695944652998 40.078 2 Ca 0.75195577050037 0.92169193021507 0.49552625633888 40.078 3 Ca 0.91271981188002 0.75000000000000 0.80216538050843 40.078 4 Ca 0.43258153580001 0.55555199624250 0.83304055347002 40.078 5 Ca 0.24804422949963 0.42169193021507 0.50447374366112 40.078 6 Ca 0.93127326760814 0.42170567735775 0.83096784386400 40.078 7 Ca 0.93127326760814 0.07829432264225 0.83096784386400 40.078 8 Ca 0.06872673239186 0.57829432264225 0.16903215613600 40.078 9 Ca 0.75195577050037 0.57830806978493 0.49552625633888 40.078 10 Ca 0.06872673239186 0.92170567735775 0.16903215613600 40.078 11 Ca 0.24804422949963 0.07830806978493 0.50447374366112 40.078 12 Ca 0.43258153580001 0.94444800375750 0.83304055347002 40.078 13 Ca 0.08728018811998 0.25000000000000 0.19783461949157 40.078 14 Ca 0.56741846419999 0.44444800375750 0.16695944652998 40.078 15 Nb 0.72039577198424 0.25000000000000 0.43893601524801 92.906 16 Nb 0.27960422801576 0.75000000000000 0.56106398475199 92.906 17 Si 0.67625810466664 0.75000000000000 0.06032654565856 28.085 18 Si 0.54045111424915 0.25000000000000 0.72248473441631 28.085 19 Si 0.32374189533336 0.25000000000000 0.93967345434144 28.085 20 Si 0.45954888575085 0.75000000000000 0.27751526558369 28.085 21 N 0.76843468348406 0.59925293035806 0.98038458820438 14.007 22 N 0.75604065980724 0.75000000000000 0.25877781239010 14.007 23 N 0.88539020571891 0.09702558278436 0.34160620193390 14.007 24 N 0.63323788673722 0.39187867818837 0.63038704304451 14.007 25 N 0.43960542220030 0.25000000000000 0.33157804691816 14.007 26 N 0.37771590521867 0.75000000000000 0.08254058445952 14.007 27 N 0.63323788673722 0.10812132181163 0.63038704304451 14.007 28 N 0.36676211326278 0.60812132181163 0.36961295695549 14.007 29 N 0.62228409478133 0.25000000000000 0.91745941554048 14.007 30 N 0.11460979428109 0.90297441721564 0.65839379806610 14.007 31 N 0.24395934019276 0.25000000000000 0.74122218760990 14.007 32 N 0.36676211326278 0.89187867818837 0.36961295695549 14.007 33 N 0.23156531651594 0.40074706964194 0.01961541179562 14.007 34 N 0.56039457779970 0.75000000000000 0.66842195308184 14.007 35 N 0.11460979428109 0.59702558278436 0.65839379806610 14.007 36 N 0.88539020571891 0.40297441721564 0.34160620193390 14.007 37 N 0.76843468348406 0.90074706964194 0.98038458820438 14.007 38 N 0.23156531651594 0.09925293035806 0.01961541179562 14.007 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.978263620536220 0.000000000000000 0.000000000000000 b 0.000000000000000 9.835673979999999 0.000000000000000 c -0.328700089470065 0.000000000000000 8.914532030605130 Atomic positions (fractional): 1 Ca 0.28370923210000 0.05555199624250 0.16695944652998 40.078 > 1 2 Ca 0.78370923210000 0.05555199624250 0.16695944652998 40.078 > 1 3 Ca 0.37597788525019 0.92169193021507 0.49552625633888 40.078 > 3 4 Ca 0.87597788525019 0.92169193021507 0.49552625633888 40.078 > 3 5 Ca 0.45635990594001 0.75000000000000 0.80216538050843 40.078 > 5 6 Ca 0.95635990594001 0.75000000000000 0.80216538050843 40.078 > 5 7 Ca 0.21629076790000 0.55555199624250 0.83304055347002 40.078 > 7 8 Ca 0.71629076790000 0.55555199624250 0.83304055347002 40.078 > 7 9 Ca 0.12402211474981 0.42169193021507 0.50447374366112 40.078 > 9 10 Ca 0.62402211474981 0.42169193021507 0.50447374366112 40.078 > 9 11 Ca 0.46563663380407 0.42170567735775 0.83096784386400 40.078 > 11 12 Ca 0.96563663380407 0.42170567735775 0.83096784386400 40.078 > 11 13 Ca 0.46563663380407 0.07829432264225 0.83096784386400 40.078 > 13 14 Ca 0.96563663380407 0.07829432264225 0.83096784386400 40.078 > 13 15 Ca 0.03436336619593 0.57829432264225 0.16903215613600 40.078 > 15 16 Ca 0.53436336619593 0.57829432264225 0.16903215613600 40.078 > 15 17 Ca 0.37597788525019 0.57830806978493 0.49552625633888 40.078 > 17 18 Ca 0.87597788525019 0.57830806978493 0.49552625633888 40.078 > 17 19 Ca 0.03436336619593 0.92170567735775 0.16903215613600 40.078 > 19 20 Ca 0.53436336619593 0.92170567735775 0.16903215613600 40.078 > 19 21 Ca 0.12402211474981 0.07830806978493 0.50447374366112 40.078 > 21 22 Ca 0.62402211474981 0.07830806978493 0.50447374366112 40.078 > 21 23 Ca 0.21629076790000 0.94444800375750 0.83304055347002 40.078 > 23 24 Ca 0.71629076790000 0.94444800375750 0.83304055347002 40.078 > 23 25 Ca 0.04364009405999 0.25000000000000 0.19783461949157 40.078 > 25 26 Ca 0.54364009405999 0.25000000000000 0.19783461949157 40.078 > 25 27 Ca 0.28370923210000 0.44444800375750 0.16695944652998 40.078 > 27 28 Ca 0.78370923210000 0.44444800375750 0.16695944652998 40.078 > 27 29 Nb 0.36019788599212 0.25000000000000 0.43893601524801 92.906 > 29 30 Nb 0.86019788599212 0.25000000000000 0.43893601524801 92.906 > 29 31 Nb 0.13980211400788 0.75000000000000 0.56106398475199 92.906 > 31 32 Nb 0.63980211400788 0.75000000000000 0.56106398475199 92.906 > 31 33 Si 0.33812905233332 0.75000000000000 0.06032654565856 28.085 > 33 34 Si 0.83812905233332 0.75000000000000 0.06032654565856 28.085 > 33 35 Si 0.27022555712457 0.25000000000000 0.72248473441631 28.085 > 35 36 Si 0.77022555712457 0.25000000000000 0.72248473441631 28.085 > 35 37 Si 0.16187094766668 0.25000000000000 0.93967345434144 28.085 > 37 38 Si 0.66187094766668 0.25000000000000 0.93967345434144 28.085 > 37 39 Si 0.22977444287543 0.75000000000000 0.27751526558369 28.085 > 39 40 Si 0.72977444287543 0.75000000000000 0.27751526558369 28.085 > 39 41 N 0.38421734174203 0.59925293035806 0.98038458820438 14.007 > 41 42 N 0.88421734174203 0.59925293035806 0.98038458820438 14.007 > 41 43 N 0.37802032990362 0.75000000000000 0.25877781239010 14.007 > 43 44 N 0.87802032990362 0.75000000000000 0.25877781239010 14.007 > 43 45 N 0.44269510285945 0.09702558278436 0.34160620193390 14.007 > 45 46 N 0.94269510285945 0.09702558278436 0.34160620193390 14.007 > 45 47 N 0.31661894336861 0.39187867818837 0.63038704304451 14.007 > 47 48 N 0.81661894336861 0.39187867818837 0.63038704304451 14.007 > 47 49 N 0.21980271110015 0.25000000000000 0.33157804691816 14.007 > 49 50 N 0.71980271110015 0.25000000000000 0.33157804691816 14.007 > 49 51 N 0.18885795260933 0.75000000000000 0.08254058445952 14.007 > 51 52 N 0.68885795260933 0.75000000000000 0.08254058445952 14.007 > 51 53 N 0.31661894336861 0.10812132181163 0.63038704304451 14.007 > 53 54 N 0.81661894336861 0.10812132181163 0.63038704304451 14.007 > 53 55 N 0.18338105663139 0.60812132181163 0.36961295695549 14.007 > 55 56 N 0.68338105663139 0.60812132181163 0.36961295695549 14.007 > 55 57 N 0.31114204739067 0.25000000000000 0.91745941554048 14.007 > 57 58 N 0.81114204739067 0.25000000000000 0.91745941554048 14.007 > 57 59 N 0.05730489714055 0.90297441721564 0.65839379806610 14.007 > 59 60 N 0.55730489714055 0.90297441721564 0.65839379806610 14.007 > 59 61 N 0.12197967009638 0.25000000000000 0.74122218760990 14.007 > 61 62 N 0.62197967009638 0.25000000000000 0.74122218760990 14.007 > 61 63 N 0.18338105663139 0.89187867818837 0.36961295695549 14.007 > 63 64 N 0.68338105663139 0.89187867818837 0.36961295695549 14.007 > 63 65 N 0.11578265825797 0.40074706964194 0.01961541179562 14.007 > 65 66 N 0.61578265825797 0.40074706964194 0.01961541179562 14.007 > 65 67 N 0.28019728889985 0.75000000000000 0.66842195308184 14.007 > 67 68 N 0.78019728889985 0.75000000000000 0.66842195308184 14.007 > 67 69 N 0.05730489714055 0.59702558278436 0.65839379806610 14.007 > 69 70 N 0.55730489714055 0.59702558278436 0.65839379806610 14.007 > 69 71 N 0.44269510285945 0.40297441721564 0.34160620193390 14.007 > 71 72 N 0.94269510285945 0.40297441721564 0.34160620193390 14.007 > 71 73 N 0.38421734174203 0.90074706964194 0.98038458820438 14.007 > 73 74 N 0.88421734174203 0.90074706964194 0.98038458820438 14.007 > 73 75 N 0.11578265825797 0.09925293035806 0.01961541179562 14.007 > 75 76 N 0.61578265825797 0.09925293035806 0.01961541179562 14.007 > 75 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.7805444 0.0000000 -0.2207822 0.0000000 6.2733422 0.0000000 -0.2207252 0.0000000 5.7803940 -------------------------- Born effective charges -------------------------- 1 Ca 1.9338325 0.0769711 0.2635938 0.0696920 2.5842038 0.0458525 0.1172331 0.0126035 2.6891043 2 Ca 2.4399230 0.2211312 0.1353904 0.1166601 2.8075079 0.0055477 -0.0469572 0.1160502 1.9317606 3 Ca 2.8205701 0.0000000 -0.4461538 0.0000000 1.8081263 0.0000000 -0.2933865 0.0000000 2.4599772 4 Ca 1.9338325 -0.0769711 0.2635938 -0.0696920 2.5842038 -0.0458525 0.1172331 -0.0126035 2.6891043 5 Ca 2.4399230 -0.2211312 0.1353904 -0.1166601 2.8075079 -0.0055477 -0.0469572 -0.1160502 1.9317606 6 Ca 2.7468708 -0.0070847 -0.1251315 0.0450070 2.5273970 0.0369532 0.2451507 0.0471845 2.3560098 7 Ca 2.7468708 0.0070847 -0.1251315 -0.0450070 2.5273970 -0.0369532 0.2451507 -0.0471845 2.3560098 8 Ca 2.7468708 -0.0070847 -0.1251315 0.0450070 2.5273970 0.0369532 0.2451507 0.0471845 2.3560098 9 Ca 2.4399230 -0.2211312 0.1353904 -0.1166601 2.8075079 -0.0055477 -0.0469572 -0.1160502 1.9317606 10 Ca 2.7468708 0.0070847 -0.1251315 -0.0450070 2.5273970 -0.0369532 0.2451507 -0.0471845 2.3560098 11 Ca 2.4399230 0.2211312 0.1353904 0.1166601 2.8075079 0.0055477 -0.0469572 0.1160502 1.9317606 12 Ca 1.9338325 0.0769711 0.2635938 0.0696920 2.5842038 0.0458525 0.1172331 0.0126035 2.6891043 13 Ca 2.8205701 0.0000000 -0.4461538 0.0000000 1.8081263 0.0000000 -0.2933865 0.0000000 2.4599772 14 Ca 1.9338325 -0.0769711 0.2635938 -0.0696920 2.5842038 -0.0458525 0.1172331 -0.0126035 2.6891043 15 Nb 3.4335484 0.0000000 -0.9506574 0.0000000 4.7043710 0.0000000 -0.9359166 0.0000000 3.1820418 16 Nb 3.4335484 0.0000000 -0.9506574 0.0000000 4.7043710 0.0000000 -0.9359166 0.0000000 3.1820418 17 Si 2.2539765 0.0000000 -0.7100078 0.0000000 2.7496516 0.0000000 -0.8887654 0.0000000 2.9838949 18 Si 2.2201217 0.0000000 -0.7785238 0.0000000 1.8770051 0.0000000 -0.8788840 0.0000000 3.2202220 19 Si 2.2539765 0.0000000 -0.7100078 0.0000000 2.7496516 0.0000000 -0.8887654 0.0000000 2.9838949 20 Si 2.2201217 0.0000000 -0.7785238 0.0000000 1.8770051 0.0000000 -0.8788840 0.0000000 3.2202220 21 N -2.5909868 0.3656759 0.3051418 0.3690997 -3.1951955 -0.4902545 0.2069937 -0.4026681 -3.0545472 22 N -2.9987326 0.0000000 0.1278159 0.0000000 -2.3892096 0.0000000 0.3541626 0.0000000 -3.2091295 23 N -2.9913896 0.7107833 0.7124849 0.8149986 -3.7307776 -0.6060114 0.5106385 -0.4392618 -2.3593816 24 N -2.0750592 -0.0836409 0.4974266 -0.2239250 -3.3168305 -0.1458635 0.5005101 -0.1179259 -3.1668950 25 N -3.5682505 0.0000000 -1.0788022 0.0000000 -1.9692627 0.0000000 -0.6672104 0.0000000 -2.2062654 26 N -3.0876153 0.0000000 0.2585171 0.0000000 -2.1332920 0.0000000 0.2428625 0.0000000 -3.2228428 27 N -2.0750592 0.0836409 0.4974266 0.2239250 -3.3168305 0.1458635 0.5005101 0.1179259 -3.1668950 28 N -2.0750592 -0.0836409 0.4974266 -0.2239250 -3.3168305 -0.1458635 0.5005101 -0.1179259 -3.1668950 29 N -3.0876153 0.0000000 0.2585171 0.0000000 -2.1332920 0.0000000 0.2428625 0.0000000 -3.2228428 30 N -2.9913896 0.7107833 0.7124849 0.8149986 -3.7307776 -0.6060114 0.5106385 -0.4392618 -2.3593816 31 N -2.9987326 0.0000000 0.1278159 0.0000000 -2.3892096 0.0000000 0.3541626 0.0000000 -3.2091295 32 N -2.0750592 0.0836409 0.4974266 0.2239250 -3.3168305 0.1458635 0.5005101 0.1179259 -3.1668950 33 N -2.5909868 0.3656759 0.3051418 0.3690997 -3.1951955 -0.4902545 0.2069937 -0.4026681 -3.0545472 34 N -3.5682505 0.0000000 -1.0788022 0.0000000 -1.9692627 0.0000000 -0.6672104 0.0000000 -2.2062654 35 N -2.9913896 -0.7107833 0.7124849 -0.8149986 -3.7307776 0.6060114 0.5106385 0.4392618 -2.3593816 36 N -2.9913896 -0.7107833 0.7124849 -0.8149986 -3.7307776 0.6060114 0.5106385 0.4392618 -2.3593816 37 N -2.5909868 -0.3656759 0.3051418 -0.3690997 -3.1951955 0.4902545 0.2069937 0.4026681 -3.0545472 38 N -2.5909868 -0.3656759 0.3051418 -0.3690997 -3.1951955 0.4902545 0.2069937 0.4026681 -3.0545472 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 8 5 6 ] 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: 0.51, Number of G-points: 295, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/78) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 78 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 1.755 ( 0.000 0.000 0.000) 0.000 2.728 ( 0.000 0.000 0.000) 0.000 2.957 ( 0.000 0.000 0.000) 0.000 3.603 ( 0.000 0.000 0.000) 0.000 3.707 ( 0.000 0.000 0.000) 0.000 3.710 ( 0.000 0.000 0.000) 0.000 4.022 ( 0.000 0.000 0.000) 0.000 4.069 ( 0.000 0.000 0.000) 0.000 4.188 ( 0.000 0.000 0.000) 0.000 4.312 ( 0.000 0.000 0.000) 0.000 4.429 ( 0.000 0.000 0.000) 0.000 4.665 ( 0.000 0.000 0.000) 0.000 4.677 ( 0.000 0.000 0.000) 0.000 4.831 ( 0.000 0.000 0.000) 0.000 4.838 ( 0.000 0.000 0.000) 0.000 4.865 ( 0.000 0.000 0.000) 0.000 5.057 ( 0.000 0.000 0.000) 0.000 5.257 ( 0.000 0.000 0.000) 0.000 5.276 ( 0.000 0.000 0.000) 0.000 5.309 ( 0.000 0.000 0.000) 0.000 5.530 ( 0.000 0.000 0.000) 0.000 5.567 ( 0.000 0.000 0.000) 0.000 5.742 ( 0.000 0.000 0.000) 0.000 5.798 ( 0.000 0.000 0.000) 0.000 5.982 ( 0.000 0.000 0.000) 0.000 6.143 ( 0.000 0.000 0.000) 0.000 6.180 ( 0.000 0.000 0.000) 0.000 6.358 ( 0.000 0.000 0.000) 0.000 6.425 ( 0.000 0.000 0.000) 0.000 6.538 ( 0.000 0.000 0.000) 0.000 6.593 ( 0.000 0.000 0.000) 0.000 6.838 ( 0.000 0.000 0.000) 0.000 6.943 ( 0.000 0.000 0.000) 0.000 7.026 ( 0.000 0.000 0.000) 0.000 7.251 ( 0.000 0.000 0.000) 0.000 7.323 ( 0.000 0.000 0.000) 0.000 7.330 ( 0.000 0.000 0.000) 0.000 7.509 ( 0.000 0.000 0.000) 0.000 7.588 ( 0.000 0.000 0.000) 0.000 7.593 ( 0.000 0.000 0.000) 0.000 7.741 ( 0.000 0.000 0.000) 0.000 7.855 ( 0.000 0.000 0.000) 0.000 8.098 ( 0.000 0.000 0.000) 0.000 8.166 ( 0.000 0.000 0.000) 0.000 8.262 ( 0.000 0.000 0.000) 0.000 8.321 ( 0.000 0.000 0.000) 0.000 8.325 ( 0.000 0.000 0.000) 0.000 8.351 ( 0.000 0.000 0.000) 0.000 8.561 ( 0.000 0.000 0.000) 0.000 8.611 ( 0.000 0.000 0.000) 0.000 8.718 ( 0.000 0.000 0.000) 0.000 9.130 ( 0.000 0.000 0.000) 0.000 9.188 ( 0.000 0.000 0.000) 0.000 9.208 ( 0.000 0.000 0.000) 0.000 9.212 ( 0.000 0.000 0.000) 0.000 9.273 ( 0.000 0.000 0.000) 0.000 9.598 ( 0.000 0.000 0.000) 0.000 9.617 ( 0.000 0.000 0.000) 0.000 9.773 ( 0.000 0.000 0.000) 0.000 9.799 ( 0.000 0.000 0.000) 0.000 10.012 ( 0.000 0.000 0.000) 0.000 10.241 ( 0.000 0.000 0.000) 0.000 10.292 ( 0.000 0.000 0.000) 0.000 11.044 ( 0.000 0.000 0.000) 0.000 11.275 ( 0.000 0.000 0.000) 0.000 11.712 ( 0.000 0.000 0.000) 0.000 11.794 ( 0.000 0.000 0.000) 0.000 11.805 ( 0.000 0.000 0.000) 0.000 12.199 ( 0.000 0.000 0.000) 0.000 12.626 ( 0.000 0.000 0.000) 0.000 13.009 ( 0.000 0.000 0.000) 0.000 13.082 ( 0.000 0.000 0.000) 0.000 13.124 ( 0.000 0.000 0.000) 0.000 13.173 ( 0.000 0.000 0.000) 0.000 13.268 ( 0.000 0.000 0.000) 0.000 13.529 ( 0.000 0.000 0.000) 0.000 13.535 ( 0.000 0.000 0.000) 0.000 13.722 ( 0.000 0.000 0.000) 0.000 13.814 ( 0.000 0.000 0.000) 0.000 13.819 ( 0.000 0.000 0.000) 0.000 13.884 ( 0.000 0.000 0.000) 0.000 14.482 ( 0.000 0.000 0.000) 0.000 15.007 ( 0.000 0.000 0.000) 0.000 15.343 ( 0.000 0.000 0.000) 0.000 15.392 ( 0.000 0.000 0.000) 0.000 15.584 ( 0.000 0.000 0.000) 0.000 15.707 ( 0.000 0.000 0.000) 0.000 16.909 ( 0.000 0.000 0.000) 0.000 16.920 ( 0.000 0.000 0.000) 0.000 17.033 ( 0.000 0.000 0.000) 0.000 17.380 ( 0.000 0.000 0.000) 0.000 18.268 ( 0.000 0.000 0.000) 0.000 18.301 ( 0.000 0.000 0.000) 0.000 18.856 ( 0.000 0.000 0.000) 0.000 19.148 ( 0.000 0.000 0.000) 0.000 20.376 ( 0.000 0.000 0.000) 0.000 20.558 ( 0.000 0.000 0.000) 0.000 21.406 ( 0.000 0.000 0.000) 0.000 21.525 ( 0.000 0.000 0.000) 0.000 21.651 ( 0.000 0.000 0.000) 0.000 21.651 ( 0.000 0.000 0.000) 0.000 23.074 ( 0.000 0.000 0.000) 0.000 23.150 ( 0.000 0.000 0.000) 0.000 23.165 ( 0.000 0.000 0.000) 0.000 23.565 ( 0.000 0.000 0.000) 0.000 23.710 ( 0.000 0.000 0.000) 0.000 24.355 ( 0.000 0.000 0.000) 0.000 25.499 ( 0.000 0.000 0.000) 0.000 26.299 ( 0.000 0.000 0.000) 0.000 26.302 ( 0.000 0.000 0.000) 0.000 26.507 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/78) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( 42.576 0.000 1.285) 42.595 0.931 ( 43.783 0.000 -10.798) 45.095 1.489 ( 70.383 0.000 -10.004) 71.090 1.833 ( 7.368 0.000 -2.350) 7.733 2.729 ( 0.434 0.000 -1.811) 1.862 3.087 ( 11.368 0.000 4.051) 12.068 3.666 ( 5.032 0.000 1.731) 5.322 3.803 ( -3.652 0.000 -23.618) 23.899 3.824 ( 9.423 0.000 -11.903) 15.182 4.074 ( 4.869 0.000 -1.236) 5.023 4.111 ( 2.763 0.000 7.211) 7.722 4.188 ( 0.651 0.000 0.855) 1.074 4.345 ( 6.707 0.000 -16.400) 17.719 4.395 ( -2.803 0.000 -4.511) 5.311 4.661 ( -4.622 0.000 8.124) 9.347 4.745 ( 0.920 0.000 2.434) 2.602 4.805 ( 6.098 0.000 11.047) 12.619 4.829 ( -0.688 0.000 -0.409) 0.800 5.004 ( 7.043 0.000 -9.779) 12.051 5.091 ( 2.400 0.000 -1.608) 2.889 5.246 ( 2.750 0.000 1.156) 2.983 5.292 ( -1.149 0.000 -0.557) 1.277 5.397 ( 7.444 0.000 -5.364) 9.175 5.533 ( 0.290 0.000 -1.902) 1.924 5.579 ( 1.282 0.000 -0.449) 1.359 5.716 ( -1.861 0.000 6.107) 6.384 5.937 ( -3.861 0.000 -7.753) 8.662 6.099 ( -3.180 0.000 1.152) 3.382 6.161 ( 2.834 0.000 -6.373) 6.975 6.176 ( -1.428 0.000 -4.006) 4.253 6.339 ( -1.442 0.000 -0.379) 1.491 6.401 ( -3.128 0.000 -10.002) 10.479 6.502 ( -3.385 0.000 0.952) 3.516 6.716 ( 2.879 0.000 3.782) 4.753 6.802 ( -3.321 0.000 0.453) 3.352 6.888 ( -3.393 0.000 -1.810) 3.845 7.127 ( -8.207 0.000 -3.520) 8.930 7.181 ( 4.918 0.000 7.621) 9.071 7.238 ( -9.987 0.000 1.603) 10.115 7.311 ( -1.312 0.000 4.287) 4.484 7.463 ( -12.107 0.000 11.081) 16.412 7.565 ( -8.224 0.000 1.360) 8.335 7.703 ( 5.194 0.000 6.950) 8.677 7.743 ( -13.103 0.000 -1.313) 13.168 7.822 ( -13.941 0.000 5.014) 14.815 7.957 ( 3.755 0.000 -2.951) 4.776 8.143 ( -5.580 0.000 -4.598) 7.231 8.160 ( -9.068 0.000 3.399) 9.684 8.312 ( -7.504 0.000 23.868) 25.020 8.413 ( 3.550 0.000 0.984) 3.684 8.473 ( -0.662 0.000 2.086) 2.189 8.588 ( -2.175 0.000 -1.709) 2.766 8.604 ( 9.121 0.000 2.340) 9.416 8.798 ( 5.468 0.000 4.855) 7.313 9.053 ( -9.180 0.000 16.006) 18.451 9.098 ( -6.455 0.000 7.068) 9.572 9.234 ( 1.176 0.000 -1.302) 1.755 9.240 ( -0.873 0.000 4.655) 4.736 9.340 ( 3.443 0.000 -2.149) 4.059 9.596 ( -0.365 0.000 0.889) 0.961 9.689 ( -6.807 0.000 11.096) 13.017 9.785 ( -1.018 0.000 -0.805) 1.298 9.854 ( 0.034 0.000 6.767) 6.767 10.256 ( 19.448 0.000 -24.627) 31.380 10.264 ( -2.797 0.000 2.137) 3.520 10.967 ( -6.673 0.000 -2.233) 7.037 11.089 ( 2.966 0.000 -25.097) 25.272 11.167 ( -9.927 0.000 -2.673) 10.281 11.658 ( -0.463 0.000 0.998) 1.100 11.788 ( -4.703 0.000 16.019) 16.695 11.924 ( 7.662 0.000 5.042) 9.172 12.188 ( -1.119 0.000 -0.465) 1.211 12.679 ( 4.698 0.000 0.201) 4.702 12.965 ( -4.910 0.000 -1.887) 5.260 13.008 ( -3.464 0.000 -3.968) 5.267 13.193 ( -4.170 0.000 1.487) 4.427 13.215 ( 3.470 0.000 -1.511) 3.785 13.405 ( 9.198 0.000 -2.481) 9.527 13.463 ( -4.823 0.000 5.824) 7.562 13.719 ( -1.634 0.000 -2.186) 2.729 13.721 ( 0.033 0.000 4.323) 4.323 13.897 ( 1.093 0.000 1.052) 1.517 13.921 ( 6.924 0.000 0.486) 6.941 14.241 ( -0.178 0.000 -20.740) 20.741 14.516 ( 2.980 0.000 -5.818) 6.537 14.976 ( -4.400 0.000 -0.861) 4.483 15.333 ( -1.044 0.000 2.160) 2.399 15.601 ( 1.567 0.000 -1.148) 1.943 15.726 ( 1.715 0.000 0.445) 1.772 15.754 ( -1.237 0.000 -15.291) 15.341 16.884 ( -2.318 0.000 -0.826) 2.461 16.923 ( 0.148 0.000 1.648) 1.655 17.356 ( -2.264 0.000 0.619) 2.347 17.386 ( -5.141 0.000 -12.281) 13.313 18.223 ( -3.989 0.000 -3.132) 5.071 18.275 ( -2.793 0.000 0.452) 2.829 18.961 ( 9.023 0.000 -6.890) 11.353 19.545 ( -2.644 0.000 -3.251) 4.190 20.488 ( 1.888 0.000 -25.397) 25.467 20.609 ( 3.417 0.000 0.912) 3.536 21.456 ( 1.932 0.000 -3.422) 3.930 21.557 ( 2.573 0.000 2.497) 3.585 21.711 ( 5.520 0.000 2.280) 5.973 22.486 ( -2.915 0.000 30.019) 30.160 23.085 ( 0.875 0.000 -0.765) 1.162 23.172 ( 2.080 0.000 -0.031) 2.081 23.247 ( 3.451 0.000 -11.643) 12.144 23.588 ( 2.263 0.000 -0.907) 2.438 24.323 ( -2.917 0.000 -0.229) 2.926 24.650 ( -0.239 0.000 -8.026) 8.029 25.512 ( 1.221 0.000 0.142) 1.230 26.260 ( -3.582 0.000 0.103) 3.584 26.288 ( -1.048 0.000 -0.997) 1.447 26.573 ( -0.215 0.000 -8.157) 8.160 ======================= Grid point 2 (3/78) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( 34.328 0.000 1.619) 34.366 1.781 ( 37.438 0.000 -8.898) 38.481 2.051 ( 14.967 0.000 -3.063) 15.277 2.750 ( 1.643 0.000 -2.757) 3.209 2.854 ( 55.961 0.000 -9.930) 56.836 3.408 ( 21.398 0.000 5.609) 22.121 3.657 ( -6.293 0.000 -9.745) 11.600 3.761 ( 2.669 0.000 5.759) 6.347 4.100 ( 15.231 0.000 -18.434) 23.912 4.111 ( -4.201 0.000 7.786) 8.847 4.181 ( 5.057 0.000 -7.697) 9.210 4.257 ( 4.176 0.000 0.475) 4.203 4.325 ( -2.493 0.000 -4.143) 4.835 4.509 ( -7.019 0.000 -0.609) 7.045 4.623 ( 18.651 0.000 -14.392) 23.558 4.698 ( -2.892 0.000 -7.056) 7.626 4.885 ( 10.364 0.000 5.807) 11.880 5.088 ( 12.091 0.000 8.083) 14.544 5.092 ( 2.124 0.000 -1.630) 2.677 5.136 ( 3.448 0.000 4.817) 5.924 5.221 ( -4.016 0.000 -2.059) 4.513 5.399 ( 8.733 0.000 -0.156) 8.735 5.518 ( -1.489 0.000 -8.417) 8.548 5.522 ( 2.750 0.000 -8.602) 9.031 5.639 ( 5.024 0.000 3.176) 5.944 5.728 ( 3.123 0.000 14.488) 14.820 5.862 ( -1.124 0.000 -11.667) 11.721 6.024 ( -4.432 0.000 4.925) 6.626 6.096 ( -5.161 0.000 -9.488) 10.801 6.218 ( -1.631 0.000 -4.975) 5.236 6.296 ( -2.951 0.000 3.323) 4.444 6.323 ( 0.003 0.000 -0.351) 0.351 6.417 ( -4.219 0.000 2.714) 5.016 6.668 ( -7.719 0.000 5.582) 9.526 6.721 ( -3.556 0.000 -3.628) 5.080 6.851 ( -2.491 0.000 -2.440) 3.487 6.926 ( -17.159 0.000 4.398) 17.714 6.974 ( -6.499 0.000 -2.721) 7.045 7.092 ( -21.645 0.000 8.914) 23.409 7.209 ( -9.345 0.000 6.004) 11.108 7.311 ( 2.921 0.000 12.773) 13.102 7.437 ( -6.919 0.000 0.516) 6.938 7.446 ( -4.234 0.000 2.306) 4.821 7.675 ( -4.779 0.000 3.224) 5.765 7.749 ( -0.856 0.000 2.449) 2.594 7.924 ( -15.392 0.000 6.939) 16.884 7.963 ( -3.274 0.000 -2.498) 4.118 8.021 ( -15.772 0.000 17.394) 23.480 8.077 ( -1.582 0.000 0.297) 1.610 8.442 ( -0.539 0.000 -3.868) 3.905 8.461 ( -2.059 0.000 6.066) 6.406 8.526 ( -2.964 0.000 2.170) 3.674 8.758 ( 4.424 0.000 2.995) 5.342 8.896 ( 2.705 0.000 1.910) 3.311 9.004 ( -2.308 0.000 3.664) 4.331 9.022 ( 4.870 0.000 1.994) 5.263 9.198 ( -2.131 0.000 -5.318) 5.729 9.249 ( 0.103 0.000 -1.198) 1.202 9.393 ( 1.786 0.000 -0.203) 1.798 9.497 ( -10.879 0.000 10.321) 14.996 9.592 ( -0.340 0.000 3.631) 3.647 9.770 ( 0.042 0.000 -0.738) 0.739 9.856 ( -0.671 0.000 4.531) 4.580 10.181 ( -5.088 0.000 2.625) 5.725 10.642 ( 17.563 0.000 -21.920) 28.088 10.803 ( -7.793 0.000 -2.806) 8.283 10.913 ( -12.506 0.000 -1.551) 12.602 11.165 ( 5.852 0.000 -25.361) 26.028 11.703 ( 3.760 0.000 1.208) 3.949 11.705 ( -2.813 0.000 1.014) 2.990 12.083 ( 6.932 0.000 5.270) 8.708 12.148 ( -2.711 0.000 0.777) 2.820 12.796 ( 5.736 0.000 0.841) 5.797 12.810 ( -8.400 0.000 -1.200) 8.485 12.956 ( -1.472 0.000 -5.142) 5.348 13.102 ( -5.624 0.000 10.182) 11.631 13.306 ( 5.017 0.000 -4.464) 6.715 13.363 ( -4.830 0.000 2.359) 5.375 13.569 ( 6.205 0.000 -0.871) 6.266 13.651 ( -4.876 0.000 -1.552) 5.117 13.742 ( 1.724 0.000 7.412) 7.610 13.919 ( 0.592 0.000 -0.902) 1.079 14.038 ( 4.398 0.000 -4.588) 6.356 14.277 ( 4.548 0.000 -2.566) 5.221 14.575 ( 2.522 0.000 -2.024) 3.233 14.863 ( -5.749 0.000 -1.864) 6.044 15.306 ( -1.609 0.000 3.794) 4.121 15.645 ( 2.690 0.000 -1.125) 2.916 15.697 ( -3.196 0.000 -10.115) 10.608 15.774 ( 2.609 0.000 -0.224) 2.619 16.820 ( -3.419 0.000 -0.837) 3.520 16.927 ( 0.377 0.000 2.229) 2.260 17.267 ( -5.223 0.000 -1.591) 5.460 17.291 ( -3.762 0.000 0.823) 3.851 18.123 ( -4.797 0.000 0.551) 4.828 18.219 ( -2.251 0.000 -2.120) 3.092 19.163 ( 9.889 0.000 -7.639) 12.495 19.495 ( -1.750 0.000 1.037) 2.034 20.517 ( 2.045 0.000 -9.768) 9.980 20.659 ( 0.844 0.000 3.423) 3.525 21.508 ( 2.985 0.000 -1.129) 3.191 21.615 ( 2.370 0.000 3.595) 4.306 21.867 ( 8.538 0.000 2.129) 8.800 22.430 ( -3.840 0.000 8.626) 9.442 23.103 ( 0.973 0.000 -1.803) 2.048 23.231 ( 3.381 0.000 -0.032) 3.381 23.330 ( 4.553 0.000 -5.557) 7.184 23.657 ( 4.217 0.000 -0.259) 4.225 24.242 ( -4.566 0.000 -0.312) 4.576 24.638 ( -0.431 0.000 -1.858) 1.908 25.548 ( 2.138 0.000 0.226) 2.150 26.163 ( -5.260 0.000 0.110) 5.261 26.268 ( -0.554 0.000 -1.330) 1.441 26.548 ( -1.811 0.000 -1.636) 2.441 ======================= Grid point 3 (4/78) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( 8.935 0.000 -0.555) 8.952 2.420 ( 22.384 0.000 -4.719) 22.876 2.589 ( 30.259 0.000 0.532) 30.264 2.783 ( 1.432 0.000 -2.710) 3.065 3.435 ( 9.244 0.000 2.794) 9.657 3.599 ( 3.468 0.000 -5.640) 6.621 3.755 ( -5.329 0.000 5.126) 7.394 3.934 ( -10.086 0.000 1.891) 10.262 4.028 ( 1.041 0.000 -9.906) 9.960 4.291 ( -0.806 0.000 4.905) 4.971 4.309 ( 0.573 0.000 -3.687) 3.731 4.346 ( 37.804 0.000 -2.523) 37.888 4.420 ( 8.805 0.000 -11.175) 14.227 4.455 ( 1.211 0.000 -2.118) 2.440 4.741 ( 14.883 0.000 -16.187) 21.989 5.038 ( 10.204 0.000 -1.813) 10.364 5.044 ( -3.453 0.000 -0.774) 3.539 5.111 ( 5.480 0.000 2.609) 6.070 5.152 ( 6.983 0.000 -8.304) 10.849 5.259 ( 9.178 0.000 -0.012) 9.178 5.396 ( 8.022 0.000 5.348) 9.641 5.470 ( -1.861 0.000 -8.924) 9.116 5.515 ( 2.981 0.000 8.431) 8.942 5.532 ( 4.003 0.000 -0.024) 4.003 5.791 ( 7.523 0.000 -4.291) 8.661 5.809 ( 3.484 0.000 9.814) 10.415 5.893 ( 1.560 0.000 -1.753) 2.346 5.935 ( -3.231 0.000 2.341) 3.990 5.961 ( -8.351 0.000 -6.462) 10.559 6.090 ( -3.787 0.000 3.646) 5.257 6.266 ( -4.761 0.000 -0.875) 4.841 6.280 ( -5.083 0.000 1.221) 5.228 6.366 ( -1.164 0.000 3.123) 3.333 6.420 ( -17.283 0.000 2.881) 17.521 6.586 ( -8.583 0.000 3.114) 9.130 6.639 ( -15.543 0.000 -1.619) 15.627 6.730 ( -8.051 0.000 6.853) 10.573 6.746 ( 3.432 0.000 -7.293) 8.060 6.865 ( -3.920 0.000 1.441) 4.177 7.027 ( -7.728 0.000 10.560) 13.086 7.281 ( -14.168 0.000 1.399) 14.237 7.353 ( -5.349 0.000 2.839) 6.056 7.416 ( 1.432 0.000 3.683) 3.951 7.557 ( -9.958 0.000 9.047) 13.454 7.604 ( -0.586 0.000 6.698) 6.724 7.718 ( -2.803 0.000 -4.527) 5.324 7.819 ( -6.363 0.000 3.127) 7.090 7.820 ( -7.302 0.000 1.909) 7.548 8.038 ( -2.077 0.000 1.232) 2.415 8.393 ( -3.484 0.000 5.333) 6.370 8.440 ( -0.153 0.000 3.874) 3.877 8.519 ( 2.155 0.000 -5.158) 5.590 8.767 ( -2.717 0.000 1.557) 3.132 8.970 ( 3.985 0.000 3.574) 5.353 8.996 ( 0.511 0.000 0.920) 1.053 9.107 ( 1.765 0.000 -7.727) 7.926 9.188 ( 1.530 0.000 -7.338) 7.496 9.239 ( -0.683 0.000 -0.715) 0.989 9.306 ( -6.819 0.000 9.182) 11.437 9.419 ( 0.738 0.000 0.183) 0.760 9.595 ( 0.270 0.000 4.464) 4.472 9.793 ( 2.070 0.000 -0.512) 2.132 9.835 ( -1.240 0.000 1.816) 2.199 10.070 ( -5.242 0.000 1.994) 5.608 10.668 ( -4.568 0.000 -1.569) 4.830 10.693 ( -7.777 0.000 -0.619) 7.802 10.902 ( 7.920 0.000 -11.146) 13.673 11.261 ( 4.018 0.000 -14.562) 15.107 11.720 ( 5.383 0.000 -10.931) 12.185 11.782 ( 3.062 0.000 0.818) 3.170 12.066 ( -6.221 0.000 8.797) 10.774 12.211 ( 4.654 0.000 3.380) 5.752 12.684 ( -1.745 0.000 -6.454) 6.686 12.890 ( 2.783 0.000 2.299) 3.610 12.930 ( -0.620 0.000 -5.611) 5.645 12.956 ( -9.155 0.000 13.270) 16.121 13.280 ( -2.875 0.000 0.203) 2.882 13.397 ( 3.490 0.000 -3.817) 5.172 13.540 ( -4.672 0.000 -0.017) 4.672 13.673 ( 4.084 0.000 0.870) 4.175 13.794 ( 2.262 0.000 10.166) 10.415 13.908 ( -1.458 0.000 -6.106) 6.278 14.113 ( 2.993 0.000 -1.788) 3.486 14.381 ( 4.378 0.000 -0.506) 4.407 14.615 ( 1.716 0.000 -0.359) 1.754 14.753 ( -4.470 0.000 -3.005) 5.386 15.279 ( -1.098 0.000 3.264) 3.443 15.618 ( -3.254 0.000 -5.483) 6.376 15.705 ( 2.843 0.000 0.145) 2.847 15.817 ( 1.241 0.000 -1.587) 2.015 16.756 ( -2.252 0.000 -0.132) 2.256 16.961 ( 2.924 0.000 0.835) 3.041 17.163 ( -5.022 0.000 0.965) 5.114 17.214 ( -3.260 0.000 0.506) 3.299 18.044 ( -2.562 0.000 1.202) 2.830 18.183 ( -1.051 0.000 -1.831) 2.111 19.333 ( 6.491 0.000 -6.043) 8.869 19.472 ( -0.915 0.000 2.650) 2.804 20.556 ( 2.263 0.000 -5.712) 6.144 20.649 ( -1.819 0.000 4.555) 4.905 21.567 ( 2.416 0.000 -0.544) 2.476 21.653 ( 0.923 0.000 2.688) 2.842 22.044 ( 7.743 0.000 0.931) 7.799 22.344 ( -4.669 0.000 2.543) 5.316 23.121 ( 0.723 0.000 -1.442) 1.613 23.301 ( 2.876 0.000 -0.011) 2.876 23.406 ( 2.673 0.000 -2.939) 3.973 23.748 ( 3.875 0.000 0.358) 3.892 24.150 ( -3.712 0.000 -0.216) 3.719 24.631 ( -0.176 0.000 -0.195) 0.262 25.595 ( 2.071 0.000 0.190) 2.079 26.060 ( -4.135 0.000 0.039) 4.135 26.266 ( 0.345 0.000 -1.084) 1.138 26.502 ( -2.210 0.000 0.077) 2.211 ======================= Grid point 4 (5/78) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 42 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( 0.000 0.000 -0.000) 0.000 2.651 ( 0.000 0.000 0.000) 0.000 2.796 ( 0.000 0.000 -0.000) 0.000 3.012 ( 0.000 0.000 0.000) 0.000 3.519 ( 0.000 0.000 -0.000) 0.000 3.576 ( -0.000 0.000 -0.000) 0.000 3.767 ( 0.000 0.000 0.000) 0.000 3.847 ( -0.000 0.000 0.000) 0.000 3.850 ( 0.000 0.000 -0.000) 0.000 4.268 ( 0.000 0.000 0.000) 0.000 4.332 ( 0.000 0.000 -0.000) 0.000 4.465 ( 0.000 0.000 0.000) 0.000 4.470 ( 0.000 0.000 0.000) 0.000 4.910 ( 0.000 0.000 -0.000) 0.000 4.998 ( 0.000 0.000 -0.000) 0.000 5.047 ( 0.000 0.000 0.000) 0.000 5.086 ( 0.000 0.000 0.000) 0.000 5.155 ( 0.000 0.000 0.000) 0.000 5.249 ( -0.000 0.000 -0.000) 0.000 5.385 ( 0.000 0.000 0.000) 0.000 5.394 ( 0.000 0.000 -0.000) 0.000 5.440 ( 0.000 0.000 0.000) 0.000 5.660 ( 0.000 0.000 0.000) 0.000 5.735 ( -0.000 0.000 -0.000) 0.000 5.735 ( -0.000 0.000 -0.000) 0.000 5.772 ( 0.000 0.000 0.000) 0.000 5.879 ( 0.000 0.000 -0.000) 0.000 5.904 ( -0.000 0.000 0.000) 0.000 5.966 ( 0.000 0.000 0.000) 0.000 6.064 ( 0.000 0.000 0.000) 0.000 6.155 ( 0.000 0.000 -0.000) 0.000 6.202 ( 0.000 0.000 0.000) 0.000 6.212 ( -0.000 0.000 0.000) 0.000 6.347 ( 0.000 0.000 0.000) 0.000 6.400 ( 0.000 0.000 -0.000) 0.000 6.522 ( 0.000 0.000 -0.000) 0.000 6.680 ( 0.000 0.000 0.000) 0.000 6.789 ( 0.000 0.000 -0.000) 0.000 6.868 ( 0.000 0.000 0.000) 0.000 6.926 ( 0.000 0.000 0.000) 0.000 6.981 ( 0.000 0.000 0.000) 0.000 7.259 ( 0.000 0.000 0.000) 0.000 7.440 ( 0.000 0.000 0.000) 0.000 7.515 ( 0.000 0.000 -0.000) 0.000 7.640 ( 0.000 0.000 -0.000) 0.000 7.649 ( 0.000 0.000 -0.000) 0.000 7.722 ( 0.000 0.000 0.000) 0.000 7.771 ( 0.000 0.000 -0.000) 0.000 8.012 ( 0.000 0.000 0.000) 0.000 8.352 ( 0.000 0.000 0.000) 0.000 8.444 ( 0.000 0.000 0.000) 0.000 8.549 ( 0.000 0.000 -0.000) 0.000 8.724 ( 0.000 0.000 -0.000) 0.000 9.003 ( 0.000 0.000 0.000) 0.000 9.043 ( 0.000 0.000 0.000) 0.000 9.081 ( -0.000 0.000 -0.000) 0.000 9.207 ( 0.000 0.000 0.000) 0.000 9.230 ( 0.000 0.000 -0.000) 0.000 9.251 ( 0.000 0.000 -0.000) 0.000 9.426 ( 0.000 0.000 0.000) 0.000 9.602 ( 0.000 0.000 0.000) 0.000 9.820 ( 0.000 0.000 0.000) 0.000 9.828 ( 0.000 0.000 -0.000) 0.000 10.003 ( 0.000 0.000 0.000) 0.000 10.608 ( 0.000 0.000 0.000) 0.000 10.619 ( 0.000 0.000 -0.000) 0.000 10.972 ( 0.000 0.000 0.000) 0.000 11.297 ( 0.000 0.000 0.000) 0.000 11.816 ( 0.000 0.000 -0.000) 0.000 11.884 ( -0.000 0.000 0.000) 0.000 11.900 ( 0.000 0.000 -0.000) 0.000 12.264 ( 0.000 0.000 -0.000) 0.000 12.722 ( 0.000 0.000 0.000) 0.000 12.802 ( 0.000 0.000 -0.000) 0.000 12.917 ( 0.000 0.000 -0.000) 0.000 12.923 ( 0.000 0.000 0.000) 0.000 13.250 ( 0.000 0.000 0.000) 0.000 13.433 ( 0.000 0.000 -0.000) 0.000 13.488 ( 0.000 0.000 0.000) 0.000 13.724 ( 0.000 0.000 0.000) 0.000 13.845 ( -0.000 0.000 -0.000) 0.000 13.862 ( 0.000 0.000 0.000) 0.000 14.147 ( 0.000 0.000 0.000) 0.000 14.429 ( 0.000 0.000 -0.000) 0.000 14.659 ( 0.000 0.000 0.000) 0.000 14.677 ( -0.000 0.000 -0.000) 0.000 15.269 ( 0.000 0.000 -0.000) 0.000 15.578 ( 0.000 0.000 0.000) 0.000 15.743 ( 0.000 0.000 0.000) 0.000 15.824 ( 0.000 0.000 -0.000) 0.000 16.733 ( 0.000 0.000 0.000) 0.000 17.028 ( -0.000 0.000 0.000) 0.000 17.075 ( 0.000 0.000 -0.000) 0.000 17.176 ( 0.000 0.000 -0.000) 0.000 18.019 ( 0.000 0.000 -0.000) 0.000 18.172 ( 0.000 0.000 -0.000) 0.000 19.409 ( 0.000 0.000 -0.000) 0.000 19.456 ( 0.000 0.000 0.000) 0.000 20.602 ( -0.000 0.000 0.000) 0.000 20.605 ( 0.000 0.000 -0.000) 0.000 21.594 ( 0.000 0.000 0.000) 0.000 21.661 ( 0.000 0.000 0.000) 0.000 22.153 ( 0.000 0.000 -0.000) 0.000 22.269 ( 0.000 0.000 0.000) 0.000 23.128 ( 0.000 0.000 0.000) 0.000 23.334 ( 0.000 0.000 -0.000) 0.000 23.433 ( 0.000 0.000 0.000) 0.000 23.792 ( 0.000 0.000 0.000) 0.000 24.107 ( 0.000 0.000 -0.000) 0.000 24.629 ( 0.000 0.000 0.000) 0.000 25.620 ( 0.000 0.000 -0.000) 0.000 26.013 ( 0.000 0.000 -0.000) 0.000 26.272 ( 0.000 0.000 0.000) 0.000 26.475 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 9 (6/78) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.768 ( 0.000 36.776 0.000) 36.776 0.893 ( 0.000 43.685 0.000) 43.685 1.610 ( 0.000 75.168 0.000) 75.168 2.183 ( 0.000 -3.200 0.000) 3.200 2.730 ( 0.000 0.553 0.000) 0.553 2.928 ( 0.000 -5.457 0.000) 5.457 3.435 ( 0.000 -14.244 0.000) 14.244 3.608 ( 0.000 -23.889 0.000) 23.889 3.641 ( 0.000 -5.988 0.000) 5.988 4.057 ( 0.000 5.468 0.000) 5.468 4.142 ( 0.000 5.671 0.000) 5.671 4.301 ( 0.000 0.055 0.000) 0.055 4.314 ( 0.000 3.213 0.000) 3.213 4.495 ( 0.000 2.495 0.000) 2.495 4.536 ( 0.000 5.971 0.000) 5.971 4.789 ( 0.000 -0.562 0.000) 0.562 4.825 ( 0.000 -2.781 0.000) 2.781 4.877 ( 0.000 1.641 0.000) 1.641 5.082 ( 0.000 4.310 0.000) 4.310 5.265 ( 0.000 15.092 0.000) 15.092 5.307 ( 0.000 0.466 0.000) 0.466 5.399 ( 0.000 9.772 0.000) 9.772 5.521 ( 0.000 4.515 0.000) 4.515 5.581 ( 0.000 4.951 0.000) 4.951 5.721 ( 0.000 -3.557 0.000) 3.557 5.762 ( 0.000 -3.216 0.000) 3.216 5.848 ( 0.000 5.996 0.000) 5.996 6.006 ( 0.000 2.420 0.000) 2.420 6.129 ( 0.000 -1.284 0.000) 1.284 6.147 ( 0.000 1.617 0.000) 1.617 6.320 ( 0.000 -2.031 0.000) 2.031 6.393 ( 0.000 -3.982 0.000) 3.982 6.494 ( 0.000 -24.888 0.000) 24.888 6.615 ( 0.000 -3.805 0.000) 3.805 6.851 ( 0.000 2.696 0.000) 2.696 6.939 ( 0.000 -11.597 0.000) 11.597 6.950 ( 0.000 -2.479 0.000) 2.479 7.042 ( 0.000 -8.387 0.000) 8.387 7.207 ( 0.000 -7.137 0.000) 7.137 7.238 ( 0.000 -1.910 0.000) 1.910 7.356 ( 0.000 -20.933 0.000) 20.933 7.501 ( 0.000 1.894 0.000) 1.894 7.704 ( 0.000 7.803 0.000) 7.803 7.891 ( 0.000 -2.138 0.000) 2.138 7.898 ( 0.000 2.032 0.000) 2.032 8.089 ( 0.000 -3.790 0.000) 3.790 8.124 ( 0.000 3.996 0.000) 3.996 8.198 ( 0.000 5.641 0.000) 5.641 8.282 ( 0.000 -3.134 0.000) 3.134 8.477 ( 0.000 -6.721 0.000) 6.721 8.716 ( 0.000 2.728 0.000) 2.728 8.719 ( 0.000 6.928 0.000) 6.928 8.900 ( 0.000 22.989 0.000) 22.989 9.041 ( 0.000 -3.896 0.000) 3.896 9.068 ( 0.000 -0.449 0.000) 0.449 9.217 ( 0.000 2.447 0.000) 2.447 9.285 ( 0.000 5.435 0.000) 5.435 9.329 ( 0.000 4.933 0.000) 4.933 9.583 ( 0.000 -1.608 0.000) 1.608 9.621 ( 0.000 1.111 0.000) 1.111 9.718 ( 0.000 -3.980 0.000) 3.980 9.850 ( 0.000 2.048 0.000) 2.048 9.854 ( 0.000 5.570 0.000) 5.570 10.001 ( 0.000 -0.254 0.000) 0.254 10.210 ( 0.000 -2.865 0.000) 2.865 10.601 ( 0.000 -7.343 0.000) 7.343 11.197 ( 0.000 0.614 0.000) 0.614 11.284 ( 0.000 0.642 0.000) 0.642 11.606 ( 0.000 -8.053 0.000) 8.053 11.700 ( 0.000 -3.382 0.000) 3.382 11.988 ( 0.000 8.028 0.000) 8.028 12.192 ( 0.000 -0.423 0.000) 0.423 12.619 ( 0.000 -9.328 0.000) 9.328 12.909 ( 0.000 -13.246 0.000) 13.246 13.103 ( 0.000 -0.909 0.000) 0.909 13.134 ( 0.000 5.120 0.000) 5.120 13.300 ( 0.000 2.925 0.000) 2.925 13.301 ( 0.000 3.559 0.000) 3.559 13.538 ( 0.000 1.075 0.000) 1.075 13.639 ( 0.000 3.723 0.000) 3.723 13.802 ( 0.000 0.073 0.000) 0.073 13.816 ( 0.000 3.490 0.000) 3.490 13.929 ( 0.000 2.583 0.000) 2.583 14.054 ( 0.000 0.951 0.000) 0.951 14.464 ( 0.000 -1.432 0.000) 1.432 14.845 ( 0.000 -13.229 0.000) 13.229 15.356 ( 0.000 1.034 0.000) 1.034 15.371 ( 0.000 -0.539 0.000) 0.539 15.873 ( 0.000 12.183 0.000) 12.183 16.293 ( 0.000 -0.953 0.000) 0.953 16.932 ( 0.000 1.211 0.000) 1.211 17.026 ( 0.000 -0.781 0.000) 0.781 17.394 ( 0.000 1.558 0.000) 1.558 17.703 ( 0.000 -6.246 0.000) 6.246 18.290 ( 0.000 1.510 0.000) 1.510 18.304 ( 0.000 0.289 0.000) 0.289 18.903 ( 0.000 4.269 0.000) 4.269 19.137 ( 0.000 -1.194 0.000) 1.194 20.397 ( 0.000 1.979 0.000) 1.979 20.545 ( 0.000 -1.325 0.000) 1.325 21.415 ( 0.000 0.911 0.000) 0.911 21.513 ( 0.000 -1.148 0.000) 1.148 21.652 ( 0.000 0.073 0.000) 0.073 21.652 ( 0.000 0.073 0.000) 0.073 23.072 ( 0.000 -0.022 0.000) 0.022 23.150 ( 0.000 -1.417 0.000) 1.417 23.569 ( 0.000 0.531 0.000) 0.531 23.685 ( 0.000 -2.258 0.000) 2.258 24.036 ( 0.000 3.887 0.000) 3.887 24.327 ( 0.000 -2.706 0.000) 2.706 26.309 ( 0.000 0.649 0.000) 0.649 26.311 ( 0.000 1.001 0.000) 1.001 26.499 ( 0.000 -0.592 0.000) 0.592 26.547 ( 0.000 -1.269 0.000) 1.269 ======================= Grid point 10 (7/78) ======================= q-point: ( 0.12 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( 28.809 24.955 -9.491) 39.278 1.358 ( 36.143 26.815 -7.857) 45.685 2.043 ( 19.313 24.542 -1.893) 31.287 2.157 ( 20.457 36.779 -0.598) 42.090 2.732 ( 0.468 0.420 -0.871) 1.074 3.077 ( 12.967 -2.844 4.047) 13.878 3.420 ( 3.264 -13.237 -3.820) 14.159 3.636 ( 1.790 -18.790 -9.536) 21.147 3.737 ( 6.229 -15.828 -4.313) 17.548 4.082 ( 2.026 9.761 -1.560) 10.090 4.196 ( 3.812 5.835 -0.247) 6.974 4.245 ( 4.012 3.923 -9.906) 11.384 4.386 ( 4.059 5.901 -5.148) 8.820 4.412 ( -3.699 2.828 7.021) 8.424 4.688 ( 4.947 1.635 7.009) 8.733 4.784 ( 2.518 6.220 6.161) 9.110 4.797 ( -4.830 -1.221 -4.411) 6.654 4.842 ( 0.145 -6.943 -2.937) 7.540 5.164 ( 1.023 8.014 4.406) 9.202 5.255 ( 2.567 13.732 -5.958) 15.187 5.311 ( -0.214 3.503 -0.535) 3.550 5.369 ( 0.924 5.316 -2.893) 6.122 5.439 ( -1.092 5.125 -3.072) 6.074 5.608 ( 2.101 6.003 7.321) 9.698 5.629 ( -0.172 6.712 -3.156) 7.419 5.761 ( 0.247 -0.324 2.655) 2.687 5.913 ( -1.377 -0.371 -12.426) 12.508 6.029 ( -4.157 -6.507 -0.817) 7.764 6.138 ( 4.587 2.326 0.129) 5.144 6.166 ( 0.199 0.408 -1.665) 1.726 6.278 ( -1.249 -6.015 1.200) 6.260 6.376 ( -2.118 -1.876 0.237) 2.839 6.537 ( 1.020 -11.076 1.479) 11.221 6.566 ( -3.362 -9.465 -2.822) 10.433 6.775 ( -4.819 -5.299 -10.546) 12.749 6.871 ( -1.184 -0.132 4.033) 4.205 7.018 ( -1.490 -10.139 3.055) 10.694 7.061 ( 0.032 -7.543 9.102) 11.821 7.167 ( -4.022 -7.330 2.795) 8.816 7.186 ( -2.245 -1.597 1.307) 3.049 7.373 ( -3.415 -17.074 1.935) 17.519 7.505 ( 0.715 0.017 6.641) 6.679 7.602 ( -15.465 6.962 4.142) 17.458 7.674 ( -2.930 5.077 3.519) 6.837 7.895 ( -11.608 -0.984 -6.295) 13.242 7.957 ( -1.986 0.074 -1.539) 2.514 8.115 ( -4.962 -0.850 5.735) 7.631 8.217 ( -3.013 -5.222 0.710) 6.070 8.251 ( -6.787 -1.027 2.456) 7.290 8.476 ( 0.892 0.107 2.486) 2.643 8.626 ( -7.952 7.798 6.009) 12.655 8.723 ( -5.329 2.586 7.548) 9.594 8.763 ( -8.522 8.318 -1.396) 11.990 8.898 ( -1.071 9.909 1.094) 10.027 9.021 ( -1.651 -2.877 12.834) 13.256 9.134 ( -7.959 3.307 3.956) 9.483 9.253 ( -4.363 1.866 3.651) 5.987 9.320 ( 3.274 10.425 1.241) 10.997 9.387 ( -3.134 2.000 3.790) 5.310 9.596 ( -1.089 0.259 3.070) 3.268 9.666 ( -3.719 -0.925 5.339) 6.572 9.830 ( -0.981 3.673 -0.852) 3.896 9.887 ( 0.072 3.529 4.382) 5.627 10.223 ( 9.744 -0.356 -12.005) 15.466 10.294 ( 9.505 0.050 -14.234) 17.116 10.770 ( 7.784 -12.926 -17.741) 23.290 11.082 ( -7.207 1.406 -2.573) 7.780 11.194 ( -7.988 0.481 -4.297) 9.084 11.692 ( 1.673 -2.225 13.978) 14.253 11.737 ( 2.433 -3.274 2.279) 4.673 12.007 ( 2.825 5.494 -3.481) 7.091 12.192 ( -0.074 0.413 -2.845) 2.876 12.616 ( 1.176 -6.218 1.104) 6.424 12.856 ( -5.215 -9.253 4.519) 11.543 12.993 ( -3.499 2.237 1.487) 4.411 13.166 ( 0.356 -2.148 -3.466) 4.093 13.301 ( 2.181 5.584 -0.902) 6.063 13.388 ( 0.423 -2.581 2.948) 3.942 13.534 ( 2.017 5.871 0.611) 6.238 13.695 ( 1.285 2.000 -1.965) 3.084 13.794 ( 0.635 0.802 0.645) 1.209 13.906 ( 0.168 2.511 0.050) 2.518 13.937 ( 7.311 1.641 1.163) 7.582 14.142 ( 5.453 -4.348 -16.047) 17.497 14.460 ( 0.757 -2.680 -0.827) 2.905 14.826 ( -2.458 -12.710 -0.645) 12.962 15.331 ( -1.323 0.421 2.820) 3.143 15.414 ( 2.516 -3.512 -2.379) 4.932 15.864 ( -0.527 11.309 1.162) 11.380 16.123 ( -9.696 11.148 -3.559) 15.197 16.881 ( -4.482 0.609 -1.324) 4.713 16.954 ( -2.638 0.891 0.782) 2.892 17.344 ( -4.809 0.655 2.731) 5.569 17.474 ( -8.633 3.206 -10.661) 14.088 18.219 ( -3.885 0.291 -1.567) 4.199 18.272 ( -3.277 -0.279 0.205) 3.295 18.996 ( 8.217 3.293 -5.999) 10.693 19.369 ( 7.053 -11.093 -2.948) 13.472 20.472 ( 4.033 0.080 -12.589) 13.220 20.594 ( 3.538 -1.370 1.080) 3.945 21.456 ( 2.413 0.342 -1.900) 3.090 21.546 ( 2.603 -1.141 2.313) 3.664 21.717 ( 5.946 0.664 2.322) 6.418 21.997 ( 19.428 -18.456 13.842) 30.161 23.062 ( -0.708 -0.423 0.221) 0.853 23.145 ( -0.419 -1.710 0.025) 1.760 23.529 ( -3.993 8.196 -2.830) 9.546 23.602 ( 1.178 1.707 -3.437) 4.014 24.275 ( 9.234 -8.540 -1.863) 12.715 24.318 ( 2.100 -4.427 3.759) 6.176 26.088 ( -21.539 20.778 2.671) 30.046 26.271 ( -3.701 0.986 0.330) 3.844 26.305 ( -1.363 1.920 -1.891) 3.020 26.542 ( -0.730 -2.765 -6.909) 7.478 ======================= Grid point 11 (8/78) ======================= q-point: ( 0.25 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( 27.559 9.676 -5.195) 29.667 2.042 ( 22.103 12.973 -5.168) 26.145 2.246 ( 22.401 16.906 -4.683) 28.453 2.765 ( 3.338 1.765 -2.566) 4.565 3.031 ( 35.934 15.404 -3.073) 39.217 3.448 ( 21.318 -0.864 3.108) 21.561 3.519 ( 7.088 -3.756 -7.235) 10.802 3.695 ( 7.867 -8.358 -5.134) 12.574 3.884 ( 7.852 -18.054 -4.705) 20.241 4.170 ( 5.635 7.055 -3.236) 9.592 4.266 ( 2.815 6.716 -4.563) 8.594 4.331 ( -1.582 6.681 8.110) 10.626 4.377 ( 2.820 6.249 -0.643) 6.886 4.572 ( 3.572 0.371 -7.666) 8.466 4.642 ( 5.240 5.504 -8.218) 11.193 4.662 ( -1.256 2.188 -4.453) 5.118 4.871 ( 2.553 -9.018 -4.410) 10.358 4.989 ( 7.146 -0.804 6.014) 9.374 5.171 ( 2.497 5.042 5.539) 7.896 5.273 ( 0.998 9.802 3.889) 10.592 5.341 ( 3.417 4.394 -0.553) 5.594 5.442 ( 4.057 3.393 -5.943) 7.956 5.523 ( 5.451 6.379 -6.957) 10.900 5.622 ( 0.133 1.916 1.986) 2.763 5.669 ( 1.899 7.124 1.458) 7.515 5.797 ( 3.530 1.711 2.160) 4.478 5.823 ( -3.773 -2.205 -8.082) 9.188 5.998 ( 0.419 -2.740 -0.236) 2.782 6.076 ( -5.601 1.562 -3.549) 6.812 6.186 ( -3.597 -4.098 2.508) 6.002 6.278 ( 1.497 -1.882 2.016) 3.138 6.336 ( -2.288 -0.153 4.014) 4.623 6.449 ( -4.020 4.645 -6.621) 9.031 6.566 ( -0.696 -13.767 1.158) 13.833 6.681 ( -2.890 -9.384 -11.391) 15.039 6.807 ( -5.508 -0.118 11.842) 13.061 6.869 ( -13.546 -5.917 2.157) 14.939 6.929 ( -10.084 0.340 0.010) 10.090 7.124 ( -11.682 -4.807 8.353) 15.145 7.170 ( 1.249 -13.464 9.141) 16.322 7.227 ( -7.098 1.665 3.319) 8.011 7.315 ( -5.724 4.609 6.135) 9.573 7.497 ( -2.560 0.335 4.822) 5.470 7.613 ( -8.631 -11.118 1.389) 14.143 7.654 ( -4.177 4.534 1.005) 6.247 7.805 ( -11.491 -2.739 9.394) 15.093 7.997 ( -7.614 1.577 -0.651) 7.803 8.062 ( -6.654 -0.212 4.394) 7.976 8.182 ( -3.066 -5.620 -2.661) 6.933 8.340 ( -11.691 -1.802 1.110) 11.881 8.403 ( -7.363 1.946 8.694) 11.558 8.695 ( -1.167 -1.680 -1.593) 2.593 8.743 ( 2.020 2.752 5.949) 6.859 8.865 ( -1.765 4.285 2.961) 5.499 8.988 ( -4.220 2.463 5.475) 7.338 9.106 ( 4.629 -2.519 2.814) 5.975 9.194 ( -1.078 0.539 -4.688) 4.841 9.311 ( -4.258 -5.208 2.665) 7.236 9.398 ( 2.870 11.841 1.043) 12.228 9.539 ( -3.578 2.465 4.747) 6.435 9.620 ( -1.132 3.587 1.755) 4.151 9.817 ( -0.519 1.228 -0.217) 1.351 9.860 ( -2.115 3.855 2.834) 5.231 10.203 ( -4.277 1.252 2.327) 5.027 10.638 ( 15.761 -0.280 -20.599) 25.938 10.793 ( -4.314 -1.800 -7.838) 9.126 10.918 ( -9.554 0.832 -2.350) 9.874 11.092 ( 3.246 -4.794 -18.607) 19.487 11.705 ( -1.046 0.438 4.750) 4.884 11.796 ( 4.930 4.793 -2.839) 7.439 12.076 ( 2.368 -0.726 3.332) 4.152 12.196 ( 1.301 3.396 -2.734) 4.550 12.614 ( -4.720 -8.672 3.966) 10.640 12.750 ( -2.282 -6.767 3.343) 7.885 12.971 ( -0.034 0.807 3.296) 3.394 13.142 ( -2.055 -0.441 -2.937) 3.612 13.336 ( -1.206 0.709 -1.878) 2.341 13.362 ( 0.559 1.505 1.830) 2.435 13.605 ( 2.991 3.629 -1.684) 4.995 13.689 ( -1.198 4.625 1.029) 4.888 13.803 ( 0.263 3.774 8.369) 9.184 13.931 ( 1.545 1.723 -4.509) 5.068 14.063 ( 4.651 2.041 -2.412) 5.622 14.244 ( 5.765 -2.927 -4.534) 7.896 14.502 ( 2.595 -5.486 -2.150) 6.439 14.746 ( -4.522 -10.407 -2.058) 11.532 15.304 ( -1.573 0.251 3.321) 3.684 15.458 ( 1.812 -6.129 -2.898) 7.017 15.865 ( 0.501 9.008 0.357) 9.029 15.984 ( -3.794 12.381 -4.101) 13.583 16.786 ( -4.383 -2.117 -1.630) 5.133 16.916 ( -1.123 -1.672 0.557) 2.090 17.241 ( -4.241 -0.513 2.586) 4.994 17.333 ( -6.078 1.363 -2.920) 6.879 18.129 ( -4.223 0.661 0.390) 4.292 18.207 ( -2.518 -1.027 -1.566) 3.138 19.185 ( 9.342 2.061 -6.765) 11.717 19.437 ( 1.502 -4.920 0.023) 5.144 20.527 ( 2.288 1.087 -6.973) 7.418 20.647 ( 1.015 -1.166 2.817) 3.213 21.513 ( 2.979 0.601 -0.542) 3.087 21.604 ( 2.412 -1.103 3.522) 4.409 21.880 ( 8.718 1.516 1.897) 9.050 22.259 ( 5.803 -12.114 5.135) 14.381 23.059 ( 0.610 -2.791 -0.111) 2.859 23.139 ( 0.042 -3.723 -0.503) 3.757 23.511 ( 1.571 8.733 -4.601) 9.995 23.658 ( 3.749 0.126 -0.910) 3.860 24.258 ( -2.517 1.261 0.363) 2.839 24.482 ( 5.714 -9.876 1.979) 11.580 25.792 ( -7.866 16.561 -0.640) 18.346 26.170 ( -5.562 0.404 0.474) 5.596 26.283 ( -0.657 1.439 -1.309) 2.053 26.510 ( -1.963 -3.544 -1.828) 4.445 ======================= Grid point 12 (9/78) ======================= q-point: ( 0.38 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.162 ( 8.737 1.890 -2.056) 9.172 2.387 ( 13.355 -1.891 -2.042) 13.642 2.817 ( 19.981 13.304 -6.949) 24.990 2.908 ( 14.834 15.426 2.188) 21.512 3.411 ( 7.721 -1.860 3.473) 8.668 3.548 ( 6.318 -4.500 -5.261) 9.373 3.776 ( 1.592 1.477 1.709) 2.764 3.969 ( -3.341 1.716 -4.503) 5.864 4.005 ( 2.693 -5.627 -6.599) 9.081 4.269 ( -6.997 -1.063 -0.165) 7.079 4.314 ( -3.410 2.017 5.078) 6.440 4.393 ( 10.989 3.071 -4.715) 12.345 4.487 ( 28.760 10.482 -6.420) 31.277 4.576 ( 5.472 8.539 -3.374) 10.688 4.715 ( 9.828 1.043 -6.007) 11.566 4.907 ( 3.161 -5.535 -3.905) 7.474 4.927 ( 2.661 -7.080 -4.329) 8.715 5.111 ( 10.344 -2.064 -4.060) 11.303 5.250 ( 5.849 5.737 1.636) 8.355 5.388 ( 2.795 3.449 -1.726) 4.763 5.466 ( 5.981 10.288 -1.393) 11.982 5.478 ( 3.789 -0.862 5.005) 6.336 5.567 ( -0.841 5.709 -0.592) 5.801 5.593 ( -0.116 2.000 1.844) 2.723 5.736 ( 4.257 0.071 4.902) 6.493 5.822 ( 3.345 -2.348 -9.279) 10.139 5.865 ( 1.093 -2.130 0.311) 2.414 5.975 ( -4.541 1.099 -4.217) 6.294 6.003 ( 0.093 6.393 5.757) 8.603 6.077 ( -3.198 -3.054 1.671) 4.727 6.237 ( -7.082 -3.655 1.712) 8.151 6.287 ( -1.504 0.676 2.864) 3.305 6.395 ( -3.131 9.479 -3.339) 10.526 6.475 ( -11.871 -2.539 -1.281) 12.207 6.590 ( -12.343 -3.028 0.408) 12.716 6.605 ( -3.182 -5.155 0.199) 6.061 6.655 ( -8.324 -2.046 8.657) 12.183 6.747 ( -2.035 -0.742 -3.417) 4.046 6.860 ( -4.393 0.934 7.009) 8.325 7.067 ( -5.929 0.824 5.903) 8.407 7.189 ( -14.370 -3.838 3.253) 15.225 7.280 ( 2.371 -5.750 5.515) 8.313 7.411 ( -5.596 -5.963 1.592) 8.331 7.445 ( -4.808 -4.671 4.860) 8.280 7.563 ( -2.427 -2.042 8.242) 8.831 7.648 ( -2.032 -0.922 1.111) 2.493 7.824 ( -8.084 2.580 -2.209) 8.769 7.982 ( -3.723 5.728 -0.046) 6.832 8.055 ( -5.326 -1.482 1.638) 5.766 8.193 ( -1.692 -6.501 -0.054) 6.718 8.302 ( -4.257 -8.841 4.687) 10.875 8.634 ( -3.649 -14.432 -1.774) 14.992 8.787 ( 0.412 2.705 1.741) 3.243 8.830 ( -0.989 8.659 3.369) 9.344 8.965 ( 1.563 -1.728 1.200) 2.621 9.133 ( -1.832 -2.118 -3.545) 4.517 9.170 ( -2.035 -2.252 -3.954) 4.985 9.288 ( 2.438 -0.062 4.985) 5.550 9.429 ( 0.042 10.286 -0.196) 10.288 9.505 ( 0.297 5.867 1.598) 6.088 9.609 ( -0.171 3.018 1.891) 3.566 9.782 ( -2.162 -3.821 0.696) 4.445 9.854 ( 1.216 5.386 0.085) 5.522 10.099 ( -5.062 1.614 2.057) 5.697 10.663 ( -4.563 -0.293 -1.587) 4.840 10.695 ( -6.729 0.012 -1.331) 6.860 10.923 ( 7.030 1.948 -10.730) 12.975 11.183 ( 4.292 -5.989 -13.188) 15.106 11.735 ( 4.793 2.181 -6.017) 7.996 11.890 ( 3.301 7.144 -3.742) 8.714 12.098 ( -0.635 1.216 4.082) 4.306 12.230 ( 0.945 2.340 5.007) 5.607 12.493 ( -3.541 -11.156 -3.355) 12.176 12.707 ( -4.052 -9.700 8.013) 13.218 12.980 ( 0.641 2.018 3.981) 4.509 13.094 ( -1.875 1.920 -3.853) 4.696 13.282 ( -2.331 2.182 0.787) 3.288 13.397 ( 1.278 -0.545 -2.133) 2.545 13.612 ( -1.267 6.798 -2.823) 7.469 13.697 ( 1.746 2.243 3.339) 4.385 13.832 ( 1.680 3.298 11.998) 12.556 13.935 ( -0.836 2.786 -9.004) 9.462 14.143 ( 3.117 2.593 -1.201) 4.229 14.358 ( 4.385 -2.287 -0.199) 4.950 14.544 ( 1.640 -6.234 -0.294) 6.453 14.657 ( -3.497 -8.609 -4.184) 10.191 15.274 ( -1.349 0.327 2.589) 2.938 15.484 ( 0.880 -6.300 -2.001) 6.669 15.868 ( -0.385 8.586 -1.276) 8.689 15.944 ( -0.138 10.599 -1.467) 10.701 16.706 ( -2.923 -3.855 -0.616) 4.877 16.924 ( 2.069 -3.906 -0.283) 4.429 17.174 ( -3.240 0.561 1.926) 3.811 17.204 ( -5.217 -0.642 -0.051) 5.257 18.061 ( -2.169 1.495 0.934) 2.795 18.169 ( -1.112 -1.309 -1.495) 2.277 19.347 ( 6.202 1.275 -5.306) 8.261 19.457 ( 0.395 -1.328 1.807) 2.276 20.565 ( 1.957 0.924 -4.341) 4.851 20.642 ( -1.457 -0.664 3.746) 4.074 21.570 ( 2.279 0.400 -0.229) 2.325 21.642 ( 0.937 -1.039 2.694) 3.036 22.053 ( 7.141 1.300 0.728) 7.295 22.302 ( -0.761 -3.502 1.227) 3.788 23.078 ( 0.870 -4.002 -0.691) 4.153 23.147 ( 0.632 -7.930 -0.121) 7.957 23.549 ( 1.836 7.360 -2.636) 8.030 23.736 ( 3.172 -0.912 -0.283) 3.313 24.211 ( -1.734 5.032 0.634) 5.360 24.559 ( 2.042 -5.896 1.166) 6.348 25.703 ( -1.661 9.153 -0.516) 9.317 26.062 ( -4.214 -0.136 0.176) 4.220 26.277 ( 0.167 1.119 -0.891) 1.441 26.464 ( -2.086 -3.477 -0.141) 4.057 ======================= Grid point 13 (10/78) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 0.000 1.068 -0.000) 1.068 2.517 ( 0.000 -7.791 0.000) 7.791 2.964 ( 0.000 11.082 0.000) 11.082 3.216 ( 0.000 17.454 0.000) 17.454 3.489 ( 0.000 -2.696 -0.000) 2.696 3.699 ( 0.000 8.049 -0.000) 8.049 3.779 ( 0.000 1.305 -0.000) 1.305 3.824 ( -0.000 -0.634 0.000) 0.634 3.943 ( 0.000 9.485 -0.000) 9.485 4.196 ( 0.000 -6.311 0.000) 6.311 4.291 ( 0.000 -4.203 0.000) 4.203 4.456 ( 0.000 0.354 0.000) 0.354 4.619 ( 0.000 11.754 0.000) 11.754 4.853 ( 0.000 -12.501 0.000) 12.501 4.889 ( 0.000 -7.520 -0.000) 7.520 4.960 ( 0.000 4.560 -0.000) 4.560 5.017 ( 0.000 -1.124 0.000) 1.124 5.247 ( 0.000 -1.263 -0.000) 1.263 5.334 ( 0.000 5.904 -0.000) 5.904 5.366 ( 0.000 2.575 0.000) 2.575 5.469 ( 0.000 4.731 -0.000) 4.731 5.493 ( 0.000 1.450 0.000) 1.450 5.634 ( 0.000 -1.991 -0.000) 1.991 5.740 ( 0.000 0.592 -0.000) 0.592 5.769 ( 0.000 2.117 0.000) 2.117 5.791 ( 0.000 2.259 0.000) 2.259 5.872 ( 0.000 1.029 0.000) 1.029 5.911 ( 0.000 2.585 0.000) 2.585 6.034 ( -0.000 -0.488 -0.000) 0.488 6.085 ( 0.000 -0.730 0.000) 0.730 6.145 ( 0.000 -0.869 -0.000) 0.869 6.232 ( -0.000 7.637 0.000) 7.637 6.312 ( 0.000 4.676 0.000) 4.676 6.329 ( 0.000 -0.887 -0.000) 0.887 6.385 ( 0.000 3.253 -0.000) 3.253 6.509 ( 0.000 -1.136 -0.000) 1.136 6.698 ( 0.000 -2.329 0.000) 2.329 6.754 ( 0.000 -5.860 0.000) 5.860 6.851 ( 0.000 -3.904 -0.000) 3.904 6.876 ( -0.000 1.116 0.000) 1.116 7.006 ( 0.000 3.182 0.000) 3.182 7.290 ( 0.000 2.800 0.000) 2.800 7.378 ( 0.000 -11.615 0.000) 11.615 7.391 ( 0.000 -4.147 -0.000) 4.147 7.587 ( 0.000 -1.397 -0.000) 1.397 7.611 ( 0.000 -2.593 0.000) 2.593 7.730 ( 0.000 2.004 0.000) 2.004 7.911 ( 0.000 6.313 -0.000) 6.313 8.027 ( 0.000 1.289 0.000) 1.289 8.194 ( 0.000 -9.418 0.000) 9.418 8.247 ( 0.000 -10.813 0.000) 10.813 8.578 ( 0.000 -16.303 0.000) 16.303 8.780 ( 0.000 -3.811 0.000) 3.811 8.833 ( 0.000 11.630 -0.000) 11.630 9.034 ( 0.000 -1.762 0.000) 1.762 9.037 ( -0.000 -2.917 -0.000) 2.917 9.171 ( 0.000 -2.524 0.000) 2.524 9.321 ( 0.000 3.277 -0.000) 3.277 9.427 ( 0.000 9.768 0.000) 9.768 9.515 ( 0.000 6.457 0.000) 6.457 9.610 ( 0.000 2.329 0.000) 2.329 9.757 ( 0.000 -4.754 0.000) 4.754 9.876 ( 0.000 4.223 -0.000) 4.223 10.036 ( 0.000 1.934 0.000) 1.934 10.612 ( 0.000 -0.446 0.000) 0.446 10.618 ( 0.000 0.696 -0.000) 0.696 10.988 ( 0.000 1.504 0.000) 1.504 11.222 ( 0.000 -5.726 0.000) 5.726 11.835 ( 0.000 2.634 0.000) 2.634 11.910 ( 0.000 2.631 -0.000) 2.631 12.058 ( 0.000 12.425 -0.000) 12.425 12.248 ( 0.000 -3.038 -0.000) 3.038 12.480 ( 0.000 -14.416 0.000) 14.416 12.638 ( 0.000 -8.539 0.000) 8.539 12.993 ( 0.000 1.372 -0.000) 1.372 13.070 ( 0.000 3.531 0.000) 3.531 13.256 ( 0.000 3.194 0.000) 3.194 13.406 ( 0.000 -1.276 0.000) 1.276 13.597 ( 0.000 8.594 0.000) 8.594 13.722 ( 0.000 0.034 0.000) 0.034 13.877 ( -0.000 1.463 -0.000) 1.463 13.898 ( 0.000 4.996 0.000) 4.996 14.178 ( 0.000 2.878 0.000) 2.878 14.403 ( 0.000 -2.406 -0.000) 2.406 14.588 ( 0.000 -6.476 0.000) 6.476 14.592 ( -0.000 -7.803 -0.000) 7.803 15.259 ( 0.000 0.213 -0.000) 0.213 15.492 ( 0.000 -5.579 -0.000) 5.579 15.861 ( 0.000 8.500 -0.000) 8.500 15.946 ( 0.000 9.829 -0.000) 9.829 16.674 ( 0.000 -4.596 0.000) 4.596 16.970 ( 0.000 -6.087 -0.000) 6.087 17.100 ( 0.000 1.902 -0.000) 1.902 17.165 ( 0.000 -0.682 -0.000) 0.682 18.039 ( 0.000 1.817 -0.000) 1.817 18.157 ( 0.000 -1.365 -0.000) 1.365 19.419 ( 0.000 0.884 -0.000) 0.884 19.455 ( 0.000 -0.090 0.000) 0.090 20.605 ( 2.143 0.155 -3.841) 4.401 20.605 ( -2.143 0.161 3.841) 4.401 21.597 ( 0.000 0.222 0.000) 0.222 21.651 ( 0.000 -1.005 0.000) 1.005 22.144 ( 0.000 0.004 -0.000) 0.004 22.277 ( 0.000 0.426 0.000) 0.426 23.087 ( 0.000 -3.705 0.000) 3.705 23.156 ( 0.000 -10.336 0.000) 10.336 23.569 ( 0.000 6.948 0.000) 6.948 23.771 ( 0.000 -1.535 0.000) 1.535 24.192 ( 0.000 6.871 0.000) 6.871 24.580 ( 0.000 -4.452 0.000) 4.452 25.690 ( 0.000 6.468 -0.000) 6.468 26.015 ( 0.000 -0.220 0.000) 0.220 26.281 ( 0.000 0.896 0.000) 0.896 26.438 ( 0.000 -3.274 -0.000) 3.274 ======================= Grid point 18 (11/78) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 0.000 30.687 0.000) 30.687 1.765 ( 0.000 41.530 0.000) 41.530 1.956 ( 0.000 -16.384 0.000) 16.384 2.524 ( 0.000 -28.924 0.000) 28.924 2.775 ( 0.000 4.726 0.000) 4.726 2.893 ( 0.000 8.728 0.000) 8.728 3.333 ( 0.000 28.807 0.000) 28.807 3.366 ( 0.000 10.856 0.000) 10.856 3.492 ( 0.000 -7.935 0.000) 7.935 4.161 ( 0.000 4.402 0.000) 4.402 4.203 ( 0.000 -4.122 0.000) 4.122 4.270 ( 0.000 -18.051 0.000) 18.051 4.328 ( 0.000 0.049 0.000) 0.049 4.342 ( 0.000 -7.650 0.000) 7.650 4.740 ( 0.000 4.672 0.000) 4.672 4.747 ( 0.000 -1.054 0.000) 1.054 4.875 ( 0.000 5.209 0.000) 5.209 4.886 ( 0.000 2.711 0.000) 2.711 5.187 ( 0.000 5.067 0.000) 5.067 5.276 ( 0.000 -3.238 0.000) 3.238 5.429 ( 0.000 3.165 0.000) 3.165 5.521 ( 0.000 -2.523 0.000) 2.523 5.634 ( 0.000 2.494 0.000) 2.494 5.683 ( 0.000 2.123 0.000) 2.123 5.715 ( 0.000 2.486 0.000) 2.486 5.727 ( 0.000 5.725 0.000) 5.725 5.850 ( 0.000 -5.692 0.000) 5.692 5.888 ( 0.000 -17.349 0.000) 17.349 6.085 ( 0.000 7.139 0.000) 7.139 6.122 ( 0.000 0.729 0.000) 0.729 6.275 ( 0.000 -4.972 0.000) 4.972 6.295 ( 0.000 -2.570 0.000) 2.570 6.388 ( 0.000 17.291 0.000) 17.291 6.566 ( 0.000 0.114 0.000) 0.114 6.668 ( 0.000 -11.358 0.000) 11.358 6.727 ( 0.000 -13.740 0.000) 13.740 6.837 ( 0.000 -4.851 0.000) 4.851 6.921 ( 0.000 -13.442 0.000) 13.442 7.166 ( 0.000 6.999 0.000) 6.999 7.245 ( 0.000 -0.240 0.000) 0.240 7.248 ( 0.000 7.730 0.000) 7.730 7.425 ( 0.000 -7.836 0.000) 7.836 7.786 ( 0.000 2.109 0.000) 2.109 7.844 ( 0.000 -3.002 0.000) 3.002 7.999 ( 0.000 7.214 0.000) 7.214 8.080 ( 0.000 0.505 0.000) 0.505 8.181 ( 0.000 0.350 0.000) 0.350 8.205 ( 0.000 -3.548 0.000) 3.548 8.297 ( 0.000 3.613 0.000) 3.613 8.356 ( 0.000 -3.918 0.000) 3.918 8.742 ( 0.000 1.550 0.000) 1.550 8.790 ( 0.000 -1.011 0.000) 1.011 8.968 ( 0.000 -1.533 0.000) 1.533 8.978 ( 0.000 -1.587 0.000) 1.587 9.261 ( 0.000 4.597 0.000) 4.597 9.269 ( 0.000 2.068 0.000) 2.068 9.420 ( 0.000 5.892 0.000) 5.892 9.478 ( 0.000 8.612 0.000) 8.612 9.527 ( 0.000 -4.109 0.000) 4.109 9.615 ( 0.000 -5.943 0.000) 5.943 9.714 ( 0.000 8.220 0.000) 8.220 9.843 ( 0.000 -3.233 0.000) 3.233 10.032 ( 0.000 3.162 0.000) 3.162 10.033 ( 0.000 10.539 0.000) 10.539 10.145 ( 0.000 -1.229 0.000) 1.229 10.377 ( 0.000 -14.450 0.000) 14.450 11.222 ( 0.000 1.993 0.000) 1.993 11.273 ( 0.000 -2.228 0.000) 2.228 11.521 ( 0.000 0.581 0.000) 0.581 11.600 ( 0.000 -5.652 0.000) 5.652 12.116 ( 0.000 4.520 0.000) 4.520 12.177 ( 0.000 -1.582 0.000) 1.582 12.520 ( 0.000 0.914 0.000) 0.914 12.650 ( 0.000 -10.785 0.000) 10.785 13.111 ( 0.000 1.624 0.000) 1.624 13.152 ( 0.000 -1.722 0.000) 1.722 13.357 ( 0.000 2.208 0.000) 2.208 13.371 ( 0.000 1.383 0.000) 1.383 13.577 ( 0.000 2.511 0.000) 2.511 13.629 ( 0.000 -2.413 0.000) 2.413 13.860 ( 0.000 5.274 0.000) 5.274 13.934 ( 0.000 1.322 0.000) 1.322 13.966 ( 0.000 4.014 0.000) 4.014 14.048 ( 0.000 -2.032 0.000) 2.032 14.452 ( 0.000 1.471 0.000) 1.471 14.577 ( 0.000 -11.036 0.000) 11.036 15.373 ( 0.000 0.332 0.000) 0.332 15.373 ( 0.000 0.422 0.000) 0.422 16.105 ( 0.000 9.561 0.000) 9.561 16.245 ( 0.000 -4.280 0.000) 4.280 16.965 ( 0.000 1.850 0.000) 1.850 17.001 ( 0.000 -1.587 0.000) 1.587 17.451 ( 0.000 4.159 0.000) 4.159 17.563 ( 0.000 -6.683 0.000) 6.683 18.311 ( 0.000 0.312 0.000) 0.312 18.311 ( 0.000 0.377 0.000) 0.377 19.005 ( 0.000 5.143 0.000) 5.143 19.093 ( 0.000 -3.265 0.000) 3.265 20.449 ( 0.000 2.890 0.000) 2.890 20.505 ( 0.000 -2.482 0.000) 2.482 21.443 ( 0.000 1.711 0.000) 1.711 21.481 ( 0.000 -1.886 0.000) 1.886 21.654 ( 0.000 0.066 0.000) 0.066 21.654 ( 0.000 0.053 0.000) 0.053 23.081 ( 0.000 1.043 0.000) 1.043 23.113 ( 0.000 -1.953 0.000) 1.953 23.590 ( 0.000 1.561 0.000) 1.561 23.633 ( 0.000 -2.551 0.000) 2.551 24.137 ( 0.000 5.625 0.000) 5.625 24.248 ( 0.000 -4.943 0.000) 4.943 26.324 ( 0.000 0.702 0.000) 0.702 26.329 ( 0.000 0.425 0.000) 0.425 26.494 ( 0.000 0.320 0.000) 0.320 26.515 ( 0.000 -1.584 0.000) 1.584 ======================= Grid point 19 (12/78) ======================= q-point: ( 0.12 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 18.385 23.324 -13.464) 32.608 1.959 ( 14.692 24.446 -1.857) 28.581 2.074 ( 13.920 -0.318 -6.021) 15.170 2.630 ( 7.678 -22.380 -1.879) 23.735 2.847 ( 9.335 -0.001 0.687) 9.361 2.988 ( 8.556 -2.974 -0.424) 9.068 3.361 ( 2.565 4.156 -3.373) 5.936 3.505 ( 8.437 11.433 4.142) 14.801 3.540 ( 10.061 19.822 -5.486) 22.896 4.204 ( 3.956 -4.681 -2.652) 6.677 4.268 ( 3.956 1.577 -3.538) 5.536 4.310 ( 6.133 -4.437 -3.638) 8.399 4.346 ( 5.782 4.293 -0.321) 7.208 4.511 ( 9.180 -9.205 5.979) 14.309 4.684 ( -3.868 0.825 -2.337) 4.594 4.721 ( -1.572 -2.700 1.347) 3.402 4.832 ( -2.882 6.148 0.268) 6.795 4.925 ( 3.346 1.612 0.862) 3.813 5.222 ( -1.360 4.526 4.047) 6.221 5.316 ( 3.239 -2.056 -4.468) 5.889 5.419 ( 0.392 2.067 -2.403) 3.194 5.488 ( -0.503 4.015 -2.446) 4.728 5.587 ( -1.766 0.649 1.377) 2.332 5.649 ( -1.518 -2.235 0.138) 2.706 5.709 ( 0.841 2.587 -0.230) 2.730 5.780 ( 1.229 0.086 -1.771) 2.158 5.850 ( 1.124 -3.890 4.249) 5.870 5.935 ( 2.660 -9.219 4.350) 10.535 6.017 ( -2.912 2.154 -8.080) 8.855 6.154 ( -0.310 -5.631 -2.443) 6.146 6.247 ( 0.402 3.546 4.753) 5.944 6.316 ( -3.547 3.551 -1.932) 5.378 6.392 ( 1.068 6.826 6.724) 9.641 6.523 ( -2.116 -2.301 -3.803) 4.923 6.624 ( -2.444 -5.645 -14.823) 16.049 6.698 ( -3.093 -11.497 -5.881) 13.279 6.891 ( 3.669 -6.367 10.216) 12.585 6.949 ( 1.226 -11.196 4.242) 12.035 7.126 ( -5.419 3.426 9.838) 11.743 7.169 ( -4.655 -0.674 4.915) 6.803 7.246 ( -1.097 7.951 -6.065) 10.060 7.421 ( -0.926 -7.514 2.157) 7.872 7.726 ( -7.239 3.904 3.141) 8.804 7.746 ( -5.515 1.992 3.129) 6.646 7.963 ( -7.189 5.279 -2.199) 9.186 8.001 ( -8.237 1.719 1.724) 8.589 8.061 ( -8.898 -2.071 4.444) 10.160 8.118 ( -6.259 -5.252 5.479) 9.838 8.263 ( -4.236 4.252 -4.633) 7.582 8.395 ( -0.032 -6.707 -0.112) 6.708 8.671 ( -6.601 1.625 6.709) 9.551 8.747 ( -4.610 -3.113 5.105) 7.550 8.867 ( -6.327 3.412 0.618) 7.215 8.931 ( -2.820 -2.285 1.994) 4.141 9.080 ( -8.508 6.343 8.593) 13.655 9.166 ( -8.886 -1.492 5.911) 10.776 9.303 ( -7.240 3.271 5.316) 9.559 9.373 ( -8.000 -2.872 6.559) 10.737 9.528 ( 1.772 5.386 -0.239) 5.675 9.589 ( -0.177 -1.740 2.554) 3.095 9.735 ( 0.465 7.809 1.791) 8.025 9.850 ( -0.793 -2.472 1.831) 3.177 10.051 ( 0.053 11.514 0.412) 11.521 10.218 ( 1.864 -3.312 -2.819) 4.732 10.300 ( 19.329 4.334 -25.461) 32.259 10.504 ( 12.233 -13.302 -19.088) 26.286 11.130 ( -7.736 2.988 -0.119) 8.294 11.184 ( -8.105 -1.699 -2.043) 8.530 11.627 ( 6.556 -1.429 7.983) 10.429 11.662 ( 5.744 -3.959 1.554) 7.147 12.098 ( -0.579 3.917 -6.476) 7.590 12.173 ( -0.049 -2.878 -7.746) 8.263 12.551 ( 1.978 1.638 7.019) 7.474 12.665 ( 0.148 -8.455 10.709) 13.645 13.053 ( -4.553 3.027 -0.781) 5.523 13.113 ( -2.084 -2.856 -1.886) 4.008 13.365 ( 0.063 1.105 -1.159) 1.602 13.377 ( 0.010 0.265 1.114) 1.145 13.626 ( 4.016 3.590 -2.758) 6.051 13.687 ( 4.462 -2.533 -2.761) 5.827 13.869 ( 1.149 6.026 3.194) 6.916 13.945 ( 0.328 -0.348 3.654) 3.685 14.009 ( 4.526 4.694 -3.663) 7.479 14.086 ( 3.493 -2.627 -7.348) 8.550 14.436 ( -1.126 1.272 -0.497) 1.770 14.561 ( -1.511 -11.134 -1.248) 11.305 15.354 ( -1.202 1.455 1.652) 2.508 15.380 ( 0.082 -1.088 0.018) 1.091 16.084 ( -1.744 9.034 1.264) 9.287 16.200 ( -3.601 -1.801 0.291) 4.037 16.908 ( -5.364 1.787 -1.120) 5.764 16.945 ( -4.226 -1.523 -0.415) 4.511 17.384 ( -5.785 3.231 0.480) 6.644 17.461 ( -6.988 -3.448 -4.977) 9.246 18.240 ( -4.660 1.387 -0.491) 4.886 18.263 ( -4.044 -0.740 -0.186) 4.116 19.083 ( 6.919 5.010 -4.025) 9.443 19.196 ( 7.203 -6.381 -2.504) 9.943 20.502 ( 3.795 2.428 -3.589) 5.760 20.554 ( 3.589 -2.439 -0.164) 4.342 21.476 ( 2.571 1.552 0.075) 3.004 21.513 ( 2.602 -1.911 1.500) 3.560 21.741 ( 7.726 1.764 2.869) 8.428 21.799 ( 11.905 -4.561 5.426) 13.856 23.067 ( -1.348 1.026 0.313) 1.723 23.102 ( -1.108 -2.231 0.082) 2.493 23.600 ( 1.032 1.782 -1.352) 2.463 23.627 ( 0.246 -0.442 -4.184) 4.214 24.206 ( 5.578 1.075 2.510) 6.210 24.258 ( 0.966 -3.104 1.792) 3.712 26.273 ( -7.207 2.285 4.861) 8.988 26.288 ( -4.337 0.333 2.317) 4.928 26.386 ( -5.675 4.930 -4.268) 8.645 26.473 ( -2.789 -3.820 -5.221) 7.045 ======================= Grid point 20 (13/78) ======================= q-point: ( 0.25 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 13.251 11.772 -8.206) 19.532 2.174 ( 8.807 -0.078 -5.399) 10.330 2.595 ( 29.711 16.216 -6.195) 34.410 2.814 ( 12.659 -0.072 -4.723) 13.512 3.166 ( 16.749 -10.770 -1.415) 19.963 3.196 ( 9.730 -5.173 2.075) 11.214 3.506 ( 12.072 -2.116 -6.745) 13.990 3.608 ( 7.530 -8.882 -7.734) 13.979 3.913 ( 16.631 25.890 0.528) 30.776 4.250 ( -0.200 -7.225 2.497) 7.647 4.375 ( 6.180 9.848 -3.397) 12.113 4.499 ( -4.279 2.442 0.849) 5.000 4.525 ( 12.387 -0.205 -6.018) 13.773 4.566 ( 10.851 13.512 2.358) 17.489 4.641 ( 1.972 -5.705 -3.305) 6.882 4.769 ( 0.139 10.348 -2.958) 10.763 4.829 ( 6.359 -2.950 -4.172) 8.158 5.046 ( 7.844 -10.370 9.617) 16.173 5.109 ( -6.277 10.985 -0.329) 12.657 5.385 ( 2.560 -4.245 -3.602) 6.128 5.464 ( 0.711 1.579 -1.458) 2.264 5.473 ( 2.961 -0.724 -1.902) 3.593 5.627 ( 3.127 3.043 -5.950) 7.378 5.645 ( 1.446 3.053 3.796) 5.082 5.715 ( -0.306 -0.918 -2.601) 2.776 5.798 ( 1.221 0.617 1.023) 1.708 5.891 ( -0.570 0.634 2.431) 2.576 5.970 ( 1.083 2.610 -5.334) 6.037 6.006 ( 4.180 -10.477 7.249) 13.409 6.126 ( -3.798 -6.906 -2.183) 8.178 6.194 ( -3.372 1.891 1.009) 3.995 6.245 ( -2.642 -3.828 0.964) 4.750 6.382 ( -1.502 2.927 0.758) 3.376 6.471 ( -2.999 -6.618 -5.055) 8.851 6.602 ( 0.675 4.056 -7.299) 8.378 6.632 ( -2.351 -4.260 -6.257) 7.926 6.864 ( -9.354 -4.750 9.106) 13.892 6.906 ( -11.267 -5.252 6.845) 14.191 6.990 ( -0.810 1.374 10.097) 10.222 7.101 ( -3.137 -4.346 0.664) 5.401 7.242 ( 1.800 5.571 2.266) 6.278 7.381 ( -3.137 -6.099 7.936) 10.489 7.518 ( -16.527 11.038 2.068) 19.981 7.587 ( -9.287 6.092 1.617) 11.224 7.692 ( -13.419 -3.947 8.236) 16.232 7.777 ( -5.654 -6.507 0.688) 8.648 7.905 ( -9.929 -2.353 5.809) 11.742 7.985 ( -6.753 -4.362 4.867) 9.398 8.173 ( -2.976 5.470 -5.557) 8.346 8.291 ( -7.512 -4.558 -3.548) 9.476 8.479 ( -11.886 3.429 9.150) 15.387 8.567 ( -10.523 -5.154 5.057) 12.762 8.845 ( 0.805 4.282 2.841) 5.201 8.935 ( -0.304 -1.941 5.307) 5.659 9.011 ( -2.178 1.030 5.568) 6.067 9.038 ( 1.148 -1.193 5.967) 6.192 9.208 ( -1.927 0.740 -2.593) 3.315 9.235 ( -4.920 -2.295 -0.363) 5.441 9.551 ( 0.251 3.518 0.877) 3.634 9.589 ( -0.084 0.346 1.828) 1.862 9.723 ( -1.336 5.948 0.251) 6.102 9.804 ( -3.360 -1.885 0.226) 3.859 10.026 ( -2.058 10.136 2.142) 10.562 10.185 ( -3.999 -4.173 2.603) 6.339 10.648 ( 12.641 1.864 -19.341) 23.181 10.720 ( 5.848 -4.588 -16.781) 18.354 10.957 ( -6.629 2.715 -4.101) 8.254 11.015 ( -3.555 -3.010 -9.039) 10.169 11.731 ( 3.160 2.513 3.490) 5.337 11.804 ( 7.208 -3.521 0.460) 8.035 12.090 ( -0.270 3.092 -3.343) 4.562 12.184 ( 1.955 -4.658 -8.735) 10.090 12.560 ( -3.296 2.813 13.782) 14.448 12.641 ( -2.902 -4.212 12.400) 13.413 12.990 ( -0.952 2.249 -1.936) 3.116 13.071 ( -1.643 -4.896 -4.833) 7.072 13.355 ( -0.652 1.076 -0.839) 1.512 13.373 ( -0.043 -0.517 -0.956) 1.087 13.697 ( 2.336 4.352 -0.852) 5.012 13.753 ( 1.370 -0.453 2.669) 3.034 13.906 ( 1.407 6.612 5.276) 8.575 13.972 ( 2.044 0.756 -1.579) 2.691 14.112 ( 5.040 2.839 -2.723) 6.393 14.177 ( 5.592 -3.370 -5.567) 8.580 14.422 ( 0.004 -0.950 -2.174) 2.373 14.515 ( -2.476 -9.961 -2.953) 10.680 15.329 ( -1.190 2.114 1.728) 2.979 15.379 ( -0.055 -2.715 -0.360) 2.739 16.051 ( -1.188 7.873 1.601) 8.122 16.131 ( -2.428 1.268 -0.160) 2.744 16.779 ( -5.968 2.023 -3.275) 7.102 16.853 ( -3.905 -4.182 -2.093) 6.093 17.261 ( -5.182 2.330 1.808) 5.963 17.318 ( -6.500 -2.539 -1.514) 7.141 18.152 ( -3.544 1.500 -0.088) 3.849 18.183 ( -3.107 -1.403 -0.705) 3.481 19.244 ( 7.921 3.671 -4.575) 9.856 19.331 ( 5.645 -4.898 -2.057) 7.752 20.563 ( 2.112 2.346 -2.326) 3.921 20.612 ( 1.526 -2.232 0.986) 2.878 21.535 ( 2.783 1.553 1.006) 3.342 21.572 ( 2.522 -1.912 2.696) 4.158 21.937 ( 9.690 4.184 1.576) 10.672 22.055 ( 10.559 -7.612 2.199) 13.201 23.031 ( -1.827 0.318 0.649) 1.965 23.069 ( -1.899 -3.057 -0.106) 3.600 23.627 ( 1.707 3.072 -3.675) 5.085 23.658 ( 2.714 -0.406 -2.284) 3.571 24.285 ( 1.674 1.504 1.903) 2.947 24.337 ( 5.635 -4.289 3.547) 7.920 26.059 ( -10.160 8.849 0.456) 13.481 26.161 ( -7.131 -1.944 1.112) 7.474 26.330 ( -1.188 3.357 -1.854) 4.015 26.418 ( -2.075 -4.958 -2.271) 5.834 ======================= Grid point 21 (14/78) ======================= q-point: ( 0.38 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( 5.778 4.505 -3.246) 8.014 2.325 ( 5.242 -4.299 -2.538) 7.239 3.067 ( 13.459 12.742 -1.494) 18.594 3.228 ( 22.933 6.603 -4.178) 24.227 3.353 ( 6.733 -2.134 1.688) 7.262 3.445 ( 12.388 -5.241 -5.070) 14.375 3.803 ( 13.209 1.015 -3.558) 13.718 3.850 ( 13.773 -4.905 -7.346) 16.362 4.027 ( -4.822 5.715 -2.523) 7.892 4.193 ( -4.937 -7.987 4.993) 10.635 4.376 ( -4.967 4.075 -0.961) 6.496 4.452 ( -1.191 -1.170 -4.031) 4.363 4.629 ( -0.669 5.254 -0.546) 5.324 4.741 ( 1.524 -4.142 -0.041) 4.414 4.827 ( 11.707 13.740 -0.434) 18.056 4.897 ( 10.349 3.480 -8.215) 13.664 5.009 ( 8.218 15.115 -3.808) 17.621 5.070 ( 7.946 1.226 -1.065) 8.111 5.227 ( 8.386 -7.120 4.681) 11.956 5.354 ( -1.949 -11.764 -2.176) 12.122 5.512 ( 0.001 4.341 -2.441) 4.980 5.572 ( 2.269 -0.355 -5.273) 5.752 5.642 ( 1.396 7.719 3.403) 8.550 5.688 ( 2.292 4.800 3.801) 6.538 5.754 ( 4.887 -1.066 -3.533) 6.124 5.808 ( -0.875 -5.079 6.791) 8.525 5.863 ( 1.118 5.867 0.783) 6.024 6.001 ( -1.568 -1.083 -5.003) 5.354 6.025 ( -1.968 2.363 -3.336) 4.537 6.078 ( 1.127 -1.846 3.194) 3.857 6.159 ( -1.676 -5.210 -2.101) 5.862 6.229 ( 1.269 -6.258 -4.197) 7.642 6.404 ( 1.999 -2.157 -1.076) 3.132 6.440 ( 1.976 -4.076 2.408) 5.130 6.480 ( -12.002 0.703 8.381) 14.656 6.579 ( -8.842 -3.229 6.751) 11.584 6.630 ( -3.751 4.932 0.873) 6.258 6.738 ( -2.063 -2.936 -6.511) 7.434 6.897 ( -8.801 3.231 9.704) 13.493 7.022 ( -4.830 -6.483 2.485) 8.458 7.136 ( -15.862 2.819 4.016) 16.604 7.252 ( -10.848 -3.208 5.767) 12.697 7.348 ( 3.178 4.926 1.220) 5.988 7.406 ( -1.648 -0.220 4.979) 5.249 7.565 ( 0.092 3.440 1.278) 3.671 7.706 ( -6.208 5.936 2.187) 8.863 7.781 ( -1.481 -12.248 0.374) 12.343 7.843 ( -2.802 -7.982 -0.164) 8.461 8.111 ( -6.863 3.266 0.436) 7.613 8.131 ( -3.367 -0.215 -1.609) 3.738 8.242 ( -10.615 1.816 6.761) 12.716 8.364 ( -8.234 -10.105 1.006) 13.074 8.818 ( -3.241 2.424 3.387) 5.278 8.880 ( -2.911 -2.814 3.976) 5.674 9.017 ( 1.068 3.028 -1.019) 3.369 9.078 ( -0.125 -3.333 -2.371) 4.092 9.180 ( 0.965 4.455 0.027) 4.558 9.265 ( 4.896 -2.817 1.871) 5.951 9.539 ( -0.937 3.494 0.929) 3.735 9.591 ( 0.085 -0.021 1.016) 1.020 9.698 ( -0.854 3.564 -1.139) 3.837 9.731 ( -3.090 -0.673 -0.626) 3.223 9.988 ( -1.323 6.886 1.228) 7.119 10.093 ( -4.157 -2.759 1.809) 5.307 10.667 ( -4.408 0.758 -1.974) 4.889 10.687 ( -5.049 -0.861 -2.241) 5.591 10.978 ( 5.488 3.484 -10.436) 12.295 11.065 ( 4.636 -5.128 -11.435) 13.362 11.815 ( 5.849 5.871 -4.381) 9.374 11.956 ( 7.389 -5.181 -3.939) 9.846 12.072 ( -1.292 3.443 -1.597) 4.009 12.211 ( 0.122 -7.407 -5.373) 9.152 12.447 ( -6.773 7.189 13.609) 16.816 12.576 ( -4.134 -4.607 11.469) 13.033 12.986 ( 0.038 0.398 -0.073) 0.406 13.040 ( -0.918 -4.408 -4.383) 6.283 13.348 ( 0.100 2.506 -0.997) 2.699 13.380 ( 0.615 -1.040 -1.697) 2.083 13.726 ( 0.881 3.656 -0.969) 3.884 13.759 ( -0.684 1.391 5.113) 5.342 13.930 ( 0.710 6.763 6.224) 9.219 14.000 ( 0.537 1.649 -4.350) 4.683 14.207 ( 4.059 3.576 -1.855) 5.718 14.289 ( 4.685 -4.305 -0.138) 6.364 14.419 ( -0.469 -3.800 -0.601) 3.876 14.466 ( -1.766 -7.982 -5.731) 9.984 15.308 ( -0.911 2.872 0.997) 3.174 15.381 ( 0.264 -4.198 -0.730) 4.270 16.037 ( -0.370 7.322 0.864) 7.382 16.104 ( -0.257 2.528 -0.131) 2.544 16.672 ( -3.746 2.455 -2.487) 5.123 16.798 ( -1.045 -7.842 -2.478) 8.290 17.181 ( -2.631 0.448 2.012) 3.342 17.193 ( -5.000 -0.586 0.820) 5.100 18.098 ( -1.618 1.966 0.197) 2.553 18.136 ( -1.333 -1.769 -0.699) 2.323 19.381 ( 5.093 1.982 -3.219) 6.343 19.422 ( 2.987 -1.982 -0.457) 3.614 20.592 ( 0.975 1.565 -1.331) 2.274 20.622 ( -0.388 -1.310 1.614) 2.115 21.585 ( 1.776 1.079 0.812) 2.231 21.613 ( 1.167 -1.614 2.124) 2.912 22.111 ( 6.353 4.431 0.145) 7.747 22.215 ( 4.666 -5.053 -0.099) 6.878 23.002 ( -0.814 -1.693 0.544) 1.956 23.030 ( -1.722 -3.890 -0.155) 4.257 23.662 ( 1.623 3.798 -2.191) 4.676 23.713 ( 2.257 -1.533 -1.250) 3.001 24.320 ( 1.426 5.439 1.663) 5.863 24.434 ( 3.217 -5.908 2.133) 7.057 25.899 ( -4.950 8.840 -0.532) 10.146 26.030 ( -4.820 -3.720 0.095) 6.089 26.312 ( -0.438 2.430 -0.636) 2.549 26.380 ( -1.457 -4.137 -0.526) 4.418 ======================= Grid point 22 (15/78) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( 0.000 3.144 -0.000) 3.144 2.379 ( 0.000 -5.648 0.000) 5.648 3.194 ( 0.000 10.968 0.000) 10.968 3.379 ( 0.000 -6.301 -0.000) 6.301 3.588 ( 0.000 12.232 -0.000) 12.232 3.715 ( 0.000 -3.205 -0.000) 3.205 3.829 ( -0.000 4.628 0.000) 4.628 3.886 ( 0.000 2.425 -0.000) 2.425 4.092 ( 0.000 -2.316 0.000) 2.316 4.143 ( 0.000 -4.357 0.000) 4.357 4.244 ( 0.000 11.999 0.000) 11.999 4.431 ( 0.000 -3.716 -0.000) 3.716 4.657 ( 0.000 -5.385 -0.000) 5.385 4.683 ( -0.000 -6.758 0.000) 6.758 4.937 ( 0.000 11.242 -0.000) 11.242 5.035 ( 0.000 0.587 -0.000) 0.587 5.072 ( 0.000 7.633 0.000) 7.633 5.282 ( 0.000 5.159 -0.000) 5.159 5.297 ( 0.000 -8.447 -0.000) 8.447 5.431 ( 0.000 -1.524 0.000) 1.524 5.457 ( 0.000 -0.992 -0.000) 0.992 5.497 ( -0.000 -0.986 -0.000) 0.986 5.676 ( 0.000 5.801 0.000) 5.801 5.783 ( 0.000 4.268 -0.000) 4.268 5.793 ( 0.000 -3.698 0.000) 3.698 5.835 ( 0.000 2.803 -0.000) 2.803 5.908 ( 0.000 0.765 -0.000) 0.765 5.927 ( 0.000 -4.019 0.000) 4.019 6.020 ( -0.000 4.960 0.000) 4.960 6.064 ( 0.000 -0.166 -0.000) 0.166 6.152 ( 0.000 -0.002 -0.000) 0.002 6.237 ( 0.000 -6.587 -0.000) 6.587 6.329 ( 0.000 -0.791 0.000) 0.791 6.351 ( 0.000 0.696 0.000) 0.696 6.437 ( 0.000 -0.675 0.000) 0.675 6.554 ( 0.000 2.675 -0.000) 2.675 6.682 ( 0.000 2.086 0.000) 2.086 6.745 ( 0.000 7.149 0.000) 7.149 6.786 ( -0.000 1.579 0.000) 1.579 6.860 ( 0.000 -4.047 -0.000) 4.047 6.970 ( 0.000 -5.765 0.000) 5.765 7.076 ( -0.000 -13.720 0.000) 13.720 7.408 ( 0.000 5.170 0.000) 5.170 7.433 ( 0.000 5.824 0.000) 5.824 7.607 ( 0.000 6.569 0.000) 6.569 7.614 ( -0.000 2.044 -0.000) 2.044 7.697 ( 0.000 -3.997 0.000) 3.997 7.914 ( 0.000 -16.096 0.000) 16.096 8.024 ( 0.000 0.882 -0.000) 0.882 8.048 ( -0.000 0.129 0.000) 0.129 8.129 ( 0.000 2.219 0.000) 2.219 8.267 ( 0.000 -11.602 -0.000) 11.602 8.775 ( 0.000 2.256 0.000) 2.256 8.850 ( 0.000 -4.394 0.000) 4.394 9.025 ( 0.000 1.413 -0.000) 1.413 9.070 ( 0.000 -1.789 -0.000) 1.789 9.205 ( 0.000 7.882 0.000) 7.882 9.328 ( 0.000 -3.023 0.000) 3.023 9.530 ( 0.000 3.138 0.000) 3.138 9.591 ( 0.000 -1.307 0.000) 1.307 9.689 ( 0.000 2.653 0.000) 2.653 9.694 ( 0.000 0.295 0.000) 0.295 9.976 ( 0.000 4.907 -0.000) 4.907 10.045 ( 0.000 -1.436 0.000) 1.436 10.613 ( 0.000 0.568 0.000) 0.568 10.625 ( 0.000 -0.244 -0.000) 0.244 11.032 ( 0.000 2.939 0.000) 2.939 11.110 ( 0.000 -4.794 0.000) 4.794 11.928 ( 0.000 6.578 -0.000) 6.578 11.996 ( 0.000 5.774 -0.000) 5.774 12.107 ( 0.000 -8.955 0.000) 8.955 12.170 ( 0.000 -8.596 -0.000) 8.596 12.368 ( 0.000 9.472 0.000) 9.472 12.527 ( 0.000 -4.695 0.000) 4.695 12.986 ( 0.000 -0.236 -0.000) 0.236 13.029 ( 0.000 -3.960 0.000) 3.960 13.351 ( 0.000 3.352 -0.000) 3.352 13.386 ( 0.000 -0.879 0.000) 0.879 13.742 ( 0.000 1.699 -0.000) 1.699 13.744 ( 0.000 3.308 0.000) 3.308 13.943 ( 0.000 5.611 -0.000) 5.611 13.999 ( 0.000 2.680 0.000) 2.680 14.258 ( 0.000 4.858 0.000) 4.858 14.342 ( 0.000 -3.192 -0.000) 3.192 14.417 ( 0.000 -6.770 0.000) 6.770 14.434 ( 0.000 -7.206 -0.000) 7.206 15.298 ( 0.000 3.382 -0.000) 3.382 15.384 ( 0.000 -4.914 0.000) 4.914 16.034 ( 0.000 7.561 -0.000) 7.561 16.105 ( 0.000 2.645 -0.000) 2.645 16.630 ( 0.000 2.878 0.000) 2.878 16.791 ( 0.000 -10.390 -0.000) 10.390 17.135 ( 0.000 1.395 -0.000) 1.395 17.154 ( 0.000 -0.550 -0.000) 0.550 18.082 ( 0.000 2.145 -0.000) 2.145 18.123 ( 0.000 -1.877 -0.000) 1.877 19.438 ( 0.000 0.841 -0.000) 0.841 19.451 ( 0.000 -0.367 0.000) 0.367 20.608 ( 0.000 0.199 -0.000) 0.199 20.610 ( -0.000 0.097 0.000) 0.097 21.605 ( 0.000 0.656 0.000) 0.656 21.625 ( 0.000 -1.314 0.000) 1.314 22.182 ( 0.000 3.707 -0.000) 3.707 22.259 ( 0.000 -2.721 0.000) 2.721 22.999 ( 0.000 -3.817 0.000) 3.817 23.005 ( 0.000 -3.357 0.000) 3.357 23.680 ( 0.000 3.972 0.000) 3.972 23.737 ( 0.000 -1.956 0.000) 1.956 24.338 ( 0.000 6.885 0.000) 6.885 24.469 ( 0.000 -6.071 0.000) 6.071 25.848 ( 0.000 8.018 0.000) 8.018 25.977 ( 0.000 -4.048 0.000) 4.048 26.308 ( 0.000 1.882 0.000) 1.882 26.363 ( 0.000 -3.521 0.000) 3.521 ======================= Grid point 45 (16/78) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.639 ( 0.216 0.000 33.157) 33.158 0.804 ( 6.985 0.000 42.294) 42.867 1.436 ( -21.945 0.000 74.811) 77.963 1.934 ( -2.853 0.000 17.262) 17.496 2.666 ( -1.215 0.000 -6.353) 6.468 2.971 ( 3.377 0.000 0.631) 3.436 3.599 ( 1.721 0.000 -1.565) 2.327 3.820 ( 3.775 0.000 -19.562) 19.923 3.835 ( -5.758 0.000 -13.694) 14.855 3.919 ( -9.168 0.000 18.028) 20.225 4.090 ( -17.012 0.000 -9.252) 19.366 4.117 ( 0.394 0.000 -4.836) 4.852 4.328 ( -8.744 0.000 4.389) 9.784 4.418 ( 2.307 0.000 -5.593) 6.050 4.710 ( 2.991 0.000 4.876) 5.720 4.789 ( 2.781 0.000 1.349) 3.091 4.809 ( 1.843 0.000 2.985) 3.508 4.934 ( 2.875 0.000 12.166) 12.501 5.035 ( -7.416 0.000 10.151) 12.571 5.161 ( -6.249 0.000 0.955) 6.321 5.225 ( 2.601 0.000 -2.968) 3.946 5.277 ( -1.684 0.000 -2.410) 2.940 5.297 ( -4.815 0.000 -3.171) 5.765 5.471 ( -0.539 0.000 2.026) 2.097 5.706 ( -4.097 0.000 1.391) 4.327 5.751 ( -2.017 0.000 11.808) 11.979 5.880 ( -1.290 0.000 -7.215) 7.329 5.975 ( -0.750 0.000 -16.124) 16.141 6.023 ( -8.966 0.000 5.528) 10.533 6.133 ( -0.865 0.000 -2.278) 2.437 6.333 ( -4.121 0.000 -5.666) 7.006 6.412 ( 1.856 0.000 -3.406) 3.879 6.515 ( -1.681 0.000 7.618) 7.801 6.673 ( 4.285 0.000 3.420) 5.482 6.889 ( 1.346 0.000 -3.918) 4.143 6.912 ( 0.290 0.000 3.937) 3.948 7.043 ( 2.900 0.000 -9.076) 9.528 7.241 ( -3.322 0.000 -1.069) 3.490 7.357 ( -1.621 0.000 -15.910) 15.992 7.373 ( 0.181 0.000 2.881) 2.886 7.431 ( 2.562 0.000 2.983) 3.933 7.620 ( 7.756 0.000 2.805) 8.247 7.707 ( 3.482 0.000 -2.102) 4.067 7.800 ( 10.970 0.000 -0.642) 10.989 7.845 ( -4.568 0.000 -0.952) 4.666 8.005 ( 2.063 0.000 -16.804) 16.930 8.087 ( 21.869 0.000 -13.412) 25.654 8.219 ( -9.121 0.000 -3.438) 9.747 8.307 ( 1.029 0.000 -0.089) 1.033 8.352 ( 2.872 0.000 2.233) 3.638 8.370 ( 6.229 0.000 2.653) 6.770 8.584 ( 5.273 0.000 0.726) 5.322 8.590 ( -2.488 0.000 -1.130) 2.733 8.755 ( 2.831 0.000 -7.087) 7.632 9.071 ( 5.598 0.000 -8.964) 10.568 9.162 ( 14.318 0.000 -4.514) 15.012 9.284 ( 2.522 0.000 3.652) 4.438 9.289 ( 29.364 0.000 -1.450) 29.400 9.327 ( -4.643 0.000 3.801) 6.001 9.544 ( -0.085 0.000 -4.662) 4.663 9.681 ( 2.703 0.000 -1.416) 3.051 9.742 ( -0.110 0.000 -1.997) 2.000 9.818 ( -0.764 0.000 1.888) 2.037 10.269 ( 2.007 0.000 -2.180) 2.963 10.394 ( -19.277 0.000 29.892) 35.569 10.654 ( -30.946 0.000 23.977) 39.148 11.102 ( -2.588 0.000 5.640) 6.206 11.237 ( -2.817 0.000 -3.393) 4.410 11.684 ( -1.628 0.000 -2.490) 2.975 11.790 ( 7.972 0.000 -1.075) 8.045 12.067 ( 1.940 0.000 -10.477) 10.655 12.361 ( 15.302 0.000 1.601) 15.386 12.662 ( -0.130 0.000 3.664) 3.666 12.888 ( 2.173 0.000 -11.506) 11.710 13.101 ( -7.344 0.000 2.043) 7.623 13.182 ( 4.510 0.000 0.960) 4.611 13.273 ( -4.238 0.000 0.162) 4.241 13.320 ( -8.364 0.000 -0.254) 8.368 13.433 ( 11.335 0.000 -3.050) 11.738 13.664 ( -12.358 0.000 5.269) 13.435 13.692 ( 3.805 0.000 -2.870) 4.766 13.864 ( 1.189 0.000 -1.929) 2.266 13.913 ( 2.698 0.000 9.711) 10.079 14.503 ( 0.662 0.000 2.028) 2.133 14.957 ( -0.122 0.000 -1.567) 1.572 15.242 ( 20.080 0.000 -6.842) 21.213 15.308 ( 1.184 0.000 -2.815) 3.054 15.598 ( -1.127 0.000 1.410) 1.806 15.705 ( 0.563 0.000 -0.234) 0.610 15.801 ( -48.226 0.000 7.676) 48.833 16.919 ( -0.768 0.000 0.947) 1.219 16.932 ( 0.767 0.000 1.285) 1.496 17.175 ( -23.072 0.000 3.197) 23.292 17.381 ( 0.521 0.000 0.056) 0.524 18.266 ( -1.582 0.000 -0.310) 1.612 18.375 ( -3.789 0.000 0.163) 3.792 18.825 ( 2.397 0.000 -2.974) 3.820 19.045 ( -6.182 0.000 -10.216) 11.941 20.629 ( -0.008 0.000 6.144) 6.144 20.906 ( -32.271 0.000 -0.037) 32.271 21.425 ( -5.991 0.000 0.115) 5.992 21.520 ( 2.207 0.000 -0.828) 2.357 21.712 ( 1.460 0.000 6.589) 6.748 22.346 ( 32.677 0.000 -2.169) 32.749 23.067 ( 0.307 0.000 -0.677) 0.743 23.151 ( -0.032 0.000 0.106) 0.111 23.505 ( -4.336 0.000 -4.634) 6.346 23.764 ( 8.051 0.000 4.189) 9.076 24.222 ( -19.004 0.000 -1.341) 19.051 24.358 ( -0.205 0.000 0.337) 0.395 25.511 ( 0.066 0.000 1.271) 1.273 26.272 ( 0.190 0.000 -2.628) 2.634 26.327 ( -0.089 0.000 2.589) 2.591 26.640 ( -11.636 0.000 -2.419) 11.884 ======================= Grid point 46 (17/78) ======================= q-point: ( 0.12 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.062 ( 19.321 0.000 32.533) 37.838 1.119 ( 33.764 0.000 18.474) 38.488 1.914 ( 48.435 0.000 41.783) 63.967 1.953 ( 3.699 0.000 13.477) 13.976 2.656 ( 0.898 0.000 -5.209) 5.286 3.177 ( 14.710 0.000 4.031) 15.253 3.593 ( -8.429 0.000 -1.960) 8.654 3.689 ( 6.767 0.000 0.307) 6.774 3.759 ( -4.195 0.000 0.497) 4.224 3.913 ( 3.344 0.000 -7.760) 8.449 3.936 ( 8.131 0.000 -18.363) 20.083 4.132 ( 0.506 0.000 -5.112) 5.137 4.208 ( 0.280 0.000 1.599) 1.623 4.438 ( -1.287 0.000 1.575) 2.034 4.771 ( -4.414 0.000 -1.737) 4.743 4.789 ( 2.509 0.000 -4.006) 4.727 4.857 ( 1.958 0.000 3.300) 3.837 4.882 ( -4.702 0.000 13.255) 14.064 5.019 ( -0.722 0.000 -0.500) 0.878 5.135 ( 10.780 0.000 12.045) 16.165 5.241 ( 0.446 0.000 -3.250) 3.281 5.297 ( 2.369 0.000 -1.823) 2.990 5.323 ( 5.409 0.000 -1.715) 5.674 5.436 ( -2.613 0.000 0.720) 2.710 5.697 ( -0.442 0.000 -3.364) 3.392 5.740 ( 0.469 0.000 10.363) 10.374 5.846 ( -1.067 0.000 -1.459) 1.808 5.938 ( -1.118 0.000 -15.381) 15.422 6.081 ( -3.951 0.000 -5.289) 6.602 6.134 ( 5.559 0.000 -0.996) 5.647 6.322 ( 3.413 0.000 1.406) 3.691 6.434 ( -0.976 0.000 3.489) 3.623 6.462 ( -2.468 0.000 2.745) 3.691 6.738 ( 3.747 0.000 -4.061) 5.526 6.851 ( -6.508 0.000 2.382) 6.930 6.862 ( -4.608 0.000 -0.488) 4.634 7.112 ( 3.462 0.000 -6.995) 7.804 7.121 ( -6.202 0.000 1.249) 6.326 7.291 ( -9.016 0.000 3.985) 9.857 7.400 ( 2.710 0.000 -1.642) 3.168 7.480 ( 2.679 0.000 -8.805) 9.204 7.584 ( -7.598 0.000 0.342) 7.606 7.695 ( -20.451 0.000 -6.417) 21.434 7.767 ( 0.876 0.000 -1.908) 2.099 7.877 ( -4.736 0.000 6.977) 8.433 7.904 ( 6.516 0.000 0.095) 6.517 8.075 ( -2.722 0.000 -2.789) 3.897 8.152 ( -6.901 0.000 -3.474) 7.726 8.385 ( 6.681 0.000 -11.831) 13.587 8.458 ( -1.208 0.000 3.612) 3.809 8.546 ( 1.133 0.000 -2.181) 2.457 8.596 ( 3.842 0.000 1.929) 4.299 8.607 ( 1.845 0.000 5.074) 5.399 8.824 ( 5.200 0.000 -5.490) 7.562 9.096 ( -3.516 0.000 -8.492) 9.192 9.115 ( -5.748 0.000 -2.890) 6.433 9.243 ( -2.098 0.000 4.005) 4.521 9.347 ( 2.814 0.000 1.976) 3.439 9.532 ( -13.429 0.000 11.514) 17.689 9.541 ( 3.242 0.000 -5.270) 6.187 9.806 ( -0.384 0.000 2.828) 2.854 9.815 ( 7.057 0.000 -3.927) 8.076 10.019 ( 4.401 0.000 2.889) 5.265 10.136 ( -8.625 0.000 20.584) 22.318 10.278 ( -1.302 0.000 -0.745) 1.500 10.399 ( 10.818 0.000 -16.943) 20.102 10.988 ( -7.791 0.000 3.978) 8.748 11.112 ( -8.711 0.000 -2.561) 9.079 11.642 ( 0.194 0.000 -2.433) 2.440 11.980 ( 7.658 0.000 0.509) 7.675 12.054 ( -2.090 0.000 -8.741) 8.987 12.395 ( -20.268 0.000 13.259) 24.220 12.703 ( 3.492 0.000 2.048) 4.048 12.921 ( -0.321 0.000 -5.256) 5.266 12.970 ( -4.245 0.000 0.526) 4.278 13.117 ( 0.865 0.000 -1.869) 2.060 13.205 ( 0.635 0.000 0.013) 0.635 13.350 ( 7.583 0.000 -2.853) 8.101 13.487 ( -3.567 0.000 1.537) 3.884 13.635 ( 7.464 0.000 -11.347) 13.582 13.763 ( 3.082 0.000 0.428) 3.112 13.875 ( -8.796 0.000 10.850) 13.967 13.912 ( 3.009 0.000 0.099) 3.011 14.469 ( -15.361 0.000 16.585) 22.606 14.548 ( -5.120 0.000 16.987) 17.742 14.917 ( -3.659 0.000 -4.325) 5.665 15.387 ( -0.200 0.000 3.579) 3.585 15.578 ( 3.954 0.000 -4.180) 5.754 15.592 ( 0.635 0.000 0.349) 0.724 15.731 ( 1.689 0.000 0.031) 1.690 16.882 ( -2.619 0.000 0.684) 2.707 16.999 ( 0.865 0.000 6.237) 6.297 17.107 ( 7.255 0.000 -9.821) 12.210 17.366 ( -1.894 0.000 0.405) 1.937 18.169 ( -4.677 0.000 -2.173) 5.157 18.284 ( -4.399 0.000 0.408) 4.418 18.820 ( 4.135 0.000 -5.186) 6.633 19.265 ( 11.502 0.000 -14.543) 18.542 20.526 ( -3.416 0.000 10.593) 11.130 20.725 ( 4.313 0.000 9.821) 10.726 21.428 ( 2.526 0.000 -0.552) 2.586 21.612 ( 5.291 0.000 3.106) 6.135 21.784 ( 4.764 0.000 5.061) 6.950 22.634 ( -1.062 0.000 -10.968) 11.019 23.087 ( 0.238 0.000 -1.377) 1.397 23.173 ( 2.037 0.000 0.061) 2.038 23.289 ( -8.131 0.000 11.576) 14.146 23.620 ( -1.984 0.000 6.136) 6.449 24.323 ( -3.103 0.000 0.178) 3.108 24.341 ( 10.206 0.000 -16.014) 18.989 25.525 ( 1.146 0.000 1.197) 1.657 26.238 ( -3.182 0.000 -2.281) 3.916 26.332 ( -1.360 0.000 3.894) 4.125 26.515 ( 0.478 0.000 0.164) 0.506 ======================= Grid point 47 (18/78) ======================= q-point: ( 0.25 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( 33.631 0.000 4.402) 33.917 1.841 ( 30.000 0.000 8.525) 31.188 2.118 ( 12.871 0.000 8.249) 15.288 2.702 ( 3.837 0.000 -0.830) 3.925 3.001 ( 46.738 0.000 20.426) 51.007 3.434 ( 3.216 0.000 -2.311) 3.960 3.589 ( 10.414 0.000 3.058) 10.853 3.771 ( 7.595 0.000 -14.239) 16.138 3.850 ( 7.272 0.000 3.468) 8.057 4.041 ( -1.859 0.000 -9.810) 9.985 4.047 ( 7.839 0.000 -8.281) 11.403 4.154 ( 5.649 0.000 -10.958) 12.328 4.358 ( -6.253 0.000 4.255) 7.563 4.365 ( 17.087 0.000 -6.927) 18.438 4.655 ( -4.831 0.000 -0.599) 4.868 4.666 ( -8.056 0.000 14.493) 16.581 4.918 ( 4.630 0.000 -12.352) 13.191 4.990 ( 7.793 0.000 3.967) 8.744 5.053 ( 3.138 0.000 -1.921) 3.679 5.194 ( -4.532 0.000 -3.814) 5.924 5.343 ( 6.150 0.000 1.839) 6.419 5.363 ( -1.175 0.000 -5.779) 5.897 5.428 ( 6.742 0.000 4.927) 8.351 5.460 ( 7.556 0.000 6.432) 9.923 5.637 ( -4.128 0.000 -7.627) 8.672 5.780 ( 1.310 0.000 5.865) 6.009 5.878 ( 5.407 0.000 0.212) 5.412 5.895 ( -2.729 0.000 -8.225) 8.666 6.010 ( 0.143 0.000 -8.265) 8.266 6.189 ( 0.744 0.000 1.801) 1.948 6.352 ( -4.864 0.000 3.660) 6.087 6.391 ( 1.466 0.000 4.519) 4.750 6.449 ( -0.836 0.000 2.683) 2.810 6.667 ( -10.034 0.000 -0.446) 10.044 6.701 ( -9.237 0.000 -2.087) 9.470 6.810 ( -0.069 0.000 -2.052) 2.053 6.991 ( -9.341 0.000 2.815) 9.756 7.049 ( -9.275 0.000 6.793) 11.497 7.130 ( -6.849 0.000 -4.004) 7.933 7.263 ( -12.453 0.000 2.292) 12.662 7.393 ( -2.907 0.000 -1.826) 3.433 7.488 ( -2.682 0.000 2.234) 3.491 7.536 ( 0.732 0.000 -1.173) 1.383 7.685 ( -4.921 0.000 -7.159) 8.688 7.750 ( -6.029 0.000 13.635) 14.908 7.949 ( -3.832 0.000 -0.719) 3.899 7.994 ( -9.043 0.000 -2.321) 9.336 8.109 ( 1.784 0.000 2.807) 3.326 8.301 ( -13.270 0.000 7.409) 15.198 8.396 ( -0.255 0.000 -0.738) 0.780 8.521 ( -3.445 0.000 -5.174) 6.217 8.565 ( -2.285 0.000 2.153) 3.140 8.786 ( 7.532 0.000 2.938) 8.085 8.907 ( 0.596 0.000 0.695) 0.916 8.989 ( -3.507 0.000 -5.592) 6.601 9.008 ( -1.533 0.000 -3.445) 3.771 9.222 ( -1.034 0.000 -0.885) 1.361 9.247 ( -11.514 0.000 12.494) 16.990 9.398 ( 1.989 0.000 0.780) 2.136 9.614 ( 2.303 0.000 -1.612) 2.811 9.756 ( -10.004 0.000 12.801) 16.246 9.807 ( 0.281 0.000 4.179) 4.188 10.023 ( -4.693 0.000 12.997) 13.819 10.213 ( -4.646 0.000 0.501) 4.673 10.263 ( 17.421 0.000 -14.336) 22.561 10.590 ( 11.161 0.000 -29.719) 31.746 10.826 ( -7.170 0.000 4.581) 8.508 10.906 ( -9.864 0.000 0.877) 9.903 11.686 ( 3.356 0.000 -2.702) 4.308 11.903 ( -13.709 0.000 11.458) 17.867 12.067 ( -4.611 0.000 -4.485) 6.433 12.097 ( 4.056 0.000 -3.502) 5.358 12.775 ( 2.522 0.000 -3.036) 3.947 12.851 ( -5.871 0.000 3.036) 6.609 12.934 ( 0.476 0.000 2.585) 2.629 13.167 ( 0.533 0.000 -1.930) 2.002 13.261 ( 4.358 0.000 -0.244) 4.365 13.419 ( -4.283 0.000 2.279) 4.851 13.492 ( 5.832 0.000 -6.564) 8.781 13.680 ( -4.566 0.000 3.316) 5.643 13.823 ( 6.856 0.000 -12.670) 14.406 13.827 ( 2.959 0.000 3.484) 4.571 13.970 ( 2.133 0.000 3.855) 4.406 14.309 ( -2.569 0.000 4.495) 5.177 14.612 ( 3.231 0.000 5.541) 6.414 14.814 ( -5.173 0.000 -2.859) 5.910 15.384 ( -0.588 0.000 4.394) 4.433 15.568 ( -2.576 0.000 -3.196) 4.105 15.629 ( 2.804 0.000 -0.414) 2.834 15.769 ( 1.857 0.000 -0.290) 1.879 16.820 ( -3.102 0.000 0.887) 3.227 17.008 ( -0.116 0.000 5.795) 5.796 17.188 ( 1.160 0.000 -5.812) 5.926 17.305 ( -3.810 0.000 0.531) 3.847 18.100 ( -1.880 0.000 -3.017) 3.555 18.184 ( -4.496 0.000 -0.733) 4.555 18.986 ( 10.383 0.000 -8.539) 13.443 19.402 ( 4.043 0.000 -8.044) 9.003 20.529 ( 1.148 0.000 6.988) 7.082 20.800 ( 1.341 0.000 10.271) 10.359 21.493 ( 3.321 0.000 -0.593) 3.373 21.693 ( 1.658 0.000 4.760) 5.040 21.923 ( 7.932 0.000 3.185) 8.547 22.517 ( -6.575 0.000 -1.515) 6.747 23.070 ( -0.227 0.000 -1.429) 1.447 23.231 ( 3.367 0.000 0.005) 3.367 23.302 ( 4.364 0.000 3.963) 5.895 23.657 ( 3.837 0.000 0.383) 3.856 24.239 ( -4.651 0.000 0.005) 4.651 24.462 ( 3.652 0.000 -14.095) 14.561 25.559 ( 1.963 0.000 0.904) 2.161 26.148 ( -4.873 0.000 -1.599) 5.128 26.298 ( -1.494 0.000 3.583) 3.882 26.534 ( 0.148 0.000 0.128) 0.196 ======================= Grid point 48 (19/78) ======================= q-point: ( 0.38 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 7.945 0.000 4.890) 9.329 2.333 ( 26.185 0.000 -2.708) 26.325 2.556 ( 18.070 0.000 -4.329) 18.581 2.857 ( 13.987 0.000 10.710) 17.617 3.425 ( 4.275 0.000 -6.660) 7.914 3.563 ( 3.962 0.000 0.986) 4.083 3.839 ( -11.793 0.000 3.287) 12.243 3.866 ( 10.491 0.000 -5.586) 11.886 3.973 ( -2.404 0.000 3.026) 3.865 4.076 ( 15.249 0.000 -17.101) 22.912 4.189 ( -1.243 0.000 -7.393) 7.497 4.329 ( 4.322 0.000 -2.689) 5.090 4.351 ( 22.061 0.000 2.344) 22.186 4.553 ( -3.780 0.000 11.825) 12.415 4.624 ( 11.127 0.000 1.645) 11.248 4.872 ( 23.267 0.000 -12.381) 26.355 4.970 ( -1.198 0.000 -11.498) 11.560 5.051 ( 0.546 0.000 -6.521) 6.544 5.115 ( 3.416 0.000 3.441) 4.849 5.248 ( 6.909 0.000 -1.834) 7.148 5.317 ( 1.584 0.000 -2.643) 3.082 5.377 ( -0.446 0.000 -3.407) 3.436 5.540 ( -3.226 0.000 -12.556) 12.964 5.591 ( 6.583 0.000 1.784) 6.820 5.671 ( 9.757 0.000 8.339) 12.835 5.698 ( -5.294 0.000 -8.545) 10.052 5.930 ( 4.038 0.000 7.476) 8.497 5.998 ( -5.033 0.000 -0.681) 5.079 6.019 ( 4.749 0.000 -4.768) 6.729 6.172 ( -1.431 0.000 1.105) 1.808 6.291 ( -1.107 0.000 -4.135) 4.281 6.395 ( -1.315 0.000 8.761) 8.859 6.422 ( -0.995 0.000 3.539) 3.676 6.489 ( -5.563 0.000 -2.181) 5.975 6.501 ( -8.541 0.000 9.527) 12.795 6.647 ( -15.501 0.000 2.492) 15.700 6.795 ( -5.043 0.000 7.300) 8.873 6.852 ( -8.201 0.000 4.174) 9.202 6.959 ( -2.325 0.000 5.527) 5.996 7.199 ( -4.019 0.000 0.747) 4.088 7.288 ( -10.230 0.000 4.270) 11.086 7.430 ( -3.953 0.000 5.236) 6.561 7.461 ( -5.878 0.000 1.469) 6.059 7.593 ( -3.529 0.000 -7.874) 8.629 7.680 ( -7.278 0.000 7.845) 10.702 7.771 ( -7.521 0.000 5.350) 9.230 7.817 ( -6.345 0.000 -1.869) 6.615 7.973 ( -14.991 0.000 13.094) 19.904 8.065 ( -3.617 0.000 1.269) 3.833 8.411 ( -5.182 0.000 -8.004) 9.535 8.415 ( -5.312 0.000 -3.874) 6.575 8.520 ( 4.351 0.000 5.512) 7.022 8.857 ( -3.010 0.000 4.811) 5.676 8.902 ( 2.450 0.000 -7.748) 8.126 8.966 ( 0.491 0.000 -3.566) 3.599 9.054 ( 3.558 0.000 1.489) 3.857 9.139 ( 0.811 0.000 5.297) 5.359 9.196 ( -1.032 0.000 -3.408) 3.561 9.431 ( 1.009 0.000 1.052) 1.457 9.522 ( -9.110 0.000 13.733) 16.480 9.661 ( -0.768 0.000 -1.004) 1.264 9.826 ( 1.282 0.000 3.607) 3.828 9.916 ( -5.011 0.000 7.648) 9.143 10.101 ( -5.654 0.000 1.041) 5.749 10.621 ( 16.416 0.000 -16.773) 23.469 10.708 ( -4.926 0.000 4.822) 6.893 10.748 ( -4.266 0.000 6.678) 7.924 10.849 ( 14.608 0.000 -25.426) 29.323 11.695 ( -5.493 0.000 5.263) 7.607 11.745 ( 2.061 0.000 -4.343) 4.808 12.048 ( 2.005 0.000 -8.090) 8.334 12.152 ( 1.416 0.000 -8.853) 8.966 12.703 ( -7.920 0.000 6.441) 10.208 12.811 ( 1.939 0.000 -4.500) 4.900 12.961 ( 1.207 0.000 2.119) 2.439 13.126 ( -4.658 0.000 5.076) 6.890 13.317 ( -4.496 0.000 3.648) 5.790 13.359 ( 4.333 0.000 0.173) 4.337 13.572 ( 2.374 0.000 -10.204) 10.477 13.587 ( -4.013 0.000 4.727) 6.201 13.876 ( 0.451 0.000 6.395) 6.411 13.966 ( 6.517 0.000 -13.695) 15.167 14.011 ( 1.796 0.000 7.375) 7.590 14.309 ( 1.685 0.000 -6.335) 6.555 14.642 ( 0.060 0.000 2.182) 2.183 14.733 ( -2.293 0.000 1.929) 2.997 15.362 ( -2.060 0.000 5.307) 5.692 15.523 ( -0.497 0.000 -4.062) 4.092 15.694 ( 2.777 0.000 -1.101) 2.987 15.808 ( 2.133 0.000 0.587) 2.212 16.764 ( -2.192 0.000 0.878) 2.361 17.019 ( 1.142 0.000 4.860) 4.992 17.168 ( -2.590 0.000 -0.551) 2.648 17.223 ( -3.605 0.000 0.365) 3.623 18.060 ( -2.390 0.000 0.398) 2.423 18.129 ( -0.193 0.000 -3.457) 3.463 19.183 ( 8.273 0.000 -8.416) 11.802 19.455 ( 1.649 0.000 -3.394) 3.773 20.559 ( 1.315 0.000 4.674) 4.856 20.798 ( -1.884 0.000 10.062) 10.237 21.551 ( 2.078 0.000 -1.120) 2.361 21.698 ( -1.004 0.000 2.029) 2.263 22.088 ( 6.971 0.000 3.385) 7.749 22.391 ( -5.625 0.000 1.650) 5.862 23.083 ( 1.333 0.000 -2.258) 2.622 23.301 ( 2.889 0.000 -0.010) 2.889 23.401 ( 4.371 0.000 3.115) 5.367 23.741 ( 3.429 0.000 -1.044) 3.585 24.146 ( -3.664 0.000 -0.117) 3.666 24.500 ( 1.288 0.000 -12.349) 12.416 25.602 ( 1.826 0.000 0.535) 1.903 26.051 ( -3.883 0.000 -0.958) 3.999 26.285 ( 0.034 0.000 2.542) 2.542 26.518 ( -1.431 0.000 1.521) 2.088 ======================= Grid point 49 (20/78) ======================= q-point: (-0.50 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( 0.295 0.000 3.912) 3.924 2.655 ( 3.897 0.000 1.046) 4.035 2.711 ( 1.232 0.000 -6.301) 6.420 3.167 ( 0.507 0.000 13.667) 13.677 3.472 ( -2.793 0.000 -6.193) 6.794 3.599 ( -1.921 0.000 2.601) 3.234 3.677 ( 8.156 0.000 -9.886) 12.816 3.865 ( -5.272 0.000 1.429) 5.462 3.935 ( 3.635 0.000 8.798) 9.519 4.219 ( 2.173 0.000 -1.675) 2.744 4.369 ( -0.536 0.000 -1.056) 1.184 4.385 ( 11.383 0.000 -14.145) 18.157 4.513 ( -1.071 0.000 5.375) 5.480 4.576 ( 8.829 0.000 -13.460) 16.098 4.942 ( 1.665 0.000 -6.593) 6.800 5.004 ( 4.190 0.000 -2.477) 4.868 5.093 ( 8.651 0.000 -6.000) 10.528 5.105 ( 3.713 0.000 -9.613) 10.305 5.225 ( -2.090 0.000 -7.282) 7.576 5.268 ( 0.008 0.000 -0.490) 0.490 5.391 ( -0.818 0.000 -6.806) 6.855 5.391 ( -3.912 0.000 -4.453) 5.927 5.482 ( -0.655 0.000 -3.037) 3.107 5.693 ( -0.646 0.000 -1.084) 1.261 5.723 ( 6.151 0.000 -3.169) 6.919 5.736 ( -5.698 0.000 -5.156) 7.684 5.831 ( 1.365 0.000 4.517) 4.718 6.021 ( 5.040 0.000 5.175) 7.223 6.038 ( 3.396 0.000 6.618) 7.439 6.158 ( -16.720 0.000 0.244) 16.722 6.249 ( -0.998 0.000 -0.509) 1.120 6.299 ( 6.598 0.000 7.497) 9.987 6.360 ( -5.050 0.000 1.496) 5.267 6.454 ( -0.220 0.000 -0.748) 0.780 6.462 ( 0.306 0.000 18.215) 18.218 6.495 ( 3.616 0.000 11.831) 12.372 6.775 ( -4.761 0.000 8.547) 9.784 6.798 ( 1.192 0.000 2.796) 3.039 6.958 ( 1.618 0.000 4.248) 4.546 6.981 ( -11.751 0.000 6.395) 13.378 7.021 ( -4.804 0.000 3.954) 6.222 7.338 ( -2.910 0.000 8.535) 9.017 7.347 ( -5.498 0.000 -4.825) 7.315 7.488 ( -7.129 0.000 -1.930) 7.385 7.582 ( 5.049 0.000 -5.813) 7.699 7.680 ( -5.161 0.000 2.252) 5.631 7.738 ( -1.815 0.000 -2.986) 3.494 7.825 ( -1.960 0.000 9.031) 9.241 8.014 ( -0.967 0.000 0.063) 0.969 8.301 ( -3.176 0.000 -4.274) 5.324 8.334 ( -0.840 0.000 -8.493) 8.534 8.618 ( 2.595 0.000 5.255) 5.860 8.804 ( -2.384 0.000 3.308) 4.078 8.918 ( 0.435 0.000 -7.501) 7.514 8.969 ( -0.236 0.000 -2.923) 2.932 9.118 ( 2.949 0.000 2.895) 4.133 9.187 ( 0.586 0.000 -3.989) 4.032 9.228 ( 4.876 0.000 3.089) 5.772 9.364 ( -6.978 0.000 10.224) 12.378 9.439 ( -0.251 0.000 1.088) 1.117 9.624 ( -2.651 0.000 -1.120) 2.878 9.849 ( -1.918 0.000 4.440) 4.837 9.857 ( 0.673 0.000 2.895) 2.972 10.008 ( -2.197 0.000 0.465) 2.246 10.652 ( 0.074 0.000 5.364) 5.365 10.731 ( 1.394 0.000 10.319) 10.413 10.880 ( 9.169 0.000 -9.170) 12.968 11.135 ( 13.950 0.000 -18.082) 22.838 11.687 ( 4.136 0.000 -2.935) 5.072 11.756 ( -0.671 0.000 -5.996) 6.033 12.092 ( 0.360 0.000 0.105) 0.375 12.134 ( -2.352 0.000 -12.396) 12.618 12.582 ( -2.029 0.000 -0.582) 2.111 12.858 ( 2.424 0.000 -1.724) 2.975 12.979 ( 0.586 0.000 0.375) 0.695 12.990 ( -7.708 0.000 9.631) 12.336 13.273 ( -0.121 0.000 2.388) 2.391 13.423 ( 1.703 0.000 -1.385) 2.195 13.543 ( -0.164 0.000 5.535) 5.537 13.583 ( -0.119 0.000 -10.881) 10.882 13.837 ( -4.470 0.000 8.010) 9.173 14.049 ( 2.251 0.000 -10.438) 10.678 14.058 ( 1.517 0.000 8.265) 8.403 14.333 ( 0.752 0.000 -9.611) 9.641 14.675 ( 2.108 0.000 1.288) 2.470 14.700 ( 0.105 0.000 3.207) 3.209 15.311 ( -2.908 0.000 3.924) 4.884 15.561 ( 4.337 0.000 -1.676) 4.650 15.716 ( -0.398 0.000 -1.968) 2.007 15.859 ( 1.839 0.000 2.839) 3.383 16.737 ( -0.193 0.000 0.367) 0.415 17.062 ( 1.213 0.000 3.518) 3.721 17.093 ( -2.917 0.000 1.457) 3.261 17.178 ( -0.364 0.000 0.157) 0.396 18.017 ( -1.327 0.000 -0.089) 1.330 18.148 ( 1.784 0.000 -2.344) 2.946 19.305 ( 3.999 0.000 -7.897) 8.852 19.460 ( -1.371 0.000 -1.345) 1.921 20.596 ( 1.962 0.000 3.340) 3.873 20.761 ( -1.784 0.000 10.747) 10.894 21.574 ( 0.306 0.000 -1.936) 1.960 21.664 ( -2.215 0.000 0.141) 2.219 22.183 ( -0.512 0.000 2.801) 2.848 22.295 ( -1.816 0.000 2.512) 3.100 23.111 ( 1.294 0.000 -1.698) 2.135 23.334 ( 0.003 0.000 -0.002) 0.004 23.475 ( 2.237 0.000 4.743) 5.244 23.775 ( -0.315 0.000 -1.693) 1.722 24.106 ( 0.182 0.000 -0.093) 0.204 24.505 ( 0.203 0.000 -12.321) 12.323 25.622 ( -0.187 0.000 0.260) 0.321 26.006 ( 0.016 0.000 -0.670) 0.670 26.298 ( 0.863 0.000 2.290) 2.447 26.496 ( -0.351 0.000 2.140) 2.169 ======================= Grid point 50 (21/78) ======================= q-point: (-0.38 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( -9.439 0.000 4.029) 10.263 2.505 ( -18.436 0.000 5.576) 19.261 2.577 ( -16.593 0.000 -0.931) 16.619 2.921 ( -11.182 0.000 12.201) 16.550 3.375 ( -5.452 0.000 -5.150) 7.500 3.666 ( -1.135 0.000 -3.567) 3.743 3.688 ( -1.407 0.000 2.541) 2.905 3.876 ( 5.271 0.000 -4.833) 7.152 4.160 ( 9.153 0.000 0.301) 9.158 4.246 ( 1.192 0.000 1.873) 2.220 4.358 ( 0.938 0.000 0.400) 1.019 4.461 ( -32.737 0.000 10.107) 34.262 4.501 ( 3.548 0.000 0.393) 3.570 4.510 ( 0.241 0.000 2.280) 2.293 4.927 ( -8.864 0.000 -3.493) 9.528 4.978 ( -1.397 0.000 -6.048) 6.208 5.052 ( -6.203 0.000 -20.585) 21.500 5.107 ( -5.577 0.000 2.499) 6.112 5.152 ( -6.761 0.000 7.443) 10.055 5.219 ( -7.800 0.000 -5.669) 9.642 5.221 ( 3.589 0.000 -10.200) 10.812 5.275 ( -1.447 0.000 -7.515) 7.653 5.485 ( 0.742 0.000 -0.397) 0.841 5.604 ( -2.707 0.000 3.804) 4.669 5.733 ( 0.682 0.000 7.175) 7.207 5.760 ( 0.491 0.000 -6.536) 6.554 5.942 ( -0.652 0.000 -3.771) 3.827 6.013 ( -3.920 0.000 9.061) 9.872 6.090 ( -4.512 0.000 0.986) 4.618 6.092 ( 7.976 0.000 5.263) 9.556 6.275 ( 2.608 0.000 -6.622) 7.117 6.284 ( 3.799 0.000 6.293) 7.351 6.338 ( 3.820 0.000 5.761) 6.912 6.489 ( 8.375 0.000 -3.591) 9.113 6.568 ( 3.704 0.000 13.691) 14.183 6.632 ( -4.689 0.000 -2.023) 5.107 6.699 ( 13.702 0.000 1.642) 13.800 6.769 ( -2.642 0.000 1.431) 3.005 6.924 ( 3.710 0.000 -0.952) 3.830 7.022 ( 4.403 0.000 7.359) 8.576 7.182 ( 2.479 0.000 -2.238) 3.340 7.327 ( 10.684 0.000 -8.628) 13.732 7.350 ( 2.090 0.000 4.327) 4.805 7.404 ( 4.072 0.000 0.416) 4.093 7.582 ( -3.506 0.000 0.685) 3.572 7.684 ( -1.057 0.000 -6.669) 6.752 7.812 ( 0.424 0.000 0.910) 1.004 7.824 ( 13.476 0.000 2.026) 13.628 8.024 ( 1.731 0.000 -0.463) 1.792 8.298 ( 3.415 0.000 -4.953) 6.016 8.357 ( 2.405 0.000 -3.484) 4.233 8.623 ( -2.127 0.000 5.423) 5.825 8.749 ( -3.288 0.000 -0.449) 3.319 8.911 ( -0.771 0.000 -3.974) 4.048 8.944 ( -1.962 0.000 -3.903) 4.368 9.122 ( -5.811 0.000 -4.876) 7.585 9.211 ( 1.729 0.000 -3.298) 3.723 9.290 ( 2.157 0.000 8.752) 9.014 9.316 ( 2.794 0.000 5.214) 5.916 9.426 ( -0.931 0.000 0.872) 1.276 9.566 ( -2.178 0.000 -0.676) 2.281 9.833 ( -0.206 0.000 2.401) 2.410 9.841 ( -1.554 0.000 4.049) 4.337 10.035 ( 3.876 0.000 -1.501) 4.157 10.731 ( 7.009 0.000 4.877) 8.539 10.811 ( 5.320 0.000 11.487) 12.659 11.001 ( 2.806 0.000 -0.231) 2.816 11.368 ( 8.158 0.000 -4.061) 9.113 11.711 ( -3.056 0.000 -6.551) 7.229 11.824 ( 8.028 0.000 -10.698) 13.375 12.017 ( -6.119 0.000 14.281) 15.537 12.044 ( -4.910 0.000 -12.725) 13.639 12.652 ( 7.714 0.000 -14.836) 16.722 12.876 ( -2.899 0.000 9.752) 10.174 12.877 ( -1.319 0.000 1.498) 1.996 12.999 ( 1.565 0.000 -0.271) 1.588 13.298 ( 2.089 0.000 1.855) 2.794 13.431 ( -0.571 0.000 -2.648) 2.708 13.567 ( -0.423 0.000 -9.187) 9.197 13.597 ( 4.702 0.000 5.680) 7.374 13.718 ( -6.969 0.000 6.774) 9.718 14.062 ( -2.045 0.000 7.102) 7.391 14.063 ( 0.422 0.000 -6.594) 6.608 14.320 ( -1.368 0.000 -6.573) 6.714 14.654 ( -1.425 0.000 3.897) 4.149 14.805 ( 6.133 0.000 1.316) 6.273 15.258 ( -2.082 0.000 1.375) 2.495 15.693 ( 1.744 0.000 0.013) 1.744 15.693 ( 4.860 0.000 0.917) 4.946 15.854 ( -2.647 0.000 1.891) 3.253 16.767 ( 3.044 0.000 0.936) 3.185 16.984 ( -4.260 0.000 2.747) 5.069 17.152 ( 4.302 0.000 0.455) 4.326 17.207 ( 2.866 0.000 -0.114) 2.869 18.017 ( 1.656 0.000 -1.647) 2.335 18.190 ( 2.197 0.000 -1.024) 2.424 19.344 ( 0.426 0.000 -8.308) 8.319 19.386 ( -5.555 0.000 -1.700) 5.809 20.643 ( 2.093 0.000 3.240) 3.857 20.762 ( 1.377 0.000 14.124) 14.191 21.562 ( -1.246 0.000 -1.620) 2.044 21.613 ( -2.418 0.000 -0.615) 2.494 22.058 ( -8.889 0.000 2.289) 9.179 22.319 ( 1.037 0.000 0.003) 1.037 23.126 ( 0.066 0.000 -1.015) 1.017 23.301 ( -2.859 0.000 0.000) 2.859 23.496 ( -0.755 0.000 6.548) 6.591 23.733 ( -3.072 0.000 -0.947) 3.214 24.153 ( 3.920 0.000 0.102) 3.921 24.497 ( 0.208 0.000 -13.490) 13.492 25.596 ( -2.032 0.000 0.330) 2.059 26.049 ( 3.851 0.000 -0.985) 3.975 26.316 ( 0.590 0.000 3.305) 3.357 26.518 ( 2.299 0.000 1.784) 2.909 ======================= Grid point 51 (22/78) ======================= q-point: (-0.25 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.783 ( -30.797 0.000 5.738) 31.327 1.937 ( -34.741 0.000 11.008) 36.443 2.228 ( -12.515 0.000 13.774) 18.610 2.789 ( -4.492 0.000 2.049) 4.937 3.217 ( -10.134 0.000 2.584) 10.458 3.382 ( -49.167 0.000 20.350) 53.212 3.623 ( -1.365 0.000 -8.652) 8.759 3.864 ( 3.345 0.000 14.291) 14.677 3.890 ( -2.510 0.000 -12.352) 12.605 4.154 ( -7.000 0.000 -5.087) 8.654 4.234 ( -3.085 0.000 -0.103) 3.087 4.445 ( 3.308 0.000 4.180) 5.331 4.519 ( 2.167 0.000 -0.917) 2.353 4.526 ( -13.112 0.000 11.969) 17.753 4.703 ( -1.764 0.000 -0.076) 1.765 4.795 ( -13.092 0.000 -8.685) 15.711 4.810 ( -7.290 0.000 -0.451) 7.304 4.998 ( -9.635 0.000 11.550) 15.041 5.080 ( 0.253 0.000 -0.373) 0.451 5.176 ( -0.151 0.000 4.412) 4.414 5.262 ( 2.550 0.000 1.410) 2.914 5.326 ( 2.007 0.000 -8.714) 8.942 5.471 ( 0.828 0.000 -8.053) 8.096 5.538 ( -5.252 0.000 1.631) 5.499 5.757 ( -0.574 0.000 13.575) 13.587 5.763 ( 1.050 0.000 1.259) 1.640 5.905 ( -5.470 0.000 -6.086) 8.183 5.942 ( -0.849 0.000 1.603) 1.814 6.152 ( 10.207 0.000 -18.760) 21.357 6.169 ( 0.409 0.000 -1.077) 1.152 6.309 ( -1.389 0.000 8.530) 8.642 6.330 ( 2.642 0.000 -4.275) 5.025 6.422 ( 4.119 0.000 8.798) 9.714 6.618 ( 4.986 0.000 -9.028) 10.313 6.753 ( 3.347 0.000 0.851) 3.453 6.791 ( 15.889 0.000 -12.909) 20.472 6.847 ( 19.488 0.000 -2.458) 19.643 6.923 ( 5.407 0.000 1.526) 5.618 7.079 ( 9.875 0.000 -0.396) 9.883 7.129 ( 4.807 0.000 7.755) 9.124 7.205 ( 2.811 0.000 -1.020) 2.990 7.367 ( -0.401 0.000 -3.322) 3.346 7.414 ( 4.028 0.000 0.286) 4.039 7.523 ( 7.950 0.000 -7.750) 11.102 7.645 ( -1.919 0.000 -5.731) 6.044 7.828 ( 7.888 0.000 -5.780) 9.779 7.846 ( 11.916 0.000 -1.533) 12.014 8.012 ( 1.721 0.000 0.459) 1.781 8.105 ( 6.448 0.000 4.100) 7.641 8.398 ( 1.666 0.000 -0.756) 1.830 8.438 ( 9.048 0.000 -5.408) 10.541 8.555 ( -4.359 0.000 5.846) 7.292 8.652 ( -6.382 0.000 -3.935) 7.498 8.857 ( -5.260 0.000 -4.966) 7.234 8.897 ( -1.166 0.000 -7.168) 7.262 8.952 ( -6.870 0.000 -1.688) 7.074 9.238 ( 0.779 0.000 -1.773) 1.937 9.318 ( -0.580 0.000 6.806) 6.831 9.410 ( -0.589 0.000 1.366) 1.487 9.423 ( 6.037 0.000 1.454) 6.210 9.552 ( 1.067 0.000 -2.343) 2.575 9.826 ( -0.239 0.000 4.420) 4.427 9.828 ( -0.692 0.000 1.170) 1.359 10.127 ( 4.525 0.000 -2.783) 5.312 10.925 ( 9.197 0.000 7.645) 11.960 10.971 ( 9.966 0.000 6.413) 11.851 10.975 ( -6.450 0.000 11.733) 13.389 11.421 ( -4.064 0.000 7.226) 8.290 11.632 ( -3.524 0.000 -6.513) 7.405 11.890 ( 0.546 0.000 4.477) 4.510 11.927 ( -5.186 0.000 -9.889) 11.167 12.035 ( 6.382 0.000 -1.158) 6.487 12.802 ( 5.988 0.000 -18.824) 19.753 12.806 ( -4.957 0.000 2.167) 5.410 12.915 ( 6.972 0.000 7.359) 10.137 13.038 ( 1.837 0.000 2.130) 2.813 13.350 ( 2.471 0.000 0.375) 2.499 13.389 ( -4.003 0.000 2.006) 4.477 13.553 ( -2.092 0.000 -8.875) 9.119 13.589 ( -3.232 0.000 1.979) 3.790 13.717 ( 5.336 0.000 4.326) 6.869 13.982 ( -5.532 0.000 3.928) 6.785 14.069 ( -0.708 0.000 1.226) 1.416 14.290 ( 0.786 0.000 -2.466) 2.588 14.649 ( 1.116 0.000 4.373) 4.513 14.909 ( 3.250 0.000 3.349) 4.667 15.243 ( 0.964 0.000 -2.522) 2.700 15.663 ( -1.505 0.000 0.649) 1.639 15.777 ( -3.983 0.000 0.012) 3.983 15.875 ( 8.434 0.000 6.579) 10.697 16.846 ( 3.767 0.000 1.717) 4.140 16.928 ( -1.144 0.000 1.899) 2.217 17.253 ( 5.716 0.000 -1.885) 6.019 17.280 ( 3.670 0.000 -0.316) 3.683 18.093 ( 5.842 0.000 -2.410) 6.320 18.234 ( 1.970 0.000 -0.466) 2.024 19.211 ( -10.117 0.000 -1.635) 10.248 19.336 ( -0.936 0.000 -13.376) 13.408 20.675 ( 0.332 0.000 4.330) 4.342 20.860 ( 7.226 0.000 19.960) 21.228 21.533 ( -1.110 0.000 -0.606) 1.265 21.571 ( -1.251 0.000 1.642) 2.064 21.862 ( -9.218 0.000 1.709) 9.376 22.279 ( -5.787 0.000 -6.418) 8.641 23.111 ( -1.301 0.000 -1.154) 1.739 23.232 ( -3.346 0.000 0.036) 3.347 23.462 ( -2.179 0.000 7.500) 7.810 23.671 ( -2.608 0.000 1.701) 3.114 24.248 ( 4.656 0.000 0.323) 4.667 24.500 ( 1.160 0.000 -14.722) 14.768 25.552 ( -1.966 0.000 0.664) 2.076 26.145 ( 4.920 0.000 -1.700) 5.206 26.331 ( 0.562 0.000 3.933) 3.973 26.588 ( 4.146 0.000 2.064) 4.631 ======================= Grid point 52 (23/78) ======================= q-point: (-0.12 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.080 ( -33.988 0.000 17.074) 38.036 1.166 ( -36.601 0.000 21.937) 42.672 2.035 ( -7.786 0.000 17.333) 19.001 2.268 ( -53.207 0.000 54.693) 76.304 2.712 ( -2.781 0.000 -3.593) 4.543 3.030 ( -7.624 0.000 -1.023) 7.693 3.599 ( -0.563 0.000 -7.338) 7.359 3.818 ( -2.008 0.000 -15.947) 16.072 3.959 ( -6.447 0.000 -10.481) 12.305 4.117 ( 10.559 0.000 7.385) 12.885 4.153 ( -3.551 0.000 -2.311) 4.237 4.195 ( -14.140 0.000 22.230) 26.346 4.407 ( -1.628 0.000 -7.321) 7.499 4.415 ( -13.849 0.000 -8.574) 16.288 4.632 ( 4.788 0.000 6.409) 8.000 4.770 ( 1.361 0.000 3.357) 3.623 4.777 ( -1.495 0.000 4.457) 4.701 4.911 ( 1.130 0.000 7.522) 7.606 5.098 ( 1.226 0.000 1.177) 1.700 5.165 ( -0.497 0.000 8.220) 8.235 5.247 ( -5.103 0.000 0.053) 5.103 5.319 ( -1.000 0.000 -0.819) 1.293 5.442 ( -6.139 0.000 -3.916) 7.282 5.467 ( -0.400 0.000 1.641) 1.689 5.705 ( -0.509 0.000 6.583) 6.602 5.779 ( -0.770 0.000 10.242) 10.271 5.845 ( 1.464 0.000 -10.714) 10.814 5.968 ( 2.353 0.000 -11.149) 11.395 6.151 ( -1.204 0.000 -2.435) 2.716 6.295 ( 1.430 0.000 -13.467) 13.543 6.374 ( 2.044 0.000 -4.868) 5.280 6.377 ( 5.046 0.000 4.994) 7.099 6.504 ( 2.226 0.000 9.197) 9.463 6.663 ( -2.339 0.000 -8.148) 8.477 6.848 ( 4.870 0.000 3.302) 5.884 6.897 ( -1.732 0.000 -5.056) 5.344 7.031 ( 0.041 0.000 -8.170) 8.170 7.191 ( 8.784 0.000 -0.235) 8.787 7.259 ( 9.241 0.000 3.765) 9.978 7.322 ( 13.466 0.000 15.603) 20.610 7.329 ( 12.085 0.000 -10.698) 16.140 7.520 ( 5.792 0.000 -3.454) 6.744 7.554 ( 11.663 0.000 -15.775) 19.618 7.601 ( -0.546 0.000 -0.977) 1.119 7.626 ( 2.515 0.000 -12.745) 12.991 7.910 ( 8.133 0.000 -16.277) 18.196 7.974 ( -4.699 0.000 -0.730) 4.756 8.127 ( 10.315 0.000 1.140) 10.377 8.237 ( 6.012 0.000 4.552) 7.541 8.407 ( -7.940 0.000 -0.293) 7.945 8.441 ( 2.308 0.000 -0.556) 2.374 8.485 ( -6.125 0.000 -2.000) 6.443 8.600 ( 2.704 0.000 0.105) 2.706 8.748 ( -2.757 0.000 -0.636) 2.829 8.875 ( 0.003 0.000 -2.245) 2.245 8.937 ( 6.033 0.000 -9.693) 11.417 9.249 ( 0.735 0.000 1.336) 1.524 9.282 ( -3.201 0.000 4.462) 5.491 9.392 ( -1.747 0.000 2.419) 2.984 9.522 ( 3.009 0.000 -3.630) 4.715 9.601 ( 3.595 0.000 -1.965) 4.097 9.798 ( -2.329 0.000 -0.684) 2.427 9.827 ( -0.207 0.000 3.153) 3.160 10.210 ( 3.614 0.000 -3.084) 4.751 10.749 ( -15.755 0.000 24.631) 29.239 11.074 ( 4.423 0.000 8.710) 9.769 11.197 ( 8.086 0.000 0.400) 8.096 11.200 ( -18.351 0.000 7.974) 20.008 11.596 ( 2.362 0.000 -5.569) 6.049 11.819 ( -4.568 0.000 -5.305) 7.001 11.971 ( 6.086 0.000 2.700) 6.658 12.154 ( 5.332 0.000 2.732) 5.991 12.706 ( -4.122 0.000 3.033) 5.118 12.860 ( 1.876 0.000 -14.973) 15.090 13.084 ( 2.809 0.000 3.415) 4.422 13.152 ( 13.593 0.000 1.775) 13.709 13.268 ( -7.159 0.000 3.822) 8.116 13.386 ( 0.470 0.000 -1.635) 1.701 13.422 ( -7.989 0.000 -1.291) 8.093 13.617 ( 3.345 0.000 -5.385) 6.339 13.798 ( 1.938 0.000 0.454) 1.991 13.882 ( -3.102 0.000 -0.589) 3.157 13.960 ( -9.039 0.000 10.082) 13.540 14.416 ( 8.307 0.000 1.438) 8.430 14.760 ( 12.192 0.000 8.997) 15.153 14.955 ( 1.619 0.000 -0.709) 1.767 15.282 ( 2.370 0.000 -3.360) 4.112 15.630 ( -1.772 0.000 1.786) 2.516 15.715 ( -1.626 0.000 -0.729) 1.782 16.026 ( 4.478 0.000 9.711) 10.694 16.908 ( 1.770 0.000 1.522) 2.334 16.927 ( 0.331 0.000 1.532) 1.567 17.347 ( 2.585 0.000 -0.244) 2.597 17.386 ( 5.420 0.000 -7.080) 8.916 18.240 ( 6.328 0.000 -1.245) 6.450 18.272 ( 3.403 0.000 0.089) 3.405 18.972 ( -11.998 0.000 -3.815) 12.590 19.276 ( -5.006 0.000 -19.177) 19.819 20.656 ( -2.222 0.000 5.418) 5.856 21.083 ( 9.981 0.000 12.955) 16.354 21.507 ( -1.109 0.000 -2.561) 2.791 21.649 ( 10.862 0.000 15.356) 18.810 21.715 ( -4.504 0.000 2.196) 5.011 22.011 ( -18.850 0.000 -13.139) 22.978 23.080 ( -1.245 0.000 -1.142) 1.689 23.173 ( -2.070 0.000 0.092) 2.072 23.472 ( 3.729 0.000 7.521) 8.394 23.624 ( -1.640 0.000 3.973) 4.298 24.330 ( 2.824 0.000 0.411) 2.854 24.500 ( -1.944 0.000 -15.931) 16.049 25.521 ( -1.044 0.000 1.051) 1.481 26.235 ( 3.448 0.000 -2.386) 4.193 26.339 ( -0.308 0.000 3.031) 3.047 26.690 ( 4.814 0.000 0.768) 4.875 ======================= Grid point 53 (24/78) ======================= q-point: ( 0.00 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( 2.084 32.667 26.121) 41.878 1.227 ( -13.070 29.669 29.709) 43.974 1.971 ( -6.177 47.112 38.189) 60.960 2.219 ( -1.551 11.891 8.986) 14.985 2.701 ( -0.317 4.838 -1.101) 4.972 2.946 ( 3.470 -4.489 1.446) 5.855 3.455 ( -2.519 -7.873 2.621) 8.672 3.605 ( -3.113 -23.790 1.614) 24.047 3.797 ( -4.461 -10.882 2.897) 12.113 3.952 ( -6.080 0.082 -11.173) 12.720 3.985 ( -2.490 5.834 -12.545) 14.058 4.161 ( -2.027 7.094 -3.385) 8.118 4.313 ( 0.081 3.652 3.648) 5.162 4.474 ( -1.176 3.124 -6.044) 6.905 4.672 ( 5.398 -4.226 9.395) 11.630 4.762 ( -0.990 2.217 -0.320) 2.449 4.922 ( 1.775 -6.263 3.641) 7.459 4.935 ( 1.225 4.314 4.856) 6.610 5.003 ( -2.668 0.906 -1.761) 3.322 5.288 ( -1.648 13.029 -0.096) 13.133 5.342 ( -2.268 4.117 -0.956) 4.797 5.375 ( -4.537 9.884 1.237) 10.945 5.445 ( 2.761 7.340 -8.709) 11.719 5.599 ( -0.912 6.771 6.997) 9.780 5.640 ( 3.134 -2.129 -1.911) 4.243 5.802 ( -2.602 -0.210 5.201) 5.819 5.918 ( -6.334 3.789 -2.971) 7.956 5.958 ( -0.481 -1.137 -9.822) 9.899 6.049 ( -2.191 5.077 0.339) 5.540 6.151 ( 0.496 0.882 1.014) 1.432 6.316 ( -3.217 -3.017 -5.031) 6.690 6.382 ( 1.389 -3.951 0.326) 4.201 6.520 ( 0.189 -0.556 -3.280) 3.332 6.589 ( 1.128 -21.763 4.180) 22.189 6.644 ( -1.238 -8.610 -4.792) 9.931 6.890 ( 3.888 -2.098 1.056) 4.542 7.006 ( 1.063 -13.570 -3.661) 14.095 7.145 ( 1.361 0.559 -2.152) 2.606 7.217 ( 0.524 -6.499 -1.367) 6.662 7.314 ( 0.308 -12.014 2.789) 12.337 7.406 ( 4.521 -9.436 6.458) 12.296 7.491 ( 3.605 5.337 -2.366) 6.861 7.616 ( 5.927 -3.368 -8.498) 10.894 7.835 ( 6.379 0.902 -2.810) 7.029 7.875 ( -7.711 2.540 -11.367) 13.969 7.932 ( -6.325 3.356 0.360) 7.170 8.067 ( 5.466 2.431 -13.492) 14.759 8.212 ( 9.428 -1.603 2.927) 10.001 8.274 ( -0.374 -1.347 2.029) 2.464 8.442 ( 4.984 -1.484 -4.124) 6.637 8.607 ( -1.519 3.260 -6.736) 7.636 8.678 ( 1.107 6.452 -3.603) 7.472 8.798 ( 3.904 13.253 -7.296) 15.624 8.836 ( 1.347 10.270 -10.650) 14.856 9.030 ( 8.002 -6.741 -5.760) 11.944 9.117 ( 2.146 1.686 -11.924) 12.233 9.277 ( 0.722 2.186 3.606) 4.278 9.349 ( 4.146 2.808 2.430) 5.566 9.506 ( 14.654 6.881 -3.012) 16.467 9.576 ( 1.238 3.003 -2.423) 4.052 9.687 ( 3.925 0.261 -0.858) 4.026 9.770 ( -1.605 3.637 -2.738) 4.828 9.912 ( 2.045 7.513 2.293) 8.117 10.298 ( 1.195 1.192 4.513) 4.818 10.430 ( -14.380 1.581 23.066) 27.227 10.635 ( -26.994 -2.279 19.737) 33.517 11.120 ( -1.396 2.080 1.982) 3.194 11.253 ( -2.898 1.306 -2.945) 4.334 11.654 ( -0.249 -3.268 -3.387) 4.713 11.679 ( 10.232 -9.659 0.325) 14.075 12.070 ( -1.452 0.878 -5.552) 5.806 12.196 ( 0.380 -6.207 4.783) 7.845 12.628 ( 2.634 -5.953 1.460) 6.671 12.917 ( 3.692 0.036 -7.331) 8.208 13.068 ( -1.082 -1.767 3.597) 4.151 13.164 ( -3.334 -6.158 1.936) 7.265 13.294 ( 5.449 5.376 -0.011) 7.655 13.326 ( -4.314 0.975 0.408) 4.441 13.477 ( 3.001 4.753 -4.126) 6.973 13.667 ( -3.071 0.894 1.973) 3.758 13.739 ( -0.700 0.849 -3.860) 4.013 13.890 ( -0.573 5.043 1.234) 5.224 13.986 ( 2.646 2.694 9.297) 10.034 14.424 ( -14.192 -23.402 17.832) 32.666 14.490 ( 1.251 -6.084 6.142) 8.735 14.816 ( -0.736 -12.109 -2.711) 12.431 15.321 ( 2.993 1.216 -2.830) 4.295 15.429 ( -2.099 -3.528 4.757) 6.284 15.890 ( 1.544 13.028 1.587) 13.215 16.243 ( -3.181 6.356 -4.177) 8.244 16.935 ( -0.631 1.002 0.276) 1.216 17.036 ( 2.627 0.622 0.904) 2.847 17.270 ( -5.275 7.342 -11.076) 14.297 17.516 ( -9.195 7.673 -4.330) 12.735 18.281 ( -0.457 1.175 -0.613) 1.402 18.343 ( -1.698 -2.208 1.505) 3.165 18.825 ( -1.905 1.541 -4.588) 5.201 19.028 ( -2.504 -1.533 -10.172) 10.587 20.613 ( -1.874 -1.473 6.812) 7.217 20.728 ( -15.366 -9.587 14.061) 22.929 21.424 ( -2.949 0.248 0.362) 2.982 21.504 ( 2.144 -1.355 -0.815) 2.664 21.712 ( 1.904 0.040 6.288) 6.570 21.897 ( 17.382 -14.992 18.027) 29.186 23.032 ( -0.051 0.546 -2.279) 2.344 23.213 ( 0.986 -1.280 4.254) 4.551 23.527 ( -0.832 1.218 -4.032) 4.293 23.721 ( -7.944 -6.570 3.336) 10.835 24.009 ( 3.674 2.419 -2.235) 4.934 24.357 ( 0.601 -2.816 2.291) 3.680 26.078 ( 2.913 18.315 -21.276) 28.224 26.279 ( 1.619 0.400 -2.938) 3.379 26.357 ( -1.504 3.309 1.564) 3.957 26.604 ( -8.105 -3.008 -0.946) 8.696 ======================= Grid point 54 (25/78) ======================= q-point: ( 0.12 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.245 ( 14.407 19.300 24.000) 34.001 1.506 ( 24.014 26.276 16.121) 39.077 2.172 ( 0.551 9.234 12.551) 15.592 2.328 ( 26.774 31.263 15.059) 43.829 2.746 ( 7.071 13.931 7.461) 17.313 3.168 ( 16.223 -4.359 5.367) 17.635 3.419 ( -0.657 -10.408 1.707) 10.568 3.500 ( -4.544 -10.203 -1.850) 11.321 3.767 ( 1.835 -17.833 5.246) 18.679 3.893 ( 3.268 0.387 -17.921) 18.221 4.035 ( 5.383 7.568 -10.183) 13.782 4.114 ( 2.740 14.454 -5.238) 15.616 4.334 ( 0.597 6.764 0.244) 6.795 4.491 ( 2.694 1.976 -3.471) 4.817 4.703 ( -2.346 -4.314 -3.373) 5.958 4.732 ( -3.035 -3.173 0.136) 4.393 4.871 ( -5.329 -1.402 10.140) 11.540 4.997 ( 3.861 6.059 5.163) 8.847 5.085 ( 7.021 2.900 -6.448) 9.964 5.230 ( -2.273 11.765 0.010) 11.982 5.295 ( 1.806 1.829 2.044) 3.284 5.323 ( -1.538 6.409 -1.521) 6.764 5.472 ( 0.480 8.425 -1.747) 8.618 5.567 ( -0.388 10.107 2.835) 10.504 5.682 ( -0.508 -3.049 -3.905) 4.980 5.781 ( -4.046 0.086 -0.864) 4.138 5.789 ( 1.716 1.714 5.329) 5.856 5.940 ( -1.047 -0.163 -8.852) 8.915 6.120 ( 2.235 1.491 0.504) 2.734 6.162 ( 0.080 4.021 -4.097) 5.741 6.280 ( 1.894 -4.032 0.603) 4.496 6.418 ( 1.027 -2.982 -4.028) 5.116 6.460 ( -2.807 0.175 4.237) 5.085 6.576 ( -1.728 -9.369 -1.655) 9.670 6.643 ( -1.112 -18.479 2.469) 18.676 6.940 ( -0.065 -13.935 -0.429) 13.942 7.006 ( -1.834 2.774 -3.996) 5.199 7.152 ( -0.595 -5.873 -0.934) 5.977 7.220 ( -3.760 -1.635 6.710) 7.864 7.291 ( 0.366 -9.708 1.736) 9.869 7.420 ( -3.219 -13.102 4.864) 14.342 7.533 ( 1.422 1.516 -5.907) 6.262 7.621 ( -9.973 2.017 -7.097) 12.405 7.644 ( -5.318 3.728 -3.460) 7.358 7.822 ( -4.131 -1.390 -0.215) 4.364 7.920 ( 0.879 6.793 1.863) 7.098 8.117 ( 0.425 -2.417 -6.119) 6.592 8.210 ( -4.913 -2.399 -0.163) 5.470 8.264 ( -5.799 -7.878 1.549) 9.904 8.483 ( -3.609 1.703 -2.019) 4.472 8.616 ( 2.466 4.295 -9.371) 10.599 8.709 ( 4.166 7.303 1.883) 8.616 8.790 ( -5.465 2.278 -4.422) 7.390 8.872 ( 4.117 10.190 -3.142) 11.431 9.082 ( -2.106 -3.870 -5.443) 7.003 9.095 ( -3.110 0.952 -7.571) 8.240 9.317 ( 0.575 2.293 0.079) 2.365 9.373 ( 1.386 6.445 4.821) 8.167 9.551 ( -3.783 2.230 2.277) 4.946 9.609 ( -2.575 5.802 3.450) 7.224 9.784 ( 1.669 -3.846 0.430) 4.214 9.827 ( 4.096 3.154 -1.278) 5.325 9.994 ( 4.123 0.434 1.086) 4.286 10.115 ( -7.606 -0.436 19.129) 20.591 10.254 ( -6.164 -2.299 10.763) 12.614 10.448 ( 2.462 0.034 -12.635) 12.873 11.031 ( -6.784 3.669 0.163) 7.714 11.131 ( -8.329 1.411 -2.269) 8.747 11.649 ( 1.421 -0.240 -4.918) 5.125 11.930 ( 8.510 -7.876 -5.214) 12.713 12.023 ( -1.879 -1.371 0.487) 2.377 12.165 ( -4.480 -10.049 7.516) 13.324 12.685 ( 2.716 -3.289 4.874) 6.477 12.924 ( -3.143 -0.553 -4.727) 5.704 13.001 ( -5.727 2.031 -0.529) 6.100 13.117 ( 1.156 -0.580 2.211) 2.562 13.262 ( 0.059 3.902 -1.874) 4.329 13.426 ( 4.269 1.403 -0.485) 4.519 13.543 ( 1.056 2.617 1.229) 3.078 13.604 ( 2.236 2.953 -5.259) 6.432 13.746 ( 0.612 -0.488 -1.548) 1.735 13.924 ( 1.694 1.447 0.163) 2.234 14.010 ( -4.623 9.756 7.598) 13.202 14.180 ( -0.090 -18.226 15.698) 24.054 14.478 ( -0.947 -2.224 2.169) 3.247 14.781 ( -2.743 -11.628 -3.708) 12.509 15.369 ( 1.012 -0.035 -0.701) 1.232 15.412 ( 0.085 -3.423 3.724) 5.058 15.905 ( -0.292 12.469 3.223) 12.883 16.052 ( -9.761 17.108 -4.230) 20.146 16.876 ( -4.621 0.301 0.692) 4.682 17.001 ( -2.825 -1.326 3.843) 4.951 17.216 ( 2.293 8.275 -11.628) 14.455 17.381 ( -4.321 1.220 1.639) 4.779 18.186 ( -5.195 1.595 -1.704) 5.696 18.278 ( -4.058 -0.700 0.317) 4.130 18.847 ( 5.486 2.904 -6.711) 9.142 19.190 ( 10.572 -5.969 -11.336) 16.610 20.535 ( -0.888 1.290 9.772) 9.896 20.708 ( 4.200 -1.745 9.610) 10.632 21.440 ( 2.748 1.266 -0.358) 3.046 21.591 ( 5.272 -1.944 2.391) 6.106 21.791 ( 4.938 0.779 5.059) 7.112 22.208 ( 9.369 -22.130 6.296) 24.843 23.028 ( -0.088 0.173 -2.240) 2.249 23.228 ( -0.861 -3.561 7.221) 8.097 23.442 ( -5.114 8.464 -5.262) 11.202 23.590 ( 0.180 -1.886 1.398) 2.354 24.204 ( 8.605 -2.466 -5.036) 10.271 24.362 ( 0.560 -1.870 0.882) 2.142 25.920 ( -11.463 21.645 -12.467) 27.484 26.258 ( -3.567 1.712 -2.440) 4.648 26.342 ( -1.210 0.938 3.617) 3.927 26.488 ( -0.663 -2.406 0.218) 2.505 ======================= Grid point 55 (26/78) ======================= q-point: ( 0.25 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( 26.866 7.864 4.071) 28.288 2.033 ( 19.917 11.735 4.825) 23.615 2.320 ( 16.951 17.022 9.273) 25.751 2.662 ( 7.673 -1.875 -3.175) 8.513 3.240 ( 28.271 16.870 19.272) 38.148 3.404 ( -0.703 -5.692 -3.118) 6.528 3.509 ( 12.080 -7.470 -1.523) 14.285 3.587 ( 16.393 -1.422 0.615) 16.466 3.813 ( 3.832 -14.422 -3.725) 15.381 4.066 ( 10.528 6.387 -12.155) 17.302 4.167 ( 7.336 10.153 0.343) 12.531 4.269 ( 9.144 11.580 -10.649) 18.196 4.375 ( 7.346 3.733 -7.138) 10.902 4.501 ( -1.765 10.687 4.033) 11.559 4.582 ( -6.463 -4.474 0.067) 7.861 4.711 ( -0.444 -3.001 5.032) 5.876 4.805 ( 0.229 -3.533 2.446) 4.303 5.011 ( -1.959 1.932 -4.160) 4.987 5.177 ( 2.326 3.794 -9.152) 10.177 5.220 ( 1.673 7.188 -1.914) 7.625 5.319 ( 1.916 3.330 -4.723) 6.089 5.441 ( 8.009 -0.229 8.471) 11.661 5.509 ( 3.141 4.952 3.147) 6.655 5.571 ( -0.971 9.458 -3.113) 10.004 5.632 ( -2.986 -0.080 -5.618) 6.363 5.748 ( 3.067 -7.056 -1.818) 7.906 5.852 ( 2.446 4.908 4.815) 7.298 5.899 ( -2.422 0.525 -7.744) 8.131 6.091 ( -2.018 3.597 2.110) 4.633 6.165 ( 0.142 -0.440 -5.048) 5.069 6.335 ( 1.313 -5.523 2.791) 6.326 6.384 ( -2.285 -3.585 -2.447) 4.906 6.439 ( -3.677 0.451 2.094) 4.256 6.522 ( -0.781 -2.925 5.113) 5.943 6.625 ( -1.627 -11.920 1.303) 12.101 6.839 ( -8.182 -3.290 -4.416) 9.862 6.914 ( -8.470 -2.283 0.134) 8.774 7.030 ( -8.221 -6.913 6.482) 12.546 7.185 ( 1.232 0.633 1.615) 2.128 7.254 ( -15.184 2.736 0.425) 15.434 7.320 ( -2.116 -4.943 4.516) 7.022 7.407 ( -1.644 -8.786 1.630) 9.086 7.505 ( -2.504 -1.561 -1.352) 3.246 7.650 ( 2.360 4.116 -3.452) 5.867 7.701 ( -7.701 -6.411 6.516) 11.953 7.882 ( -4.210 6.285 3.817) 8.473 8.053 ( -9.304 -6.918 2.533) 11.867 8.088 ( -7.309 0.685 -2.460) 7.742 8.131 ( -2.506 -6.401 -1.701) 7.081 8.374 ( -6.618 -5.786 2.402) 9.113 8.595 ( -7.764 4.638 3.041) 9.541 8.629 ( -4.835 -0.888 -2.044) 5.324 8.797 ( 2.133 0.174 -0.079) 2.141 8.905 ( 0.289 6.577 -2.221) 6.948 8.992 ( -4.897 2.255 -3.397) 6.372 9.085 ( 2.346 2.423 -4.959) 5.997 9.223 ( -10.327 -0.517 12.676) 16.358 9.333 ( 0.445 3.119 -1.435) 3.462 9.480 ( -1.824 7.071 5.773) 9.309 9.659 ( 2.351 3.489 1.210) 4.378 9.698 ( -7.682 -2.005 10.185) 12.914 9.843 ( -0.498 2.322 3.587) 4.302 9.977 ( -5.413 -1.670 8.259) 10.015 10.219 ( 4.134 0.402 -3.652) 5.530 10.288 ( 10.593 1.437 -8.198) 13.472 10.496 ( 8.290 -7.167 -22.255) 24.807 10.881 ( -6.394 3.174 1.274) 7.251 10.931 ( -9.655 1.990 0.453) 9.869 11.684 ( 0.735 0.045 -3.865) 3.935 11.889 ( -4.959 -2.759 3.913) 6.893 12.048 ( -3.494 -1.133 -3.235) 4.895 12.102 ( 3.330 -0.277 -3.652) 4.950 12.764 ( 2.733 -1.278 1.950) 3.592 12.777 ( -7.186 -0.441 6.079) 9.423 12.979 ( 1.594 -0.761 -2.986) 3.470 13.143 ( -0.246 -1.341 2.484) 2.834 13.288 ( 1.769 2.016 -0.852) 2.814 13.425 ( -2.832 -0.438 2.384) 3.727 13.572 ( 1.859 4.277 -1.261) 4.831 13.659 ( 0.702 3.621 -3.329) 4.969 13.803 ( 5.671 -1.823 -9.398) 11.127 13.917 ( 0.232 4.928 3.308) 5.940 14.027 ( 3.490 6.259 1.328) 7.288 14.230 ( 1.452 -7.796 3.624) 8.719 14.508 ( 3.245 -7.040 2.242) 8.070 14.696 ( -4.633 -10.057 -3.194) 11.524 15.364 ( -1.127 -0.805 2.212) 2.609 15.424 ( 0.617 -4.685 0.481) 4.750 15.882 ( -2.194 13.194 1.103) 13.420 15.935 ( -1.283 12.681 -0.734) 12.766 16.784 ( -4.125 -2.600 1.277) 5.040 16.966 ( -1.203 -4.097 4.289) 6.052 17.229 ( -0.658 2.977 -4.988) 5.846 17.297 ( -4.088 -0.618 0.977) 4.249 18.110 ( -2.122 0.952 -2.361) 3.314 18.183 ( -4.251 -0.200 -0.486) 4.283 19.020 ( 10.162 3.217 -8.365) 13.549 19.347 ( 5.683 -4.879 -7.316) 10.470 20.559 ( 1.354 2.809 7.112) 7.766 20.780 ( 1.316 -1.983 9.951) 10.232 21.508 ( 3.270 1.566 -0.141) 3.628 21.678 ( 2.041 -1.591 4.296) 5.015 21.928 ( 7.720 0.727 2.630) 8.188 22.317 ( 2.067 -14.043 0.093) 14.195 23.030 ( 0.556 -1.460 -2.187) 2.688 23.184 ( -2.207 -4.200 4.907) 6.825 23.441 ( 3.529 8.220 -2.309) 9.239 23.643 ( 3.924 -1.036 -0.622) 4.106 24.257 ( -1.535 1.564 -0.654) 2.287 24.422 ( 3.998 -3.221 -7.198) 8.841 25.742 ( -4.753 14.166 -3.320) 15.306 26.158 ( -5.341 0.629 -1.645) 5.624 26.310 ( -1.460 1.125 3.334) 3.810 26.493 ( -0.151 -3.755 0.102) 3.760 ======================= Grid point 56 (27/78) ======================= q-point: ( 0.38 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.169 ( 11.486 -0.045 2.708) 11.801 2.367 ( 14.376 0.582 0.717) 14.406 2.699 ( 12.811 11.751 -6.661) 18.617 2.977 ( 24.104 11.010 7.709) 27.597 3.421 ( 3.112 -0.956 -4.648) 5.675 3.517 ( 3.209 -4.030 -0.070) 5.152 3.772 ( 11.612 -6.144 -4.069) 13.753 3.885 ( 0.587 -2.696 -3.250) 4.263 3.893 ( 4.587 1.016 -0.844) 4.773 4.232 ( -2.764 10.675 -3.237) 11.493 4.262 ( 1.092 4.492 -4.196) 6.243 4.382 ( 8.918 3.910 -2.315) 10.009 4.420 ( 1.174 5.727 1.128) 5.954 4.569 ( 9.519 5.597 4.742) 12.017 4.710 ( 7.553 7.364 3.938) 11.260 4.821 ( 13.567 -3.554 -7.912) 16.102 4.868 ( 2.968 -7.808 -0.648) 8.378 5.005 ( 9.896 2.480 -6.796) 12.259 5.221 ( 3.138 4.993 -10.570) 12.103 5.253 ( -0.942 0.178 -3.332) 3.467 5.371 ( 3.545 4.771 -3.613) 6.956 5.505 ( -2.213 5.278 -8.287) 10.071 5.550 ( 0.960 3.721 -3.695) 5.331 5.590 ( 5.321 -6.314 3.356) 8.913 5.630 ( 1.707 2.506 -0.076) 3.033 5.743 ( -2.958 2.885 -6.598) 7.785 5.926 ( 7.520 -3.479 -2.449) 8.639 5.950 ( 3.684 0.998 6.900) 7.885 6.054 ( -2.559 0.081 5.195) 5.792 6.175 ( -0.744 0.537 -2.299) 2.476 6.237 ( -7.691 -3.807 -0.188) 8.584 6.348 ( -0.925 -5.799 3.484) 6.828 6.375 ( -1.890 -1.371 -7.188) 7.558 6.488 ( -9.484 -2.639 -1.000) 9.895 6.552 ( -1.732 5.284 9.820) 11.285 6.695 ( -4.327 2.255 4.706) 6.779 6.744 ( -3.511 -6.263 3.108) 7.824 6.869 ( -10.485 4.238 10.258) 15.268 6.967 ( -4.764 -1.883 5.152) 7.265 7.192 ( -3.557 1.351 1.911) 4.258 7.293 ( -13.389 -1.958 7.970) 15.704 7.313 ( 0.202 -1.993 -0.061) 2.005 7.466 ( -1.898 -9.672 1.689) 10.000 7.563 ( -5.670 -8.001 6.064) 11.529 7.589 ( -7.818 3.840 1.568) 8.851 7.788 ( -6.134 4.022 0.502) 7.353 7.817 ( -10.185 -5.634 9.688) 15.144 7.957 ( -3.414 4.389 -1.913) 5.880 8.060 ( -4.996 -5.088 -1.091) 7.213 8.242 ( -3.969 -6.776 3.854) 8.748 8.399 ( -8.650 -0.666 4.953) 9.990 8.559 ( -2.340 -8.592 -5.215) 10.319 8.774 ( -2.372 -2.666 -2.428) 4.316 8.904 ( -3.391 3.445 -1.937) 5.208 8.959 ( 3.754 2.256 -0.207) 4.384 9.093 ( -1.565 3.210 -0.600) 3.622 9.130 ( 0.653 -0.809 5.870) 5.962 9.334 ( -0.526 2.366 -1.535) 2.869 9.452 ( -1.296 5.078 3.182) 6.131 9.571 ( -3.804 3.006 6.269) 7.925 9.684 ( -0.454 3.175 3.176) 4.513 9.815 ( -2.788 -4.686 3.243) 6.344 9.896 ( -1.225 3.698 3.903) 5.515 10.135 ( -5.876 1.580 1.454) 6.256 10.602 ( 12.875 -1.215 -14.133) 19.157 10.669 ( 4.245 -3.725 -4.239) 7.062 10.771 ( -3.431 2.614 2.687) 5.082 10.863 ( 7.756 0.585 -12.861) 15.030 11.658 ( -0.933 -0.154 -1.518) 1.789 11.850 ( -0.203 4.995 -2.580) 5.626 12.015 ( 1.753 -3.073 -8.756) 9.443 12.148 ( 0.923 -0.805 -9.172) 9.254 12.615 ( -8.069 -1.756 8.273) 11.689 12.811 ( 0.544 -1.682 4.521) 4.854 13.016 ( 1.532 -0.084 -3.109) 3.467 13.107 ( -2.980 -0.216 5.906) 6.618 13.297 ( -1.870 0.033 2.036) 2.764 13.391 ( 0.767 0.264 1.366) 1.588 13.589 ( -0.319 2.634 -1.030) 2.846 13.653 ( -0.380 7.112 -6.207) 9.447 13.872 ( -0.059 -2.824 -0.961) 2.983 13.974 ( 5.115 4.832 0.401) 7.048 14.093 ( 2.116 5.309 1.005) 5.803 14.275 ( 3.151 -3.396 -7.333) 8.674 14.562 ( 1.324 -7.394 2.349) 7.870 14.618 ( -2.002 -9.639 -0.126) 9.845 15.333 ( -2.006 -1.279 3.130) 3.931 15.439 ( 1.009 -4.473 -1.726) 4.899 15.856 ( -0.017 10.976 0.178) 10.977 15.940 ( 1.003 10.417 0.813) 10.497 16.711 ( -2.738 -4.123 1.124) 5.075 16.967 ( 1.216 -5.687 4.262) 7.210 17.181 ( -3.773 1.196 -1.232) 4.146 17.218 ( -3.013 -0.175 1.497) 3.369 18.073 ( -1.908 1.110 0.258) 2.222 18.127 ( -0.561 -0.171 -2.502) 2.570 19.210 ( 7.934 2.598 -7.778) 11.411 19.431 ( 2.797 -2.339 -3.623) 5.140 20.587 ( 1.011 2.619 5.333) 6.027 20.779 ( -1.677 -1.768 9.624) 9.927 21.561 ( 1.725 1.114 -0.733) 2.181 21.688 ( -0.921 -1.144 1.931) 2.425 22.088 ( 6.607 0.295 2.645) 7.123 22.325 ( -1.045 -5.346 0.763) 5.501 23.048 ( 1.219 -2.867 -2.151) 3.786 23.165 ( -0.189 -7.902 1.962) 8.144 23.525 ( 4.012 6.794 0.443) 7.902 23.724 ( 3.314 -1.247 -0.875) 3.648 24.211 ( -2.226 5.121 -0.562) 5.612 24.473 ( 1.441 -2.569 -9.507) 9.953 25.693 ( -0.523 8.092 -0.370) 8.118 26.054 ( -4.029 -0.063 -0.955) 4.141 26.295 ( -0.133 1.006 2.317) 2.529 26.476 ( -1.297 -3.803 1.355) 4.240 ======================= Grid point 57 (28/78) ======================= q-point: (-0.50 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.294 ( 1.325 1.337 4.283) 4.678 2.530 ( 1.631 -6.424 1.695) 6.841 2.894 ( 4.324 11.509 -5.446) 13.447 3.328 ( -1.503 13.650 10.305) 17.169 3.433 ( -2.693 -3.212 -6.621) 7.837 3.682 ( 10.586 3.404 -7.456) 13.389 3.730 ( -1.235 6.644 -0.335) 6.766 3.890 ( 1.750 -1.120 6.485) 6.810 3.979 ( -3.641 9.297 3.952) 10.738 4.156 ( 8.152 -4.913 -6.153) 11.334 4.328 ( -2.995 -5.984 2.053) 7.000 4.407 ( 3.862 1.174 -5.593) 6.898 4.551 ( 2.630 5.766 -6.624) 9.167 4.679 ( 5.324 8.349 -4.034) 10.692 4.836 ( 1.629 -7.516 -3.231) 8.341 4.918 ( 3.092 -3.371 -2.661) 5.292 5.086 ( 9.934 0.068 -1.715) 10.081 5.163 ( -5.764 0.601 -8.210) 10.050 5.218 ( 2.273 3.298 -14.012) 14.573 5.340 ( 3.371 -0.870 -0.866) 3.587 5.410 ( 2.767 1.315 -9.386) 9.874 5.439 ( -5.610 5.350 -3.330) 8.437 5.523 ( -3.120 5.731 -1.436) 6.681 5.667 ( 2.125 -3.504 -4.369) 5.990 5.728 ( -5.746 0.609 3.126) 6.570 5.779 ( 7.948 3.702 -0.880) 8.812 5.857 ( 0.520 -0.166 -2.306) 2.370 5.983 ( -1.278 -0.056 1.050) 1.655 6.054 ( -1.013 -1.698 4.893) 5.278 6.145 ( 0.957 0.325 1.011) 1.429 6.193 ( -2.565 -3.650 -0.114) 4.462 6.268 ( -5.133 -2.217 -0.067) 5.592 6.377 ( 3.702 0.210 7.502) 8.368 6.402 ( 4.474 -2.333 -0.356) 5.058 6.526 ( 1.750 3.407 6.268) 7.345 6.605 ( -5.341 8.648 16.664) 19.519 6.753 ( -5.562 -5.990 2.645) 8.591 6.783 ( 3.359 -0.657 7.627) 8.360 6.903 ( -2.567 -4.014 9.088) 10.262 6.976 ( -11.172 1.355 6.935) 13.219 7.078 ( -2.579 5.695 4.418) 7.655 7.298 ( -2.002 -1.827 -1.107) 2.928 7.371 ( -3.935 -8.293 2.808) 9.599 7.396 ( -8.937 0.331 2.642) 9.325 7.527 ( -0.450 -2.198 -2.011) 3.013 7.649 ( 0.156 0.882 -0.868) 1.247 7.748 ( -2.853 -2.564 3.244) 5.024 7.908 ( -0.079 6.208 -0.228) 6.213 8.008 ( -0.121 -1.635 -1.445) 2.185 8.201 ( -0.519 -4.761 1.637) 5.061 8.258 ( -4.571 -6.564 -0.939) 8.054 8.570 ( 3.412 -14.786 -0.095) 15.175 8.732 ( -1.436 -5.887 -3.839) 7.173 8.849 ( -1.663 3.793 -0.877) 4.234 9.019 ( -2.169 4.071 -0.058) 4.613 9.063 ( 3.117 -1.217 1.032) 3.502 9.186 ( 2.751 -2.701 4.797) 6.154 9.297 ( -3.018 3.584 -3.240) 5.697 9.431 ( -0.782 5.888 1.843) 6.219 9.529 ( -1.126 5.231 1.084) 5.460 9.658 ( -1.743 3.883 1.915) 4.667 9.780 ( -0.439 -4.950 3.785) 6.247 9.900 ( 0.319 3.675 2.246) 4.319 10.041 ( -2.259 1.824 0.390) 2.930 10.659 ( 0.942 0.420 4.955) 5.062 10.714 ( 1.491 -1.368 8.731) 8.963 10.898 ( 8.769 1.713 -8.697) 12.469 11.092 ( 12.156 -3.551 -14.176) 19.009 11.706 ( 6.018 2.590 -6.328) 9.108 11.820 ( -2.558 4.546 -5.766) 7.775 12.096 ( 3.080 -1.629 -9.950) 10.543 12.123 ( -0.888 -1.718 -9.875) 10.063 12.463 ( -5.764 -4.518 7.847) 10.734 12.794 ( -2.965 -4.921 8.839) 10.542 12.996 ( -2.555 -0.852 0.297) 2.709 13.094 ( 1.756 5.403 1.458) 5.866 13.263 ( -0.694 1.160 1.203) 1.810 13.420 ( 1.204 -0.863 1.027) 1.802 13.584 ( 0.308 3.356 -0.337) 3.387 13.634 ( -0.759 5.745 -8.947) 10.659 13.832 ( -3.492 -0.772 5.671) 6.705 14.074 ( 3.471 3.777 2.927) 5.906 14.108 ( -0.466 3.223 -3.553) 4.819 14.315 ( 0.679 -1.687 -8.777) 8.963 14.584 ( -0.877 -9.168 2.595) 9.569 14.623 ( 4.025 -6.263 0.725) 7.480 15.289 ( -2.230 -0.709 2.784) 3.637 15.466 ( 1.690 -4.731 -2.005) 5.409 15.874 ( 1.384 8.791 1.336) 8.999 15.964 ( 0.842 9.604 1.394) 9.741 16.682 ( 0.278 -4.058 0.892) 4.165 17.008 ( 0.733 -6.190 3.377) 7.089 17.112 ( -0.738 1.876 1.329) 2.415 17.170 ( -1.631 -0.322 0.520) 1.742 18.038 ( -1.032 1.865 -0.032) 2.132 18.140 ( 1.456 -0.789 -1.673) 2.354 19.325 ( 3.523 1.859 -7.196) 8.225 19.452 ( -0.876 -0.855 -1.803) 2.179 20.616 ( 1.484 1.868 4.274) 4.895 20.747 ( -1.583 -1.290 10.139) 10.342 21.579 ( 0.045 0.446 -1.727) 1.784 21.654 ( -2.208 -1.009 0.106) 2.430 22.168 ( -0.599 -0.574 2.294) 2.439 22.297 ( -0.593 -0.149 1.897) 1.993 23.071 ( 0.875 -3.545 -1.560) 3.971 23.165 ( -0.164 -10.545 0.873) 10.582 23.593 ( 2.198 6.341 2.766) 7.259 23.763 ( 0.272 -0.879 -0.756) 1.191 24.178 ( -0.644 5.810 -1.419) 6.015 24.472 ( -0.689 -2.962 -10.667) 11.092 25.695 ( 0.319 6.531 0.388) 6.551 26.008 ( -0.068 -0.177 -0.676) 0.702 26.305 ( 0.692 0.625 2.054) 2.256 26.458 ( -0.170 -3.450 1.942) 3.962 ======================= Grid point 58 (29/78) ======================= q-point: (-0.38 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( -7.378 3.770 5.511) 9.950 2.452 ( -9.872 -1.385 5.516) 11.393 2.828 ( -10.710 14.281 -5.564) 18.698 3.008 ( -20.419 11.888 13.799) 27.361 3.349 ( -4.199 -2.393 -5.019) 6.968 3.652 ( -5.677 -3.147 4.436) 7.862 3.726 ( -2.804 4.715 -2.327) 5.959 3.991 ( 4.142 9.108 -3.047) 10.460 4.117 ( 2.995 -3.747 1.981) 5.190 4.231 ( -0.954 -9.262 0.258) 9.314 4.317 ( 4.866 2.094 1.616) 5.538 4.422 ( -6.691 -3.028 -2.749) 7.842 4.526 ( -2.470 9.105 -0.560) 9.450 4.651 ( -16.725 11.295 5.726) 20.978 4.816 ( -4.461 -7.624 1.750) 9.005 4.925 ( -1.896 -6.746 -1.035) 7.084 5.003 ( -3.964 1.307 -5.835) 7.174 5.129 ( -4.041 -1.169 -8.869) 9.816 5.174 ( -5.471 -1.093 -1.695) 5.831 5.245 ( -8.581 7.124 -7.293) 13.325 5.317 ( 5.511 5.881 -11.603) 14.127 5.437 ( -0.714 8.226 -3.380) 8.922 5.499 ( -1.290 0.272 3.812) 4.033 5.563 ( -3.356 2.431 -1.154) 4.301 5.734 ( 2.124 3.155 1.574) 4.117 5.839 ( -0.409 -2.803 -0.367) 2.856 5.936 ( 1.302 -0.394 -2.034) 2.446 5.998 ( 1.924 -4.740 1.790) 5.420 6.040 ( -4.015 2.478 5.652) 7.363 6.150 ( 2.088 4.526 3.078) 5.858 6.198 ( 2.721 -4.977 0.548) 5.699 6.224 ( 2.770 0.365 -2.108) 3.500 6.481 ( 3.733 0.180 1.120) 3.901 6.503 ( 6.029 2.833 -2.216) 7.020 6.585 ( 4.221 -4.182 5.655) 8.203 6.628 ( 5.761 -7.414 1.149) 9.459 6.686 ( 3.619 5.015 10.840) 12.479 6.752 ( -7.476 4.087 -0.950) 8.573 6.822 ( 0.582 -7.735 4.014) 8.734 7.077 ( 9.394 0.760 0.335) 9.431 7.135 ( 2.805 -0.356 -1.640) 3.268 7.226 ( -4.264 -5.795 6.833) 9.922 7.283 ( 2.960 -4.793 -8.070) 9.842 7.417 ( 10.496 -0.614 1.430) 10.611 7.500 ( -2.509 -1.143 1.081) 2.961 7.655 ( -2.708 -0.908 0.120) 2.859 7.846 ( 12.870 1.375 0.154) 12.945 7.964 ( 4.047 8.052 -0.793) 9.047 8.035 ( 2.932 -0.902 -1.116) 3.264 8.179 ( 0.926 -8.299 -2.040) 8.597 8.267 ( 3.360 -6.216 1.256) 7.176 8.633 ( 1.041 -14.810 -1.575) 14.930 8.722 ( 1.612 -1.578 -5.744) 6.171 8.818 ( -2.288 8.958 1.634) 9.389 8.945 ( -3.086 -2.983 0.572) 4.330 9.117 ( -1.862 -0.511 -5.583) 5.908 9.212 ( -1.887 0.416 -3.016) 3.582 9.245 ( 2.352 -2.235 5.525) 6.407 9.435 ( 1.268 6.257 1.316) 6.518 9.507 ( -1.313 5.612 0.677) 5.803 9.623 ( -1.609 5.876 1.396) 6.250 9.798 ( 1.668 -2.239 2.981) 4.085 9.889 ( -1.085 4.105 3.269) 5.359 10.065 ( 3.806 1.686 -1.523) 4.433 10.742 ( 6.571 0.760 5.802) 8.799 10.797 ( 5.657 -1.134 10.154) 11.679 11.019 ( 3.090 1.796 -0.412) 3.598 11.295 ( 7.145 -5.804 -2.399) 9.513 11.733 ( -5.240 1.897 -4.817) 7.366 11.873 ( 9.334 4.119 -12.432) 16.083 11.998 ( -7.059 -2.636 -9.182) 11.878 12.124 ( -2.729 7.165 5.303) 9.322 12.472 ( 6.116 -11.992 -8.735) 16.047 12.723 ( -3.261 -7.787 11.005) 13.870 12.963 ( -0.908 2.345 1.462) 2.909 13.137 ( 1.953 6.565 -0.526) 6.869 13.269 ( 1.047 -0.243 -0.116) 1.081 13.437 ( 0.242 -0.200 0.580) 0.659 13.590 ( 0.092 1.966 -6.377) 6.674 13.630 ( 0.955 2.837 -3.300) 4.456 13.755 ( -3.424 3.767 8.113) 9.578 14.070 ( -2.409 0.920 0.719) 2.677 14.118 ( 0.283 4.922 -0.783) 4.992 14.298 ( -1.337 -1.913 -5.601) 6.068 14.561 ( -0.947 -8.384 2.254) 8.733 14.728 ( 4.673 -7.204 1.670) 8.748 15.252 ( -1.200 0.617 0.657) 1.501 15.499 ( 1.215 -6.651 -0.112) 6.762 15.899 ( -0.098 6.292 1.946) 6.587 15.979 ( 1.657 11.207 1.386) 11.413 16.732 ( 4.228 -2.175 2.029) 5.170 16.970 ( -2.586 -2.115 3.852) 5.099 17.143 ( 0.752 -0.425 -0.957) 1.289 17.207 ( 6.289 -0.421 0.495) 6.322 18.040 ( 1.418 2.077 -1.267) 2.816 18.176 ( 2.010 -1.261 -0.634) 2.456 19.350 ( -0.430 0.585 -7.656) 7.690 19.384 ( -5.387 -0.148 -1.997) 5.747 20.654 ( 1.648 1.020 4.326) 4.741 20.747 ( 0.993 -1.336 13.150) 13.255 21.563 ( -1.336 0.093 -1.586) 2.076 21.603 ( -2.453 -0.943 -0.644) 2.706 22.064 ( -8.126 0.929 1.696) 8.353 22.292 ( -1.764 -2.468 0.229) 3.042 23.069 ( -1.084 -5.093 -1.497) 5.418 23.164 ( 0.223 -7.832 1.382) 7.957 23.619 ( -0.050 6.746 4.819) 8.290 23.734 ( -2.660 0.125 -0.394) 2.692 24.190 ( 1.857 3.125 -1.595) 3.970 24.430 ( -2.403 -5.125 -11.562) 12.873 25.706 ( 1.068 9.100 -0.197) 9.165 26.049 ( 3.780 -0.294 -1.073) 3.941 26.321 ( 0.705 0.566 2.967) 3.101 26.482 ( 2.349 -3.259 1.745) 4.380 ======================= Grid point 59 (30/78) ======================= q-point: (-0.25 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( -23.721 13.025 10.275) 28.947 2.156 ( -19.576 13.302 7.302) 24.769 2.442 ( -18.146 21.489 11.866) 30.526 2.757 ( -6.948 -2.290 1.519) 7.471 3.214 ( -9.466 0.197 1.930) 9.663 3.475 ( -26.165 3.196 8.833) 27.800 3.670 ( -6.721 2.367 -3.955) 8.150 3.731 ( -15.822 -9.263 17.046) 25.034 3.981 ( -11.383 -8.057 2.512) 14.171 4.028 ( -1.912 10.854 -11.142) 15.672 4.270 ( -1.005 0.609 1.675) 2.046 4.370 ( -4.380 -5.071 -1.425) 6.851 4.460 ( -5.987 1.427 3.989) 7.334 4.626 ( 2.598 -0.481 -3.951) 4.753 4.692 ( 0.209 9.205 2.816) 9.629 4.806 ( -10.425 2.294 -4.430) 11.557 4.874 ( -9.698 -1.415 6.629) 11.832 4.946 ( -3.396 -4.059 5.569) 7.683 5.138 ( -2.657 2.143 0.319) 3.429 5.224 ( 1.945 6.920 0.580) 7.212 5.328 ( -1.520 5.843 -2.468) 6.522 5.426 ( 2.530 4.640 -7.184) 8.919 5.532 ( 0.693 5.370 -6.848) 8.730 5.566 ( 2.868 -0.717 3.109) 4.290 5.730 ( -4.640 8.344 4.813) 10.691 5.863 ( 2.513 -1.155 -2.876) 3.990 5.915 ( -3.359 1.340 11.420) 11.978 5.957 ( -1.872 1.694 -5.286) 5.858 6.071 ( 8.089 -7.330 -6.662) 12.788 6.189 ( 0.704 2.217 2.925) 3.737 6.261 ( -2.038 0.833 0.795) 2.341 6.297 ( 4.729 -2.637 -1.491) 5.616 6.486 ( -2.087 -4.612 -7.988) 9.457 6.539 ( -1.286 -10.661 -0.695) 10.761 6.638 ( 6.459 1.050 -5.147) 8.325 6.810 ( 9.322 -12.553 -3.045) 15.929 6.848 ( 11.887 -2.775 -1.879) 12.350 6.897 ( 7.067 -7.399 -1.617) 10.359 6.931 ( 14.885 1.346 -4.188) 15.521 7.113 ( -0.376 0.456 4.275) 4.315 7.194 ( 0.678 -4.351 -1.890) 4.792 7.269 ( 7.669 5.392 7.866) 12.238 7.415 ( 6.687 -4.578 -10.595) 13.339 7.425 ( -2.039 -1.958 -2.183) 3.572 7.670 ( 4.384 3.163 -0.391) 5.420 7.715 ( 13.616 -4.765 -0.594) 14.438 7.992 ( 1.064 1.966 -1.737) 2.831 8.056 ( 7.267 1.177 3.582) 8.186 8.212 ( 9.962 -1.542 0.969) 10.127 8.252 ( 4.105 -1.741 -8.667) 9.746 8.364 ( 7.129 -0.852 2.903) 7.745 8.631 ( -0.771 -4.364 -4.745) 6.493 8.739 ( -3.656 3.603 1.879) 5.466 8.769 ( 2.956 4.970 -7.087) 9.146 8.908 ( -1.971 -2.644 -0.496) 3.334 8.974 ( -7.132 -0.174 -8.706) 11.256 9.218 ( 1.127 -1.280 -2.537) 3.057 9.304 ( 1.981 -2.520 2.769) 4.236 9.445 ( -1.894 6.986 3.728) 8.142 9.511 ( 2.790 4.837 1.301) 5.734 9.603 ( -0.263 5.020 -1.037) 5.132 9.834 ( 1.077 0.574 2.183) 2.501 9.883 ( 0.266 5.153 3.661) 6.327 10.154 ( 4.222 1.611 -2.681) 5.255 10.900 ( 4.728 -1.552 9.745) 10.942 10.963 ( 9.194 -0.794 6.880) 11.510 11.018 ( -1.948 3.441 8.930) 9.767 11.359 ( -1.927 -5.510 8.553) 10.355 11.605 ( -5.776 -1.033 -5.248) 7.872 11.824 ( -7.426 -3.426 -6.011) 10.150 12.046 ( 6.738 3.140 -11.755) 13.908 12.090 ( -0.242 8.391 5.626) 10.106 12.595 ( 3.962 -11.685 -11.785) 17.062 12.717 ( 2.992 -10.164 9.820) 14.446 12.951 ( -0.079 3.843 1.541) 4.141 13.173 ( 1.692 6.169 -0.875) 6.456 13.297 ( 1.172 -2.199 -1.541) 2.930 13.418 ( -2.271 1.034 2.628) 3.624 13.569 ( -2.343 1.777 -6.350) 6.998 13.631 ( 0.455 2.647 -3.069) 4.079 13.748 ( 1.130 3.444 4.613) 5.866 14.006 ( -3.728 1.687 3.070) 5.116 14.101 ( -2.028 3.117 1.690) 4.085 14.276 ( 0.863 -1.319 -1.389) 2.101 14.556 ( 0.148 -7.694 2.253) 8.019 14.796 ( 1.650 -9.839 3.058) 10.434 15.247 ( 0.757 1.154 -2.276) 2.662 15.507 ( -0.625 -7.667 2.045) 7.959 15.869 ( -1.658 8.044 0.569) 8.233 16.063 ( 5.538 9.207 3.451) 11.284 16.839 ( 5.005 0.050 3.469) 6.089 16.945 ( 0.050 0.555 3.167) 3.215 17.179 ( 3.267 -1.740 -3.565) 5.139 17.361 ( 7.934 2.307 0.538) 8.280 18.105 ( 4.998 1.194 -2.007) 5.517 18.220 ( 2.189 -1.229 -0.218) 2.520 19.218 ( -9.692 0.648 -2.425) 10.012 19.313 ( -2.786 -1.975 -11.458) 11.956 20.679 ( 0.070 0.452 5.459) 5.478 20.818 ( 4.603 -3.651 18.804) 19.701 21.531 ( -1.335 -0.172 -0.413) 1.408 21.557 ( -1.736 -1.177 0.880) 2.274 21.872 ( -9.418 1.136 1.128) 9.553 22.164 ( -11.507 -8.576 -4.322) 14.988 23.040 ( -1.016 -3.758 -1.628) 4.220 23.175 ( 0.601 -3.910 2.423) 4.639 23.590 ( -2.825 6.605 2.925) 7.757 23.690 ( -0.880 1.831 3.494) 4.042 24.239 ( 2.187 -1.273 -2.919) 3.863 24.354 ( -3.950 -8.519 -9.460) 13.329 25.759 ( 4.668 14.509 -3.021) 15.538 26.144 ( 4.963 -0.277 -2.013) 5.363 26.342 ( 1.066 1.212 3.662) 4.002 26.551 ( 3.957 -3.348 2.046) 5.572 ======================= Grid point 60 (31/78) ======================= q-point: (-0.12 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -22.622 26.350 20.132) 40.142 1.637 ( -26.086 32.378 12.557) 43.434 2.250 ( -4.018 13.933 14.818) 20.733 2.482 ( -32.755 16.666 27.056) 45.636 2.775 ( -12.480 11.583 11.537) 20.567 3.018 ( -8.997 -1.364 -1.736) 9.264 3.522 ( -4.686 -8.800 4.439) 10.914 3.680 ( -3.996 -24.331 -1.192) 24.686 3.858 ( -1.763 -3.207 -6.200) 7.200 4.014 ( 0.909 2.204 -3.549) 4.275 4.185 ( -5.605 4.088 6.232) 9.325 4.214 ( -12.874 -1.603 -13.225) 18.526 4.310 ( -0.364 1.034 0.452) 1.186 4.533 ( -5.431 6.568 -4.274) 9.534 4.644 ( -5.293 1.141 13.799) 14.823 4.759 ( 2.313 4.547 1.292) 5.263 4.838 ( 4.060 -2.458 -1.762) 5.062 4.937 ( 0.315 -1.807 8.055) 8.261 5.084 ( -3.219 0.745 -3.277) 4.654 5.276 ( 3.872 5.108 -0.708) 6.448 5.312 ( -0.452 10.136 0.356) 10.152 5.438 ( -1.719 5.617 -2.282) 6.301 5.506 ( -4.373 7.595 2.972) 9.254 5.588 ( 1.929 2.090 -2.602) 3.855 5.625 ( -4.037 2.736 10.544) 11.617 5.849 ( -2.833 2.005 5.066) 6.141 5.921 ( 0.192 0.212 -3.654) 3.665 5.946 ( 3.609 5.721 -11.483) 13.327 6.142 ( -2.266 -1.013 -1.946) 3.154 6.226 ( -3.457 -3.615 1.907) 5.353 6.255 ( 7.565 -7.066 -0.937) 10.394 6.389 ( 3.494 -3.891 -1.861) 5.551 6.495 ( -3.195 -9.687 -1.154) 10.265 6.544 ( 5.239 -11.378 -7.639) 14.672 6.685 ( -1.540 -2.035 1.107) 2.782 6.867 ( -0.897 -9.866 -5.451) 11.307 6.963 ( 3.383 -15.140 -2.115) 15.656 7.097 ( 4.685 0.744 -4.237) 6.360 7.193 ( 4.842 -6.461 -2.898) 8.578 7.207 ( 5.232 1.523 8.890) 10.427 7.289 ( 14.383 -2.914 -4.016) 15.215 7.385 ( -1.293 -10.527 -6.408) 12.392 7.468 ( 9.547 3.976 -5.012) 11.493 7.580 ( 12.276 3.727 -0.657) 12.846 7.813 ( 9.389 4.442 -9.378) 13.994 7.922 ( 5.314 -3.957 -7.738) 10.187 8.086 ( 5.982 5.089 -0.995) 7.916 8.119 ( -3.474 -3.261 1.241) 4.924 8.286 ( 3.992 0.258 2.261) 4.595 8.353 ( -0.590 3.263 -8.816) 9.419 8.555 ( 9.497 3.867 -1.709) 10.395 8.605 ( 2.611 6.053 -3.837) 7.627 8.747 ( 3.903 1.318 -1.607) 4.422 8.785 ( -2.002 9.865 -5.945) 11.691 8.880 ( 3.609 1.611 -2.819) 4.855 8.960 ( 6.757 2.266 -10.839) 12.972 9.234 ( 0.717 -0.726 -0.579) 1.174 9.306 ( -1.899 1.250 1.247) 2.593 9.425 ( 0.200 5.454 4.534) 7.096 9.560 ( 1.104 2.843 -0.315) 3.066 9.622 ( 2.441 2.437 -1.236) 3.664 9.826 ( -2.130 2.192 -0.031) 3.056 9.895 ( 0.413 6.247 3.144) 7.006 10.229 ( 3.452 1.209 -2.828) 4.623 10.760 ( -15.066 0.803 24.558) 28.823 11.064 ( -2.784 -3.751 13.909) 14.672 11.106 ( -2.175 -2.334 2.955) 4.349 11.256 ( -1.059 2.001 2.886) 3.668 11.541 ( 1.274 -4.662 -4.158) 6.375 11.704 ( -3.557 -5.939 -2.937) 7.519 12.090 ( 0.157 6.200 -6.368) 8.889 12.152 ( 3.341 0.675 3.467) 4.862 12.604 ( -0.354 -7.991 -3.366) 8.678 12.831 ( 4.955 -6.990 -0.314) 8.574 12.999 ( 4.986 -1.727 4.155) 6.717 13.207 ( 0.947 1.625 0.633) 1.984 13.276 ( -2.967 1.214 -2.002) 3.780 13.379 ( -1.114 0.414 1.290) 1.754 13.491 ( -3.856 5.893 -3.957) 8.078 13.659 ( 1.843 2.659 -3.465) 4.741 13.757 ( -0.087 -1.833 -2.123) 2.806 13.944 ( -2.054 3.321 2.213) 4.488 14.010 ( -6.135 4.146 8.811) 11.509 14.378 ( 7.425 -4.259 4.257) 9.560 14.554 ( -1.538 -12.310 7.392) 14.441 14.817 ( 0.641 -11.410 -0.343) 11.433 15.273 ( 1.809 0.723 -3.301) 3.833 15.477 ( -2.282 -6.713 3.745) 8.018 15.859 ( 0.777 11.541 0.401) 11.574 16.189 ( 5.628 5.950 3.044) 8.737 16.919 ( 2.113 0.654 2.291) 3.184 16.973 ( 2.328 2.502 2.617) 4.304 17.265 ( 4.216 -0.072 -5.790) 7.163 17.529 ( 7.264 4.650 -1.979) 8.849 18.227 ( 5.458 -0.557 -0.835) 5.550 18.272 ( 3.574 -0.115 0.150) 3.579 18.991 ( -11.104 1.810 -4.731) 12.205 19.210 ( -6.918 -5.192 -14.742) 17.092 20.656 ( -2.596 0.019 6.292) 6.806 20.931 ( 1.627 -12.561 20.032) 23.700 21.501 ( -1.333 -0.557 -2.203) 2.635 21.569 ( 1.955 -6.734 11.273) 13.276 21.718 ( -4.712 0.357 2.076) 5.162 21.797 ( -19.004 -6.517 -5.081) 20.723 23.032 ( 0.148 -0.707 -1.791) 1.931 23.192 ( 0.768 -1.717 3.180) 3.695 23.543 ( -1.220 2.994 -0.600) 3.288 23.706 ( 2.247 4.591 6.585) 8.336 24.165 ( -9.295 -11.610 -9.933) 17.885 24.328 ( 1.647 -3.187 1.748) 3.990 25.910 ( 10.039 18.993 -10.744) 24.020 26.234 ( 3.372 -0.242 -2.882) 4.442 26.365 ( 0.605 2.649 2.773) 3.883 26.639 ( 3.511 -4.261 1.243) 5.659 ======================= Grid point 61 (32/78) ======================= q-point: ( 0.00 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( -13.117 24.175 25.566) 37.551 1.917 ( 0.010 37.212 15.013) 40.126 2.156 ( -6.886 -11.912 18.383) 22.962 2.601 ( -2.886 -22.705 6.691) 23.846 2.709 ( 2.341 9.421 -1.592) 9.837 2.987 ( -1.226 -10.569 8.638) 13.705 3.398 ( 0.285 9.492 2.684) 9.869 3.411 ( 2.616 19.558 5.919) 20.601 3.616 ( -4.376 7.898 12.155) 15.142 3.997 ( -5.597 3.557 -13.835) 15.342 4.067 ( -1.940 -0.933 -9.138) 9.388 4.338 ( -0.704 4.815 0.147) 4.869 4.346 ( 2.812 -10.929 6.252) 12.901 4.421 ( 1.911 -8.099 1.082) 8.391 4.599 ( -1.261 2.813 -4.881) 5.773 4.749 ( 1.717 -8.426 -6.563) 10.818 4.843 ( -3.144 2.461 -0.179) 3.996 4.903 ( -0.972 -1.980 0.094) 2.208 5.193 ( 2.273 10.922 3.801) 11.785 5.338 ( -0.615 -2.893 2.538) 3.898 5.477 ( -2.925 4.945 -3.655) 6.809 5.523 ( -1.092 2.279 4.855) 5.474 5.561 ( 1.388 -2.042 -5.409) 5.945 5.583 ( 0.425 3.229 -1.328) 3.517 5.721 ( -0.195 6.172 0.668) 6.211 5.806 ( -1.480 -0.026 3.882) 4.154 5.829 ( 1.627 -7.643 -2.918) 8.341 5.925 ( 3.688 -17.193 1.079) 17.617 6.068 ( -7.334 5.825 2.664) 9.737 6.166 ( -0.615 -1.445 2.413) 2.879 6.250 ( 1.193 8.347 -4.807) 9.706 6.312 ( 3.426 -3.528 2.889) 5.704 6.351 ( 2.450 4.594 -6.961) 8.692 6.515 ( -4.494 -6.091 -4.522) 8.817 6.548 ( -5.319 2.527 -2.439) 6.374 6.704 ( -2.749 -11.850 -1.771) 12.293 6.899 ( 5.583 -2.802 0.369) 6.257 6.936 ( 1.601 -10.801 -1.331) 11.000 7.123 ( 4.324 -1.888 -4.626) 6.607 7.147 ( 3.494 -5.646 -1.987) 6.930 7.419 ( -1.246 7.314 11.082) 13.337 7.521 ( 1.334 -2.203 5.172) 5.778 7.654 ( 4.780 5.339 -15.916) 17.455 7.801 ( 1.369 -6.809 -7.740) 10.399 7.960 ( 0.318 7.130 -5.814) 9.205 8.014 ( 2.768 4.913 -1.349) 5.798 8.101 ( 0.615 -2.315 -6.736) 7.149 8.117 ( 5.807 -5.667 -2.245) 8.419 8.328 ( -4.952 5.628 2.890) 8.034 8.418 ( 1.544 -1.468 3.460) 4.064 8.623 ( 2.549 1.591 -8.625) 9.133 8.714 ( 3.973 -3.960 -6.641) 8.693 8.865 ( 2.874 1.551 -7.454) 8.138 8.902 ( 3.343 -3.492 -7.106) 8.595 9.090 ( 2.018 6.932 -14.652) 16.334 9.154 ( 2.956 0.134 -16.883) 17.141 9.331 ( 3.661 2.771 3.043) 5.508 9.371 ( 5.688 -0.749 1.320) 5.887 9.605 ( 0.792 1.485 1.710) 2.399 9.618 ( 3.515 0.663 -0.504) 3.612 9.742 ( 1.898 6.599 2.359) 7.260 9.827 ( 1.394 -0.198 -0.804) 1.621 10.094 ( 1.209 10.779 2.450) 11.120 10.280 ( 2.802 -4.856 1.749) 5.873 10.438 ( -19.353 1.643 29.359) 35.202 10.537 ( -21.149 -6.717 23.598) 32.393 11.187 ( 0.251 4.190 -0.914) 4.296 11.262 ( -1.833 -1.730 -1.454) 2.910 11.522 ( 5.604 -3.009 -0.431) 6.375 11.561 ( 0.759 -4.855 -3.478) 6.021 12.101 ( -4.319 1.740 -3.681) 5.935 12.133 ( -3.793 -1.606 -2.427) 4.781 12.580 ( 5.382 2.913 5.022) 7.917 12.742 ( 6.451 -11.601 6.673) 14.857 13.083 ( 0.032 1.234 -2.665) 2.937 13.105 ( -2.411 -1.038 -2.313) 3.499 13.351 ( -0.530 1.675 -0.877) 1.964 13.366 ( 0.795 0.891 -0.543) 1.312 13.587 ( -0.629 5.064 -0.742) 5.156 13.663 ( -1.285 -2.044 1.487) 2.835 13.776 ( 1.017 3.846 -5.199) 6.547 13.890 ( -0.200 -6.775 0.019) 6.778 14.052 ( -2.875 8.650 7.049) 11.523 14.220 ( -4.730 -5.367 12.246) 14.183 14.452 ( -0.062 1.782 0.096) 1.785 14.577 ( -1.178 -9.644 -0.197) 9.718 15.351 ( 1.814 1.595 -1.799) 3.012 15.383 ( 0.089 -1.647 0.734) 1.805 16.127 ( 1.210 9.379 2.115) 9.690 16.256 ( 0.299 -3.252 1.079) 3.440 16.966 ( -0.290 1.921 -0.114) 1.946 17.009 ( 0.073 -2.130 0.470) 2.182 17.412 ( -1.078 6.948 -3.669) 7.931 17.537 ( -4.799 -4.256 -1.618) 6.615 18.300 ( 0.103 0.707 -0.969) 1.204 18.314 ( -0.857 -0.759 0.052) 1.146 18.896 ( -2.556 4.553 -8.481) 9.959 18.980 ( -1.305 -3.321 -9.933) 10.554 20.592 ( -3.539 0.154 9.484) 10.124 20.621 ( -2.975 -2.591 11.015) 11.701 21.440 ( -0.383 1.278 -0.226) 1.353 21.472 ( 1.124 -1.711 -0.753) 2.181 21.719 ( 3.073 0.771 6.514) 7.243 21.752 ( 6.162 -2.936 9.421) 11.634 23.069 ( 0.126 2.930 -0.667) 3.008 23.145 ( 0.291 -4.222 2.767) 5.056 23.555 ( -1.037 1.794 -3.271) 3.873 23.610 ( -4.153 -3.836 -2.538) 6.197 24.134 ( 2.621 7.169 -0.102) 7.634 24.268 ( 1.164 -5.694 1.745) 6.068 26.247 ( 2.416 3.025 -8.659) 9.485 26.279 ( 2.670 -0.582 -4.463) 5.233 26.447 ( -2.362 4.561 -0.894) 5.214 26.532 ( -4.246 -3.902 -0.381) 5.779 ======================= Grid point 62 (33/78) ======================= q-point: ( 0.12 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( 6.191 23.277 15.073) 28.414 2.019 ( 4.793 9.998 8.316) 13.860 2.193 ( 12.674 7.011 16.083) 21.643 2.613 ( 2.415 -6.188 -1.347) 6.778 2.865 ( 12.329 -7.533 5.139) 15.335 3.049 ( 7.361 -12.836 6.750) 16.264 3.386 ( 0.013 3.985 4.866) 6.290 3.484 ( 0.030 -2.511 1.718) 3.043 3.725 ( 12.951 37.476 15.614) 42.614 3.967 ( 6.363 6.458 -17.002) 19.268 4.107 ( 7.252 -2.371 -11.536) 13.831 4.340 ( 1.118 -0.488 2.523) 2.802 4.406 ( 2.912 2.112 5.252) 6.366 4.517 ( 5.105 2.369 -9.779) 11.283 4.590 ( -0.057 -5.281 -1.516) 5.494 4.720 ( -4.078 -6.374 -0.414) 7.578 4.819 ( 2.252 2.804 -4.933) 6.105 4.973 ( 6.605 -7.474 1.546) 10.094 5.232 ( 0.013 6.633 -2.366) 7.042 5.309 ( -1.553 -1.506 4.687) 5.162 5.382 ( -3.151 7.209 -0.717) 7.900 5.500 ( -4.923 5.022 2.509) 7.466 5.564 ( 2.187 -2.590 -1.272) 3.620 5.586 ( -0.655 -2.761 -3.642) 4.617 5.731 ( -0.325 3.985 0.409) 4.019 5.754 ( -2.385 2.159 -3.515) 4.765 5.886 ( 3.467 1.567 0.123) 3.806 5.949 ( -1.373 2.700 4.260) 5.227 6.028 ( 3.467 -13.641 2.312) 14.264 6.135 ( -2.631 -9.150 0.050) 9.521 6.221 ( -2.172 7.967 -8.625) 11.941 6.346 ( -2.368 -1.962 -0.844) 3.189 6.395 ( 2.375 3.015 0.463) 3.866 6.414 ( -3.803 -5.985 -4.920) 8.630 6.527 ( 3.690 2.956 4.598) 6.595 6.630 ( -3.709 -11.385 -1.970) 12.135 6.997 ( 3.275 -6.986 -1.247) 7.816 7.023 ( 5.868 -6.897 1.833) 9.239 7.114 ( -5.111 -2.164 -2.389) 6.043 7.151 ( -3.593 -2.795 -3.320) 5.635 7.379 ( -2.516 6.815 11.097) 13.263 7.507 ( -2.256 -4.638 3.514) 6.241 7.683 ( -2.089 4.840 -9.502) 10.866 7.754 ( -3.193 1.177 -2.297) 4.106 7.900 ( -4.724 7.751 -2.099) 9.317 8.036 ( -3.408 -1.445 2.834) 4.662 8.063 ( -8.730 -2.307 -2.981) 9.509 8.099 ( -1.331 -4.075 -5.280) 6.801 8.234 ( -4.101 7.079 1.964) 8.413 8.420 ( -3.095 -7.655 1.867) 8.465 8.646 ( -0.576 2.562 -7.971) 8.393 8.741 ( -2.620 -5.255 -5.358) 7.949 8.856 ( 0.582 4.909 -0.468) 4.965 8.936 ( 1.319 -3.437 -1.820) 4.106 9.092 ( -1.780 4.642 -9.682) 10.884 9.129 ( -2.742 0.826 -10.207) 10.601 9.384 ( -0.577 3.421 0.931) 3.592 9.430 ( -2.069 -0.617 1.002) 2.380 9.610 ( 1.262 2.848 1.351) 3.395 9.686 ( 1.153 -4.743 0.805) 4.947 9.771 ( -0.337 8.415 1.759) 8.603 9.884 ( 1.829 -1.488 0.382) 2.388 10.084 ( -1.665 8.404 4.173) 9.530 10.141 ( -5.939 3.158 17.226) 18.493 10.201 ( -4.896 -1.686 11.255) 12.389 10.349 ( -1.681 -9.126 -1.798) 9.453 11.111 ( -7.584 3.459 -1.470) 8.465 11.148 ( -8.257 -0.166 -1.757) 8.444 11.631 ( 5.729 0.011 -4.181) 7.092 11.718 ( 9.067 -8.923 -0.677) 12.740 12.026 ( -1.217 0.965 -1.075) 1.889 12.060 ( -2.332 -2.626 -2.197) 4.143 12.694 ( 4.503 4.640 6.643) 9.271 12.834 ( 1.395 -7.339 3.865) 8.411 13.038 ( -4.130 1.781 -1.220) 4.661 13.083 ( 0.278 -2.357 -0.042) 2.374 13.338 ( -0.204 3.283 -1.654) 3.682 13.396 ( 0.893 -2.563 0.258) 2.727 13.588 ( 1.695 2.913 -0.068) 3.371 13.638 ( 0.094 -1.565 1.046) 1.885 13.811 ( 2.303 4.997 -6.632) 8.617 13.927 ( 3.654 -7.125 -3.033) 8.562 14.025 ( -0.005 8.174 4.786) 9.472 14.151 ( -1.502 0.753 8.362) 8.529 14.433 ( -1.837 -0.347 0.190) 1.879 14.538 ( -2.449 -9.957 -1.518) 10.366 15.375 ( 0.335 0.341 -0.549) 0.728 15.381 ( -0.407 -0.438 1.385) 1.509 16.129 ( -1.026 8.429 3.292) 9.107 16.215 ( -3.867 0.726 0.913) 4.039 16.902 ( -6.083 2.173 0.332) 6.468 16.955 ( -4.657 -2.751 1.103) 5.520 17.343 ( -3.580 4.062 -5.441) 7.676 17.392 ( -6.507 -0.793 0.190) 6.558 18.223 ( -5.115 1.818 -1.257) 5.572 18.256 ( -4.094 -1.382 -0.465) 4.346 18.938 ( 6.559 5.729 -8.636) 12.265 19.063 ( 7.896 -6.272 -9.251) 13.684 20.584 ( 1.962 3.342 8.793) 9.609 20.655 ( 3.517 -3.277 9.053) 10.250 21.480 ( 3.547 2.571 0.160) 4.384 21.539 ( 4.675 -2.993 1.095) 5.658 21.823 ( 5.908 2.675 5.287) 8.367 21.921 ( 8.136 -7.909 6.635) 13.144 23.059 ( -1.019 2.766 -0.630) 3.014 23.137 ( -1.498 -4.658 3.093) 5.789 23.538 ( -0.666 2.176 -4.542) 5.080 23.564 ( 1.280 -0.852 -2.439) 2.883 24.222 ( 4.907 3.095 -0.416) 5.816 24.299 ( 1.746 -3.889 1.682) 4.583 26.199 ( -7.150 7.405 -9.789) 14.205 26.278 ( -4.155 -0.852 -4.822) 6.423 26.372 ( -2.390 2.216 2.679) 4.219 26.429 ( -3.125 -3.127 0.937) 4.519 ======================= Grid point 63 (34/78) ======================= q-point: ( 0.25 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( 14.467 12.553 2.236) 19.284 2.149 ( 7.836 -2.776 3.082) 8.866 2.623 ( 24.626 10.702 7.831) 27.969 2.715 ( 8.977 5.742 -4.194) 11.452 3.157 ( 12.744 -8.504 2.419) 15.511 3.269 ( 10.326 -11.512 5.645) 16.463 3.468 ( 8.713 -1.116 2.418) 9.111 3.507 ( 4.822 -5.476 -1.695) 7.491 3.950 ( 8.814 21.274 -2.862) 23.205 4.241 ( 9.207 1.588 -3.416) 9.947 4.300 ( 8.937 2.291 -5.022) 10.504 4.420 ( 7.342 -1.955 -1.067) 7.672 4.464 ( 5.242 6.006 0.642) 7.998 4.580 ( 3.066 6.191 -5.364) 8.746 4.615 ( 3.756 2.389 0.334) 4.464 4.726 ( 7.156 6.094 -1.037) 9.457 4.820 ( -3.033 7.390 1.483) 8.125 5.088 ( 1.897 0.600 -2.388) 3.108 5.212 ( -3.593 -5.303 3.466) 7.283 5.246 ( 0.765 -0.973 -9.011) 9.096 5.410 ( 2.532 1.456 0.427) 2.952 5.443 ( -0.360 -0.079 0.020) 0.369 5.547 ( -0.018 -0.553 -1.768) 1.852 5.587 ( -1.047 -2.500 -6.353) 6.907 5.690 ( 1.332 9.226 -1.354) 9.420 5.786 ( 2.284 4.844 -1.752) 5.635 5.924 ( -0.167 1.086 -2.033) 2.311 5.950 ( 0.160 3.405 2.931) 4.496 6.028 ( -5.173 -8.039 -3.159) 10.068 6.103 ( 1.742 -15.212 -0.474) 15.318 6.208 ( 1.095 3.293 -2.073) 4.042 6.274 ( -3.902 -3.382 -0.100) 5.164 6.375 ( -0.519 -5.376 2.831) 6.098 6.416 ( 0.818 -6.645 2.669) 7.208 6.597 ( 1.317 1.656 2.455) 3.241 6.633 ( 4.954 0.685 4.525) 6.744 6.896 ( -12.532 -0.285 -5.396) 13.647 6.952 ( -11.405 -4.024 -1.411) 12.176 7.096 ( 1.989 -5.817 3.066) 6.870 7.133 ( 3.119 -8.027 2.237) 8.898 7.352 ( -0.713 6.029 6.247) 8.711 7.440 ( -6.935 2.417 -1.738) 7.547 7.533 ( -8.337 6.115 1.795) 10.494 7.676 ( -11.289 6.448 7.516) 15.017 7.757 ( -1.400 -2.928 -2.740) 4.248 7.819 ( -10.272 -8.895 5.462) 14.645 7.988 ( -3.604 -1.368 0.371) 3.873 8.042 ( -5.444 -2.946 -4.114) 7.432 8.120 ( -6.055 7.276 2.625) 9.823 8.271 ( -9.171 -6.116 3.668) 11.617 8.572 ( -6.285 -0.105 -3.708) 7.298 8.615 ( -8.728 -2.509 1.518) 9.207 8.877 ( -0.681 5.405 -0.302) 5.456 8.981 ( -1.207 -3.828 -2.352) 4.652 9.024 ( -1.652 4.669 -4.384) 6.614 9.092 ( 0.864 -1.763 -3.732) 4.217 9.255 ( -8.308 3.281 12.102) 15.041 9.322 ( -5.167 -2.797 8.056) 9.971 9.599 ( -2.286 4.592 5.506) 7.526 9.659 ( -2.291 -1.035 5.273) 5.842 9.757 ( -1.598 3.694 1.672) 4.359 9.835 ( -4.638 -3.231 2.455) 6.162 10.078 ( -2.539 10.172 1.177) 10.550 10.228 ( 0.144 -1.009 -0.679) 1.225 10.294 ( 11.886 -0.721 -8.429) 14.589 10.340 ( 12.067 -6.784 -18.705) 23.271 10.934 ( -7.909 2.011 1.050) 8.228 10.955 ( -8.856 0.063 0.801) 8.892 11.703 ( 0.394 2.296 -4.563) 5.123 11.788 ( 0.504 -5.722 -3.097) 6.526 12.043 ( 0.181 0.744 -1.790) 1.947 12.075 ( 3.400 -2.017 -3.371) 5.196 12.766 ( 1.176 1.844 3.298) 3.957 12.807 ( -3.355 -0.209 4.078) 5.284 12.968 ( -1.186 3.120 1.378) 3.611 13.082 ( -1.108 -5.287 8.337) 9.934 13.331 ( -0.299 2.205 -1.074) 2.470 13.382 ( -1.642 -2.828 1.006) 3.421 13.644 ( 2.897 3.658 -2.639) 5.361 13.716 ( 6.029 -2.916 -6.056) 9.029 13.846 ( 1.295 7.960 -7.100) 10.745 14.006 ( 3.280 -4.078 -1.083) 5.344 14.071 ( 4.525 3.539 -0.778) 5.797 14.162 ( 1.369 2.134 5.323) 5.896 14.396 ( -1.104 -2.874 -0.614) 3.140 14.476 ( -3.031 -9.471 -1.729) 10.093 15.360 ( -1.264 0.333 1.441) 1.945 15.374 ( -0.470 -1.083 0.320) 1.223 16.101 ( -1.922 7.463 3.364) 8.408 16.137 ( -2.636 4.766 0.567) 5.476 16.762 ( -6.212 1.552 1.427) 6.560 16.853 ( -4.421 -6.247 1.895) 7.884 17.274 ( -2.974 1.276 -2.187) 3.906 17.287 ( -4.010 -0.318 0.552) 4.060 18.138 ( -2.765 1.689 -1.251) 3.473 18.170 ( -3.570 -1.208 -0.524) 3.806 19.110 ( 9.374 5.407 -7.723) 13.295 19.230 ( 7.978 -6.143 -6.999) 12.263 20.635 ( 1.527 4.327 7.791) 9.041 20.721 ( 1.404 -3.788 8.985) 9.851 21.557 ( 3.115 3.175 1.195) 4.606 21.627 ( 2.731 -3.279 2.978) 5.204 21.967 ( 7.580 3.486 1.341) 8.450 22.083 ( 7.147 -8.348 0.544) 11.003 23.029 ( -1.608 1.455 -0.674) 2.271 23.090 ( -2.824 -4.332 2.048) 5.562 23.564 ( 3.031 4.050 -2.520) 5.652 23.618 ( 3.643 -1.623 -1.681) 4.327 24.297 ( 1.940 2.359 -0.836) 3.166 24.354 ( 3.362 -3.202 -1.519) 4.885 26.007 ( -8.298 10.483 -4.717) 14.178 26.144 ( -6.966 -3.016 -2.712) 8.060 26.341 ( -1.147 2.038 2.446) 3.384 26.404 ( -0.628 -4.257 0.781) 4.374 ======================= Grid point 64 (35/78) ======================= q-point: ( 0.38 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( 8.884 4.325 1.821) 10.047 2.317 ( 6.932 -4.706 1.771) 8.563 2.971 ( 13.566 14.046 -7.503) 20.919 3.169 ( 24.875 1.676 -0.933) 24.949 3.341 ( 5.503 -3.151 -3.518) 7.251 3.420 ( 7.762 -5.362 0.330) 9.440 3.701 ( 14.789 0.145 -4.445) 15.443 3.770 ( 12.872 -6.206 0.241) 14.293 4.033 ( -1.368 11.646 2.090) 11.911 4.260 ( -3.025 -7.491 1.487) 8.215 4.378 ( -3.052 2.728 1.793) 4.469 4.398 ( -0.703 0.007 0.112) 0.712 4.614 ( -2.782 9.283 -1.982) 9.891 4.707 ( 2.837 -0.912 -3.665) 4.724 4.792 ( 11.110 5.658 -3.083) 12.843 4.817 ( 11.212 5.054 -0.840) 12.327 4.959 ( 3.985 12.840 -1.124) 13.491 5.085 ( 9.710 6.655 1.111) 11.824 5.215 ( -2.916 -6.517 -7.945) 10.682 5.270 ( 6.992 -7.761 -5.214) 11.675 5.398 ( -2.979 0.356 -6.330) 7.005 5.445 ( -0.754 -1.196 -5.607) 5.783 5.568 ( 2.290 1.827 -9.473) 9.916 5.612 ( 3.434 -0.762 -2.262) 4.182 5.721 ( -0.893 8.256 -0.929) 8.356 5.835 ( 4.018 7.826 -3.553) 9.488 5.922 ( -1.511 -4.483 -1.924) 5.107 5.942 ( 0.108 -5.361 -1.415) 5.546 5.998 ( 5.387 3.224 5.287) 8.208 6.145 ( -0.431 -7.907 -0.093) 7.919 6.168 ( -2.858 -2.848 3.152) 5.120 6.222 ( -1.712 -3.493 2.701) 4.735 6.333 ( -3.048 -0.102 -4.187) 5.180 6.424 ( -3.771 -4.584 -4.261) 7.307 6.633 ( -7.790 -0.242 0.360) 7.802 6.655 ( 1.788 6.796 7.500) 10.278 6.742 ( -4.994 -7.017 4.783) 9.852 6.776 ( 7.705 -0.794 10.586) 13.117 7.083 ( -8.885 0.706 9.091) 12.731 7.130 ( -3.287 -5.766 3.466) 7.488 7.199 ( -9.108 1.045 3.284) 9.739 7.312 ( -9.939 2.305 1.475) 10.309 7.415 ( -4.207 3.325 6.684) 8.570 7.476 ( -1.295 -2.140 4.258) 4.938 7.652 ( -5.716 2.659 4.763) 7.901 7.771 ( -2.590 -0.964 2.552) 3.762 7.826 ( -8.707 -3.603 4.591) 10.482 7.852 ( -8.600 -5.667 0.436) 10.308 8.068 ( -0.531 4.166 -0.603) 4.243 8.147 ( -2.071 -3.593 2.473) 4.829 8.377 ( -11.436 -2.995 3.624) 12.365 8.388 ( -12.378 -3.310 2.205) 13.002 8.790 ( -5.962 3.575 -5.327) 8.758 8.887 ( -5.908 -4.468 -3.904) 8.373 9.022 ( 1.618 3.032 1.973) 3.962 9.077 ( -0.642 -2.338 2.284) 3.331 9.220 ( 1.463 6.113 5.410) 8.293 9.314 ( 2.584 -2.966 3.464) 5.241 9.551 ( -2.501 4.216 0.792) 4.966 9.620 ( -2.018 -0.580 2.357) 3.156 9.720 ( -1.573 0.441 3.239) 3.628 9.748 ( -2.902 -0.652 1.616) 3.385 10.021 ( -2.421 6.811 1.277) 7.340 10.126 ( -5.203 -2.898 0.984) 6.037 10.586 ( 10.827 -0.239 -12.456) 16.505 10.603 ( 9.040 -2.164 -10.411) 13.957 10.825 ( -0.628 2.316 0.272) 2.415 10.859 ( 2.256 -0.962 -3.419) 4.208 11.701 ( 1.700 4.311 -5.557) 7.236 11.821 ( 3.754 -6.510 -8.528) 11.367 12.019 ( -2.318 3.659 -3.829) 5.781 12.101 ( -0.751 -3.754 -7.095) 8.062 12.679 ( -6.799 6.125 6.615) 11.292 12.784 ( -2.570 -2.536 8.802) 9.514 12.971 ( 0.644 0.534 -0.965) 1.277 13.061 ( -0.837 -5.276 8.471) 10.015 13.329 ( 0.252 2.207 -0.284) 2.239 13.368 ( 0.632 -1.674 0.576) 1.880 13.680 ( 0.341 5.404 -3.284) 6.333 13.786 ( -0.113 -4.468 -4.760) 6.529 13.862 ( 1.345 11.489 -4.812) 12.528 14.065 ( 2.197 -3.230 0.545) 3.944 14.161 ( 3.144 2.970 -2.880) 5.196 14.228 ( 5.072 1.650 -1.873) 5.652 14.389 ( 0.003 -6.700 -0.802) 6.748 14.430 ( -0.707 -7.744 -0.219) 7.780 15.333 ( -1.333 1.106 1.577) 2.342 15.370 ( 0.219 -2.499 0.310) 2.528 16.060 ( -1.674 7.944 1.327) 8.226 16.115 ( -0.141 3.960 1.256) 4.157 16.666 ( -2.824 1.815 1.666) 3.748 16.801 ( -0.499 -9.390 2.383) 9.700 17.205 ( -3.605 0.936 0.301) 3.737 17.216 ( -2.875 -0.214 1.596) 3.295 18.099 ( -1.294 1.260 -0.115) 1.810 18.119 ( -1.059 -0.690 -0.970) 1.593 19.281 ( 6.878 4.090 -6.228) 10.141 19.365 ( 5.052 -3.943 -4.585) 7.880 20.656 ( 0.173 3.764 6.848) 7.816 20.728 ( -0.925 -3.167 8.438) 9.060 21.597 ( 0.718 2.371 0.404) 2.510 21.650 ( -0.393 -2.476 1.536) 2.940 22.120 ( 6.177 3.197 0.715) 6.992 22.212 ( 4.734 -5.409 -0.256) 7.193 23.000 ( -0.860 -0.878 -0.766) 1.448 23.035 ( -2.371 -4.340 0.744) 5.001 23.636 ( 3.435 4.024 -0.411) 5.306 23.694 ( 3.266 -1.927 -0.608) 3.840 24.316 ( 0.080 4.808 -2.107) 5.249 24.405 ( 1.313 -3.945 -4.911) 6.434 25.881 ( -3.519 9.097 -1.114) 9.818 26.020 ( -4.309 -4.049 -1.006) 5.998 26.326 ( -0.474 2.075 1.738) 2.748 26.388 ( -0.878 -4.115 1.254) 4.391 ======================= Grid point 65 (36/78) ======================= q-point: (-0.50 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.337 ( 2.452 2.948 4.572) 5.967 2.416 ( 2.138 -4.798 3.832) 6.503 3.126 ( 1.278 10.764 -5.986) 12.382 3.315 ( -2.262 -7.455 -6.111) 9.901 3.628 ( 8.020 11.263 1.516) 13.909 3.729 ( 18.563 0.406 -8.995) 20.632 3.809 ( -4.796 1.846 4.454) 6.800 3.869 ( -2.965 -1.679 1.616) 3.771 4.090 ( 3.711 0.711 -1.175) 3.957 4.180 ( -3.583 -5.533 3.577) 7.499 4.262 ( -0.524 11.969 2.143) 12.171 4.411 ( 0.653 -1.813 0.134) 1.931 4.586 ( 3.079 0.708 -3.870) 4.996 4.690 ( -2.624 -7.092 -0.199) 7.565 4.922 ( 0.967 12.562 -3.537) 13.087 4.976 ( 4.572 6.930 -4.653) 9.517 5.069 ( 5.545 -1.955 -2.705) 6.472 5.140 ( -4.249 -4.235 -11.308) 12.801 5.274 ( 0.658 2.446 -6.417) 6.898 5.340 ( -1.046 -1.278 1.681) 2.357 5.397 ( 1.715 -0.505 -5.423) 5.711 5.461 ( 8.344 -0.985 -6.794) 10.805 5.632 ( 1.080 2.424 -4.837) 5.517 5.661 ( 3.010 0.567 -9.426) 9.911 5.737 ( -1.607 2.962 2.940) 4.472 5.834 ( -3.622 -3.732 -2.636) 5.831 5.868 ( -1.892 4.233 -2.055) 5.071 5.957 ( -1.547 -2.568 0.294) 3.012 6.004 ( -0.885 0.823 -0.167) 1.220 6.091 ( -1.773 -3.803 2.868) 5.082 6.220 ( -3.310 2.368 -6.989) 8.088 6.225 ( 5.186 -0.653 2.492) 5.791 6.282 ( 5.783 -4.123 2.517) 7.535 6.380 ( 0.825 -4.943 -7.466) 8.992 6.552 ( -0.996 -0.172 6.645) 6.722 6.612 ( -8.286 -5.449 9.252) 13.563 6.771 ( 1.776 10.893 8.634) 14.013 6.853 ( -5.020 3.476 10.572) 12.209 6.893 ( -6.684 2.596 10.718) 12.896 6.992 ( -3.465 3.533 7.387) 8.892 7.057 ( -2.115 -14.643 11.328) 18.634 7.133 ( -1.278 -4.903 6.823) 8.499 7.398 ( -3.140 6.122 0.118) 6.881 7.444 ( -5.545 3.259 2.400) 6.865 7.583 ( -1.816 6.593 -0.359) 6.848 7.666 ( 2.205 2.678 2.268) 4.145 7.697 ( -1.456 -2.928 0.321) 3.286 7.879 ( 4.251 -11.931 -2.056) 12.831 8.014 ( -3.880 4.455 0.509) 5.930 8.110 ( -12.582 -5.368 3.994) 14.250 8.158 ( 2.530 0.263 2.204) 3.365 8.267 ( 2.228 -11.156 -0.267) 11.380 8.699 ( -1.545 2.360 -6.024) 6.652 8.794 ( -1.888 -5.784 -3.718) 7.130 9.064 ( 0.789 1.592 1.924) 2.619 9.104 ( 2.727 -1.497 3.090) 4.385 9.222 ( -2.346 7.637 2.372) 8.334 9.326 ( -2.807 -1.667 -0.294) 3.278 9.516 ( -0.259 3.536 -0.706) 3.615 9.584 ( -0.821 -1.621 -0.487) 1.881 9.714 ( 0.988 0.785 1.869) 2.255 9.730 ( 0.557 0.898 3.694) 3.842 9.989 ( -0.745 4.356 0.837) 4.498 10.050 ( -1.718 -1.273 0.177) 2.146 10.667 ( 2.114 0.586 4.315) 4.840 10.687 ( 2.103 -1.235 5.558) 6.069 10.947 ( 8.321 2.968 -7.862) 11.826 11.015 ( 9.517 -3.698 -9.239) 13.770 11.796 ( 7.682 6.143 -9.459) 13.646 11.899 ( -0.509 1.352 -8.952) 9.068 11.992 ( 4.671 -5.224 -10.131) 12.318 12.040 ( -4.108 -5.141 -8.808) 10.995 12.525 ( -8.156 8.068 10.766) 15.732 12.688 ( -6.648 -6.594 10.685) 14.207 12.988 ( 1.150 2.104 0.996) 2.597 13.075 ( 1.495 -4.816 4.432) 6.714 13.344 ( 0.970 3.935 -0.152) 4.056 13.394 ( 1.414 -1.527 1.073) 2.342 13.662 ( -1.258 4.300 -4.198) 6.140 13.732 ( -3.474 -1.012 -6.305) 7.269 13.885 ( 0.685 9.700 0.772) 9.755 14.083 ( -0.346 -5.666 0.174) 5.679 14.218 ( 1.889 6.293 -3.970) 7.676 14.293 ( 0.559 0.430 -2.236) 2.344 14.387 ( 0.190 -6.185 -0.606) 6.218 14.468 ( 4.022 -8.311 0.382) 9.241 15.312 ( -0.773 2.715 1.641) 3.265 15.382 ( 0.690 -3.845 0.352) 3.922 16.039 ( -0.466 7.274 0.764) 7.329 16.115 ( -0.206 1.908 0.739) 2.057 16.658 ( 2.023 3.894 2.531) 5.065 16.828 ( 2.334 -10.425 3.116) 11.128 17.148 ( -1.225 1.396 1.342) 2.291 17.165 ( -1.925 -0.361 1.110) 2.251 18.081 ( -0.267 2.072 -0.041) 2.089 18.117 ( 0.666 -1.453 -0.556) 1.692 19.373 ( 2.211 2.636 -5.363) 6.372 19.422 ( 0.508 -2.041 -3.248) 3.870 20.664 ( 0.320 2.567 6.401) 6.904 20.712 ( -0.876 -2.104 8.542) 8.840 21.595 ( -0.790 1.194 -0.975) 1.732 21.625 ( -1.792 -1.644 -0.140) 2.436 22.193 ( 0.031 3.161 1.030) 3.325 22.268 ( 0.460 -3.063 0.833) 3.208 22.995 ( -0.687 -2.986 -0.799) 3.166 23.002 ( 0.358 -4.195 -0.018) 4.211 23.693 ( 1.808 3.472 1.415) 4.162 23.741 ( 1.042 -1.498 0.384) 1.865 24.298 ( -1.402 5.511 -3.848) 6.866 24.397 ( -1.544 -4.246 -7.038) 8.363 25.851 ( 0.485 7.814 0.256) 7.833 25.974 ( 0.048 -3.730 -0.303) 3.742 26.326 ( 0.398 1.630 1.607) 2.324 26.379 ( 0.179 -3.616 1.568) 3.945 ======================= Grid point 66 (37/78) ======================= q-point: (-0.38 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -3.163 4.729 6.924) 8.962 2.413 ( -2.575 -3.042 6.710) 7.804 3.034 ( -9.572 9.465 -4.707) 14.260 3.219 ( -7.383 -6.154 -3.577) 10.255 3.417 ( -17.647 15.572 8.052) 24.875 3.587 ( -14.814 -3.019 9.327) 17.764 3.809 ( -6.407 3.783 -2.017) 7.709 3.965 ( -12.817 -10.067 1.424) 16.360 4.093 ( 4.717 -0.787 -2.113) 5.228 4.103 ( 7.549 -1.026 1.761) 7.820 4.410 ( 1.248 5.589 0.915) 5.800 4.455 ( 6.370 4.846 -4.919) 9.394 4.639 ( -0.750 -4.018 -1.027) 4.215 4.668 ( -0.452 -2.344 -3.408) 4.161 4.895 ( -16.259 9.177 2.221) 18.802 4.939 ( -0.416 7.099 -5.024) 8.707 5.044 ( 2.413 -3.232 -9.112) 9.965 5.083 ( -5.003 -1.913 -2.027) 5.727 5.168 ( -9.706 9.254 6.412) 14.864 5.364 ( 2.768 -1.604 0.660) 3.266 5.417 ( -2.610 7.955 -10.947) 13.781 5.490 ( 4.111 -0.268 -3.947) 5.706 5.539 ( -5.508 0.507 -5.649) 7.907 5.647 ( -4.865 -7.187 0.081) 8.679 5.693 ( -0.163 4.575 1.111) 4.711 5.827 ( 0.003 -3.769 -0.666) 3.828 5.861 ( -0.223 -1.047 0.016) 1.071 6.010 ( 5.540 5.134 -4.836) 8.969 6.011 ( 0.694 -10.023 -2.915) 10.461 6.121 ( -0.695 1.961 4.520) 4.976 6.221 ( 4.608 -0.412 -8.485) 9.664 6.257 ( -1.727 1.819 -2.117) 3.283 6.363 ( 3.676 -4.662 1.644) 6.160 6.417 ( 0.026 -4.110 5.166) 6.601 6.430 ( -1.054 -2.413 4.629) 5.325 6.555 ( 1.182 -10.296 4.786) 11.415 6.762 ( 1.862 4.176 3.114) 5.532 6.782 ( 0.459 4.210 3.764) 5.666 6.902 ( -0.800 5.443 9.657) 11.114 7.038 ( 7.656 1.020 0.529) 7.742 7.130 ( 5.246 -6.128 -1.278) 8.168 7.198 ( -1.147 -2.925 10.731) 11.182 7.280 ( -1.290 8.180 -3.572) 9.019 7.358 ( 3.194 -0.275 0.490) 3.243 7.582 ( -0.768 4.504 0.591) 4.607 7.691 ( 2.376 3.760 0.028) 4.448 7.799 ( 3.541 -7.384 2.204) 8.480 7.883 ( 0.096 -8.359 4.256) 9.380 8.051 ( 8.113 0.516 -3.502) 8.851 8.068 ( 8.303 -2.071 -6.386) 10.678 8.242 ( 4.810 3.201 3.465) 6.738 8.365 ( 5.543 -9.519 -0.441) 11.025 8.720 ( 3.502 1.749 -6.033) 7.192 8.797 ( 1.943 -5.254 -3.407) 6.557 9.017 ( -5.827 5.242 -0.791) 7.878 9.113 ( -5.473 -3.231 0.897) 6.418 9.185 ( 1.392 1.944 -0.004) 2.391 9.235 ( -3.092 -1.352 -0.767) 3.461 9.536 ( 1.692 4.195 0.945) 4.621 9.584 ( 0.323 0.593 0.047) 0.676 9.740 ( 0.688 3.865 2.130) 4.466 9.774 ( 3.056 -0.238 3.864) 4.932 9.986 ( 0.523 4.952 0.806) 5.044 10.064 ( 2.929 -2.125 -1.373) 3.870 10.755 ( 5.935 0.752 7.146) 9.319 10.775 ( 6.049 -1.022 7.903) 10.004 11.076 ( 4.027 3.836 -0.626) 5.597 11.174 ( 5.512 -5.652 -0.904) 7.946 11.793 ( -6.835 4.301 -5.643) 9.852 11.902 ( -6.157 -5.703 -9.160) 12.424 11.987 ( 8.065 6.750 -11.843) 15.839 12.152 ( 7.884 -8.033 -11.712) 16.244 12.390 ( -4.298 7.205 8.314) 11.811 12.564 ( -5.073 -8.292 9.833) 13.827 13.018 ( 1.410 3.989 2.805) 5.076 13.118 ( 2.049 -4.868 3.839) 6.530 13.355 ( -0.093 4.680 -0.256) 4.688 13.416 ( 0.349 -1.781 1.924) 2.644 13.636 ( -0.675 2.243 -6.625) 7.027 13.664 ( -1.946 -0.084 -6.958) 7.226 13.894 ( 0.014 9.559 3.670) 10.239 14.060 ( -1.837 -3.989 -0.025) 4.392 14.214 ( -1.646 2.413 -2.341) 3.744 14.266 ( -2.335 -1.586 -0.147) 2.826 14.413 ( 2.107 -0.652 -1.346) 2.584 14.548 ( 2.813 -9.475 1.243) 9.962 15.302 ( -0.335 3.852 0.691) 3.927 15.390 ( 0.007 -4.669 0.701) 4.722 16.036 ( 0.015 6.608 0.799) 6.657 16.114 ( 0.512 0.675 0.772) 1.146 16.746 ( 5.592 4.470 4.487) 8.449 16.878 ( 1.893 -6.705 4.923) 8.531 17.151 ( 0.939 1.231 -0.922) 1.802 17.184 ( 4.822 -1.704 0.130) 5.116 18.091 ( 1.360 2.709 -0.497) 3.071 18.141 ( 1.663 -2.133 -0.192) 2.711 19.365 ( -2.467 0.768 -5.709) 6.266 19.378 ( -4.412 -0.484 -3.384) 5.582 20.681 ( 0.757 1.551 7.090) 7.297 20.715 ( 0.469 -1.685 10.439) 10.584 21.567 ( -1.695 0.404 -1.283) 2.164 21.581 ( -2.242 -0.996 -0.791) 2.577 22.115 ( -7.205 4.251 0.507) 8.381 22.217 ( -5.911 -4.907 0.147) 7.684 22.988 ( 0.565 -1.124 -0.858) 1.523 23.034 ( 2.184 -4.934 0.263) 5.403 23.712 ( -0.147 2.447 2.938) 3.826 23.735 ( -1.591 -0.242 0.898) 1.843 24.260 ( -1.683 3.564 -4.417) 5.920 24.335 ( -3.662 -3.998 -7.503) 9.257 25.895 ( 3.728 8.344 -0.800) 9.174 26.017 ( 3.847 -3.466 -1.092) 5.292 26.345 ( 1.296 1.942 2.290) 3.271 26.404 ( 2.151 -3.802 1.838) 4.739 ======================= Grid point 67 (38/78) ======================= q-point: (-0.25 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( -7.868 12.649 10.795) 18.396 2.323 ( -6.837 2.865 9.734) 12.235 2.765 ( -15.088 6.337 2.721) 16.589 2.894 ( -19.583 12.845 11.179) 25.951 3.179 ( -7.061 -10.056 -0.480) 12.297 3.236 ( -19.475 -7.812 7.126) 22.160 3.616 ( -9.733 -1.224 2.524) 10.130 3.691 ( -11.970 -6.691 0.725) 13.732 4.047 ( -10.377 11.346 11.712) 19.328 4.207 ( 0.957 -5.476 -2.530) 6.108 4.317 ( -10.450 16.767 -12.538) 23.400 4.475 ( -11.148 12.452 2.196) 16.857 4.531 ( -8.027 3.819 -3.463) 9.541 4.579 ( 1.726 -4.104 -4.922) 6.637 4.664 ( -0.068 -6.161 5.436) 8.217 4.809 ( -10.145 -4.596 -0.980) 11.181 4.936 ( -8.699 2.603 7.965) 12.078 4.999 ( -1.916 -1.027 3.435) 4.065 5.167 ( 3.889 12.767 4.908) 14.220 5.356 ( 0.244 4.363 -5.582) 7.089 5.421 ( -3.744 0.050 -4.189) 5.619 5.468 ( -0.939 0.025 -2.722) 2.880 5.543 ( 5.082 0.336 -2.376) 5.620 5.664 ( 2.262 1.972 -5.765) 6.500 5.728 ( 5.183 -13.682 0.768) 14.651 5.825 ( -4.503 -3.328 -0.330) 5.609 5.834 ( -0.889 -4.593 2.221) 5.179 5.899 ( -4.727 -6.344 -2.815) 8.397 6.074 ( 2.928 7.677 3.031) 8.757 6.157 ( 1.823 -1.628 2.133) 3.244 6.230 ( -0.234 0.084 3.609) 3.617 6.249 ( -0.417 -2.649 -0.315) 2.700 6.378 ( -2.356 8.121 2.267) 8.754 6.511 ( 4.834 -7.426 -0.653) 8.885 6.587 ( 9.420 -0.809 -14.596) 17.391 6.640 ( 7.691 -3.663 -11.381) 14.216 6.764 ( 1.351 0.808 -6.256) 6.451 6.842 ( -0.258 0.205 11.218) 11.223 6.902 ( 5.004 -3.916 3.249) 7.137 7.050 ( -5.060 -9.942 -1.576) 11.266 7.242 ( 8.564 2.217 -7.362) 11.509 7.280 ( 7.346 0.378 1.589) 7.525 7.405 ( 7.968 8.579 -0.132) 11.709 7.540 ( 8.421 9.855 -2.059) 13.125 7.595 ( 6.480 -7.002 -2.015) 9.751 7.748 ( 5.023 -4.290 -1.803) 6.848 7.891 ( 7.785 -0.738 3.810) 8.698 7.991 ( 5.098 -5.206 4.083) 8.353 8.222 ( 6.046 3.462 -2.719) 7.479 8.293 ( 12.465 -2.425 -3.721) 13.233 8.367 ( 7.186 3.687 -0.337) 8.084 8.491 ( 6.901 -6.849 -2.186) 9.965 8.789 ( 1.633 1.672 -2.911) 3.733 8.853 ( 3.605 -2.638 -7.686) 8.890 8.879 ( -3.828 4.206 -3.025) 6.442 8.948 ( -7.725 -1.864 -3.514) 8.689 9.209 ( 1.366 0.613 -1.953) 2.461 9.245 ( 2.153 -2.708 0.670) 3.524 9.563 ( 0.380 3.763 1.727) 4.157 9.592 ( 0.507 1.470 1.559) 2.202 9.745 ( -0.263 7.381 1.888) 7.624 9.834 ( 1.900 -1.428 2.957) 3.794 10.016 ( 2.031 7.406 0.832) 7.725 10.142 ( 3.896 -3.682 -2.148) 5.775 10.888 ( 3.903 0.906 9.422) 10.239 10.930 ( 6.611 -2.432 7.965) 10.633 11.107 ( -0.539 5.314 8.078) 9.684 11.230 ( -0.231 -6.549 8.629) 10.835 11.626 ( -8.082 3.409 -5.664) 10.441 11.729 ( -8.356 -5.725 -6.852) 12.229 12.131 ( 5.220 5.802 -7.846) 11.067 12.227 ( -0.035 1.183 -3.375) 3.577 12.409 ( 5.025 -2.789 -4.555) 7.333 12.514 ( -0.101 -8.932 8.366) 12.239 13.043 ( 0.764 5.319 3.250) 6.280 13.153 ( 0.765 -4.936 3.669) 6.197 13.348 ( -0.157 3.994 -1.784) 4.377 13.408 ( -1.092 -1.889 1.674) 2.750 13.620 ( -0.427 2.498 -6.997) 7.442 13.652 ( 0.881 -0.473 -6.845) 6.917 13.871 ( -2.997 7.910 2.968) 8.964 14.004 ( -3.552 -3.349 1.371) 5.071 14.170 ( -2.166 3.055 2.037) 4.263 14.236 ( 0.086 -3.042 0.911) 3.177 14.452 ( 1.318 0.771 0.033) 1.527 14.581 ( 0.433 -9.851 2.643) 10.209 15.299 ( 0.208 3.689 -1.043) 3.839 15.386 ( -0.316 -4.809 0.699) 4.870 16.045 ( 0.996 7.945 0.794) 8.047 16.147 ( 2.476 -1.104 1.434) 3.067 16.865 ( 4.721 2.422 4.883) 7.211 16.921 ( 2.155 -2.596 4.508) 5.631 17.219 ( 5.825 5.104 -2.358) 8.096 17.334 ( 8.765 -4.676 0.403) 9.942 18.143 ( 3.724 2.336 -0.971) 4.502 18.188 ( 2.885 -1.951 -0.201) 3.489 19.238 ( -8.382 1.259 -4.615) 9.651 19.270 ( -6.039 -1.942 -7.798) 10.052 20.697 ( -0.270 1.372 8.839) 8.949 20.742 ( 0.784 -3.183 14.137) 14.512 21.528 ( -1.834 -0.015 -0.173) 1.842 21.535 ( -2.130 -0.759 -0.227) 2.272 21.917 ( -10.780 3.430 -0.388) 11.319 22.012 ( -13.197 -5.971 -2.117) 14.638 23.015 ( 1.899 1.409 -0.782) 2.491 23.083 ( 2.304 -4.631 1.127) 5.294 23.671 ( -3.457 2.528 0.615) 4.327 23.710 ( -0.891 -0.815 3.086) 3.314 24.217 ( -3.186 0.587 -6.394) 7.168 24.256 ( -2.007 -2.687 -2.750) 4.337 26.003 ( 6.556 8.677 -4.257) 11.679 26.117 ( 5.355 -2.975 -3.070) 6.852 26.386 ( 2.472 3.218 3.043) 5.072 26.467 ( 3.576 -4.452 2.320) 6.163 ======================= Grid point 68 (39/78) ======================= q-point: (-0.12 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( -11.331 28.242 17.415) 35.061 2.122 ( -14.768 16.169 12.741) 25.335 2.380 ( -17.344 0.353 22.613) 28.501 2.686 ( -3.491 -2.051 1.859) 4.456 2.833 ( -16.116 -8.938 4.365) 18.939 3.057 ( -5.400 -15.339 6.031) 17.344 3.456 ( -6.508 8.776 2.515) 11.212 3.463 ( -7.634 8.186 1.666) 11.316 3.775 ( -11.887 15.251 16.851) 25.649 4.127 ( -5.006 3.503 -9.817) 11.563 4.181 ( -5.440 -1.311 -11.833) 13.090 4.322 ( -5.187 -7.541 0.142) 9.154 4.362 ( -2.105 9.564 -4.631) 10.833 4.504 ( -8.432 -8.089 6.560) 13.399 4.668 ( -4.739 -1.634 3.605) 6.174 4.698 ( 3.173 -5.660 -3.457) 7.352 4.865 ( 0.004 5.871 2.962) 6.576 4.962 ( -2.426 -2.497 1.965) 3.998 5.185 ( -1.464 11.208 1.912) 11.464 5.344 ( -0.761 -1.842 -4.017) 4.484 5.412 ( 4.235 3.617 0.972) 5.654 5.520 ( 3.997 1.006 -1.733) 4.471 5.583 ( -1.280 0.065 -4.675) 4.847 5.625 ( -5.146 3.798 7.282) 9.692 5.743 ( -1.360 3.445 -1.600) 4.035 5.801 ( -0.865 -7.333 4.581) 8.690 5.836 ( 0.648 -13.176 -4.873) 14.063 5.860 ( 1.956 -9.395 3.029) 10.063 6.142 ( 2.644 5.855 4.185) 7.667 6.176 ( 0.220 2.379 -3.693) 4.398 6.220 ( -1.289 -1.693 3.428) 4.035 6.268 ( -0.044 -3.363 -3.966) 5.200 6.327 ( 0.621 11.437 -2.820) 11.796 6.560 ( 0.501 -7.564 -0.387) 7.590 6.646 ( -1.826 5.639 -10.441) 12.006 6.745 ( 1.072 -2.750 -3.782) 4.798 6.813 ( 1.779 -3.305 -0.715) 3.821 6.931 ( 1.214 -16.105 -1.626) 16.233 6.996 ( 5.983 -5.913 -5.129) 9.852 7.021 ( 6.738 -7.299 -1.670) 10.073 7.394 ( 2.954 5.921 7.588) 10.068 7.420 ( 7.830 3.582 -4.183) 9.573 7.551 ( 6.051 6.985 -10.547) 14.023 7.675 ( 8.795 1.085 -1.260) 8.950 7.834 ( 11.011 -0.082 -12.205) 16.438 7.896 ( 8.406 -1.442 -7.677) 11.475 8.024 ( 1.872 -1.589 1.964) 3.145 8.087 ( 4.121 -3.883 3.656) 6.741 8.331 ( 5.112 5.139 -0.469) 7.264 8.415 ( -1.783 0.277 2.216) 2.857 8.539 ( 7.576 -0.319 -4.684) 8.913 8.623 ( 4.852 -5.445 -4.908) 8.791 8.794 ( 2.924 3.798 -5.824) 7.542 8.851 ( 0.321 -0.996 -5.898) 5.990 8.949 ( 8.753 4.218 -5.898) 11.366 9.001 ( 11.187 -0.287 -10.496) 15.343 9.245 ( 2.682 1.562 -1.196) 3.327 9.285 ( 1.621 -2.141 -1.079) 2.894 9.569 ( 0.543 4.233 2.706) 5.053 9.600 ( 0.132 0.533 1.833) 1.913 9.734 ( -0.710 8.158 1.322) 8.295 9.843 ( -1.195 -1.690 0.997) 2.297 10.059 ( 1.884 9.211 1.355) 9.499 10.212 ( 3.166 -4.208 -1.860) 5.585 10.792 ( -14.075 3.283 22.942) 27.114 10.913 ( -12.228 -8.023 18.941) 23.930 11.147 ( 3.045 4.280 3.113) 6.106 11.244 ( 2.224 -3.867 4.616) 6.419 11.497 ( -2.584 2.098 -5.129) 6.114 11.591 ( -3.688 -5.649 -4.498) 8.108 12.175 ( -1.061 2.983 -7.882) 8.494 12.195 ( -2.181 1.774 0.178) 2.817 12.488 ( 3.128 -1.424 -1.503) 3.751 12.595 ( 6.398 -11.069 6.847) 14.503 13.065 ( 1.263 4.533 0.787) 4.771 13.150 ( -1.329 -3.949 2.082) 4.658 13.347 ( 0.124 2.867 -2.562) 3.847 13.383 ( -1.247 -0.596 0.153) 1.390 13.604 ( -0.716 4.415 -5.218) 6.872 13.668 ( 0.708 -1.992 -3.973) 4.501 13.797 ( -2.905 5.985 -1.137) 6.750 13.928 ( -3.232 -5.189 1.729) 6.353 14.118 ( -3.361 6.607 6.407) 9.798 14.260 ( 0.579 -6.510 7.677) 10.082 14.458 ( -0.658 2.071 1.885) 2.877 14.586 ( 0.074 -9.703 1.189) 9.775 15.315 ( 1.465 2.940 -2.252) 3.983 15.382 ( -0.101 -3.640 0.467) 3.671 16.083 ( 2.404 9.320 1.012) 9.678 16.211 ( 3.224 -2.997 1.442) 4.632 16.940 ( 2.352 1.446 1.879) 3.339 16.974 ( 2.421 -1.600 2.363) 3.742 17.358 ( 6.058 7.590 -2.269) 9.973 17.509 ( 6.653 -5.774 0.504) 8.823 18.238 ( 4.819 1.348 -0.817) 5.070 18.263 ( 4.108 -0.855 -0.153) 4.199 19.041 ( -9.237 2.982 -7.003) 11.969 19.111 ( -8.035 -4.106 -9.922) 13.411 20.665 ( -3.561 1.239 9.501) 10.221 20.730 ( -4.297 -5.969 15.981) 17.592 21.489 ( -1.985 -0.521 -0.952) 2.263 21.491 ( -2.658 -1.207 2.089) 3.589 21.729 ( -5.597 0.693 1.632) 5.871 21.746 ( -8.102 -0.989 0.477) 8.176 23.053 ( 1.455 2.563 -0.679) 3.024 23.125 ( 1.458 -4.058 1.970) 4.741 23.600 ( -2.957 3.211 -1.358) 4.572 23.682 ( -2.274 -4.582 1.119) 5.236 24.137 ( -2.640 5.036 -3.781) 6.829 24.248 ( 0.530 -4.973 0.450) 5.021 26.145 ( 6.865 6.051 -7.861) 12.064 26.216 ( 4.085 -1.760 -4.509) 6.334 26.442 ( 2.154 4.632 1.789) 5.412 26.542 ( 2.637 -5.001 1.433) 5.833 ======================= Grid point 85 (40/78) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.220 ( 0.327 0.000 27.976) 27.978 1.561 ( 5.043 0.000 37.597) 37.934 2.231 ( -3.835 0.000 4.549) 5.950 2.568 ( -1.117 0.000 3.662) 3.829 2.670 ( -3.916 0.000 38.942) 39.139 2.941 ( -11.399 0.000 6.014) 12.888 3.395 ( 4.877 0.000 -17.978) 18.628 3.596 ( 0.984 0.000 -4.775) 4.875 3.613 ( -1.147 0.000 -0.976) 1.506 3.929 ( -12.292 0.000 -6.174) 13.756 4.082 ( -0.830 0.000 1.903) 2.076 4.287 ( 3.410 0.000 -7.199) 7.966 4.352 ( -12.081 0.000 21.032) 24.255 4.422 ( -1.862 0.000 4.083) 4.488 4.779 ( 0.388 0.000 -0.743) 0.838 4.786 ( -0.426 0.000 3.177) 3.205 4.888 ( 2.371 0.000 4.783) 5.338 5.058 ( 0.064 0.000 -11.733) 11.733 5.147 ( 2.674 0.000 -5.281) 5.920 5.181 ( -2.681 0.000 5.673) 6.274 5.192 ( -2.976 0.000 2.524) 3.902 5.220 ( -2.323 0.000 1.172) 2.602 5.291 ( 1.469 0.000 7.792) 7.929 5.499 ( -1.341 0.000 -6.505) 6.641 5.592 ( 2.793 0.000 -17.729) 17.948 5.704 ( 0.483 0.000 -2.899) 2.939 5.787 ( -2.699 0.000 2.625) 3.765 5.941 ( -1.553 0.000 0.804) 1.749 6.100 ( -3.164 0.000 4.481) 5.485 6.140 ( -5.617 0.000 9.201) 10.780 6.276 ( -1.991 0.000 -2.836) 3.465 6.409 ( 3.030 0.000 2.038) 3.652 6.622 ( 4.159 0.000 -12.958) 13.609 6.634 ( -2.201 0.000 2.871) 3.617 6.811 ( 10.683 0.000 -10.856) 15.231 6.874 ( 0.184 0.000 -6.435) 6.438 6.969 ( 0.080 0.000 3.621) 3.622 6.985 ( 1.060 0.000 -10.594) 10.647 7.199 ( -2.528 0.000 -3.651) 4.441 7.397 ( 3.733 0.000 0.315) 3.746 7.445 ( -1.079 0.000 -1.285) 1.678 7.631 ( 6.963 0.000 -9.675) 11.920 7.634 ( 1.041 0.000 -1.928) 2.191 7.712 ( 5.641 0.000 -14.091) 15.178 7.740 ( 8.799 0.000 4.906) 10.075 7.842 ( -6.672 0.000 0.853) 6.727 8.034 ( 13.991 0.000 5.015) 14.862 8.143 ( -7.997 0.000 -4.151) 9.011 8.282 ( -7.942 0.000 -1.577) 8.097 8.390 ( 4.566 0.000 -0.248) 4.573 8.434 ( 6.750 0.000 4.385) 8.049 8.568 ( 3.309 0.000 -2.151) 3.947 8.609 ( -2.838 0.000 3.176) 4.259 8.715 ( -4.074 0.000 1.377) 4.301 8.894 ( 4.810 0.000 -9.304) 10.474 9.074 ( 11.862 0.000 -4.038) 12.531 9.271 ( 5.174 0.000 -1.086) 5.287 9.347 ( 1.553 0.000 2.624) 3.049 9.386 ( -2.390 0.000 2.290) 3.310 9.473 ( 1.371 0.000 -2.556) 2.900 9.657 ( 0.471 0.000 -1.152) 1.245 9.717 ( 0.344 0.000 -0.727) 0.805 9.858 ( -0.570 0.000 2.047) 2.125 10.226 ( 2.002 0.000 -2.028) 2.849 10.915 ( -12.688 0.000 23.139) 26.389 11.128 ( -18.348 0.000 24.402) 30.531 11.156 ( -3.511 0.000 -2.587) 4.361 11.245 ( -2.707 0.000 6.455) 6.999 11.637 ( -2.878 0.000 -1.988) 3.498 11.742 ( 10.174 0.000 -3.770) 10.850 11.848 ( 2.439 0.000 -12.528) 12.763 12.330 ( 3.166 0.000 -5.161) 6.055 12.663 ( 5.351 0.000 -9.930) 11.280 12.747 ( -0.315 0.000 4.736) 4.747 13.151 ( -8.074 0.000 2.878) 8.571 13.202 ( 2.607 0.000 0.926) 2.766 13.264 ( -2.487 0.000 -1.086) 2.713 13.324 ( -4.004 0.000 0.473) 4.032 13.403 ( 6.230 0.000 -0.574) 6.256 13.630 ( 4.837 0.000 -3.252) 5.828 13.724 ( -5.262 0.000 1.384) 5.441 13.823 ( 1.059 0.000 -1.988) 2.252 14.130 ( -2.095 0.000 12.147) 12.327 14.535 ( 1.674 0.000 0.525) 1.754 14.891 ( -0.710 0.000 -5.275) 5.322 15.135 ( 9.726 0.000 -3.423) 10.311 15.255 ( 0.384 0.000 -2.413) 2.443 15.632 ( -1.606 0.000 2.078) 2.627 15.695 ( 1.061 0.000 -0.911) 1.399 15.939 ( -18.216 0.000 6.092) 19.208 16.939 ( -0.777 0.000 0.965) 1.240 16.962 ( 0.488 0.000 1.577) 1.651 17.242 ( -5.655 0.000 3.343) 6.569 17.381 ( 0.536 0.000 0.037) 0.537 18.257 ( -2.070 0.000 -0.523) 2.135 18.374 ( -1.023 0.000 -0.308) 1.069 18.761 ( 3.520 0.000 -3.290) 4.818 18.854 ( -3.430 0.000 -8.347) 9.024 20.734 ( 0.320 0.000 4.200) 4.212 20.905 ( -11.774 0.000 -0.061) 11.774 21.434 ( -4.288 0.000 0.865) 4.374 21.494 ( 3.891 0.000 -1.700) 4.246 21.880 ( 0.516 0.000 10.407) 10.420 22.276 ( 11.230 0.000 -5.367) 12.446 23.052 ( 0.287 0.000 -0.759) 0.812 23.153 ( -0.032 0.000 0.106) 0.111 23.428 ( -3.078 0.000 -3.176) 4.423 23.834 ( 4.816 0.000 2.950) 5.647 24.193 ( -7.004 0.000 -1.527) 7.169 24.365 ( -0.207 0.000 0.342) 0.399 25.540 ( 0.058 0.000 1.492) 1.493 26.216 ( 0.200 0.000 -2.848) 2.855 26.393 ( 0.398 0.000 4.264) 4.283 26.577 ( -4.613 0.000 -4.097) 6.170 ======================= Grid point 86 (41/78) ======================= q-point: ( 0.12 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( 22.165 0.000 20.495) 30.188 1.796 ( 9.337 0.000 39.108) 40.208 2.183 ( -0.529 0.000 4.622) 4.652 2.624 ( 5.715 0.000 6.639) 8.760 2.789 ( 16.097 0.000 38.167) 41.423 3.070 ( 21.504 0.000 -10.268) 23.830 3.538 ( 9.899 0.000 -20.197) 22.492 3.565 ( -6.520 0.000 4.981) 8.205 3.664 ( 6.027 0.000 -5.471) 8.140 3.710 ( -5.342 0.000 0.665) 5.383 4.091 ( 0.302 0.000 1.597) 1.625 4.099 ( -11.173 0.000 16.737) 20.123 4.313 ( -3.701 0.000 8.970) 9.703 4.382 ( 5.415 0.000 -6.418) 8.397 4.746 ( -3.288 0.000 1.673) 3.689 4.752 ( -2.616 0.000 -0.084) 2.618 4.949 ( 3.187 0.000 4.657) 5.643 5.006 ( -1.357 0.000 -0.796) 1.573 5.094 ( -6.203 0.000 3.282) 7.018 5.161 ( -2.013 0.000 -4.541) 4.967 5.214 ( 3.913 0.000 0.194) 3.918 5.232 ( 3.574 0.000 -0.038) 3.574 5.448 ( 9.268 0.000 10.359) 13.900 5.476 ( 0.167 0.000 -3.389) 3.393 5.671 ( 4.582 0.000 -13.101) 13.879 5.687 ( -1.515 0.000 -2.994) 3.355 5.719 ( -3.462 0.000 -0.171) 3.466 5.900 ( -2.459 0.000 -1.337) 2.799 6.023 ( -3.894 0.000 5.960) 7.120 6.130 ( 4.047 0.000 0.552) 4.084 6.321 ( 4.521 0.000 -3.537) 5.740 6.473 ( 2.327 0.000 2.218) 3.215 6.556 ( -5.305 0.000 2.673) 5.940 6.637 ( -0.530 0.000 -5.924) 5.948 6.837 ( -3.092 0.000 -1.418) 3.401 6.900 ( -7.189 0.000 4.028) 8.241 6.988 ( 5.531 0.000 -8.914) 10.491 7.125 ( -3.877 0.000 -1.092) 4.028 7.140 ( 13.018 0.000 -16.046) 20.663 7.342 ( -8.661 0.000 -0.368) 8.669 7.409 ( -2.098 0.000 -2.700) 3.419 7.546 ( -9.919 0.000 -6.711) 11.976 7.574 ( -3.687 0.000 -0.506) 3.722 7.693 ( -6.936 0.000 -3.658) 7.841 7.847 ( 2.064 0.000 -12.081) 12.256 7.948 ( 6.426 0.000 2.479) 6.888 8.052 ( 1.644 0.000 1.291) 2.090 8.114 ( -3.850 0.000 -5.146) 6.426 8.245 ( 4.537 0.000 4.333) 6.274 8.509 ( -1.596 0.000 0.375) 1.639 8.538 ( 2.407 0.000 2.376) 3.383 8.566 ( -3.411 0.000 -3.806) 5.111 8.668 ( 9.071 0.000 -8.708) 12.575 8.694 ( 6.123 0.000 3.541) 7.074 8.904 ( -2.509 0.000 -10.718) 11.008 9.006 ( -5.472 0.000 -7.101) 8.965 9.292 ( -4.430 0.000 1.053) 4.553 9.395 ( 1.218 0.000 2.789) 3.044 9.426 ( 0.771 0.000 -4.522) 4.587 9.622 ( -2.304 0.000 0.591) 2.379 9.719 ( 14.487 0.000 -7.852) 16.478 9.823 ( 9.428 0.000 -8.401) 12.628 9.869 ( 1.119 0.000 3.158) 3.350 10.239 ( -0.663 0.000 -2.993) 3.066 10.633 ( -15.060 0.000 29.995) 33.564 10.746 ( -19.013 0.000 29.321) 34.946 11.063 ( -4.917 0.000 1.829) 5.247 11.123 ( -9.175 0.000 5.793) 10.851 11.576 ( 0.003 0.000 -4.373) 4.373 11.877 ( 1.218 0.000 -8.768) 8.852 11.935 ( 5.823 0.000 -5.212) 7.815 12.353 ( -2.561 0.000 -9.678) 10.011 12.753 ( 0.185 0.000 3.275) 3.280 12.765 ( 4.379 0.000 -9.046) 10.050 13.025 ( -3.958 0.000 4.919) 6.314 13.173 ( -8.030 0.000 3.596) 8.799 13.199 ( 0.399 0.000 -1.214) 1.278 13.315 ( 4.570 0.000 -0.473) 4.594 13.492 ( 2.428 0.000 -3.680) 4.409 13.589 ( -6.058 0.000 5.560) 8.223 13.748 ( 6.291 0.000 -2.041) 6.613 13.895 ( 5.256 0.000 -1.599) 5.493 14.055 ( -7.404 0.000 8.786) 11.489 14.525 ( -3.254 0.000 -0.655) 3.319 14.837 ( -3.212 0.000 -2.704) 4.199 14.939 ( -18.376 0.000 11.291) 21.567 15.367 ( 4.864 0.000 -5.893) 7.642 15.613 ( -0.144 0.000 1.758) 1.764 15.668 ( -4.452 0.000 13.204) 13.934 15.725 ( 1.678 0.000 -0.653) 1.800 16.905 ( -2.411 0.000 1.496) 2.838 17.005 ( 3.485 0.000 -1.992) 4.014 17.151 ( -2.390 0.000 7.726) 8.087 17.368 ( -1.805 0.000 -0.215) 1.818 18.137 ( -6.759 0.000 -1.105) 6.849 18.288 ( -4.891 0.000 -0.022) 4.891 18.764 ( 2.048 0.000 -0.951) 2.258 19.043 ( 12.918 0.000 -9.383) 15.966 20.681 ( -2.137 0.000 6.043) 6.409 20.907 ( 5.513 0.000 8.639) 10.248 21.425 ( 2.049 0.000 0.197) 2.059 21.658 ( 10.605 0.000 1.551) 10.717 21.891 ( -0.324 0.000 6.033) 6.042 22.389 ( 1.432 0.000 -13.669) 13.744 23.053 ( -0.383 0.000 -1.622) 1.666 23.174 ( 1.984 0.000 0.092) 1.986 23.406 ( 1.300 0.000 2.916) 3.193 23.795 ( -8.691 0.000 9.580) 12.935 24.120 ( 3.021 0.000 -8.399) 8.926 24.329 ( -3.201 0.000 0.412) 3.228 25.550 ( 0.847 0.000 1.237) 1.500 26.188 ( -2.600 0.000 -2.568) 3.654 26.405 ( -1.023 0.000 3.688) 3.827 26.519 ( 0.446 0.000 0.119) 0.462 ======================= Grid point 87 (42/78) ======================= q-point: ( 0.25 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( 23.404 0.000 10.199) 25.530 2.035 ( 13.408 0.000 30.981) 33.757 2.230 ( 5.066 0.000 1.623) 5.320 2.808 ( 11.379 0.000 13.454) 17.621 3.220 ( 13.649 0.000 -11.713) 17.986 3.449 ( 3.540 0.000 -3.529) 4.998 3.614 ( 2.125 0.000 9.809) 10.037 3.704 ( 22.082 0.000 15.794) 27.149 3.751 ( 10.578 0.000 -16.982) 20.007 3.826 ( 9.393 0.000 -11.426) 14.791 4.050 ( 9.694 0.000 9.350) 13.468 4.072 ( -1.974 0.000 5.266) 5.623 4.359 ( 7.678 0.000 4.587) 8.944 4.435 ( -2.300 0.000 1.635) 2.822 4.684 ( -1.070 0.000 -6.213) 6.304 4.691 ( -2.341 0.000 5.319) 5.812 4.915 ( -8.612 0.000 6.462) 10.766 5.053 ( 6.022 0.000 1.189) 6.138 5.055 ( -0.206 0.000 0.032) 0.208 5.092 ( 1.087 0.000 -3.375) 3.545 5.266 ( 0.025 0.000 -4.198) 4.198 5.296 ( 0.843 0.000 -1.337) 1.580 5.519 ( 3.763 0.000 -0.638) 3.817 5.565 ( -3.521 0.000 -1.802) 3.955 5.666 ( 4.198 0.000 8.740) 9.696 5.669 ( -0.132 0.000 -1.846) 1.851 5.798 ( 7.463 0.000 -6.586) 9.953 5.830 ( -1.643 0.000 -7.985) 8.152 6.003 ( 1.878 0.000 9.576) 9.759 6.195 ( 0.128 0.000 -2.085) 2.089 6.400 ( 2.126 0.000 -5.110) 5.535 6.415 ( -7.925 0.000 2.057) 8.188 6.500 ( -0.536 0.000 0.713) 0.892 6.615 ( 0.177 0.000 -5.116) 5.119 6.699 ( -10.902 0.000 4.085) 11.642 6.796 ( -1.354 0.000 0.747) 1.546 7.017 ( -3.327 0.000 -7.494) 8.199 7.025 ( -6.214 0.000 0.863) 6.274 7.142 ( -7.474 0.000 1.358) 7.596 7.286 ( -8.482 0.000 0.499) 8.496 7.353 ( 4.088 0.000 -11.084) 11.814 7.432 ( 4.208 0.000 2.244) 4.769 7.533 ( -0.668 0.000 2.410) 2.501 7.558 ( -5.504 0.000 -4.763) 7.279 7.787 ( -5.273 0.000 -12.237) 13.325 7.933 ( -4.616 0.000 -0.272) 4.624 8.052 ( -3.692 0.000 2.807) 4.638 8.157 ( 0.916 0.000 2.217) 2.398 8.274 ( -3.339 0.000 -0.903) 3.459 8.407 ( -2.804 0.000 1.066) 2.999 8.422 ( -6.856 0.000 -2.655) 7.352 8.586 ( -1.850 0.000 -0.634) 1.955 8.745 ( -2.372 0.000 -8.301) 8.633 8.850 ( 8.564 0.000 -7.639) 11.476 8.859 ( 1.164 0.000 -6.177) 6.285 9.016 ( 4.590 0.000 2.377) 5.168 9.200 ( -4.105 0.000 -1.439) 4.350 9.399 ( -3.575 0.000 -2.580) 4.409 9.426 ( 1.440 0.000 1.749) 2.265 9.591 ( -0.462 0.000 5.030) 5.051 9.857 ( 1.454 0.000 -1.802) 2.315 9.892 ( 0.622 0.000 4.039) 4.087 10.016 ( 7.057 0.000 -18.497) 19.798 10.192 ( -3.625 0.000 -2.773) 4.564 10.370 ( -10.335 0.000 23.134) 25.338 10.459 ( -7.729 0.000 21.332) 22.689 10.934 ( -7.873 0.000 4.713) 9.176 10.970 ( -4.005 0.000 7.681) 8.662 11.609 ( 2.327 0.000 -5.468) 5.942 11.878 ( -0.468 0.000 -4.982) 5.004 11.975 ( -0.480 0.000 -8.735) 8.748 12.129 ( -16.168 0.000 1.394) 16.228 12.754 ( -0.035 0.000 1.386) 1.387 12.827 ( 1.644 0.000 -6.482) 6.687 12.980 ( -1.070 0.000 2.237) 2.480 13.112 ( 1.818 0.000 -1.470) 2.338 13.246 ( 3.125 0.000 -3.688) 4.834 13.410 ( 4.588 0.000 0.118) 4.589 13.483 ( -3.140 0.000 5.467) 6.305 13.556 ( 3.076 0.000 -8.181) 8.740 13.879 ( -8.305 0.000 9.210) 12.402 13.885 ( 6.639 0.000 1.850) 6.892 14.009 ( 5.043 0.000 0.488) 5.066 14.343 ( -11.189 0.000 -1.736) 11.323 14.737 ( -4.617 0.000 5.605) 7.261 14.804 ( 0.157 0.000 2.776) 2.780 15.420 ( 1.393 0.000 -1.886) 2.344 15.596 ( -4.869 0.000 6.564) 8.173 15.635 ( 1.985 0.000 0.995) 2.221 15.763 ( 2.212 0.000 -0.249) 2.226 16.847 ( -3.114 0.000 1.667) 3.532 17.064 ( 1.811 0.000 -2.760) 3.301 17.151 ( 1.268 0.000 4.816) 4.980 17.308 ( -3.786 0.000 -0.270) 3.795 18.040 ( -2.042 0.000 -2.766) 3.437 18.185 ( -4.823 0.000 0.441) 4.844 18.888 ( 8.609 0.000 -1.834) 8.802 19.257 ( 8.245 0.000 -6.753) 10.658 20.671 ( -0.232 0.000 6.923) 6.927 20.989 ( 1.085 0.000 8.879) 8.945 21.483 ( 2.861 0.000 -0.450) 2.896 21.785 ( -1.701 0.000 4.444) 4.759 21.965 ( 9.136 0.000 1.035) 9.194 22.389 ( 0.590 0.000 -9.999) 10.016 23.041 ( -0.292 0.000 -1.332) 1.364 23.231 ( 3.319 0.000 0.036) 3.319 23.464 ( 2.993 0.000 10.389) 10.811 23.685 ( -1.059 0.000 3.730) 3.878 24.190 ( 3.363 0.000 -14.057) 14.453 24.242 ( -4.828 0.000 0.320) 4.838 25.577 ( 1.568 0.000 0.782) 1.752 26.113 ( -4.097 0.000 -1.812) 4.480 26.365 ( -2.160 0.000 2.974) 3.676 26.549 ( 0.973 0.000 1.315) 1.636 ======================= Grid point 88 (43/78) ======================= q-point: ( 0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 4.990 0.000 5.636) 7.528 2.405 ( 18.651 0.000 11.833) 22.087 2.466 ( 12.377 0.000 -4.138) 13.050 3.134 ( 18.084 0.000 17.541) 25.193 3.291 ( 1.914 0.000 -7.153) 7.405 3.411 ( -5.733 0.000 -13.005) 14.213 3.774 ( 11.520 0.000 -2.197) 11.728 3.846 ( -3.597 0.000 -2.836) 4.580 3.968 ( 2.558 0.000 -12.744) 12.998 4.076 ( 9.936 0.000 10.895) 14.745 4.099 ( 5.914 0.000 6.495) 8.784 4.327 ( -4.164 0.000 3.176) 5.237 4.410 ( 11.216 0.000 3.740) 11.823 4.668 ( 20.164 0.000 -3.129) 20.405 4.674 ( -0.661 0.000 -14.526) 14.541 4.733 ( -8.738 0.000 3.524) 9.422 4.762 ( 11.455 0.000 6.695) 13.268 4.955 ( -3.048 0.000 -3.266) 4.467 5.198 ( 0.251 0.000 -2.814) 2.826 5.201 ( -2.921 0.000 -0.457) 2.957 5.283 ( 13.799 0.000 2.383) 14.003 5.313 ( 4.412 0.000 0.346) 4.425 5.427 ( -7.568 0.000 -3.181) 8.210 5.551 ( -0.066 0.000 -5.203) 5.204 5.667 ( 2.217 0.000 5.518) 5.947 5.730 ( -1.401 0.000 -4.348) 4.568 5.893 ( 3.825 0.000 -7.026) 8.000 5.986 ( 9.623 0.000 5.322) 10.997 6.092 ( 4.552 0.000 7.703) 8.948 6.156 ( 0.013 0.000 -2.625) 2.625 6.221 ( -9.898 0.000 -1.727) 10.047 6.401 ( -0.639 0.000 -3.492) 3.549 6.449 ( -1.628 0.000 -1.450) 2.180 6.553 ( -3.610 0.000 5.772) 6.808 6.590 ( -6.672 0.000 -1.697) 6.885 6.765 ( -0.819 0.000 4.995) 5.062 6.899 ( -2.624 0.000 1.660) 3.105 6.906 ( -3.830 0.000 3.784) 5.384 7.047 ( -3.044 0.000 3.247) 4.451 7.179 ( -3.580 0.000 0.905) 3.692 7.346 ( -4.457 0.000 -0.687) 4.510 7.454 ( -3.853 0.000 -5.393) 6.627 7.475 ( -4.304 0.000 1.144) 4.453 7.531 ( -0.330 0.000 3.950) 3.963 7.650 ( -5.896 0.000 -8.964) 10.729 7.799 ( -6.908 0.000 1.605) 7.092 7.937 ( -8.563 0.000 7.292) 11.247 8.075 ( -5.167 0.000 -0.472) 5.188 8.117 ( -7.348 0.000 -7.443) 10.459 8.301 ( -6.144 0.000 6.324) 8.817 8.321 ( -6.757 0.000 -6.549) 9.410 8.610 ( 4.823 0.000 3.826) 6.157 8.695 ( -0.886 0.000 -6.747) 6.805 8.908 ( 2.185 0.000 -1.949) 2.928 8.960 ( 0.650 0.000 -3.106) 3.174 9.089 ( 3.494 0.000 3.594) 5.012 9.131 ( -2.117 0.000 -2.917) 3.604 9.341 ( -0.612 0.000 8.790) 8.811 9.451 ( 0.781 0.000 0.860) 1.162 9.576 ( -1.936 0.000 -0.814) 2.100 9.769 ( -8.449 0.000 8.491) 11.979 9.903 ( 0.388 0.000 3.962) 3.981 10.018 ( -4.132 0.000 -3.288) 5.280 10.097 ( -4.832 0.000 -1.661) 5.110 10.379 ( 9.403 0.000 -3.987) 10.213 10.511 ( 10.253 0.000 -3.997) 11.004 10.819 ( -3.694 0.000 6.426) 7.412 10.926 ( -0.580 0.000 11.435) 11.450 11.634 ( 0.321 0.000 -7.154) 7.161 11.803 ( -9.284 0.000 4.210) 10.194 11.902 ( -0.004 0.000 -5.209) 5.209 11.936 ( -2.080 0.000 -12.496) 12.668 12.771 ( 1.886 0.000 0.379) 1.924 12.799 ( -3.783 0.000 1.775) 4.179 12.968 ( -0.359 0.000 -0.542) 0.650 13.164 ( 1.465 0.000 -0.568) 1.571 13.282 ( 0.552 0.000 -8.705) 8.723 13.409 ( -4.507 0.000 6.340) 7.778 13.505 ( 4.006 0.000 3.188) 5.120 13.642 ( 5.003 0.000 -9.178) 10.453 13.756 ( -3.524 0.000 4.036) 5.358 14.001 ( 3.118 0.000 5.613) 6.421 14.092 ( 3.111 0.000 1.642) 3.518 14.160 ( -5.134 0.000 -9.009) 10.369 14.674 ( -1.525 0.000 1.878) 2.419 14.812 ( -0.345 0.000 4.385) 4.398 15.446 ( 1.557 0.000 0.048) 1.557 15.488 ( -4.999 0.000 3.315) 5.998 15.676 ( 1.338 0.000 -0.660) 1.492 15.831 ( 4.322 0.000 1.700) 4.644 16.783 ( -2.920 0.000 0.933) 3.066 17.094 ( 1.483 0.000 1.103) 1.848 17.168 ( -0.560 0.000 2.066) 2.140 17.226 ( -3.558 0.000 -0.101) 3.559 18.039 ( 1.487 0.000 -2.780) 3.152 18.094 ( -3.643 0.000 0.309) 3.656 19.064 ( 7.406 0.000 -3.683) 8.271 19.383 ( 4.220 0.000 -3.607) 5.551 20.670 ( -0.170 0.000 5.883) 5.885 20.978 ( -2.006 0.000 8.215) 8.456 21.525 ( 1.103 0.000 -1.616) 1.957 21.720 ( -3.216 0.000 0.020) 3.216 22.148 ( 7.212 0.000 2.391) 7.598 22.388 ( -1.052 0.000 -1.655) 1.961 23.048 ( 1.039 0.000 -1.186) 1.577 23.300 ( 2.885 0.000 0.000) 2.885 23.540 ( 3.549 0.000 11.485) 12.021 23.715 ( 2.295 0.000 -1.414) 2.696 24.146 ( -3.822 0.000 0.099) 3.824 24.227 ( 1.216 0.000 -15.647) 15.694 25.612 ( 1.511 0.000 0.389) 1.560 26.030 ( -3.315 0.000 -1.040) 3.475 26.335 ( -0.787 0.000 2.336) 2.465 26.551 ( -0.582 0.000 1.760) 1.854 ======================= Grid point 89 (44/78) ======================= q-point: (-0.50 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( -0.138 0.000 3.624) 3.626 2.604 ( 1.471 0.000 -4.632) 4.860 2.712 ( 7.158 0.000 5.071) 8.773 3.291 ( -3.926 0.000 -11.758) 12.396 3.405 ( 9.776 0.000 -15.639) 18.444 3.463 ( 4.217 0.000 16.067) 16.611 3.679 ( -5.825 0.000 6.052) 8.400 3.881 ( -8.029 0.000 -0.529) 8.046 4.033 ( 11.980 0.000 -14.970) 19.173 4.150 ( 0.722 0.000 12.294) 12.315 4.236 ( 5.676 0.000 3.540) 6.689 4.319 ( 0.162 0.000 -2.845) 2.850 4.546 ( 3.322 0.000 2.287) 4.033 4.574 ( -5.459 0.000 -2.078) 5.841 4.689 ( 5.657 0.000 -17.248) 18.152 4.924 ( 2.491 0.000 -3.230) 4.079 4.951 ( 1.349 0.000 -2.821) 3.127 5.031 ( 7.152 0.000 -2.266) 7.503 5.132 ( -0.586 0.000 -8.302) 8.323 5.183 ( 0.888 0.000 -0.679) 1.118 5.261 ( -7.378 0.000 -5.947) 9.476 5.290 ( -5.345 0.000 -4.872) 7.233 5.572 ( 5.100 0.000 5.756) 7.691 5.654 ( -0.209 0.000 -3.258) 3.264 5.678 ( 2.705 0.000 -1.614) 3.150 5.717 ( 2.517 0.000 3.316) 4.163 5.873 ( 2.451 0.000 0.527) 2.507 6.058 ( -2.078 0.000 3.495) 4.067 6.102 ( -0.363 0.000 -8.977) 8.985 6.164 ( 1.726 0.000 5.085) 5.370 6.244 ( -2.735 0.000 3.618) 4.536 6.391 ( 7.352 0.000 1.705) 7.547 6.453 ( -7.201 0.000 4.883) 8.701 6.499 ( 3.784 0.000 3.095) 4.889 6.519 ( 2.524 0.000 0.308) 2.543 6.772 ( 0.770 0.000 7.108) 7.150 6.878 ( -0.348 0.000 4.128) 4.142 6.917 ( -4.038 0.000 4.944) 6.384 6.998 ( -1.366 0.000 1.833) 2.286 7.063 ( -7.153 0.000 -0.661) 7.183 7.090 ( -8.321 0.000 3.413) 8.993 7.374 ( -5.588 0.000 6.951) 8.919 7.449 ( 5.315 0.000 -7.483) 9.178 7.514 ( -1.482 0.000 6.565) 6.731 7.517 ( -7.338 0.000 4.260) 8.485 7.718 ( 0.166 0.000 3.719) 3.723 7.736 ( -7.446 0.000 3.646) 8.291 7.973 ( -7.304 0.000 1.990) 7.571 8.000 ( -1.704 0.000 -2.402) 2.945 8.206 ( -2.516 0.000 -5.352) 5.914 8.258 ( 2.195 0.000 5.222) 5.665 8.697 ( 2.110 0.000 2.763) 3.477 8.704 ( 1.982 0.000 -5.548) 5.891 8.909 ( -3.830 0.000 -0.926) 3.940 8.925 ( -0.455 0.000 -1.337) 1.412 9.112 ( 0.571 0.000 -3.290) 3.340 9.151 ( 0.466 0.000 0.632) 0.785 9.379 ( 2.567 0.000 10.999) 11.295 9.457 ( -0.284 0.000 0.658) 0.717 9.505 ( -4.392 0.000 -2.519) 5.063 9.617 ( -5.286 0.000 9.872) 11.198 9.922 ( 0.920 0.000 3.635) 3.749 9.943 ( -2.743 0.000 2.427) 3.662 10.011 ( -2.624 0.000 -0.477) 2.667 10.636 ( 14.486 0.000 -16.383) 21.869 10.770 ( 14.018 0.000 -15.731) 21.070 10.786 ( 0.094 0.000 7.762) 7.763 10.963 ( 2.931 0.000 12.969) 13.296 11.613 ( -1.649 0.000 -8.601) 8.758 11.705 ( 0.360 0.000 2.358) 2.385 11.876 ( -2.681 0.000 -13.104) 13.376 11.957 ( 4.499 0.000 -8.853) 9.931 12.694 ( -6.216 0.000 7.657) 9.862 12.834 ( 4.046 0.000 -1.170) 4.211 12.958 ( -0.720 0.000 -1.309) 1.494 13.129 ( -4.907 0.000 5.284) 7.211 13.268 ( -0.678 0.000 -10.352) 10.374 13.342 ( -1.307 0.000 5.253) 5.413 13.563 ( 0.990 0.000 3.665) 3.796 13.681 ( -0.334 0.000 8.946) 8.952 13.787 ( 5.544 0.000 -15.808) 16.751 13.995 ( -3.862 0.000 7.904) 8.797 14.116 ( 1.192 0.000 -12.650) 12.706 14.151 ( 1.811 0.000 1.674) 2.466 14.682 ( 2.162 0.000 0.185) 2.170 14.796 ( -1.184 0.000 5.078) 5.215 15.391 ( -3.890 0.000 4.234) 5.750 15.521 ( 5.458 0.000 -2.424) 5.972 15.686 ( -0.109 0.000 -1.168) 1.173 15.909 ( 1.609 0.000 2.155) 2.690 16.743 ( -0.268 0.000 0.248) 0.365 17.115 ( -1.989 0.000 0.784) 2.138 17.142 ( 0.531 0.000 4.222) 4.255 17.182 ( -0.339 0.000 0.208) 0.398 18.020 ( -2.483 0.000 0.561) 2.546 18.095 ( 2.854 0.000 -3.065) 4.188 19.168 ( 2.770 0.000 -5.771) 6.402 19.421 ( -0.588 0.000 -2.071) 2.153 20.682 ( 1.094 0.000 4.588) 4.717 20.952 ( -0.323 0.000 8.450) 8.456 21.531 ( -0.203 0.000 -2.387) 2.396 21.665 ( -2.131 0.000 -0.038) 2.131 22.235 ( -0.866 0.000 2.261) 2.421 22.347 ( -1.288 0.000 2.595) 2.897 23.074 ( 1.331 0.000 -1.869) 2.295 23.334 ( 0.003 0.000 -0.002) 0.003 23.617 ( 2.557 0.000 10.368) 10.679 23.741 ( 0.107 0.000 -1.548) 1.552 24.104 ( 0.183 0.000 -0.095) 0.206 24.219 ( -0.686 0.000 -16.895) 16.909 25.628 ( -0.196 0.000 0.291) 0.351 25.992 ( 0.024 0.000 -0.699) 0.700 26.336 ( 0.708 0.000 1.475) 1.636 26.542 ( -0.158 0.000 2.249) 2.254 ======================= Grid point 90 (45/78) ======================= q-point: (-0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( -9.588 0.000 3.645) 10.258 2.538 ( -6.295 0.000 -3.278) 7.097 2.664 ( -11.977 0.000 11.257) 16.437 3.218 ( -3.533 0.000 -11.889) 12.403 3.235 ( -16.661 0.000 20.413) 26.350 3.598 ( 7.219 0.000 -14.434) 16.139 3.647 ( -8.170 0.000 0.963) 8.227 3.741 ( -2.447 0.000 -9.140) 9.462 4.016 ( -4.040 0.000 -9.682) 10.491 4.306 ( -0.005 0.000 2.277) 2.277 4.379 ( 6.790 0.000 2.244) 7.151 4.421 ( 13.942 0.000 -10.374) 17.378 4.493 ( -2.169 0.000 -2.200) 3.089 4.555 ( -0.103 0.000 -4.622) 4.623 4.809 ( -11.186 0.000 -0.647) 11.204 4.862 ( 8.029 0.000 -11.469) 14.000 4.893 ( -17.042 0.000 4.744) 17.690 4.972 ( 2.174 0.000 -5.677) 6.079 5.066 ( -5.079 0.000 -8.893) 10.241 5.158 ( -5.440 0.000 1.802) 5.730 5.238 ( 2.533 0.000 0.549) 2.592 5.257 ( 5.591 0.000 4.573) 7.223 5.578 ( -0.264 0.000 4.295) 4.303 5.616 ( -2.116 0.000 -4.434) 4.913 5.678 ( -3.463 0.000 0.724) 3.538 5.693 ( 2.413 0.000 -7.679) 8.049 5.966 ( -5.641 0.000 5.723) 8.036 6.050 ( -4.203 0.000 -7.697) 8.770 6.154 ( 12.333 0.000 1.723) 12.453 6.163 ( -16.030 0.000 3.700) 16.451 6.245 ( 3.229 0.000 6.178) 6.971 6.330 ( 2.333 0.000 -4.539) 5.104 6.341 ( -6.021 0.000 -4.678) 7.624 6.533 ( 4.506 0.000 -6.263) 7.716 6.560 ( 2.812 0.000 7.404) 7.920 6.718 ( -9.036 0.000 10.652) 13.968 6.831 ( 2.745 0.000 7.916) 8.378 6.865 ( -0.740 0.000 7.565) 7.601 6.968 ( 0.358 0.000 3.306) 3.326 7.030 ( 4.364 0.000 -3.564) 5.635 7.253 ( 6.517 0.000 3.312) 7.310 7.346 ( 1.176 0.000 8.987) 9.064 7.429 ( 8.442 0.000 4.597) 9.612 7.487 ( -1.426 0.000 5.553) 5.733 7.560 ( 3.073 0.000 -5.265) 6.096 7.667 ( -0.923 0.000 8.177) 8.229 7.836 ( -5.272 0.000 3.864) 6.536 7.878 ( 13.536 0.000 5.178) 14.493 8.001 ( 2.624 0.000 -2.844) 3.870 8.211 ( 2.679 0.000 -3.613) 4.498 8.340 ( 4.119 0.000 1.853) 4.516 8.700 ( -1.273 0.000 1.943) 2.323 8.751 ( 2.102 0.000 -0.909) 2.290 8.813 ( -5.409 0.000 -3.134) 6.251 8.876 ( -4.437 0.000 -2.433) 5.060 9.072 ( -7.287 0.000 -2.409) 7.675 9.146 ( 2.607 0.000 -3.101) 4.051 9.436 ( 1.329 0.000 5.370) 5.532 9.443 ( -0.264 0.000 6.623) 6.628 9.445 ( -0.736 0.000 0.969) 1.217 9.558 ( -1.838 0.000 4.574) 4.929 9.900 ( -1.768 0.000 2.693) 3.221 9.923 ( -0.912 0.000 4.019) 4.121 10.018 ( 2.958 0.000 -0.150) 2.962 10.843 ( 5.049 0.000 6.111) 7.927 10.900 ( 10.801 0.000 -11.314) 15.642 11.057 ( 4.852 0.000 12.433) 13.346 11.073 ( 16.550 0.000 -22.623) 28.030 11.557 ( -3.069 0.000 -8.798) 9.318 11.781 ( 4.547 0.000 2.844) 5.363 11.813 ( -2.121 0.000 -9.711) 9.940 12.047 ( 4.433 0.000 -10.118) 11.047 12.576 ( -4.725 0.000 7.529) 8.889 12.926 ( -2.535 0.000 0.129) 2.538 12.930 ( 4.981 0.000 -2.891) 5.759 13.032 ( -3.280 0.000 6.547) 7.322 13.258 ( 0.861 0.000 -10.215) 10.251 13.349 ( 0.943 0.000 3.686) 3.805 13.548 ( -2.578 0.000 2.029) 3.281 13.700 ( 1.660 0.000 1.930) 2.546 13.877 ( -7.548 0.000 8.784) 11.582 13.911 ( 7.779 0.000 -6.091) 9.880 14.145 ( -2.892 0.000 1.671) 3.340 14.160 ( 3.095 0.000 -9.811) 10.287 14.729 ( 0.499 0.000 1.979) 2.041 14.813 ( 4.381 0.000 1.390) 4.597 15.320 ( -3.579 0.000 4.435) 5.699 15.678 ( 4.362 0.000 -1.886) 4.752 15.678 ( 4.768 0.000 -1.991) 5.167 15.876 ( -4.377 0.000 0.236) 4.383 16.785 ( 3.830 0.000 0.799) 3.912 17.037 ( -4.163 0.000 2.518) 4.866 17.185 ( 2.353 0.000 2.478) 3.417 17.211 ( 2.792 0.000 0.407) 2.821 17.991 ( 0.100 0.000 -0.871) 0.877 18.156 ( 3.038 0.000 -2.279) 3.798 19.170 ( -1.950 0.000 -8.549) 8.769 19.349 ( -6.211 0.000 -1.829) 6.475 20.721 ( 2.081 0.000 3.693) 4.239 20.996 ( 3.916 0.000 9.247) 10.042 21.517 ( -0.895 0.000 -2.282) 2.451 21.636 ( -0.363 0.000 2.571) 2.597 22.113 ( -8.982 0.000 3.071) 9.493 22.335 ( -2.273 0.000 1.296) 2.616 23.088 ( -0.029 0.000 -2.585) 2.585 23.301 ( -2.855 0.000 -0.010) 2.855 23.632 ( -2.248 0.000 6.027) 6.433 23.741 ( 0.598 0.000 3.986) 4.031 24.153 ( 4.080 0.000 -0.117) 4.082 24.184 ( -0.902 0.000 -18.489) 18.511 25.605 ( -1.728 0.000 0.577) 1.822 26.029 ( 3.292 0.000 -0.999) 3.440 26.360 ( 1.307 0.000 1.222) 1.789 26.557 ( 1.551 0.000 1.849) 2.414 ======================= Grid point 91 (46/78) ======================= q-point: (-0.25 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.928 ( -22.518 0.000 8.819) 24.183 2.260 ( -26.578 0.000 23.157) 35.251 2.411 ( -5.183 0.000 1.417) 5.373 2.920 ( -14.468 0.000 14.721) 20.641 3.063 ( -10.267 0.000 -13.193) 16.717 3.463 ( -6.945 0.000 -9.353) 11.649 3.674 ( -0.683 0.000 4.129) 4.185 3.677 ( -3.036 0.000 -8.374) 8.908 3.895 ( -8.301 0.000 -20.335) 21.964 4.267 ( -3.954 0.000 3.554) 5.316 4.366 ( -19.415 0.000 29.673) 35.460 4.368 ( -5.452 0.000 -7.846) 9.554 4.407 ( -8.383 0.000 -5.955) 10.283 4.598 ( 8.299 0.000 6.353) 10.451 4.673 ( -4.664 0.000 -5.014) 6.848 4.708 ( 2.692 0.000 -13.861) 14.120 4.860 ( -2.803 0.000 4.505) 5.306 5.052 ( 3.626 0.000 -4.746) 5.973 5.087 ( -1.257 0.000 0.682) 1.431 5.125 ( 8.591 0.000 -11.307) 14.200 5.284 ( 1.270 0.000 1.206) 1.751 5.344 ( 1.620 0.000 9.537) 9.673 5.518 ( -8.183 0.000 9.487) 12.529 5.589 ( -4.239 0.000 -1.251) 4.419 5.631 ( 2.355 0.000 -4.625) 5.190 5.664 ( -14.979 0.000 -11.824) 19.083 5.814 ( 9.257 0.000 -14.374) 17.097 5.969 ( -1.922 0.000 -5.510) 5.836 5.970 ( 0.330 0.000 3.014) 3.032 6.179 ( -2.818 0.000 3.080) 4.175 6.314 ( 3.672 0.000 2.984) 4.731 6.318 ( -1.254 0.000 -5.165) 5.315 6.532 ( 6.679 0.000 0.178) 6.682 6.545 ( -3.959 0.000 14.122) 14.667 6.596 ( 2.783 0.000 -10.646) 11.004 6.745 ( 13.233 0.000 1.372) 13.304 6.911 ( 7.128 0.000 7.573) 10.400 6.933 ( 3.570 0.000 -1.365) 3.822 7.037 ( 5.438 0.000 -0.553) 5.466 7.135 ( 5.099 0.000 -4.772) 6.983 7.259 ( -3.667 0.000 0.923) 3.781 7.416 ( 9.064 0.000 3.814) 9.834 7.474 ( 0.415 0.000 3.005) 3.034 7.598 ( 1.359 0.000 0.620) 1.494 7.632 ( 0.386 0.000 17.383) 17.388 7.710 ( -2.231 0.000 -4.721) 5.221 7.876 ( 15.803 0.000 6.786) 17.198 7.989 ( 0.376 0.000 -2.060) 2.094 8.209 ( 6.785 0.000 6.107) 9.128 8.318 ( 10.799 0.000 -6.040) 12.374 8.407 ( 2.251 0.000 1.107) 2.508 8.650 ( -9.188 0.000 -0.300) 9.193 8.666 ( -2.784 0.000 4.793) 5.542 8.752 ( -5.366 0.000 -7.185) 8.968 8.786 ( 0.635 0.000 1.627) 1.746 8.920 ( -5.830 0.000 -3.507) 6.804 9.205 ( 3.275 0.000 -1.501) 3.602 9.435 ( -0.232 0.000 1.171) 1.194 9.444 ( 0.139 0.000 -1.550) 1.557 9.466 ( -0.928 0.000 8.728) 8.777 9.536 ( 0.426 0.000 3.633) 3.658 9.861 ( -2.441 0.000 1.130) 2.690 9.907 ( -0.924 0.000 3.604) 3.721 10.094 ( 3.831 0.000 -0.227) 3.837 11.004 ( 9.551 0.000 2.390) 9.845 11.061 ( 4.905 0.000 -2.467) 5.491 11.170 ( 4.788 0.000 9.646) 10.769 11.382 ( 12.508 0.000 -17.274) 21.327 11.478 ( -3.289 0.000 -7.843) 8.505 11.781 ( -0.631 0.000 -4.031) 4.080 11.796 ( -3.552 0.000 1.903) 4.030 12.143 ( 5.575 0.000 -2.639) 6.168 12.540 ( 0.851 0.000 -2.095) 2.261 12.851 ( -4.191 0.000 1.231) 4.368 13.032 ( 4.798 0.000 -1.261) 4.961 13.043 ( 4.328 0.000 5.200) 6.766 13.290 ( 2.600 0.000 -9.503) 9.852 13.372 ( 0.949 0.000 2.126) 2.329 13.467 ( -5.032 0.000 -0.591) 5.067 13.714 ( -8.134 0.000 8.500) 11.765 13.740 ( 1.980 0.000 -3.092) 3.672 14.030 ( -7.714 0.000 0.956) 7.773 14.119 ( 11.655 0.000 3.034) 12.043 14.207 ( 1.966 0.000 -4.251) 4.683 14.731 ( 0.645 0.000 4.256) 4.304 14.941 ( 6.082 0.000 -0.967) 6.158 15.247 ( -3.240 0.000 3.448) 4.731 15.668 ( -0.415 0.000 -0.097) 0.426 15.772 ( -4.653 0.000 -0.513) 4.681 15.900 ( 11.300 0.000 -3.840) 11.935 16.872 ( 3.812 0.000 0.831) 3.902 16.972 ( -1.890 0.000 2.282) 2.963 17.238 ( 2.564 0.000 0.318) 2.584 17.282 ( 3.614 0.000 0.554) 3.656 18.042 ( 5.236 0.000 -2.709) 5.896 18.216 ( 2.805 0.000 -1.192) 3.047 19.086 ( -4.866 0.000 -11.874) 12.832 19.165 ( -11.006 0.000 -1.980) 11.182 20.758 ( 0.673 0.000 3.103) 3.175 21.104 ( 4.475 0.000 5.646) 7.205 21.493 ( -1.314 0.000 -1.836) 2.258 21.688 ( 6.280 0.000 8.567) 10.623 21.916 ( -9.215 0.000 3.467) 9.845 22.199 ( -11.376 0.000 -2.222) 11.591 23.072 ( -1.044 0.000 -2.498) 2.708 23.232 ( -3.298 0.000 0.005) 3.298 23.566 ( -3.460 0.000 2.680) 4.377 23.754 ( -0.460 0.000 7.842) 7.855 24.179 ( 2.261 0.000 -17.911) 18.054 24.252 ( 4.833 0.000 0.007) 4.833 25.569 ( -1.573 0.000 1.005) 1.867 26.110 ( 4.144 0.000 -1.700) 4.480 26.385 ( 0.844 0.000 1.801) 1.989 26.605 ( 2.661 0.000 -0.412) 2.693 ======================= Grid point 92 (47/78) ======================= q-point: (-0.12 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( -21.206 0.000 20.366) 29.402 1.722 ( -22.327 0.000 34.279) 40.909 2.316 ( -4.379 0.000 3.735) 5.756 2.674 ( -9.184 0.000 6.311) 11.144 2.820 ( -10.880 0.000 -4.277) 11.691 3.369 ( -1.121 0.000 -14.395) 14.439 3.377 ( -25.777 0.000 33.648) 42.387 3.616 ( -2.033 0.000 -6.566) 6.874 3.702 ( -7.267 0.000 -9.665) 12.092 4.155 ( -5.951 0.000 2.945) 6.639 4.170 ( -9.314 0.000 0.294) 9.319 4.272 ( -1.784 0.000 -6.293) 6.541 4.304 ( 6.186 0.000 2.399) 6.634 4.555 ( -8.259 0.000 7.328) 11.041 4.742 ( 4.577 0.000 4.545) 6.450 4.747 ( 2.668 0.000 -5.066) 5.725 4.846 ( 0.954 0.000 4.972) 5.062 5.073 ( -1.226 0.000 -6.964) 7.071 5.095 ( 1.833 0.000 -1.276) 2.233 5.232 ( 1.763 0.000 -5.978) 6.232 5.265 ( -2.884 0.000 1.738) 3.367 5.274 ( -8.499 0.000 -0.550) 8.517 5.342 ( -2.749 0.000 8.272) 8.717 5.529 ( -1.433 0.000 -4.057) 4.302 5.581 ( 0.794 0.000 -11.388) 11.415 5.675 ( 2.134 0.000 -4.133) 4.651 5.846 ( -4.127 0.000 2.079) 4.621 5.956 ( 0.092 0.000 -2.833) 2.835 6.101 ( 8.736 0.000 -4.103) 9.652 6.141 ( -1.415 0.000 4.522) 4.738 6.361 ( 3.889 0.000 -7.822) 8.736 6.362 ( 1.428 0.000 2.953) 3.281 6.544 ( 0.842 0.000 -8.062) 8.106 6.631 ( 2.592 0.000 2.182) 3.388 6.649 ( 4.166 0.000 -9.329) 10.217 6.910 ( 4.766 0.000 3.822) 6.109 6.923 ( -2.331 0.000 -2.536) 3.445 7.053 ( -6.371 0.000 -8.015) 10.238 7.191 ( 10.576 0.000 1.525) 10.686 7.217 ( 5.863 0.000 -6.141) 8.490 7.341 ( 12.102 0.000 -5.403) 13.254 7.499 ( -1.038 0.000 0.550) 1.175 7.532 ( 5.188 0.000 3.217) 6.104 7.633 ( 2.315 0.000 2.194) 3.190 7.673 ( 0.938 0.000 -6.474) 6.541 7.737 ( 11.025 0.000 14.662) 18.344 7.957 ( -3.527 0.000 -0.274) 3.537 8.215 ( 13.333 0.000 6.692) 14.918 8.250 ( -0.456 0.000 -4.386) 4.409 8.423 ( -5.648 0.000 3.357) 6.571 8.446 ( -1.593 0.000 1.004) 1.883 8.497 ( -0.864 0.000 1.260) 1.527 8.629 ( 1.085 0.000 3.389) 3.558 8.752 ( 6.529 0.000 -9.523) 11.546 8.782 ( -1.544 0.000 3.931) 4.224 8.840 ( 0.421 0.000 -2.571) 2.605 9.280 ( 3.748 0.000 1.545) 4.054 9.378 ( -6.896 0.000 5.396) 8.757 9.426 ( -1.070 0.000 1.228) 1.629 9.450 ( 0.989 0.000 -3.394) 3.535 9.595 ( 3.777 0.000 1.156) 3.950 9.790 ( -4.404 0.000 -0.621) 4.447 9.883 ( -1.571 0.000 2.406) 2.874 10.169 ( 3.303 0.000 -0.836) 3.407 11.080 ( -3.809 0.000 9.765) 10.481 11.175 ( 3.824 0.000 -2.582) 4.614 11.251 ( 1.568 0.000 7.781) 7.938 11.424 ( -9.455 0.000 10.508) 14.135 11.478 ( 6.771 0.000 -5.354) 8.632 11.756 ( -2.402 0.000 -0.656) 2.489 11.781 ( 4.233 0.000 -13.728) 14.366 12.252 ( 4.517 0.000 0.084) 4.517 12.581 ( 3.202 0.000 -8.976) 9.530 12.775 ( -2.818 0.000 3.545) 4.529 13.123 ( 3.896 0.000 0.860) 3.990 13.203 ( 9.594 0.000 2.288) 9.863 13.316 ( -1.646 0.000 -2.821) 3.267 13.337 ( -6.676 0.000 -3.872) 7.718 13.383 ( -0.348 0.000 1.281) 1.327 13.592 ( -2.438 0.000 3.046) 3.902 13.768 ( 0.494 0.000 -3.001) 3.041 13.874 ( -5.813 0.000 -0.317) 5.821 14.179 ( -2.742 0.000 10.413) 10.768 14.405 ( 11.508 0.000 -2.045) 11.688 14.799 ( 6.547 0.000 -0.688) 6.583 15.011 ( 0.849 0.000 4.403) 4.484 15.227 ( 1.517 0.000 -1.697) 2.277 15.660 ( -0.641 0.000 1.111) 1.283 15.699 ( -1.975 0.000 -0.710) 2.099 16.083 ( 3.964 0.000 -3.247) 5.123 16.930 ( 1.566 0.000 0.671) 1.704 16.959 ( 0.014 0.000 1.524) 1.524 17.288 ( 1.571 0.000 -2.403) 2.871 17.349 ( 2.509 0.000 0.403) 2.541 18.194 ( 8.201 0.000 -3.263) 8.826 18.277 ( 3.900 0.000 0.380) 3.918 18.905 ( -12.753 0.000 -2.095) 12.924 18.972 ( -5.023 0.000 -12.922) 13.864 20.745 ( -1.671 0.000 3.009) 3.442 21.126 ( -3.923 0.000 -2.856) 4.852 21.463 ( -0.896 0.000 -1.961) 2.156 21.697 ( -15.540 0.000 -2.211) 15.697 21.886 ( 1.193 0.000 11.750) 11.810 21.990 ( 7.157 0.000 3.072) 7.788 23.054 ( -0.425 0.000 -1.386) 1.450 23.175 ( -2.017 0.000 0.061) 2.018 23.502 ( -3.109 0.000 -1.820) 3.602 23.751 ( 1.044 0.000 7.805) 7.874 24.236 ( 2.784 0.000 -11.611) 11.940 24.336 ( 2.920 0.000 0.183) 2.925 25.546 ( -0.751 0.000 1.379) 1.570 26.185 ( 2.874 0.000 -2.464) 3.786 26.394 ( -0.207 0.000 2.833) 2.840 26.640 ( -0.068 0.000 -4.574) 4.574 ======================= Grid point 93 (48/78) ======================= q-point: ( 0.00 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -3.827 29.238 19.727) 35.478 1.784 ( 2.961 20.514 30.592) 36.952 2.344 ( -3.652 8.060 -3.766) 9.617 2.600 ( -4.412 5.750 22.206) 23.359 2.879 ( 7.142 9.278 -3.061) 12.102 3.097 ( -9.679 19.697 34.017) 40.482 3.425 ( -1.909 -1.951 -3.987) 4.832 3.532 ( 0.235 5.037 -14.206) 15.074 3.664 ( -7.765 -21.231 -1.571) 22.661 3.746 ( 2.037 3.882 -0.915) 4.478 4.006 ( -4.119 -5.513 3.940) 7.930 4.207 ( -0.843 -4.477 -0.028) 4.555 4.360 ( -5.020 -1.581 0.370) 5.276 4.415 ( -1.295 2.800 5.794) 6.564 4.710 ( -2.941 -4.747 -6.259) 8.388 4.819 ( -0.041 -4.548 2.887) 5.387 4.891 ( 3.689 3.097 2.301) 5.338 5.010 ( -0.366 -5.929 -0.209) 5.944 5.116 ( -0.377 6.266 6.781) 9.240 5.238 ( -3.492 5.261 -4.773) 7.915 5.317 ( 1.375 6.803 1.341) 7.069 5.364 ( 0.557 6.442 -0.810) 6.517 5.398 ( -3.951 10.927 0.216) 11.622 5.613 ( 1.340 7.928 -15.331) 17.311 5.665 ( 0.493 5.213 -8.189) 9.720 5.708 ( -0.447 -2.039 1.720) 2.704 5.744 ( -0.881 3.735 3.952) 5.508 6.002 ( -2.701 -0.669 6.068) 6.675 6.096 ( -1.000 3.706 -6.581) 7.619 6.136 ( -4.510 0.494 7.548) 8.807 6.301 ( 0.963 -2.354 3.610) 4.415 6.359 ( 1.846 -2.363 -2.866) 4.148 6.545 ( 0.002 -2.371 -1.166) 2.642 6.565 ( 3.816 -13.488 -6.018) 15.255 6.668 ( -0.809 -12.833 4.123) 13.503 6.826 ( 4.737 -7.222 -9.870) 13.115 6.899 ( 2.474 4.388 -8.008) 9.461 6.967 ( 6.837 -15.146 -10.322) 19.562 7.134 ( 1.113 -7.538 0.024) 7.619 7.305 ( 1.042 -15.873 -3.086) 16.204 7.416 ( 2.916 7.943 -3.403) 9.120 7.475 ( 1.138 -4.408 -0.138) 4.554 7.535 ( 3.525 -2.787 0.969) 4.597 7.693 ( -4.103 0.617 -6.082) 7.363 7.722 ( 3.706 -5.320 -12.703) 14.262 7.905 ( -2.842 10.645 0.222) 11.020 7.996 ( 3.456 1.300 4.288) 5.658 8.261 ( 1.829 0.758 2.844) 3.465 8.323 ( 7.281 -1.516 0.101) 7.437 8.395 ( 0.846 1.149 2.940) 3.268 8.521 ( -4.950 6.587 -3.247) 8.856 8.635 ( 1.924 1.920 -0.573) 2.778 8.701 ( 0.111 9.901 -5.883) 11.517 8.726 ( 0.460 0.943 -0.241) 1.077 8.881 ( 4.069 -0.791 -9.633) 10.487 8.958 ( 3.876 -8.677 -4.560) 10.541 9.311 ( 1.829 2.969 -0.246) 3.496 9.363 ( 4.715 1.259 0.477) 4.903 9.498 ( 3.239 8.227 0.332) 8.848 9.551 ( -0.041 5.528 -0.318) 5.537 9.678 ( 1.285 2.502 -0.363) 2.836 9.757 ( -1.057 3.935 0.636) 4.124 9.954 ( 0.508 8.241 2.055) 8.508 10.251 ( 3.157 1.859 -2.841) 4.637 10.921 ( -13.037 0.310 21.881) 25.473 11.055 ( -14.265 -5.547 18.435) 23.961 11.177 ( -3.202 1.867 -0.685) 3.770 11.258 ( -5.051 0.539 8.908) 10.255 11.593 ( -1.578 -4.265 -2.526) 5.202 11.635 ( 6.749 -7.208 -4.450) 10.831 11.915 ( 2.655 3.980 -8.958) 10.155 12.218 ( 0.706 -8.075 -2.783) 8.570 12.613 ( 5.765 -2.075 -3.782) 7.200 12.822 ( -0.650 4.619 -0.349) 4.677 13.140 ( -7.001 -1.351 3.653) 8.012 13.189 ( -0.861 -6.115 0.636) 6.208 13.276 ( 5.758 3.118 -1.778) 6.785 13.327 ( -2.422 0.801 -0.525) 2.605 13.426 ( 2.443 3.437 -1.081) 4.354 13.666 ( 1.895 2.431 -2.280) 3.834 13.684 ( 0.032 -1.819 -1.331) 2.254 13.914 ( -1.840 6.644 1.237) 7.004 14.192 ( -0.319 3.230 11.811) 12.249 14.497 ( -1.293 -6.688 1.350) 6.944 14.634 ( -0.295 -17.050 -2.797) 17.281 14.808 ( -2.655 -16.844 3.578) 17.423 15.261 ( 2.814 1.382 -3.000) 4.339 15.517 ( -1.082 -6.584 3.769) 7.663 15.916 ( 2.515 15.032 0.864) 15.266 16.187 ( -6.559 10.796 -1.320) 12.701 16.948 ( -1.046 0.117 1.144) 1.554 17.055 ( 0.644 4.905 1.185) 5.087 17.149 ( -2.736 -0.164 -3.073) 4.118 17.498 ( -2.896 5.707 0.544) 6.423 18.264 ( -1.007 0.472 -1.069) 1.542 18.360 ( -0.757 -1.578 0.583) 1.845 18.753 ( -0.394 -0.369 -2.915) 2.965 18.836 ( -0.778 -1.352 -8.592) 8.732 20.725 ( -0.924 -0.525 4.331) 4.459 20.863 ( -8.556 -3.494 3.028) 9.725 21.433 ( -3.160 -0.016 0.690) 3.235 21.482 ( 3.240 -1.088 -1.415) 3.699 21.862 ( 1.406 -1.223 8.590) 8.790 22.112 ( 8.978 -10.963 4.817) 14.967 23.003 ( -0.144 0.216 -0.954) 0.989 23.281 ( 2.262 2.927 3.083) 4.815 23.440 ( -3.224 1.701 -4.681) 5.933 23.787 ( -6.833 -15.728 3.134) 17.432 23.968 ( 4.972 3.397 -2.005) 6.347 24.391 ( 0.333 -2.064 1.195) 2.408 25.817 ( 0.393 17.478 -7.376) 18.975 26.218 ( 0.801 -0.181 -3.016) 3.126 26.409 ( -0.164 1.587 3.490) 3.837 26.558 ( -4.004 -1.731 -3.393) 5.526 ======================= Grid point 94 (49/78) ======================= q-point: ( 0.12 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( 12.456 18.460 20.263) 30.108 1.934 ( 7.139 13.205 32.163) 35.493 2.327 ( 2.145 12.410 -2.669) 12.874 2.595 ( 4.090 1.028 20.823) 21.246 3.071 ( 10.717 12.630 -7.748) 18.287 3.270 ( 23.505 23.865 23.556) 40.950 3.415 ( 1.920 -8.773 7.098) 11.447 3.534 ( -5.222 -11.671 3.664) 13.300 3.603 ( 5.515 3.266 -17.011) 18.179 3.800 ( 3.224 5.409 -2.978) 6.966 3.908 ( -4.481 -8.859 6.271) 11.743 4.165 ( -0.561 1.974 7.899) 8.161 4.288 ( -2.051 -1.233 -5.492) 5.991 4.421 ( 4.803 3.019 -0.473) 5.693 4.642 ( -3.479 -3.333 -3.348) 5.867 4.810 ( -1.023 -7.684 6.454) 10.087 4.937 ( 0.020 7.624 -1.269) 7.729 5.039 ( 1.640 -4.487 3.391) 5.859 5.074 ( -4.387 -2.736 -0.950) 5.257 5.169 ( -0.942 10.545 -2.516) 10.882 5.276 ( -4.439 10.564 -2.218) 11.671 5.412 ( 5.936 5.450 1.182) 8.144 5.451 ( 5.091 1.307 3.575) 6.357 5.612 ( -0.250 5.152 -8.053) 9.563 5.639 ( -2.439 6.402 -0.225) 6.855 5.706 ( -2.623 -0.358 2.337) 3.531 5.760 ( 3.306 2.677 -5.880) 7.257 5.950 ( -2.535 3.300 5.364) 6.789 6.036 ( -0.833 0.267 -2.499) 2.647 6.138 ( 1.081 2.052 -0.688) 2.419 6.315 ( 1.494 -1.967 1.238) 2.763 6.406 ( 1.387 -6.276 0.855) 6.484 6.522 ( -1.738 -2.414 0.356) 2.996 6.566 ( -1.574 -7.151 -1.053) 7.398 6.680 ( 0.319 -12.461 1.707) 12.582 6.844 ( -3.781 -5.246 -8.469) 10.655 6.934 ( 2.218 -4.591 -3.229) 6.035 7.140 ( 6.411 -14.818 -9.466) 18.716 7.173 ( 3.803 0.055 -4.720) 6.061 7.288 ( -2.826 -7.937 -1.977) 8.654 7.385 ( -3.294 1.849 -4.812) 6.118 7.433 ( -5.187 -0.307 -4.808) 7.080 7.519 ( -4.229 -4.234 1.141) 6.092 7.616 ( -1.396 2.894 0.409) 3.239 7.784 ( 2.040 -0.789 -6.703) 7.051 7.882 ( -0.678 2.484 -6.039) 6.565 8.032 ( 1.647 0.257 1.774) 2.434 8.280 ( -6.591 -0.879 -0.054) 6.649 8.309 ( -1.796 -2.645 4.580) 5.585 8.384 ( -4.339 1.486 -2.409) 5.181 8.506 ( 3.320 0.802 -2.618) 4.303 8.679 ( 0.869 1.754 -5.017) 5.386 8.732 ( 3.706 5.461 -1.054) 6.683 8.787 ( 3.950 6.053 -5.894) 9.326 8.886 ( -1.666 -1.178 -11.182) 11.367 8.956 ( 0.019 -4.668 -5.853) 7.486 9.293 ( -2.504 1.858 -2.036) 3.724 9.433 ( 4.079 2.993 0.773) 5.118 9.517 ( -2.985 4.534 -0.616) 5.463 9.658 ( 1.839 2.570 -0.513) 3.202 9.697 ( 6.096 -1.253 -7.280) 9.578 9.815 ( 4.790 4.814 0.814) 6.840 9.978 ( 1.159 6.183 0.140) 6.293 10.292 ( 0.124 3.286 -5.603) 6.497 10.627 ( -15.827 -0.296 29.447) 33.432 10.711 ( -18.214 -2.993 28.186) 33.693 11.083 ( -5.429 1.661 3.757) 6.808 11.134 ( -7.879 0.994 4.106) 8.940 11.552 ( 0.998 -1.998 -5.268) 5.722 11.777 ( 4.353 -6.874 -8.931) 12.082 11.977 ( 2.942 1.589 -3.980) 5.198 12.220 ( -1.339 -9.776 -2.773) 10.250 12.727 ( 4.822 -1.194 -5.325) 7.282 12.800 ( -1.468 2.932 0.033) 3.279 12.996 ( -5.395 -1.430 1.816) 5.870 13.196 ( 0.826 -0.231 3.339) 3.448 13.239 ( -2.963 3.117 -0.881) 4.390 13.388 ( 4.189 4.481 -3.192) 6.915 13.489 ( 2.877 0.237 -3.325) 4.403 13.628 ( -4.317 3.245 2.666) 6.022 13.741 ( 3.619 -0.297 0.681) 3.694 13.924 ( 3.101 3.645 0.249) 4.792 14.149 ( -6.843 7.985 6.642) 12.438 14.457 ( -1.889 -27.581 9.248) 29.152 14.519 ( -6.371 -2.212 0.564) 6.768 14.732 ( -3.965 -12.520 0.972) 13.169 15.325 ( 2.720 0.209 -3.491) 4.431 15.503 ( -0.615 -6.119 4.639) 7.703 15.945 ( -0.820 15.757 -2.246) 15.938 16.015 ( -6.388 16.315 4.214) 18.020 16.905 ( -3.290 0.099 2.200) 3.959 17.065 ( -0.728 -2.823 1.207) 3.156 17.102 ( 0.704 5.238 -0.809) 5.347 17.419 ( -4.375 2.723 2.543) 5.746 18.157 ( -6.636 1.716 -1.230) 6.964 18.283 ( -4.670 -0.793 0.172) 4.740 18.768 ( 4.046 0.881 -1.815) 4.521 19.003 ( 11.696 -3.555 -8.068) 14.647 20.691 ( -0.504 1.270 6.434) 6.578 20.887 ( 5.244 -2.032 8.506) 10.197 21.438 ( 2.602 1.348 0.112) 2.932 21.626 ( 9.659 -2.949 1.211) 10.171 21.887 ( 0.423 -0.020 4.609) 4.628 22.216 ( 1.883 -12.359 -4.601) 13.321 22.998 ( -0.190 -0.190 -0.933) 0.971 23.350 ( 1.282 8.879 -1.705) 9.132 23.366 ( -1.133 -4.943 3.902) 6.399 23.651 ( -4.220 -9.947 5.274) 12.023 24.095 ( 6.119 2.400 -6.428) 9.194 24.369 ( -2.349 -0.120 0.086) 2.354 25.762 ( -3.831 15.555 -4.549) 16.653 26.198 ( -2.567 0.505 -3.193) 4.128 26.412 ( -0.968 0.588 3.587) 3.762 26.495 ( -0.549 -2.037 0.295) 2.130 ======================= Grid point 95 (50/78) ======================= q-point: ( 0.25 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( 11.370 3.324 23.252) 26.096 2.190 ( 13.943 8.666 11.051) 19.790 2.396 ( 6.298 14.564 0.552) 15.877 2.818 ( 14.324 1.151 18.115) 23.123 3.320 ( 6.282 7.514 -13.838) 16.953 3.433 ( -1.701 -3.300 0.215) 3.719 3.543 ( 5.706 -4.002 5.364) 8.795 3.646 ( 9.686 -5.404 2.361) 11.340 3.831 ( 13.651 -6.668 8.741) 17.527 3.934 ( 18.785 15.756 -2.327) 24.628 3.988 ( 7.502 9.837 -9.102) 15.360 4.254 ( 6.933 7.789 4.811) 11.483 4.306 ( 7.623 1.375 2.151) 8.039 4.542 ( 1.482 6.681 -2.332) 7.230 4.577 ( 1.530 -6.981 1.999) 7.421 4.795 ( -0.355 -6.181 6.954) 9.310 4.862 ( -6.940 7.051 -1.790) 10.054 4.987 ( -2.882 -2.300 6.370) 7.360 5.061 ( -0.730 1.119 -5.559) 5.717 5.171 ( 0.041 2.786 -4.404) 5.212 5.223 ( 2.600 7.599 -2.703) 8.474 5.482 ( -3.969 0.188 -5.189) 6.536 5.532 ( 3.684 1.638 -0.153) 4.035 5.603 ( 1.152 3.049 5.348) 6.264 5.635 ( -2.533 1.240 0.863) 2.949 5.685 ( 7.006 3.291 0.243) 7.744 5.761 ( -4.495 1.045 -2.738) 5.366 5.952 ( 4.438 2.788 -4.369) 6.823 6.044 ( 1.909 4.709 5.138) 7.226 6.152 ( -0.559 -3.509 -1.071) 3.711 6.320 ( -3.536 -7.461 -4.427) 9.368 6.387 ( -2.516 -5.348 1.031) 5.999 6.457 ( -3.325 -1.719 -0.141) 3.746 6.590 ( 0.926 -0.713 1.739) 2.095 6.663 ( -2.336 -5.835 -0.908) 6.350 6.737 ( -2.420 -2.268 -3.332) 4.701 6.879 ( -7.089 -6.009 -2.902) 9.736 7.101 ( -4.336 -10.370 1.580) 11.351 7.196 ( -6.384 6.682 -1.474) 9.358 7.292 ( -4.861 3.369 3.282) 6.764 7.310 ( 3.528 -8.631 -5.886) 11.026 7.369 ( 1.982 3.113 -11.254) 11.843 7.462 ( -1.448 -8.259 3.234) 8.987 7.627 ( 1.884 5.927 2.069) 6.554 7.756 ( -4.569 -4.157 3.433) 7.067 7.844 ( -1.921 0.873 -11.698) 11.887 8.059 ( 0.108 -1.654 1.257) 2.080 8.142 ( -7.182 -2.358 2.950) 8.114 8.157 ( -9.550 -5.999 4.828) 12.268 8.329 ( -3.454 0.861 -4.906) 6.062 8.515 ( -1.426 -4.422 -1.939) 5.034 8.622 ( -6.433 3.643 -6.807) 10.049 8.755 ( 0.148 -1.775 -3.248) 3.704 8.801 ( -0.883 1.915 -7.455) 7.747 8.910 ( 4.306 1.074 -5.197) 6.834 9.029 ( 4.662 3.060 -2.063) 5.945 9.257 ( -0.855 4.484 -5.026) 6.790 9.423 ( -4.729 2.265 5.607) 7.676 9.544 ( 3.662 6.805 -3.758) 8.593 9.629 ( -1.485 3.770 3.538) 5.379 9.809 ( 2.271 -7.157 -2.985) 8.080 9.891 ( 1.207 2.128 -2.318) 3.370 9.990 ( 0.057 0.765 -3.754) 3.832 10.235 ( -4.275 1.684 -4.784) 6.633 10.359 ( -9.546 -0.524 22.359) 24.318 10.435 ( -7.487 -1.859 20.614) 22.010 10.970 ( -6.051 2.264 6.229) 8.975 10.985 ( -4.982 1.757 6.131) 8.093 11.593 ( 2.031 -1.008 -5.829) 6.254 11.804 ( -0.274 -5.566 -7.205) 9.109 11.996 ( -0.888 0.727 -6.281) 6.386 12.093 ( -10.232 -3.381 0.809) 10.806 12.736 ( -2.560 -0.191 -3.866) 4.641 12.845 ( 4.959 0.087 0.937) 5.048 12.947 ( -0.091 -1.181 -0.070) 1.187 13.148 ( -1.540 5.074 -0.637) 5.341 13.314 ( 5.341 1.601 0.766) 5.628 13.441 ( 0.924 1.190 -1.450) 2.092 13.531 ( -2.056 3.813 -1.355) 4.539 13.561 ( 2.573 3.013 -4.044) 5.662 13.784 ( -1.292 -3.581 5.937) 7.052 13.989 ( 1.605 3.400 3.671) 5.255 14.053 ( 1.742 5.111 1.084) 5.507 14.285 ( -9.526 -7.025 0.182) 11.838 14.570 ( 4.231 -13.073 4.312) 14.401 14.656 ( -3.022 -9.861 -0.308) 10.318 15.355 ( 0.534 -1.261 -2.047) 2.463 15.489 ( -1.259 -5.315 4.389) 7.007 15.887 ( -2.230 15.348 -0.388) 15.514 15.963 ( -1.043 12.890 3.231) 13.330 16.824 ( -4.311 -1.517 2.600) 5.258 17.050 ( -0.470 -5.515 3.843) 6.738 17.139 ( 1.655 3.380 -3.696) 5.275 17.325 ( -4.552 0.534 1.821) 4.932 18.062 ( -2.012 2.044 -2.219) 3.626 18.184 ( -4.512 -0.294 0.302) 4.532 18.918 ( 9.215 2.919 -2.255) 9.926 19.216 ( 8.886 -3.789 -5.955) 11.348 20.702 ( 0.304 3.026 7.026) 7.655 20.965 ( 0.987 -2.391 8.776) 9.149 21.505 ( 2.935 2.166 -0.305) 3.661 21.757 ( -0.382 -2.810 3.572) 4.561 21.961 ( 8.275 -0.136 0.677) 8.304 22.254 ( 3.260 -10.458 -6.194) 12.584 22.996 ( 0.212 -1.374 -1.261) 1.877 23.264 ( -3.996 -3.158 1.483) 5.304 23.471 ( 5.530 2.871 6.556) 9.044 23.643 ( 2.372 -2.331 1.155) 3.521 24.186 ( 2.826 1.513 -8.613) 9.190 24.305 ( -3.243 2.482 -2.705) 4.898 25.700 ( -1.511 10.584 -1.056) 10.743 26.119 ( -4.336 0.113 -2.145) 4.839 26.372 ( -2.157 0.694 2.779) 3.585 26.509 ( 0.515 -3.482 1.491) 3.823 ======================= Grid point 96 (51/78) ======================= q-point: ( 0.38 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.270 ( 8.600 -0.557 7.879) 11.677 2.437 ( 9.798 0.337 5.904) 11.445 2.607 ( 12.282 12.222 -0.499) 17.334 3.173 ( 16.034 3.048 9.638) 18.954 3.358 ( -2.869 -0.819 -12.908) 13.248 3.371 ( 2.299 1.241 1.564) 3.045 3.665 ( 10.392 -4.049 -1.836) 11.303 3.922 ( -2.617 1.733 3.922) 5.023 3.997 ( 12.576 -0.464 5.479) 13.726 4.108 ( 2.798 11.134 -12.510) 16.979 4.215 ( 6.139 6.673 0.456) 9.079 4.408 ( 8.487 2.271 6.230) 10.770 4.446 ( -3.549 6.950 3.457) 8.535 4.630 ( 8.841 -0.046 -6.483) 10.963 4.722 ( 3.064 -3.370 4.130) 6.148 4.787 ( 10.952 4.966 -5.675) 13.297 4.816 ( -3.320 4.960 -0.568) 5.996 4.868 ( -0.537 -1.154 -0.353) 1.321 5.116 ( -0.645 1.002 -4.067) 4.238 5.202 ( 7.875 -1.911 -0.880) 8.152 5.337 ( -7.616 -1.852 -3.293) 8.502 5.354 ( 8.084 5.959 -0.414) 10.052 5.539 ( -2.216 1.779 -0.938) 2.992 5.573 ( -2.278 4.421 -1.229) 5.123 5.684 ( 4.978 1.342 2.225) 5.615 5.711 ( 2.770 -1.393 5.046) 5.923 5.825 ( 3.063 0.730 -6.685) 7.390 6.062 ( 0.887 -4.274 -0.477) 4.391 6.115 ( 4.081 1.061 0.161) 4.219 6.154 ( 5.129 0.714 -0.630) 5.216 6.175 ( -7.456 -2.736 2.482) 8.321 6.299 ( -5.663 -2.627 -2.208) 6.622 6.378 ( -4.428 -5.241 -2.398) 7.268 6.475 ( -4.858 -6.316 1.450) 8.099 6.667 ( -3.797 2.376 1.856) 4.848 6.728 ( 0.036 -2.557 0.169) 2.562 6.792 ( 2.430 -3.845 0.306) 4.559 7.025 ( -7.251 6.516 3.407) 10.327 7.062 ( 0.654 -3.128 5.363) 6.242 7.232 ( -2.975 4.633 3.156) 6.346 7.320 ( -2.042 -7.196 1.344) 7.600 7.350 ( -6.191 2.706 -3.534) 7.625 7.421 ( -2.268 -3.199 -3.645) 5.353 7.597 ( -5.663 -2.142 -1.752) 6.303 7.681 ( -2.837 4.021 6.779) 8.377 7.778 ( -4.598 -0.890 -3.725) 5.984 7.931 ( -7.322 -7.912 4.310) 11.610 8.023 ( -5.537 5.971 4.454) 9.282 8.045 ( -3.479 -6.294 -0.703) 7.226 8.213 ( -5.488 -3.273 -3.612) 7.340 8.441 ( -9.204 5.107 -1.987) 10.712 8.501 ( 1.068 -9.943 -2.344) 10.271 8.748 ( -2.223 -7.738 -1.304) 8.156 8.789 ( 0.694 2.983 -2.503) 3.955 8.998 ( 3.972 1.092 1.320) 4.326 9.071 ( -0.196 4.172 -3.202) 5.263 9.242 ( -0.200 5.187 -3.634) 6.337 9.358 ( -1.696 1.739 9.923) 10.216 9.517 ( -3.123 4.118 4.931) 7.143 9.650 ( 0.119 5.803 -4.738) 7.492 9.739 ( -7.361 -2.287 8.422) 11.417 9.878 ( -0.804 -6.539 -1.525) 6.762 9.959 ( -1.936 1.275 1.869) 2.977 10.129 ( -5.220 0.782 -2.950) 6.047 10.375 ( 8.800 -0.135 -3.658) 9.531 10.471 ( 8.838 -3.112 -2.576) 9.718 10.874 ( -3.249 4.010 6.858) 8.583 10.936 ( -0.432 0.816 10.736) 10.775 11.607 ( 0.060 -1.434 -4.837) 5.046 11.780 ( -1.811 -3.714 -5.237) 6.671 11.900 ( -5.328 1.295 -2.938) 6.220 11.953 ( -2.399 0.393 -9.800) 10.096 12.683 ( -2.412 -1.694 0.235) 2.957 12.911 ( 0.838 3.819 4.401) 5.887 12.963 ( 1.474 -3.114 -1.589) 3.794 13.137 ( -0.330 4.281 -2.254) 4.850 13.389 ( 0.991 4.409 -1.293) 4.700 13.406 ( -4.081 -1.105 6.006) 7.345 13.509 ( 1.436 2.273 -1.437) 3.049 13.653 ( 4.627 1.667 -6.426) 8.092 13.733 ( -1.757 -1.770 1.504) 2.912 14.042 ( 1.995 3.632 5.223) 6.668 14.116 ( -1.208 -3.360 -8.058) 8.814 14.138 ( 0.281 3.203 -0.403) 3.240 14.596 ( -0.628 -7.096 1.585) 7.298 14.654 ( 1.468 -13.359 2.745) 13.717 15.356 ( -0.150 -2.582 -0.490) 2.632 15.456 ( -1.883 -2.386 2.780) 4.120 15.877 ( 0.903 11.576 1.965) 11.776 15.960 ( 0.731 11.051 0.985) 11.119 16.740 ( -3.515 -3.121 1.755) 5.017 17.052 ( 0.394 -7.323 4.100) 8.402 17.147 ( -0.504 2.188 -2.139) 3.101 17.244 ( -3.208 0.523 1.203) 3.466 18.057 ( 1.091 1.602 -1.986) 2.775 18.103 ( -3.137 0.603 0.209) 3.202 19.099 ( 7.403 3.291 -3.527) 8.836 19.358 ( 4.905 -2.427 -3.459) 6.475 20.707 ( -0.136 3.419 6.190) 7.072 20.954 ( -1.897 -2.293 8.042) 8.575 21.541 ( 0.688 1.683 -1.448) 2.324 21.706 ( -2.926 -1.435 -0.251) 3.269 22.136 ( 6.887 -0.955 1.924) 7.214 22.322 ( 2.357 -5.466 -0.805) 6.006 23.011 ( 1.305 -2.618 -1.473) 3.275 23.205 ( -1.822 -7.977 1.604) 8.339 23.587 ( 4.983 3.638 6.593) 9.030 23.709 ( 3.100 -0.370 -0.472) 3.158 24.186 ( -2.050 2.999 -3.257) 4.879 24.258 ( -0.541 2.402 -10.780) 11.058 25.692 ( 0.426 7.298 0.242) 7.314 26.033 ( -3.345 -0.080 -1.095) 3.520 26.341 ( -0.911 0.605 2.132) 2.396 26.507 ( -0.616 -3.932 1.741) 4.344 ======================= Grid point 97 (52/78) ======================= q-point: (-0.50 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( 1.468 1.963 3.997) 4.689 2.578 ( 2.834 -2.431 2.534) 4.512 2.823 ( 5.248 9.166 -0.785) 10.591 3.255 ( -3.310 -2.635 -11.218) 11.989 3.416 ( 9.979 1.227 -15.657) 18.608 3.539 ( 4.278 4.172 8.863) 10.690 3.788 ( -7.275 8.328 5.375) 12.295 3.946 ( 11.564 1.465 -4.406) 12.461 4.006 ( -4.630 6.524 -1.425) 8.126 4.112 ( -0.920 -0.988 9.114) 9.213 4.300 ( 2.736 2.037 0.403) 3.434 4.410 ( -1.756 5.464 0.670) 5.779 4.537 ( 1.202 2.196 3.788) 4.541 4.672 ( -1.539 5.465 -8.719) 10.404 4.699 ( 4.579 2.420 -5.134) 7.292 4.830 ( 1.082 -6.028 -2.044) 6.457 4.962 ( 4.235 0.878 -8.420) 9.466 5.031 ( 4.294 0.412 -4.980) 6.589 5.066 ( -1.240 -1.454 -5.080) 5.428 5.178 ( -3.119 -1.597 -6.971) 7.802 5.303 ( 0.764 3.478 -2.511) 4.357 5.425 ( -2.585 9.079 -2.919) 9.881 5.558 ( 4.340 -0.268 3.045) 5.309 5.652 ( 1.322 -0.423 1.321) 1.916 5.725 ( -1.392 2.288 -3.647) 4.525 5.775 ( 0.348 3.875 1.858) 4.312 5.843 ( 6.858 -3.073 2.081) 7.798 6.003 ( -3.542 -2.519 -1.854) 4.725 6.060 ( -5.063 -6.708 -1.009) 8.464 6.130 ( -0.891 -3.063 -0.433) 3.220 6.225 ( 5.349 -6.024 1.875) 8.271 6.281 ( -2.858 -2.282 1.685) 4.026 6.434 ( 10.291 -2.995 2.547) 11.016 6.449 ( -0.944 -3.301 0.158) 3.437 6.588 ( -0.299 3.363 2.600) 4.262 6.716 ( -2.442 -4.079 -0.130) 4.755 6.870 ( 0.835 -0.229 7.609) 7.658 6.960 ( 0.149 4.742 5.043) 6.924 7.036 ( -9.207 -3.355 -0.845) 9.836 7.089 ( -4.540 7.676 3.932) 9.747 7.158 ( -5.950 1.811 7.847) 10.013 7.259 ( -3.925 -2.966 -0.766) 4.979 7.438 ( 2.143 -0.949 1.735) 2.916 7.477 ( -3.663 0.781 -1.448) 4.016 7.582 ( -6.581 3.596 10.074) 12.559 7.674 ( -0.563 -1.239 5.654) 5.815 7.844 ( -5.370 -6.460 5.914) 10.273 7.907 ( -1.599 7.305 0.709) 7.511 7.992 ( -1.000 -2.685 -0.461) 2.902 8.167 ( 0.085 -3.410 -5.346) 6.341 8.291 ( -3.753 1.875 5.604) 7.001 8.558 ( 3.891 -12.542 -1.090) 13.176 8.659 ( -5.150 -10.393 -3.389) 12.084 8.824 ( 2.242 1.369 0.499) 2.674 9.031 ( -2.714 4.418 -1.391) 5.368 9.081 ( 2.933 1.952 1.201) 3.723 9.211 ( -3.630 4.217 -4.229) 6.989 9.357 ( 0.596 -1.989 12.181) 12.357 9.476 ( -0.915 1.466 2.133) 2.745 9.576 ( -4.578 3.522 1.880) 6.074 9.652 ( -1.724 3.904 1.028) 4.390 9.866 ( -0.468 -5.171 2.127) 5.611 9.952 ( 0.852 2.495 3.435) 4.330 10.037 ( -2.788 1.146 -1.189) 3.240 10.619 ( 13.506 -1.268 -14.395) 19.780 10.703 ( 12.687 -4.283 -12.086) 18.039 10.851 ( 0.744 4.212 6.405) 7.702 10.981 ( 3.862 1.001 9.836) 10.615 11.612 ( 0.545 0.524 -6.666) 6.709 11.729 ( -0.729 1.442 -2.296) 2.808 11.850 ( -2.455 -2.217 -12.047) 12.493 11.933 ( 3.119 -2.423 -8.990) 9.819 12.618 ( -4.337 -1.735 5.617) 7.306 12.919 ( -0.293 0.685 4.621) 4.681 12.985 ( 0.597 -1.402 -0.601) 1.638 13.109 ( -1.818 6.324 -0.758) 6.624 13.309 ( -4.088 1.747 2.877) 5.296 13.391 ( -0.316 3.577 -1.541) 3.908 13.547 ( 1.202 -0.959 1.855) 2.409 13.675 ( -0.799 -0.161 6.462) 6.513 13.784 ( 5.346 0.154 -11.896) 13.043 14.041 ( -3.043 3.369 1.910) 4.925 14.075 ( 1.119 -1.813 -7.546) 7.841 14.196 ( 1.899 3.161 -1.177) 3.871 14.613 ( 2.082 -6.479 -0.039) 6.806 14.665 ( -0.217 -11.999 3.444) 12.485 15.339 ( -1.881 -2.244 1.924) 3.504 15.446 ( 1.390 -1.749 0.024) 2.235 15.908 ( 1.800 10.816 2.149) 11.174 15.981 ( 0.294 7.851 0.189) 7.859 16.701 ( 0.327 -2.913 0.886) 3.062 17.061 ( -0.226 -6.535 1.673) 6.750 17.150 ( 1.702 1.316 2.297) 3.147 17.183 ( -2.870 0.486 0.927) 3.055 18.042 ( -1.936 1.880 0.520) 2.748 18.101 ( 2.289 0.445 -2.305) 3.279 19.200 ( 2.436 2.960 -5.264) 6.512 19.406 ( -0.300 -1.509 -2.309) 2.775 20.717 ( 0.879 3.219 5.199) 6.178 20.931 ( -0.267 -2.020 8.188) 8.437 21.540 ( -0.456 0.964 -2.100) 2.355 21.653 ( -2.114 -1.173 -0.195) 2.425 22.212 ( -0.833 -1.478 1.971) 2.600 22.338 ( -0.227 -1.167 2.114) 2.426 23.038 ( 0.896 -3.163 -1.705) 3.703 23.183 ( -0.399 -10.894 0.920) 10.940 23.681 ( 3.400 3.602 6.700) 8.332 23.747 ( 0.271 0.497 -0.801) 0.981 24.142 ( -1.351 3.185 -3.066) 4.623 24.235 ( -0.990 1.370 -12.147) 12.264 25.702 ( 0.218 6.617 0.371) 6.631 25.994 ( -0.058 -0.048 -0.653) 0.657 26.339 ( 0.583 0.344 1.377) 1.534 26.499 ( -0.020 -3.825 2.054) 4.342 ======================= Grid point 98 (53/78) ======================= q-point: (-0.38 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.336 ( -5.993 5.182 4.192) 8.964 2.562 ( -4.139 0.916 2.508) 4.925 2.767 ( -10.030 8.668 2.621) 13.513 3.202 ( -1.807 -1.384 -10.706) 10.946 3.325 ( -17.535 9.850 19.024) 27.684 3.588 ( 3.092 0.461 -12.917) 13.290 3.732 ( -3.618 4.979 1.113) 6.254 3.856 ( -6.524 10.242 -10.903) 16.320 3.993 ( -1.838 -2.013 -6.646) 7.183 4.266 ( 7.709 -5.938 -11.877) 15.354 4.300 ( -5.065 -9.521 3.576) 11.362 4.372 ( -2.122 3.781 3.248) 5.417 4.537 ( 1.210 4.353 2.141) 5.000 4.684 ( 6.100 7.677 -8.309) 12.852 4.759 ( -6.351 -3.373 -0.522) 7.210 4.874 ( -7.532 3.016 -3.408) 8.800 4.889 ( 1.211 -1.162 -4.660) 4.953 4.964 ( -1.974 -3.986 -5.258) 6.887 5.058 ( 1.211 6.214 -5.211) 8.199 5.188 ( -0.125 -2.746 -1.653) 3.208 5.276 ( -1.509 7.935 3.460) 8.787 5.392 ( 0.847 9.255 -1.849) 9.476 5.542 ( -1.964 -2.173 -0.765) 3.027 5.613 ( -3.236 3.141 4.594) 6.438 5.747 ( 0.876 3.877 -2.210) 4.548 5.781 ( 0.679 2.620 -2.229) 3.506 5.915 ( -4.169 -3.139 1.540) 5.441 5.990 ( 2.886 -5.446 -7.131) 9.426 6.083 ( 0.127 -5.212 2.075) 5.611 6.115 ( -3.022 -5.414 -0.904) 6.265 6.216 ( 2.711 0.258 3.595) 4.510 6.291 ( 1.765 -5.268 0.057) 5.556 6.443 ( -3.693 1.284 -7.562) 8.513 6.531 ( 1.254 5.141 1.509) 5.503 6.578 ( 2.592 -2.623 -0.731) 3.760 6.669 ( -0.459 -6.877 4.118) 8.029 6.764 ( -3.977 1.347 2.509) 4.891 6.851 ( -7.777 -2.667 13.105) 15.470 7.023 ( 0.997 4.373 5.819) 7.347 7.053 ( 1.806 2.135 0.161) 2.801 7.189 ( -2.203 -6.294 4.739) 8.181 7.259 ( 7.218 -3.062 5.795) 9.750 7.418 ( 7.054 -2.035 3.152) 7.990 7.439 ( -1.576 4.361 5.621) 7.287 7.613 ( 4.010 1.503 6.203) 7.538 7.691 ( -4.883 -1.767 10.039) 11.302 7.882 ( 14.601 0.500 5.432) 15.587 7.939 ( 2.187 7.858 -2.881) 8.651 8.003 ( 2.390 -0.267 -1.818) 3.015 8.156 ( -0.099 -6.478 -0.291) 6.485 8.306 ( 3.364 -2.514 2.513) 4.894 8.551 ( -3.220 -13.105 -6.332) 14.907 8.644 ( 2.836 -5.502 -1.200) 6.305 8.852 ( -0.522 4.287 2.001) 4.760 8.957 ( -3.371 -2.198 -1.680) 4.361 9.061 ( -8.613 3.330 -1.333) 9.330 9.135 ( 0.989 2.194 -1.886) 3.057 9.385 ( 0.839 -4.575 9.954) 10.987 9.475 ( 0.474 2.686 0.959) 2.891 9.529 ( -0.242 4.915 2.182) 5.383 9.625 ( -1.242 6.060 0.329) 6.195 9.868 ( 0.576 -1.637 2.642) 3.161 9.958 ( -0.583 2.968 3.518) 4.640 10.045 ( 3.136 1.215 -0.382) 3.385 10.850 ( 8.720 -0.254 -0.701) 8.751 10.925 ( 6.528 2.789 -2.952) 7.688 10.971 ( 11.957 -4.542 -6.663) 14.422 11.111 ( 8.831 0.437 -3.185) 9.398 11.577 ( -2.682 1.869 -9.558) 10.102 11.766 ( -3.606 -2.566 -8.977) 10.009 11.797 ( 4.992 0.166 0.037) 4.994 12.032 ( 5.831 -2.459 -11.800) 13.390 12.522 ( -4.596 -1.555 9.275) 10.468 12.886 ( -2.493 -5.726 5.164) 8.104 13.003 ( 0.660 1.210 2.325) 2.703 13.085 ( 0.009 11.080 -3.550) 11.635 13.262 ( -0.222 0.012 -1.413) 1.430 13.392 ( 0.408 2.972 -0.496) 3.040 13.542 ( -1.855 -0.387 0.266) 1.914 13.670 ( -0.269 -2.536 3.138) 4.043 13.901 ( 4.817 1.349 3.669) 6.203 13.958 ( -2.679 4.239 -4.198) 6.540 14.111 ( 1.750 -0.799 -4.595) 4.982 14.198 ( -1.133 2.333 -3.233) 4.145 14.621 ( -1.485 -10.644 3.026) 11.165 14.714 ( 4.725 -8.683 -2.244) 10.137 15.291 ( -2.581 -0.371 2.775) 3.807 15.497 ( 2.756 -4.791 0.130) 5.528 15.932 ( -2.091 5.491 1.199) 5.997 15.981 ( 2.945 12.918 -0.913) 13.281 16.765 ( 5.181 -0.936 1.028) 5.364 17.041 ( -1.723 -1.221 3.343) 3.954 17.135 ( -1.296 -1.949 -0.324) 2.363 17.230 ( 5.511 0.082 1.841) 5.811 18.020 ( 0.142 2.650 -0.604) 2.722 18.151 ( 2.622 -0.485 -1.764) 3.197 19.192 ( -2.641 2.020 -7.795) 8.475 19.337 ( -6.113 -1.146 -2.367) 6.654 20.751 ( 1.771 2.782 4.513) 5.589 20.972 ( 3.561 -2.333 9.058) 10.008 21.524 ( -0.925 0.714 -1.768) 2.119 21.622 ( -0.601 -1.288 2.280) 2.687 22.106 ( -8.343 -0.293 2.442) 8.698 22.304 ( -4.533 -2.970 0.723) 5.467 23.032 ( -1.168 -4.475 -2.161) 5.104 23.192 ( 1.019 -7.909 1.462) 8.107 23.699 ( -3.250 3.263 0.976) 4.708 23.756 ( 1.949 1.184 5.190) 5.669 24.114 ( -1.824 -0.403 -9.825) 10.001 24.222 ( 1.327 1.438 -5.441) 5.782 25.701 ( -0.072 8.177 -0.205) 8.180 26.029 ( 3.131 -0.300 -0.935) 3.281 26.362 ( 1.383 0.294 1.218) 1.866 26.518 ( 1.723 -3.523 1.611) 4.240 ======================= Grid point 99 (54/78) ======================= q-point: (-0.25 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.124 ( -14.386 14.740 8.266) 22.194 2.386 ( -18.974 9.914 18.384) 28.218 2.505 ( -7.515 8.534 -3.990) 12.051 2.982 ( -15.465 7.752 20.299) 26.670 3.103 ( -7.875 4.132 -11.078) 14.206 3.579 ( -7.530 5.874 -2.555) 9.886 3.596 ( -0.223 -6.266 1.014) 6.351 3.696 ( -7.448 1.981 -15.530) 17.337 3.945 ( -6.338 4.223 -12.525) 14.659 4.095 ( -12.376 -15.808 -1.220) 20.113 4.291 ( -3.536 -4.088 0.954) 5.489 4.350 ( -4.033 1.853 -5.421) 7.006 4.428 ( -13.984 4.964 20.298) 25.144 4.551 ( -4.214 -7.224 -4.659) 9.573 4.711 ( 2.976 7.164 0.430) 7.770 4.776 ( -0.165 4.025 -7.535) 8.544 4.952 ( -5.111 3.675 1.565) 6.487 5.013 ( 4.363 -2.014 -0.625) 4.846 5.132 ( 6.330 1.346 -3.538) 7.376 5.211 ( 2.691 9.515 -4.671) 10.936 5.269 ( 0.559 -2.025 0.106) 2.103 5.390 ( -2.357 6.166 -2.310) 6.994 5.484 ( -4.207 0.042 8.878) 9.824 5.607 ( 6.239 -1.722 -1.113) 6.568 5.712 ( -5.889 2.947 -8.677) 10.893 5.782 ( -9.177 9.116 0.586) 12.948 5.844 ( 7.286 1.896 -11.444) 13.699 5.881 ( 0.081 4.344 -0.907) 4.438 6.101 ( 1.447 0.719 -3.268) 3.646 6.208 ( -1.333 1.228 1.195) 2.170 6.244 ( 1.441 -2.972 2.527) 4.159 6.291 ( 2.361 -3.474 -7.477) 8.576 6.383 ( -1.332 -8.631 3.373) 9.362 6.524 ( -4.054 -5.646 5.396) 8.800 6.606 ( -0.891 -8.471 1.755) 8.697 6.730 ( 3.199 -6.472 -0.687) 7.252 6.766 ( 13.370 3.467 -3.535) 14.257 6.893 ( 3.580 -7.904 1.887) 8.879 7.041 ( -0.426 -0.312 8.830) 8.846 7.107 ( 5.180 0.451 -2.890) 5.948 7.218 ( 1.028 -4.919 2.660) 5.686 7.307 ( 3.792 -1.631 -2.555) 4.854 7.429 ( -0.481 1.184 5.924) 6.060 7.639 ( 1.194 -0.022 19.133) 19.170 7.666 ( 5.597 -9.067 -1.073) 10.709 7.708 ( 6.366 4.674 3.078) 8.476 7.958 ( 2.247 7.748 -2.707) 8.510 8.068 ( 4.238 3.739 -3.405) 6.598 8.188 ( 4.090 -2.692 3.397) 5.960 8.230 ( 12.785 -3.842 2.746) 13.630 8.393 ( 4.568 -0.337 -0.096) 4.581 8.527 ( 2.099 -7.010 -7.411) 10.415 8.666 ( -0.722 -1.173 -0.610) 1.506 8.806 ( -3.438 1.919 1.216) 4.121 8.864 ( -7.430 4.168 0.133) 8.520 8.900 ( -3.139 -1.426 -2.376) 4.187 9.165 ( 2.177 -0.862 -1.507) 2.784 9.398 ( -0.490 -4.796 6.993) 8.494 9.490 ( 0.550 3.956 1.217) 4.175 9.542 ( 0.618 5.700 -0.122) 5.735 9.599 ( -0.708 6.714 2.450) 7.182 9.881 ( -0.266 1.665 1.852) 2.505 9.955 ( -0.037 4.091 3.304) 5.259 10.119 ( 3.459 1.411 -0.458) 3.763 11.025 ( 8.646 1.539 3.877) 9.600 11.067 ( 5.823 0.756 -4.276) 7.264 11.137 ( 4.583 -2.655 8.121) 9.696 11.315 ( 7.810 -4.411 -13.272) 16.019 11.525 ( -0.757 2.154 -6.419) 6.813 11.671 ( -4.296 -5.125 -5.762) 8.827 11.879 ( 1.803 3.104 -0.329) 3.605 12.133 ( 4.397 -1.556 -7.641) 8.952 12.478 ( 0.135 -2.811 4.599) 5.392 12.864 ( -0.416 -3.995 4.553) 6.071 12.994 ( 0.252 1.357 1.425) 1.984 13.124 ( 3.275 6.836 -2.421) 7.957 13.283 ( 1.476 -1.337 -1.109) 2.279 13.396 ( -0.394 1.443 -2.361) 2.795 13.483 ( -3.100 1.532 -1.858) 3.926 13.655 ( -1.479 -2.717 2.997) 4.307 13.829 ( -5.259 5.002 2.462) 7.664 14.052 ( -2.798 1.902 1.416) 3.668 14.127 ( 7.687 0.937 2.084) 8.019 14.210 ( 3.273 0.495 -4.789) 5.821 14.594 ( -0.943 -11.779 2.065) 11.995 14.808 ( 3.674 -11.103 -2.611) 11.983 15.243 ( -1.903 1.211 2.053) 3.050 15.537 ( 0.802 -7.037 1.257) 7.194 15.878 ( -1.789 9.234 0.312) 9.411 16.088 ( 6.417 9.531 -1.027) 11.535 16.884 ( 5.302 1.132 0.680) 5.464 17.014 ( -0.542 3.328 3.732) 5.029 17.129 ( 0.613 -4.543 -1.501) 4.824 17.367 ( 7.027 2.531 0.142) 7.471 18.062 ( 4.363 2.053 -2.174) 5.290 18.207 ( 2.870 -0.850 -0.925) 3.133 19.090 ( -6.016 0.400 -10.826) 12.392 19.156 ( -10.778 -0.884 -2.874) 11.190 20.781 ( 0.321 2.343 3.896) 4.558 21.069 ( 3.856 -3.542 6.523) 8.364 21.500 ( -1.349 0.791 -1.111) 1.918 21.658 ( 4.584 -2.889 7.725) 9.436 21.915 ( -9.026 -0.007 3.017) 9.517 22.107 ( -14.329 -7.092 -1.523) 16.061 23.008 ( -0.565 -2.982 -1.602) 3.432 23.218 ( 1.199 -3.209 2.102) 4.020 23.607 ( -4.824 2.559 -0.461) 5.480 23.800 ( 1.596 1.502 7.125) 7.455 24.047 ( -3.210 -4.494 -13.959) 15.012 24.280 ( 3.738 -0.284 -0.366) 3.767 25.713 ( 1.518 11.289 -1.657) 11.510 26.107 ( 4.028 -0.629 -1.682) 4.410 26.393 ( 1.250 0.808 1.643) 2.217 26.568 ( 2.740 -3.273 -0.357) 4.284 ======================= Grid point 100 (55/78) ======================= q-point: (-0.12 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -12.664 27.484 14.502) 33.557 1.932 ( -20.612 19.639 27.264) 39.419 2.418 ( -2.830 7.329 -4.639) 9.124 2.732 ( -9.762 6.314 18.011) 21.437 2.904 ( -7.750 7.123 -6.598) 12.423 3.408 ( -17.563 2.745 20.586) 27.199 3.472 ( -2.744 7.698 -10.562) 13.354 3.610 ( -4.660 -0.438 -1.376) 4.879 3.746 ( -5.061 -7.057 3.236) 9.267 3.877 ( -9.450 -11.013 -13.268) 19.663 4.098 ( -7.248 -2.260 10.590) 13.030 4.241 ( -3.062 -2.204 -2.711) 4.646 4.373 ( 0.866 5.761 2.107) 6.195 4.475 ( -4.099 -7.255 0.225) 8.335 4.763 ( -0.050 2.486 -1.646) 2.981 4.796 ( 2.326 -0.900 -6.101) 6.592 4.847 ( -2.275 2.498 3.345) 4.754 5.044 ( -1.297 -5.074 1.614) 5.480 5.132 ( -1.993 6.458 7.245) 9.908 5.266 ( 1.029 5.083 -5.117) 7.285 5.290 ( 0.492 -0.352 2.148) 2.232 5.359 ( 1.206 7.531 -3.923) 8.577 5.468 ( -1.586 8.307 -0.431) 8.468 5.616 ( -0.786 3.361 -17.684) 18.018 5.674 ( -1.617 8.056 -1.923) 8.438 5.726 ( 1.961 3.016 3.214) 4.824 5.801 ( -6.720 5.523 3.445) 9.355 6.013 ( 7.123 1.304 -10.880) 13.069 6.074 ( -4.074 -0.614 8.554) 9.494 6.208 ( 1.462 2.456 1.414) 3.189 6.224 ( 3.904 -8.061 -5.185) 10.349 6.359 ( 0.191 -4.053 -0.939) 4.164 6.452 ( 5.695 -10.639 -4.128) 12.754 6.562 ( 0.483 1.680 -6.985) 7.201 6.603 ( 5.042 -16.040 4.155) 17.320 6.797 ( 2.741 -12.252 -2.432) 12.788 6.852 ( -4.001 0.950 -8.050) 9.040 6.912 ( 1.144 -9.132 -1.665) 9.352 7.108 ( 2.885 -2.924 1.908) 4.529 7.248 ( 5.141 -14.158 -3.474) 15.458 7.274 ( 8.399 2.058 -0.261) 8.652 7.411 ( 4.710 -1.469 -0.977) 5.029 7.439 ( 2.693 3.497 5.077) 6.727 7.674 ( 0.894 -4.156 -7.419) 8.551 7.755 ( 0.143 -2.128 4.177) 4.690 7.808 ( 8.326 5.186 6.894) 11.989 7.998 ( -1.850 6.455 -4.831) 8.272 8.161 ( 6.005 4.354 0.115) 7.419 8.309 ( 0.668 0.221 0.549) 0.893 8.335 ( 3.081 -3.439 6.760) 8.186 8.493 ( 4.871 4.686 -2.867) 7.342 8.619 ( 1.447 -2.242 2.643) 3.756 8.693 ( 6.150 1.332 -6.716) 9.203 8.729 ( -1.260 6.823 -2.316) 7.314 8.807 ( 0.485 2.732 -0.136) 2.778 8.839 ( -0.093 -2.660 -2.807) 3.869 9.229 ( 3.992 -1.297 0.296) 4.208 9.365 ( -2.954 -1.882 4.312) 5.555 9.492 ( -0.320 5.850 2.035) 6.203 9.542 ( 0.221 6.432 -1.056) 6.522 9.628 ( 2.605 3.589 1.500) 4.682 9.835 ( -4.146 3.489 0.459) 5.438 9.954 ( -0.317 6.242 2.677) 6.800 10.186 ( 3.138 1.115 -0.990) 3.474 11.096 ( -4.095 1.343 9.262) 10.216 11.171 ( 2.329 -2.815 2.971) 4.709 11.201 ( 1.153 -1.683 0.896) 2.228 11.378 ( -1.357 -3.314 3.020) 4.684 11.471 ( -1.247 -1.598 2.882) 3.523 11.652 ( 1.255 -4.583 -5.385) 7.182 11.890 ( 0.483 5.157 -7.879) 9.429 12.197 ( 1.957 -4.471 -3.258) 5.869 12.518 ( 3.313 -2.984 -1.296) 4.643 12.841 ( -1.411 3.360 1.241) 3.849 13.085 ( 7.216 -6.665 2.445) 10.122 13.192 ( 3.061 4.062 -1.109) 5.206 13.278 ( -3.254 -3.127 2.076) 4.967 13.362 ( -1.788 0.274 -5.404) 5.699 13.429 ( -1.933 4.237 0.014) 4.658 13.633 ( 0.152 2.371 0.707) 2.479 13.730 ( -4.043 -0.676 -0.637) 4.149 13.964 ( -3.254 5.961 0.009) 6.792 14.201 ( -0.553 0.664 9.837) 9.875 14.399 ( 10.898 -0.844 -0.808) 10.960 14.593 ( 1.158 -14.640 -1.932) 14.812 14.840 ( -0.538 -13.160 1.320) 13.237 15.228 ( 0.519 1.218 -0.809) 1.552 15.536 ( -0.792 -7.284 2.342) 7.692 15.873 ( 1.116 12.921 0.988) 13.007 16.209 ( 3.902 5.968 -1.482) 7.283 16.951 ( 0.930 0.208 0.755) 1.215 17.034 ( 1.499 5.982 3.077) 6.892 17.156 ( 1.802 -3.186 -4.680) 5.942 17.492 ( 3.970 5.620 -1.391) 7.019 18.193 ( 7.121 0.113 -2.493) 7.546 18.277 ( 4.356 -0.210 0.366) 4.377 18.904 ( -11.782 -0.056 -3.349) 12.249 18.949 ( -6.398 -1.774 -11.586) 13.353 20.758 ( -2.471 1.428 3.463) 4.487 21.073 ( -5.410 -5.308 -0.280) 7.584 21.465 ( -1.393 0.284 -1.494) 2.062 21.657 ( -16.115 -5.055 -1.348) 16.943 21.852 ( 1.467 -6.564 7.506) 10.079 21.871 ( 6.387 -2.067 11.470) 13.290 23.004 ( 0.070 -0.686 -1.114) 1.310 23.245 ( 1.269 0.671 2.530) 2.909 23.514 ( -3.807 1.208 -2.427) 4.674 23.832 ( 0.990 1.157 6.466) 6.643 23.969 ( -3.255 -9.235 -10.013) 14.005 24.354 ( 2.912 -1.957 1.024) 3.655 25.766 ( 3.564 15.080 -4.518) 16.140 26.180 ( 2.907 -0.728 -2.405) 3.842 26.411 ( 0.213 1.675 2.181) 2.758 26.607 ( 0.293 -2.969 -3.649) 4.713 ======================= Grid point 101 (56/78) ======================= q-point: ( 0.00 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( -6.248 18.846 12.173) 23.289 2.271 ( -1.474 26.620 20.606) 33.696 2.391 ( -4.380 -5.306 1.006) 6.954 2.748 ( -4.892 -8.141 11.515) 14.927 2.893 ( 0.771 6.334 19.057) 20.097 3.208 ( -0.722 -19.058 11.279) 22.157 3.408 ( -3.314 2.679 -2.483) 4.932 3.484 ( 4.666 0.566 1.195) 4.850 3.729 ( -0.644 12.168 -4.857) 13.118 3.798 ( -2.302 4.200 -4.210) 6.377 4.088 ( -3.520 17.404 16.697) 24.374 4.184 ( -0.292 4.810 -12.974) 13.840 4.301 ( 0.689 -3.896 -13.416) 13.987 4.470 ( 2.916 -3.615 6.051) 7.628 4.618 ( -5.366 -0.338 1.906) 5.704 4.782 ( -3.432 -7.050 9.388) 12.232 4.815 ( -4.471 -3.187 -2.168) 5.904 4.882 ( -0.806 -6.460 0.184) 6.512 5.285 ( 0.189 6.862 -0.553) 6.887 5.343 ( 3.613 3.247 3.573) 6.030 5.407 ( -3.045 3.644 -1.210) 4.900 5.501 ( 0.506 -1.913 -1.511) 2.490 5.582 ( -1.014 9.807 1.065) 9.916 5.618 ( 1.665 4.312 1.449) 4.844 5.718 ( -1.009 -1.559 -1.168) 2.194 5.777 ( -3.584 3.270 2.985) 5.696 5.869 ( 0.513 -3.536 1.449) 3.856 5.991 ( 0.670 -18.537 4.714) 19.138 6.020 ( -1.013 11.615 -7.304) 13.759 6.193 ( 0.263 1.710 -2.564) 3.093 6.207 ( 0.935 0.169 -3.291) 3.426 6.241 ( -1.176 1.878 0.929) 2.403 6.336 ( 4.865 -7.352 -0.147) 8.817 6.431 ( -3.740 -12.900 -4.288) 14.099 6.558 ( -1.354 1.494 -1.517) 2.523 6.638 ( -0.160 -7.690 -5.809) 9.639 6.796 ( 7.459 -0.919 -9.279) 11.941 6.829 ( 4.091 -5.839 -7.541) 10.378 7.084 ( 1.801 -3.917 0.105) 4.312 7.090 ( 5.978 -1.503 -5.378) 8.180 7.342 ( 2.632 1.036 -9.163) 9.590 7.490 ( 4.542 -7.022 -10.625) 13.522 7.569 ( -1.267 2.614 2.449) 3.800 7.611 ( -3.018 -1.949 -2.372) 4.305 7.846 ( 4.345 11.677 -5.786) 13.737 8.009 ( 3.649 -2.293 0.716) 4.369 8.110 ( -1.771 5.265 6.299) 8.398 8.182 ( 1.397 -4.723 5.610) 7.465 8.366 ( -0.585 7.808 0.998) 7.893 8.448 ( 2.090 3.234 0.810) 3.935 8.536 ( -4.969 -4.228 -0.897) 6.586 8.602 ( 2.854 -6.953 -4.206) 8.613 8.748 ( 4.742 1.289 -5.292) 7.221 8.774 ( 2.940 -1.649 -5.642) 6.572 8.881 ( -0.303 2.153 -7.189) 7.510 8.892 ( 0.989 0.595 -11.056) 11.116 9.365 ( 2.233 2.064 0.230) 3.050 9.384 ( 3.865 0.312 0.278) 3.888 9.613 ( 0.314 2.558 -0.021) 2.578 9.625 ( -0.219 1.383 0.475) 1.478 9.778 ( 1.558 5.990 1.303) 6.325 9.833 ( 0.696 1.459 1.183) 2.003 10.136 ( 1.155 8.579 1.898) 8.862 10.258 ( 3.599 -2.459 -1.868) 4.742 10.915 ( -12.265 -0.257 18.250) 21.990 10.952 ( -12.051 -3.874 15.534) 20.038 11.228 ( -2.619 3.131 3.447) 5.343 11.268 ( -4.903 0.007 5.302) 7.221 11.492 ( 3.360 -3.684 -2.993) 5.815 11.508 ( -0.475 -4.664 -0.600) 4.726 11.991 ( 0.577 3.666 -6.756) 7.708 12.078 ( -0.817 -5.307 -4.306) 6.883 12.651 ( 5.886 6.215 1.830) 8.754 12.821 ( 2.754 -7.074 1.970) 7.843 13.073 ( -0.954 -1.323 1.522) 2.231 13.101 ( -5.486 -2.271 2.358) 6.388 13.315 ( 2.201 1.507 -3.022) 4.031 13.339 ( 1.202 -0.430 -2.722) 3.006 13.538 ( 1.739 6.220 -2.725) 7.010 13.634 ( 1.322 -2.990 -2.839) 4.330 13.747 ( -0.608 5.558 0.705) 5.635 13.923 ( -0.762 -10.247 2.133) 10.495 14.188 ( -2.925 7.444 6.496) 10.304 14.422 ( -2.660 -10.923 8.151) 13.886 14.460 ( -1.053 3.282 0.875) 3.556 14.562 ( -2.064 -5.835 -1.517) 6.372 15.312 ( 2.099 3.651 -1.982) 4.655 15.403 ( 0.343 -5.032 1.216) 5.188 16.168 ( 1.922 9.133 1.852) 9.515 16.276 ( -0.341 -1.144 0.854) 1.468 16.959 ( -0.862 1.258 -0.377) 1.570 17.005 ( -0.644 -3.336 -1.027) 3.550 17.354 ( -1.571 11.887 -1.796) 12.124 17.525 ( -3.002 -3.784 0.239) 4.836 18.276 ( -0.208 0.965 -1.416) 1.726 18.313 ( -0.738 -2.564 -0.166) 2.673 18.767 ( -2.035 1.687 -4.682) 5.376 18.805 ( 0.117 -1.779 -7.276) 7.492 20.733 ( -2.244 1.639 5.218) 5.912 20.788 ( -3.913 -3.494 5.607) 7.678 21.438 ( -0.820 0.593 0.045) 1.013 21.457 ( 1.485 -1.218 -0.774) 2.071 21.861 ( 2.981 1.618 7.277) 8.029 21.938 ( 5.133 -6.045 8.440) 11.582 23.062 ( 0.113 5.318 -0.121) 5.320 23.206 ( 0.971 -7.872 3.477) 8.660 23.485 ( -1.861 2.157 -3.828) 4.772 23.548 ( -3.833 -5.516 -3.411) 7.533 24.136 ( 2.469 9.163 0.235) 9.493 24.299 ( 1.057 -6.534 1.305) 6.746 26.080 ( 1.183 8.463 -7.231) 11.194 26.190 ( 1.455 -2.980 -4.252) 5.393 26.455 ( -1.346 2.758 1.187) 3.290 26.512 ( -2.666 -2.687 -1.464) 4.058 ======================= Grid point 102 (57/78) ======================= q-point: ( 0.12 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( -0.440 13.808 17.983) 22.677 2.232 ( -1.545 7.131 12.784) 14.720 2.491 ( 11.127 7.628 10.117) 16.863 2.710 ( -0.524 2.452 18.707) 18.875 3.046 ( 12.420 -5.501 10.994) 17.475 3.243 ( 3.879 -14.757 12.192) 19.531 3.423 ( 6.440 10.025 -6.293) 13.475 3.550 ( 0.012 -2.437 3.361) 4.152 3.691 ( -5.608 1.341 -4.406) 7.257 3.831 ( 7.308 -5.499 -8.118) 12.229 4.156 ( 8.864 26.842 12.517) 30.915 4.219 ( 6.979 15.668 -8.575) 19.176 4.307 ( 1.592 1.252 -9.954) 10.158 4.506 ( 0.868 4.458 5.100) 6.829 4.602 ( 0.588 -3.354 -0.318) 3.420 4.739 ( -0.237 -11.005 2.344) 11.254 4.748 ( -0.849 -3.855 2.711) 4.789 4.931 ( 4.453 -9.955 -4.449) 11.778 5.233 ( -3.524 8.978 1.318) 9.735 5.353 ( -3.904 1.182 -0.136) 4.082 5.423 ( 4.158 3.146 5.572) 7.631 5.507 ( -0.243 6.068 -2.015) 6.399 5.563 ( -0.781 8.510 -0.405) 8.555 5.598 ( -3.145 0.617 2.395) 4.001 5.696 ( -3.030 -1.126 1.215) 3.454 5.739 ( 0.100 -2.790 0.045) 2.792 5.883 ( 1.279 4.643 -2.081) 5.246 6.004 ( -1.087 -0.932 -0.246) 1.453 6.016 ( -0.947 -0.398 -5.030) 5.134 6.085 ( -3.050 -8.260 3.205) 9.370 6.161 ( -2.208 -3.552 -0.117) 4.184 6.321 ( 2.128 -13.585 -3.747) 14.252 6.348 ( 0.432 1.210 1.610) 2.060 6.472 ( 3.591 -2.682 0.330) 4.494 6.552 ( 2.248 1.579 -1.597) 3.177 6.617 ( 0.005 -10.936 0.316) 10.941 6.877 ( 0.210 1.664 -7.791) 7.970 6.930 ( 3.982 -3.168 -10.231) 11.427 7.098 ( -0.864 -3.540 -0.350) 3.660 7.176 ( 0.774 -8.971 2.309) 9.296 7.393 ( 3.817 6.707 -15.463) 17.282 7.490 ( -3.603 0.122 -3.075) 4.738 7.532 ( -3.039 2.926 -1.141) 4.370 7.622 ( 4.926 -6.172 -7.279) 10.740 7.853 ( -1.593 9.070 -5.955) 10.967 7.999 ( -3.317 1.242 0.240) 3.550 8.049 ( -5.977 2.885 2.607) 7.130 8.170 ( -5.080 -5.374 8.228) 11.063 8.309 ( -3.987 4.943 4.654) 7.873 8.434 ( -3.325 -2.356 -3.266) 5.222 8.488 ( 0.170 1.194 -4.142) 4.314 8.617 ( -1.510 -7.405 -6.548) 9.999 8.833 ( 2.731 1.248 -12.687) 13.037 8.835 ( 1.737 1.917 -4.167) 4.904 8.886 ( 0.991 0.854 -10.174) 10.258 8.903 ( 4.901 -0.331 -2.837) 5.673 9.369 ( -0.542 4.184 -2.341) 4.825 9.435 ( 2.905 -2.050 -1.737) 3.957 9.583 ( -2.261 2.311 -0.122) 3.235 9.628 ( 0.838 -2.267 -3.248) 4.049 9.803 ( -0.179 7.117 0.734) 7.157 9.895 ( 2.640 -0.422 0.571) 2.734 10.133 ( -1.545 9.393 0.958) 9.567 10.291 ( -1.170 -4.412 -3.328) 5.649 10.628 ( -15.908 0.503 27.345) 31.640 10.654 ( -16.544 -2.103 26.463) 31.280 11.124 ( -6.418 2.057 4.092) 7.885 11.148 ( -6.637 -0.079 3.010) 7.288 11.532 ( 4.381 1.377 -5.901) 7.477 11.628 ( 6.221 -7.151 -7.117) 11.853 11.999 ( 0.496 1.206 -2.113) 2.483 12.058 ( -0.991 -5.284 -0.690) 5.420 12.758 ( 2.758 3.705 -1.771) 4.946 12.824 ( -2.436 -1.372 -0.609) 2.861 13.008 ( -0.714 3.383 0.154) 3.461 13.124 ( 5.234 -6.357 2.648) 8.650 13.310 ( -1.479 3.590 -1.378) 4.120 13.379 ( 1.237 -3.092 -2.236) 4.011 13.585 ( 2.381 6.853 -2.312) 7.614 13.663 ( 0.961 -0.339 -2.249) 2.470 13.753 ( 0.509 2.533 2.797) 3.808 13.929 ( 0.692 -13.259 3.267) 13.673 14.127 ( -2.645 7.268 5.882) 9.717 14.290 ( -5.951 1.092 5.914) 8.461 14.452 ( -1.965 -5.203 2.360) 6.041 14.498 ( -3.243 -6.111 -2.683) 7.420 15.353 ( 1.449 2.244 -1.761) 3.200 15.411 ( 0.129 -3.490 1.500) 3.801 16.181 ( -0.801 7.447 0.949) 7.549 16.226 ( -3.822 3.678 0.993) 5.397 16.916 ( -3.518 1.344 1.297) 3.983 16.969 ( -2.635 -3.956 0.399) 4.770 17.285 ( -3.506 9.150 -0.686) 9.823 17.419 ( -6.121 -3.344 2.602) 7.444 18.198 ( -5.302 2.307 -1.177) 5.901 18.249 ( -4.236 -2.414 -0.252) 4.882 18.818 ( 6.829 4.025 -3.833) 8.805 18.914 ( 9.042 -4.921 -5.887) 11.858 20.742 ( 2.225 3.653 7.066) 8.260 20.824 ( 4.214 -3.955 7.904) 9.792 21.481 ( 4.371 2.908 0.018) 5.250 21.552 ( 7.111 -3.887 0.365) 8.112 21.909 ( 1.373 2.558 2.947) 4.137 22.007 ( 1.612 -7.459 1.699) 7.818 23.050 ( -1.216 5.034 -0.312) 5.188 23.199 ( -2.344 -9.233 2.761) 9.918 23.472 ( 1.660 3.711 -1.755) 4.428 23.531 ( 2.154 -2.943 -0.544) 3.688 24.195 ( 2.975 6.136 -2.365) 7.217 24.312 ( 0.163 -4.806 -0.193) 4.813 26.034 ( -4.461 10.214 -6.602) 12.954 26.174 ( -2.847 -3.671 -5.010) 6.832 26.427 ( -1.412 0.959 2.902) 3.367 26.454 ( -2.023 -1.724 1.292) 2.955 ======================= Grid point 103 (58/78) ======================= q-point: ( 0.25 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( 5.069 7.458 14.889) 17.407 2.270 ( 4.041 -2.095 8.362) 9.521 2.694 ( 7.169 13.105 5.694) 15.986 2.861 ( 13.556 -0.127 15.027) 20.238 3.287 ( 4.899 -4.055 9.246) 11.222 3.362 ( 3.710 -4.719 1.316) 6.145 3.517 ( 1.167 -0.003 4.443) 4.594 3.600 ( 9.510 -8.697 10.458) 16.597 3.751 ( 17.024 14.337 -11.632) 25.113 4.073 ( 13.156 -12.424 -10.383) 20.862 4.278 ( 6.104 12.733 -15.487) 20.958 4.374 ( 6.477 4.854 -8.580) 11.795 4.447 ( 3.759 10.834 8.696) 14.392 4.559 ( 4.508 6.186 5.372) 9.351 4.636 ( 2.732 -3.883 4.462) 6.515 4.737 ( 2.928 10.395 -3.405) 11.324 4.821 ( 6.949 -8.806 3.975) 11.901 4.999 ( 1.366 -3.448 -5.500) 6.634 5.187 ( -2.177 9.042 3.340) 9.882 5.238 ( -5.479 3.561 0.052) 6.535 5.407 ( -4.984 6.045 -1.478) 7.973 5.447 ( -3.868 2.571 -0.306) 4.654 5.551 ( -2.852 -0.259 3.647) 4.637 5.607 ( 3.961 -1.852 6.338) 7.700 5.686 ( 1.546 1.141 0.602) 2.013 5.741 ( 1.136 2.053 -1.976) 3.067 5.828 ( -5.513 1.844 -5.654) 8.109 5.917 ( -2.889 -4.433 -5.719) 7.791 6.005 ( 1.523 -4.273 -0.682) 4.587 6.121 ( 1.669 -12.851 0.466) 12.967 6.177 ( 3.525 5.175 0.497) 6.281 6.293 ( -2.896 -3.529 2.186) 5.061 6.407 ( 0.831 -3.469 -1.547) 3.888 6.484 ( -2.860 -5.099 1.360) 6.002 6.607 ( 2.978 0.108 -0.791) 3.083 6.706 ( 7.986 -5.225 2.257) 9.807 6.811 ( -4.960 2.765 -2.251) 6.108 6.873 ( -6.583 -3.981 -4.451) 8.888 7.111 ( 1.912 -5.051 -2.770) 6.069 7.166 ( -0.331 -9.668 1.810) 9.842 7.393 ( -5.511 4.582 -0.593) 7.191 7.421 ( -2.852 1.377 -4.620) 5.601 7.492 ( 1.048 10.160 -4.692) 11.240 7.701 ( 1.375 -4.224 -2.293) 4.999 7.806 ( -3.504 3.774 -2.256) 5.622 7.849 ( -7.923 3.577 3.998) 9.569 7.943 ( -3.960 -4.661 -3.549) 7.072 8.014 ( -8.407 -6.565 5.905) 12.192 8.227 ( -4.833 6.016 6.270) 9.943 8.332 ( -6.806 -2.574 0.152) 7.278 8.450 ( -3.422 1.424 -5.621) 6.733 8.566 ( -2.874 -7.350 -6.237) 10.059 8.773 ( -4.550 3.416 -10.439) 11.888 8.825 ( -1.987 -0.636 -11.948) 12.129 8.965 ( 5.450 3.898 -1.958) 6.981 9.043 ( 6.252 -2.418 -1.222) 6.814 9.371 ( -0.294 5.960 -1.870) 6.253 9.452 ( -2.931 -0.778 6.751) 7.401 9.610 ( 6.085 1.043 -9.161) 11.047 9.661 ( 2.603 -4.756 -7.504) 9.258 9.754 ( -4.868 7.055 3.147) 9.131 9.880 ( -4.818 -4.170 1.425) 6.530 10.083 ( -2.988 6.926 2.022) 7.809 10.206 ( -5.628 -4.431 -0.114) 7.164 10.370 ( -7.837 1.512 19.420) 20.996 10.403 ( -6.995 -1.415 17.392) 18.799 11.005 ( -4.769 1.452 6.808) 8.438 11.018 ( -5.594 0.521 5.918) 8.160 11.600 ( 1.608 2.323 -6.541) 7.125 11.686 ( 0.283 -5.579 -7.211) 9.121 11.999 ( -0.873 0.099 -4.121) 4.213 12.023 ( -2.868 -2.602 -1.734) 4.242 12.746 ( -2.423 0.898 -4.074) 4.825 12.784 ( 0.390 -3.165 -1.186) 3.402 13.069 ( 3.421 10.102 4.354) 11.520 13.222 ( 1.078 -0.896 4.221) 4.448 13.310 ( 3.730 0.216 -1.658) 4.087 13.377 ( -0.970 -5.221 -2.030) 5.686 13.627 ( 2.183 4.040 -1.092) 4.720 13.651 ( -1.636 2.525 -0.771) 3.106 13.756 ( -0.480 3.062 1.884) 3.627 13.951 ( 1.281 -13.298 -1.432) 13.437 14.115 ( 1.392 8.712 3.232) 9.395 14.234 ( -0.709 2.279 1.184) 2.664 14.397 ( -1.887 -5.218 0.566) 5.578 14.445 ( -1.854 -8.540 -1.047) 8.802 15.364 ( -0.133 1.543 -0.435) 1.609 15.409 ( -0.381 -2.881 2.190) 3.639 16.135 ( -3.202 7.822 -0.540) 8.469 16.164 ( -1.764 5.146 2.569) 6.016 16.817 ( -5.574 1.669 3.882) 6.995 16.908 ( -3.067 -6.804 3.581) 8.278 17.233 ( -1.636 4.636 -1.768) 5.224 17.307 ( -4.389 -2.385 1.352) 5.175 18.114 ( -2.355 2.779 -1.055) 3.793 18.163 ( -3.472 -1.803 -0.136) 3.915 19.003 ( 9.958 5.184 -3.248) 11.687 19.116 ( 9.802 -5.629 -4.489) 12.162 20.788 ( 0.977 5.065 7.448) 9.060 20.891 ( 1.001 -4.686 8.230) 9.524 21.573 ( 3.063 4.492 0.316) 5.446 21.674 ( 2.161 -4.973 1.747) 5.696 21.976 ( 6.458 2.149 -0.496) 6.824 22.066 ( 5.294 -6.950 -2.464) 9.077 23.015 ( -1.890 3.262 -0.719) 3.838 23.127 ( -4.045 -7.378 1.334) 8.519 23.551 ( 4.984 3.591 1.486) 6.320 23.605 ( 4.382 -1.910 0.537) 4.810 24.243 ( 1.636 3.549 -4.837) 6.218 24.306 ( -0.598 -2.035 -2.853) 3.555 25.929 ( -4.323 10.409 -2.995) 11.662 26.084 ( -4.669 -4.401 -3.004) 7.084 26.392 ( -1.839 1.277 2.466) 3.331 26.434 ( -0.702 -3.163 2.096) 3.859 ======================= Grid point 104 (59/78) ======================= q-point: ( 0.38 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.303 ( 7.660 3.618 7.431) 11.269 2.392 ( 6.415 -4.233 6.022) 9.764 2.886 ( 10.222 14.157 0.021) 17.462 3.149 ( 10.724 -9.851 -1.177) 14.610 3.297 ( 0.739 2.127 -1.840) 2.908 3.365 ( 1.326 -3.322 -3.586) 5.065 3.733 ( 14.893 7.569 8.494) 18.741 3.873 ( 10.476 -5.574 9.367) 15.118 4.067 ( 9.206 7.276 0.847) 11.765 4.221 ( 2.862 -3.001 -5.940) 7.244 4.397 ( 1.470 6.180 -5.733) 8.557 4.466 ( 1.200 -1.213 3.493) 3.887 4.530 ( 5.244 7.505 -1.616) 9.297 4.636 ( 1.541 -2.157 -1.908) 3.266 4.711 ( 9.019 7.330 -3.695) 12.195 4.826 ( 6.910 0.351 -1.968) 7.193 4.920 ( -6.252 4.265 -6.894) 10.238 4.974 ( 0.295 3.659 -1.400) 3.929 5.156 ( 1.337 0.581 -4.706) 4.927 5.227 ( 4.779 -4.250 5.079) 8.167 5.297 ( -5.026 7.921 -3.625) 10.057 5.426 ( -0.885 -4.979 3.445) 6.119 5.490 ( -0.950 2.023 1.428) 2.652 5.600 ( -1.926 -3.521 0.380) 4.031 5.710 ( 2.051 4.000 0.126) 4.497 5.733 ( 0.735 3.330 -6.517) 7.355 5.874 ( 4.710 -0.606 -2.190) 5.229 5.918 ( 3.370 -6.955 -0.608) 7.753 6.090 ( 6.189 -0.299 2.126) 6.551 6.113 ( -3.372 -0.347 -3.835) 5.118 6.210 ( -3.693 0.552 -3.279) 4.969 6.254 ( 2.039 -2.761 5.794) 6.734 6.289 ( -9.248 -4.972 -5.139) 11.690 6.322 ( -9.821 -4.550 0.128) 10.824 6.703 ( 0.875 2.274 4.755) 5.343 6.740 ( 3.195 5.264 1.378) 6.310 6.770 ( -2.465 -0.143 -0.742) 2.578 6.922 ( 8.883 -8.901 4.949) 13.514 7.097 ( -2.892 -1.294 -4.079) 5.165 7.195 ( 0.329 -10.155 1.677) 10.298 7.267 ( -4.005 6.369 2.895) 8.061 7.356 ( -2.256 1.701 1.368) 3.139 7.504 ( -0.417 7.037 0.150) 7.051 7.578 ( -7.439 0.983 6.976) 10.245 7.741 ( -5.844 -0.286 6.206) 8.529 7.784 ( -3.123 -1.867 -5.649) 6.720 7.820 ( -3.239 -1.348 2.814) 4.497 7.882 ( -6.100 -5.890 0.327) 8.486 8.139 ( -3.024 3.462 5.829) 7.423 8.181 ( -6.127 -0.405 -1.551) 6.333 8.332 ( -7.180 -1.986 -1.975) 7.707 8.442 ( -9.217 -7.334 -2.292) 12.000 8.678 ( -3.992 3.717 -5.972) 8.088 8.779 ( -1.564 -3.707 -6.925) 8.009 9.068 ( 4.042 4.001 2.363) 6.159 9.120 ( 1.279 -0.090 1.824) 2.230 9.345 ( -1.224 4.097 3.551) 5.558 9.389 ( -2.728 0.119 6.309) 6.875 9.608 ( -6.743 5.207 5.177) 9.969 9.696 ( -2.734 -1.441 3.883) 4.963 9.716 ( -1.156 -0.541 -5.985) 6.119 9.742 ( 0.172 -4.472 -5.248) 6.897 10.030 ( -2.079 4.339 1.609) 5.073 10.107 ( -3.882 -2.801 -1.412) 4.991 10.384 ( 7.375 1.023 -2.774) 7.945 10.415 ( 7.066 -2.104 -2.214) 7.698 10.938 ( -2.454 1.825 8.689) 9.212 10.951 ( -0.938 0.348 9.451) 9.504 11.609 ( 0.778 1.920 -5.012) 5.423 11.682 ( 0.882 -4.857 -6.604) 8.245 11.928 ( -5.268 1.076 -5.399) 7.620 11.946 ( -3.575 -0.793 -8.075) 8.866 12.707 ( -1.314 3.462 -1.157) 3.880 12.811 ( 1.384 -6.549 -2.482) 7.139 13.077 ( -2.164 8.826 7.428) 11.737 13.213 ( -2.051 -1.386 4.707) 5.318 13.365 ( 0.401 -0.603 2.123) 2.243 13.395 ( 2.854 -1.809 3.296) 4.720 13.612 ( -1.603 4.907 -3.245) 6.097 13.684 ( 1.688 -2.384 -4.587) 5.438 13.753 ( 1.521 8.060 -3.590) 8.954 13.962 ( 0.197 -10.440 -7.906) 13.097 14.162 ( 2.007 7.959 2.730) 8.651 14.244 ( 1.693 5.279 0.013) 5.544 14.388 ( 0.393 -10.258 0.508) 10.278 14.425 ( 0.170 -8.581 -0.038) 8.583 15.358 ( -0.282 1.777 1.075) 2.096 15.405 ( -0.105 -2.562 2.581) 3.638 16.081 ( -1.787 7.923 0.754) 8.157 16.140 ( -0.882 3.618 1.008) 3.858 16.719 ( -3.410 2.797 3.547) 5.659 16.864 ( -1.032 -9.820 3.790) 10.576 17.201 ( -1.389 2.478 -0.673) 2.919 17.238 ( -2.559 -1.087 0.672) 2.860 18.091 ( -0.107 1.476 -0.658) 1.619 18.109 ( -1.778 -0.192 -0.002) 1.788 19.186 ( 7.148 4.989 -3.259) 9.306 19.286 ( 6.246 -4.492 -3.224) 8.342 20.795 ( -0.406 4.824 6.872) 8.406 20.888 ( -1.275 -4.079 7.547) 8.674 21.594 ( -0.513 3.321 -0.939) 3.489 21.661 ( -1.995 -2.936 -0.540) 3.590 22.134 ( 6.835 1.501 0.627) 7.026 22.206 ( 6.536 -5.240 -0.205) 8.380 22.982 ( -0.955 0.496 -0.998) 1.468 23.048 ( -3.304 -6.075 0.470) 6.931 23.655 ( 4.500 2.754 2.601) 5.882 23.695 ( 3.801 -1.226 0.843) 4.082 24.249 ( -0.808 2.819 -5.236) 6.001 24.285 ( -1.075 -0.328 -6.220) 6.321 25.866 ( -1.563 8.609 -0.369) 8.758 26.000 ( -2.945 -3.925 -0.970) 5.002 26.362 ( -1.041 1.647 1.812) 2.661 26.418 ( -0.817 -4.006 1.741) 4.444 ======================= Grid point 105 (60/78) ======================= q-point: (-0.50 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 3.413 3.359 4.903) 6.853 2.510 ( 3.632 -3.930 5.494) 7.669 3.021 ( 1.191 9.403 -4.137) 10.342 3.178 ( -2.490 -5.586 -7.697) 9.831 3.457 ( 12.012 2.843 -15.228) 19.603 3.529 ( 12.413 -3.798 -9.886) 16.317 3.935 ( -4.804 5.733 9.584) 12.157 3.995 ( 2.803 0.165 7.660) 8.158 4.118 ( -1.120 5.873 5.402) 8.058 4.211 ( -2.965 0.231 -0.315) 2.990 4.338 ( -3.651 8.482 4.886) 10.447 4.502 ( -1.085 -3.230 7.292) 8.049 4.547 ( 0.591 4.556 -0.292) 4.603 4.669 ( 1.709 -3.640 -2.470) 4.719 4.794 ( -3.200 2.694 -7.615) 8.688 4.815 ( -2.850 2.315 -10.947) 11.546 4.953 ( 1.391 0.140 -8.319) 8.436 5.019 ( 6.518 -3.514 -2.964) 7.976 5.180 ( 1.196 11.192 -3.881) 11.906 5.225 ( 1.002 9.699 -8.117) 12.686 5.394 ( 6.180 4.338 0.870) 7.601 5.457 ( 3.386 -6.941 5.916) 9.728 5.514 ( 8.744 -7.774 -5.174) 12.793 5.584 ( -2.941 -9.231 -1.470) 9.799 5.766 ( 3.037 4.246 -1.694) 5.489 5.785 ( 2.670 1.478 0.038) 3.052 5.832 ( -11.093 1.856 -1.405) 11.335 5.949 ( -6.091 -5.426 -1.246) 8.252 5.996 ( 3.150 4.175 -0.974) 5.320 6.046 ( -7.036 1.310 -8.359) 11.004 6.148 ( 0.462 -6.527 1.954) 6.829 6.186 ( -0.963 -6.970 -3.935) 8.062 6.352 ( 5.825 -3.415 3.546) 7.627 6.361 ( 7.937 -2.669 3.552) 9.096 6.618 ( -4.834 2.196 1.357) 5.480 6.693 ( -3.034 -2.618 1.374) 4.236 6.883 ( 4.344 3.365 3.430) 6.478 6.963 ( -7.112 -3.560 -1.432) 8.082 7.055 ( -2.280 0.372 7.468) 7.817 7.129 ( -1.878 3.194 6.734) 7.686 7.239 ( -1.614 5.871 4.671) 7.674 7.327 ( -2.704 0.296 6.505) 7.051 7.463 ( -3.334 5.539 7.268) 9.727 7.530 ( -0.975 0.214 1.853) 2.105 7.622 ( -3.675 3.120 8.025) 9.362 7.675 ( -1.929 0.881 -0.240) 2.134 7.760 ( -0.669 -1.109 6.278) 6.410 7.856 ( 2.486 -8.340 -0.780) 8.738 8.052 ( -5.342 6.042 3.050) 8.622 8.125 ( -2.802 0.395 -1.447) 3.179 8.224 ( -7.236 -8.981 3.309) 11.999 8.248 ( 1.254 -11.984 -1.059) 12.096 8.608 ( -1.516 4.865 -2.796) 5.813 8.751 ( -0.494 -6.999 -1.924) 7.275 9.102 ( -1.637 3.490 2.293) 4.485 9.158 ( 2.233 0.592 4.355) 4.930 9.299 ( -4.640 3.828 3.606) 7.013 9.342 ( -3.383 0.478 3.932) 5.208 9.518 ( -0.947 2.878 1.288) 3.292 9.584 ( -2.549 -2.571 0.390) 3.641 9.725 ( 1.073 3.027 -1.769) 3.667 9.787 ( 2.213 -2.785 -0.078) 3.559 10.006 ( -0.116 2.567 1.877) 3.182 10.042 ( -1.989 -0.748 -0.508) 2.185 10.603 ( 12.609 0.028 -12.615) 17.836 10.628 ( 12.547 -2.588 -12.173) 17.672 10.932 ( 1.389 3.402 7.838) 8.656 10.981 ( 3.063 -1.226 8.204) 8.843 11.647 ( 2.557 2.933 -7.316) 8.286 11.718 ( 2.208 -3.051 -8.816) 9.587 11.825 ( -3.626 0.863 -6.948) 7.884 11.871 ( -1.163 -3.112 -7.798) 8.477 12.661 ( -3.626 5.291 3.538) 7.326 12.802 ( -2.611 -7.899 1.314) 8.423 13.052 ( 0.087 6.296 5.284) 8.220 13.173 ( -0.986 -3.629 4.997) 6.253 13.378 ( -0.121 4.633 4.324) 6.338 13.428 ( 0.354 -0.444 2.064) 2.140 13.572 ( -1.745 4.253 -3.908) 6.034 13.659 ( -2.649 -2.577 -1.273) 3.908 13.832 ( 5.145 5.414 -6.847) 10.133 13.970 ( 1.488 -6.454 -9.841) 11.862 14.182 ( -0.325 7.729 1.454) 7.871 14.282 ( 1.257 5.292 -1.001) 5.531 14.391 ( -0.512 -11.567 0.890) 11.612 14.453 ( 2.472 -8.879 -1.325) 9.312 15.353 ( -0.512 2.638 2.316) 3.548 15.409 ( 0.344 -2.347 2.096) 3.166 16.062 ( -0.268 6.123 1.499) 6.309 16.125 ( -0.550 1.925 0.230) 2.015 16.704 ( 2.084 4.942 1.982) 5.718 16.879 ( 2.186 -10.284 1.956) 10.694 17.178 ( -0.727 1.148 1.413) 1.960 17.190 ( -2.049 -0.038 1.394) 2.478 18.082 ( -0.596 1.727 0.187) 1.836 18.104 ( 0.963 -0.369 -0.821) 1.319 19.277 ( 1.579 4.223 -4.111) 6.101 19.357 ( 0.526 -3.343 -3.006) 4.527 20.797 ( 0.394 4.197 6.474) 7.725 20.875 ( -0.047 -3.345 7.506) 8.218 21.572 ( -1.168 2.135 -1.263) 2.742 21.618 ( -1.871 -2.129 -0.515) 2.881 22.214 ( -0.026 2.185 1.016) 2.410 22.287 ( 0.623 -3.844 1.020) 4.025 22.976 ( -0.145 -1.923 -0.961) 2.155 23.002 ( -0.261 -5.325 0.051) 5.332 23.732 ( 2.522 1.575 2.585) 3.940 23.751 ( 1.184 -0.307 0.635) 1.379 24.211 ( -2.060 3.103 -5.265) 6.449 24.250 ( -1.632 -0.467 -6.746) 6.957 25.856 ( 0.384 7.423 0.229) 7.437 25.968 ( 0.014 -3.151 -0.299) 3.165 26.356 ( 0.382 1.513 1.289) 2.024 26.412 ( 0.243 -4.012 1.591) 4.322 ======================= Grid point 106 (61/78) ======================= q-point: (-0.38 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( -2.125 5.163 3.972) 6.852 2.537 ( -1.210 -3.415 4.278) 5.606 2.955 ( -6.339 9.522 -1.368) 11.521 3.129 ( -1.421 -6.492 -5.295) 8.497 3.600 ( -6.127 11.485 -2.093) 13.185 3.660 ( -6.952 8.951 -1.189) 11.396 3.748 ( -4.556 -3.864 -4.909) 7.732 3.883 ( -7.032 -8.091 4.235) 11.526 4.066 ( -3.351 5.271 -2.787) 6.839 4.138 ( -4.229 -3.948 0.527) 5.809 4.270 ( -4.913 7.786 -9.005) 12.878 4.443 ( -2.689 -2.182 0.648) 3.523 4.550 ( -3.995 0.318 -5.657) 6.933 4.650 ( -1.835 -5.853 -2.164) 6.505 4.780 ( 3.698 2.329 -5.286) 6.859 4.833 ( 4.300 -3.203 -2.383) 5.867 4.967 ( 0.465 4.387 -3.928) 5.906 5.037 ( -2.113 1.542 -3.414) 4.301 5.182 ( -3.666 12.479 -3.285) 13.415 5.272 ( 3.817 12.105 -5.230) 13.728 5.444 ( 0.723 3.285 6.652) 7.454 5.492 ( -1.801 -2.756 2.209) 3.965 5.522 ( 1.310 0.165 1.619) 2.089 5.607 ( -10.044 -5.840 -5.589) 12.893 5.721 ( -0.455 -2.872 -0.671) 2.984 5.798 ( 8.499 -10.789 -3.831) 14.259 5.839 ( 2.809 3.401 3.240) 5.473 5.922 ( 1.071 4.010 -4.263) 5.949 5.968 ( 0.023 -5.249 -2.514) 5.821 6.046 ( 1.142 -5.561 -5.391) 7.829 6.131 ( -3.254 0.921 -1.063) 3.545 6.220 ( 5.933 -1.753 0.769) 6.234 6.403 ( 3.483 -3.845 -0.258) 5.194 6.455 ( -1.056 -6.409 -1.461) 6.657 6.586 ( -1.392 4.880 6.808) 8.491 6.704 ( -1.363 -5.061 8.120) 9.665 6.790 ( -6.101 7.931 0.383) 10.014 6.880 ( -7.061 7.513 6.255) 12.060 6.948 ( -2.319 -7.867 1.041) 8.268 7.051 ( 1.893 -5.795 1.967) 6.406 7.231 ( -6.176 7.424 2.053) 9.873 7.331 ( -3.325 7.468 12.570) 14.995 7.368 ( 3.781 -1.265 0.532) 4.022 7.515 ( 0.411 -6.388 11.861) 13.478 7.603 ( 1.093 6.854 6.699) 9.647 7.711 ( 0.789 -1.401 1.627) 2.287 7.874 ( 10.042 1.270 6.616) 12.093 7.953 ( 5.567 -5.448 -1.699) 7.973 7.993 ( -0.757 -0.748 3.003) 3.186 8.048 ( 4.445 -2.336 4.644) 6.840 8.264 ( 5.772 -0.815 -1.724) 6.079 8.317 ( 4.188 -7.771 -3.814) 9.616 8.621 ( 2.419 3.758 -3.483) 5.666 8.758 ( 0.913 -8.392 -2.438) 8.787 9.008 ( -6.895 5.739 0.489) 8.984 9.120 ( -8.210 -3.059 0.824) 8.801 9.203 ( -1.621 5.115 4.047) 6.721 9.288 ( -1.238 -3.923 6.215) 7.453 9.547 ( 2.218 3.640 -0.549) 4.298 9.586 ( 1.493 0.415 -0.095) 1.553 9.754 ( 1.517 5.946 -0.755) 6.182 9.843 ( 2.875 -2.113 1.919) 4.051 10.016 ( 0.572 2.245 2.202) 3.196 10.046 ( 2.609 -0.868 0.241) 2.761 10.845 ( 10.908 0.492 -5.694) 12.314 10.882 ( 11.384 -3.151 -6.632) 13.547 11.010 ( 5.710 4.268 0.880) 7.183 11.085 ( 6.451 -2.774 0.603) 7.048 11.626 ( -3.273 2.853 -10.558) 11.416 11.694 ( -4.324 -3.788 -11.463) 12.824 11.836 ( 5.506 3.655 -2.429) 7.041 11.938 ( 6.314 -5.805 -8.613) 12.155 12.573 ( -4.556 5.916 8.133) 11.041 12.727 ( -3.736 -8.531 5.535) 10.834 13.083 ( 1.844 5.607 4.008) 7.134 13.188 ( 1.603 -3.414 3.906) 5.430 13.342 ( -3.278 8.353 -1.432) 9.087 13.428 ( -0.443 -0.122 -0.407) 0.614 13.543 ( -1.064 0.978 -2.143) 2.585 13.602 ( -1.966 -4.034 1.174) 4.638 13.943 ( 5.665 2.838 -1.883) 6.610 13.993 ( 0.353 -1.257 -6.243) 6.378 14.162 ( -0.830 5.395 -0.623) 5.494 14.270 ( -2.617 2.135 -0.980) 3.517 14.384 ( 0.599 -6.450 -0.685) 6.514 14.513 ( 3.110 -10.381 -3.882) 11.511 15.334 ( -1.365 3.802 2.279) 4.638 15.416 ( 0.023 -3.925 1.792) 4.315 16.061 ( -0.026 6.252 1.527) 6.436 16.131 ( 1.339 1.013 0.985) 1.947 16.801 ( 6.340 5.143 0.843) 8.207 16.941 ( 2.994 -7.251 1.257) 7.945 17.153 ( -0.688 2.512 1.112) 2.832 17.206 ( 3.525 -2.254 1.986) 4.632 18.082 ( 0.739 3.030 -0.357) 3.139 18.131 ( 1.712 -1.660 -0.813) 2.519 19.245 ( -4.182 2.947 -5.945) 7.843 19.301 ( -5.523 -2.399 -3.881) 7.164 20.824 ( 1.535 4.105 6.413) 7.768 20.907 ( 2.423 -3.837 8.180) 9.354 21.548 ( -1.001 1.717 -0.219) 2.000 21.588 ( -0.954 -1.953 1.425) 2.599 22.127 ( -7.887 2.913 0.686) 8.435 22.218 ( -7.575 -5.165 -0.184) 9.170 22.973 ( 0.697 -0.010 -0.618) 0.932 23.041 ( 2.936 -6.124 0.463) 6.807 23.738 ( -2.472 1.262 -0.537) 2.827 23.760 ( -0.053 -0.798 1.268) 1.499 24.160 ( -2.356 3.798 -5.332) 6.957 24.222 ( -0.343 -1.651 -3.066) 3.499 25.878 ( 1.769 8.021 -0.870) 8.260 25.997 ( 2.596 -3.425 -0.884) 4.387 26.380 ( 1.745 1.642 1.167) 2.665 26.436 ( 2.010 -3.843 1.221) 4.505 ======================= Grid point 107 (62/78) ======================= q-point: (-0.25 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 122 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( -4.154 8.920 3.905) 10.586 2.486 ( -3.688 -1.357 2.745) 4.793 2.768 ( -11.527 17.934 6.837) 22.388 3.122 ( 0.677 -8.081 0.819) 8.150 3.270 ( -17.244 11.662 14.971) 25.641 3.369 ( -19.280 -4.133 6.977) 20.916 3.597 ( -9.243 -2.355 -4.483) 10.539 3.694 ( -10.518 -6.832 0.293) 12.546 4.017 ( -8.947 8.561 -15.072) 19.506 4.041 ( -2.075 3.917 -10.803) 11.677 4.199 ( -0.622 -2.914 -4.802) 5.651 4.323 ( -5.410 -10.835 -13.933) 18.460 4.482 ( -3.608 7.550 -1.429) 8.489 4.566 ( -9.158 3.000 5.167) 10.934 4.781 ( -1.642 1.768 5.488) 5.995 4.838 ( 1.282 0.969 -0.536) 1.694 4.981 ( 0.461 0.063 -5.631) 5.650 5.012 ( -5.026 -1.438 -1.715) 5.502 5.256 ( 8.123 11.336 1.929) 14.079 5.279 ( 0.590 6.590 0.173) 6.619 5.379 ( -4.985 1.359 1.411) 5.356 5.460 ( -1.732 -0.167 0.778) 1.906 5.529 ( -2.811 2.289 2.548) 4.432 5.605 ( 10.874 3.961 0.296) 11.577 5.760 ( -1.047 2.352 -4.719) 5.376 5.791 ( 3.449 -13.161 3.153) 13.966 5.827 ( -5.733 -7.140 -0.637) 9.179 5.920 ( -0.662 -4.106 4.027) 5.789 6.033 ( 5.293 2.863 -8.992) 10.820 6.115 ( 7.781 -3.901 -12.276) 15.049 6.229 ( 4.972 3.394 1.026) 6.107 6.259 ( -4.603 1.048 0.118) 4.722 6.373 ( -6.024 5.865 -3.371) 9.058 6.476 ( -5.338 1.861 7.234) 9.181 6.491 ( -0.847 -7.039 -0.649) 7.120 6.529 ( -1.253 -4.240 2.760) 5.212 6.750 ( -0.664 -5.312 3.689) 6.502 6.864 ( -1.334 -9.317 -3.487) 10.037 6.960 ( 3.651 5.097 2.507) 6.753 7.123 ( -2.302 1.413 2.770) 3.869 7.171 ( 1.666 -4.746 2.465) 5.602 7.242 ( 3.438 -2.290 -0.106) 4.132 7.496 ( 5.532 4.860 -2.617) 7.815 7.572 ( 3.986 1.227 2.803) 5.025 7.651 ( 2.650 1.252 12.516) 12.854 7.745 ( 2.002 -4.577 1.638) 5.257 7.993 ( 5.512 3.570 7.669) 10.096 8.118 ( 7.818 -4.087 8.533) 12.273 8.145 ( 8.212 2.104 -2.040) 8.719 8.229 ( 12.404 -0.853 -2.606) 12.703 8.384 ( 4.882 -0.225 -0.236) 4.893 8.418 ( 6.618 -1.825 -5.711) 8.930 8.669 ( 1.821 1.814 -7.122) 7.571 8.748 ( -2.125 -5.869 -4.360) 7.614 8.883 ( -3.530 3.292 2.110) 5.268 8.941 ( -7.332 -0.771 2.790) 7.882 9.195 ( 0.727 3.308 1.636) 3.762 9.285 ( 0.352 -5.373 4.099) 6.767 9.580 ( 1.035 3.846 -0.256) 3.991 9.613 ( 0.801 1.018 -0.025) 1.296 9.775 ( 0.359 8.757 1.162) 8.841 9.892 ( 1.062 -1.954 2.446) 3.306 10.047 ( 2.036 4.380 2.107) 5.269 10.115 ( 3.444 -2.016 0.150) 3.994 11.036 ( 6.973 0.433 1.999) 7.267 11.070 ( 6.778 -2.297 2.714) 7.654 11.133 ( 4.627 3.947 -1.774) 6.335 11.225 ( 5.857 -4.526 -5.816) 9.414 11.547 ( -3.497 0.982 -4.591) 5.854 11.591 ( -3.688 -3.057 -8.194) 9.491 11.946 ( 4.185 4.259 -4.960) 7.763 12.054 ( 4.484 -5.690 -9.821) 12.203 12.516 ( -1.024 6.345 9.316) 11.318 12.691 ( 0.249 -9.925 7.495) 12.440 13.105 ( -0.445 6.745 3.068) 7.423 13.220 ( 0.554 -3.683 3.913) 5.402 13.278 ( -1.586 6.480 -4.831) 8.237 13.387 ( -3.002 -2.987 -4.235) 5.989 13.528 ( 0.027 2.832 -1.610) 3.258 13.594 ( 0.572 -3.441 1.392) 3.755 13.928 ( -5.670 4.993 0.685) 7.586 14.032 ( 0.157 -4.389 1.740) 4.724 14.181 ( 1.894 3.350 -0.355) 3.865 14.230 ( 2.378 -0.126 -1.432) 2.779 14.418 ( 2.523 -0.365 -2.654) 3.680 14.569 ( 2.339 -11.346 -3.879) 12.216 15.306 ( -1.371 4.508 1.686) 5.004 15.411 ( -0.520 -5.657 1.736) 5.940 16.072 ( 1.167 8.438 1.958) 8.740 16.177 ( 2.782 -0.933 1.522) 3.305 16.920 ( 3.833 2.481 0.402) 4.584 16.987 ( 1.295 -3.981 1.564) 4.469 17.191 ( 4.834 7.990 -0.151) 9.340 17.339 ( 8.458 -5.199 0.164) 9.930 18.120 ( 3.191 3.254 -1.242) 4.724 18.178 ( 2.969 -2.168 -0.752) 3.752 19.105 ( -8.272 1.107 -8.246) 11.732 19.131 ( -9.946 -1.382 -5.240) 11.327 20.854 ( 0.141 4.736 5.909) 7.574 20.967 ( 1.673 -5.945 7.395) 9.635 21.529 ( -1.201 2.161 1.267) 2.778 21.587 ( 0.583 -3.478 4.867) 6.010 21.926 ( -9.883 1.396 1.324) 10.069 21.983 ( -13.341 -4.439 -0.681) 14.076 23.005 ( 2.089 2.808 -0.297) 3.512 23.108 ( 3.174 -6.443 1.392) 7.316 23.657 ( -4.778 2.727 -1.954) 5.838 23.732 ( -2.613 -4.822 -1.849) 5.788 24.114 ( -1.500 6.888 -2.443) 7.460 24.233 ( 1.345 -4.261 0.130) 4.470 25.932 ( 3.530 9.076 -2.909) 10.164 26.065 ( 3.742 -4.009 -2.096) 5.871 26.424 ( 2.250 2.437 0.976) 3.458 26.491 ( 2.831 -3.886 0.053) 4.809 ======================= Grid point 108 (63/78) ======================= q-point: (-0.12 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.282 ( -5.489 14.050 4.893) 15.858 2.365 ( -8.652 13.501 13.507) 20.966 2.540 ( -8.864 12.332 2.359) 15.369 2.946 ( -12.548 8.108 11.340) 18.756 2.987 ( -13.683 -3.799 16.872) 22.053 3.199 ( 1.772 -21.283 8.102) 22.842 3.449 ( -2.800 1.634 -2.106) 3.866 3.515 ( -6.766 -3.247 3.475) 8.270 3.817 ( -7.109 10.672 -15.034) 19.760 3.916 ( -7.367 2.322 -11.663) 13.989 4.159 ( -2.918 3.622 7.573) 8.888 4.274 ( -9.134 11.183 1.592) 14.527 4.285 ( 0.737 -9.601 -10.966) 14.594 4.468 ( -3.058 -0.503 1.951) 3.662 4.751 ( -4.580 2.013 2.326) 5.518 4.842 ( -1.809 -1.098 7.744) 8.028 4.900 ( -4.341 1.022 -2.593) 5.159 4.937 ( -3.360 -3.764 0.732) 5.098 5.265 ( 0.974 2.537 -2.579) 3.746 5.295 ( -0.672 6.436 5.711) 8.631 5.419 ( 4.657 2.098 -0.076) 5.108 5.472 ( -1.425 5.028 -0.957) 5.312 5.540 ( 3.822 0.716 0.352) 3.905 5.678 ( -4.639 6.677 -0.590) 8.152 5.747 ( -0.644 -3.831 -2.360) 4.545 5.803 ( 3.869 5.024 4.652) 7.864 5.867 ( -0.479 -18.034 4.532) 18.601 5.958 ( 3.643 -9.507 4.414) 11.096 6.073 ( -6.462 9.915 -7.739) 14.140 6.120 ( 3.418 6.056 -7.875) 10.506 6.179 ( -0.960 0.536 -6.333) 6.428 6.268 ( 1.987 -6.324 3.275) 7.394 6.288 ( 0.137 4.164 -1.609) 4.466 6.487 ( 0.156 -9.573 -5.505) 11.044 6.537 ( 4.756 -0.851 -3.749) 6.115 6.572 ( 4.228 -2.295 -9.883) 10.992 6.735 ( -0.731 -4.521 1.378) 4.782 6.797 ( -1.962 -15.605 -5.802) 16.764 7.004 ( 1.642 2.024 2.083) 3.336 7.077 ( -1.453 -2.451 2.950) 4.102 7.263 ( 5.908 2.153 -4.025) 7.466 7.377 ( 6.566 -4.468 -4.636) 9.196 7.571 ( 1.430 4.053 -2.500) 4.972 7.668 ( -0.533 2.641 3.290) 4.252 7.707 ( 6.406 1.555 -5.030) 8.292 7.844 ( 8.744 -3.128 5.434) 10.759 8.098 ( 2.535 3.648 6.809) 8.131 8.201 ( -0.546 -6.451 6.188) 8.956 8.297 ( 5.606 9.511 0.398) 11.047 8.427 ( 3.408 7.549 -3.493) 8.989 8.496 ( 6.848 -7.548 1.151) 10.257 8.557 ( 4.826 -3.426 -4.553) 7.467 8.684 ( 1.357 1.011 -6.710) 6.921 8.731 ( 1.631 -4.068 -5.014) 6.659 8.862 ( 0.941 1.948 -2.450) 3.268 8.863 ( 0.476 2.474 -2.492) 3.543 9.254 ( 5.219 2.636 1.875) 6.140 9.312 ( 2.213 -2.937 2.888) 4.676 9.597 ( 0.756 3.463 0.287) 3.556 9.622 ( 0.248 1.084 0.228) 1.135 9.771 ( -0.646 8.475 2.131) 8.763 9.874 ( -2.713 -0.976 1.855) 3.428 10.095 ( 2.261 6.454 2.184) 7.179 10.184 ( 3.299 -1.992 -0.347) 3.869 11.086 ( -4.019 -1.565 7.800) 8.913 11.108 ( -3.511 -2.268 2.708) 4.981 11.217 ( 3.279 3.006 1.206) 4.610 11.300 ( 1.971 -4.317 0.401) 4.763 11.468 ( -2.710 2.498 2.328) 4.359 11.556 ( -1.120 -5.152 -0.837) 5.338 11.988 ( 0.674 4.837 -8.414) 9.729 12.093 ( 0.244 -5.413 -8.018) 9.677 12.548 ( 3.303 6.361 6.154) 9.447 12.743 ( 3.595 -10.985 6.534) 13.278 13.088 ( -0.698 5.562 1.069) 5.707 13.199 ( -3.106 -4.701 3.054) 6.409 13.273 ( 1.169 3.688 -4.000) 5.565 13.339 ( -0.853 -2.442 -5.051) 5.675 13.526 ( -0.126 4.836 -1.448) 5.050 13.613 ( 1.074 -3.366 -1.172) 3.723 13.804 ( -5.038 6.628 0.806) 8.364 13.969 ( -3.758 -8.082 2.072) 9.151 14.213 ( 0.366 5.525 3.186) 6.388 14.349 ( 6.128 -5.092 2.821) 8.452 14.472 ( 2.049 2.311 -1.418) 3.399 14.591 ( -0.341 -9.562 -1.216) 9.646 15.289 ( 0.000 4.614 -0.054) 4.615 15.402 ( -0.373 -6.186 1.541) 6.386 16.114 ( 2.559 9.637 2.149) 10.200 16.242 ( 2.950 -2.614 1.407) 4.185 16.961 ( 0.656 1.112 0.102) 1.295 17.005 ( 0.472 -3.312 0.244) 3.355 17.315 ( 5.236 11.667 -1.822) 12.917 17.501 ( 5.487 -5.131 -1.020) 7.581 18.213 ( 5.142 1.951 -1.617) 5.732 18.257 ( 4.444 -1.842 -0.451) 4.832 18.905 ( -9.756 0.248 -6.329) 11.631 18.918 ( -8.510 -1.107 -8.563) 12.123 20.813 ( -4.370 4.198 4.746) 7.697 20.932 ( -6.253 -7.271 4.551) 10.616 21.480 ( -3.113 1.445 -0.051) 3.432 21.537 ( -7.284 -4.541 1.767) 8.763 21.804 ( 0.504 0.467 6.223) 6.261 21.832 ( 0.921 -1.882 7.692) 7.972 23.045 ( 1.492 4.460 -0.161) 4.706 23.168 ( 2.360 -6.618 2.528) 7.467 23.554 ( -4.398 2.903 -3.249) 6.191 23.651 ( -4.735 -7.476 -4.334) 9.854 24.103 ( 0.547 9.707 0.510) 9.736 24.268 ( 1.690 -6.308 1.470) 6.694 26.016 ( 4.440 8.931 -5.181) 11.239 26.139 ( 3.372 -3.667 -3.155) 5.897 26.461 ( 0.878 3.207 0.416) 3.351 26.535 ( 0.883 -3.813 -1.748) 4.287 ======================= Grid point 125 (64/78) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 39 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( 0.000 0.000 -0.000) 0.000 2.048 ( -0.000 0.000 0.000) 0.000 2.131 ( -0.000 0.000 0.000) 0.000 2.570 ( 0.000 0.000 0.000) 0.000 2.743 ( 0.000 0.000 0.000) 0.000 3.164 ( -0.000 0.000 -0.000) 0.000 3.272 ( -0.000 0.000 -0.000) 0.000 3.543 ( -0.000 0.000 0.000) 0.000 3.746 ( -0.000 0.000 0.000) 0.000 4.116 ( -0.000 0.000 0.000) 0.000 4.161 ( -0.000 0.000 0.000) 0.000 4.166 ( 0.000 0.000 -0.000) 0.000 4.321 ( 0.000 0.000 -0.000) 0.000 4.507 ( 0.000 0.000 0.000) 0.000 4.773 ( 0.000 0.000 0.000) 0.000 4.799 ( -0.000 0.000 0.000) 0.000 4.821 ( -0.000 0.000 0.000) 0.000 4.974 ( -0.000 0.000 0.000) 0.000 5.046 ( -0.000 0.000 0.000) 0.000 5.182 ( 0.000 0.000 0.000) 0.000 5.247 ( 0.000 0.000 0.000) 0.000 5.269 ( -0.000 0.000 0.000) 0.000 5.375 ( -0.000 0.000 0.000) 0.000 5.402 ( -0.000 0.000 -0.000) 0.000 5.479 ( -0.000 0.000 0.000) 0.000 5.752 ( 0.000 0.000 0.000) 0.000 5.869 ( 0.000 0.000 0.000) 0.000 5.884 ( 0.000 0.000 0.000) 0.000 6.066 ( -0.000 0.000 0.000) 0.000 6.199 ( -0.000 0.000 0.000) 0.000 6.334 ( -0.000 0.000 0.000) 0.000 6.404 ( 0.000 0.000 -0.000) 0.000 6.434 ( 0.000 0.000 0.000) 0.000 6.630 ( -0.000 0.000 0.000) 0.000 6.637 ( 0.000 0.000 0.000) 0.000 6.882 ( -0.000 0.000 -0.000) 0.000 6.909 ( 0.000 0.000 0.000) 0.000 7.039 ( 0.000 0.000 0.000) 0.000 7.134 ( -0.000 0.000 -0.000) 0.000 7.403 ( -0.000 0.000 0.000) 0.000 7.421 ( 0.000 0.000 0.000) 0.000 7.558 ( -0.000 0.000 -0.000) 0.000 7.559 ( 0.000 0.000 0.000) 0.000 7.604 ( -0.000 0.000 0.000) 0.000 7.821 ( -0.000 0.000 -0.000) 0.000 7.832 ( 0.000 0.000 0.000) 0.000 8.096 ( -0.000 0.000 0.000) 0.000 8.099 ( 0.000 0.000 0.000) 0.000 8.265 ( 0.000 0.000 0.000) 0.000 8.384 ( 0.000 0.000 0.000) 0.000 8.488 ( 0.000 0.000 0.000) 0.000 8.529 ( -0.000 0.000 -0.000) 0.000 8.669 ( 0.000 0.000 -0.000) 0.000 8.743 ( 0.000 0.000 0.000) 0.000 8.774 ( -0.000 0.000 0.000) 0.000 9.029 ( 0.000 0.000 0.000) 0.000 9.257 ( 0.000 0.000 0.000) 0.000 9.373 ( -0.000 0.000 0.000) 0.000 9.408 ( 0.000 0.000 0.000) 0.000 9.450 ( 0.000 0.000 0.000) 0.000 9.645 ( -0.000 0.000 0.000) 0.000 9.711 ( 0.000 0.000 0.000) 0.000 9.880 ( -0.000 0.000 0.000) 0.000 10.205 ( -0.000 0.000 0.000) 0.000 11.126 ( -0.000 0.000 0.000) 0.000 11.163 ( -0.000 0.000 0.000) 0.000 11.322 ( 0.000 0.000 0.000) 0.000 11.435 ( -0.000 0.000 0.000) 0.000 11.623 ( -0.000 0.000 0.000) 0.000 11.662 ( 0.000 0.000 0.000) 0.000 11.688 ( 0.000 0.000 0.000) 0.000 12.241 ( -0.000 0.000 0.000) 0.000 12.572 ( -0.000 0.000 0.000) 0.000 12.800 ( -0.000 0.000 0.000) 0.000 13.179 ( 0.000 0.000 -0.000) 0.000 13.217 ( 0.000 0.000 0.000) 0.000 13.246 ( -0.000 0.000 0.000) 0.000 13.329 ( -0.000 0.000 0.000) 0.000 13.400 ( 0.000 0.000 0.000) 0.000 13.594 ( 0.000 0.000 -0.000) 0.000 13.733 ( -0.000 0.000 0.000) 0.000 13.803 ( 0.000 0.000 0.000) 0.000 14.282 ( -0.000 0.000 0.000) 0.000 14.518 ( -0.000 0.000 0.000) 0.000 14.825 ( -0.000 0.000 0.000) 0.000 15.108 ( -0.000 0.000 0.000) 0.000 15.231 ( 0.000 0.000 0.000) 0.000 15.667 ( -0.000 0.000 0.000) 0.000 15.673 ( 0.000 0.000 -0.000) 0.000 16.000 ( 0.000 0.000 0.000) 0.000 16.949 ( 0.000 0.000 0.000) 0.000 16.979 ( 0.000 0.000 0.000) 0.000 17.277 ( 0.000 0.000 0.000) 0.000 17.382 ( -0.000 0.000 0.000) 0.000 18.251 ( -0.000 0.000 0.000) 0.000 18.369 ( -0.000 0.000 0.000) 0.000 18.726 ( 0.000 0.000 0.000) 0.000 18.773 ( 0.000 0.000 0.000) 0.000 20.773 ( 0.000 0.000 0.000) 0.000 20.904 ( -0.000 0.000 0.000) 0.000 21.450 ( 0.000 0.000 0.000) 0.000 21.469 ( 0.000 0.000 0.000) 0.000 22.025 ( 0.000 0.000 0.000) 0.000 22.185 ( 0.000 0.000 0.000) 0.000 23.044 ( 0.000 0.000 0.000) 0.000 23.154 ( 0.000 0.000 0.000) 0.000 23.397 ( 0.000 0.000 0.000) 0.000 23.863 ( 0.000 0.000 0.000) 0.000 24.177 ( -0.000 0.000 0.000) 0.000 24.369 ( -0.000 0.000 0.000) 0.000 25.556 ( -0.000 0.000 0.000) 0.000 26.186 ( 0.000 0.000 0.000) 0.000 26.462 ( 0.000 0.000 0.000) 0.000 26.510 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 127 (65/78) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 14.817 0.000 -3.412) 15.205 2.192 ( 4.854 0.000 5.976) 7.699 2.286 ( 21.052 0.000 -9.231) 22.986 2.597 ( 1.963 0.000 2.631) 3.283 2.828 ( 8.502 0.000 4.228) 9.495 3.223 ( 5.713 0.000 -7.129) 9.136 3.408 ( 10.249 0.000 9.185) 13.763 3.576 ( 3.176 0.000 -2.456) 4.015 3.768 ( -0.011 0.000 2.208) 2.208 4.006 ( -4.041 0.000 31.931) 32.185 4.163 ( 1.217 0.000 4.992) 5.139 4.253 ( 6.318 0.000 -6.457) 9.033 4.340 ( -3.775 0.000 14.703) 15.180 4.506 ( -0.267 0.000 4.062) 4.071 4.701 ( 2.317 0.000 -12.191) 12.409 4.787 ( -3.428 0.000 0.471) 3.460 4.867 ( 4.249 0.000 -4.813) 6.420 4.971 ( 0.145 0.000 -7.720) 7.721 5.047 ( 0.152 0.000 3.328) 3.332 5.137 ( -4.805 0.000 2.541) 5.436 5.281 ( 0.976 0.000 1.046) 1.431 5.326 ( 2.652 0.000 8.857) 9.245 5.401 ( 2.664 0.000 1.483) 3.049 5.459 ( 6.292 0.000 -3.995) 7.453 5.535 ( 3.033 0.000 -3.490) 4.624 5.736 ( -1.162 0.000 -1.601) 1.978 5.766 ( -6.072 0.000 8.036) 10.072 5.847 ( -3.324 0.000 3.408) 4.760 6.068 ( 1.867 0.000 -10.704) 10.866 6.167 ( -2.080 0.000 4.513) 4.969 6.268 ( -1.307 0.000 4.632) 4.812 6.452 ( 0.743 0.000 -5.047) 5.102 6.526 ( 2.908 0.000 -5.445) 6.173 6.595 ( -4.071 0.000 3.399) 5.303 6.701 ( 6.266 0.000 -12.085) 13.613 6.867 ( -0.949 0.000 2.354) 2.538 6.969 ( -6.422 0.000 0.141) 6.423 7.023 ( 8.994 0.000 -1.542) 9.125 7.114 ( -2.398 0.000 2.491) 3.458 7.269 ( -10.461 0.000 -5.651) 11.890 7.338 ( -4.482 0.000 -3.605) 5.752 7.505 ( -1.991 0.000 1.203) 2.326 7.579 ( -3.106 0.000 -0.666) 3.177 7.632 ( 1.402 0.000 -6.772) 6.915 7.647 ( -5.415 0.000 -0.823) 5.477 7.965 ( 1.815 0.000 -0.322) 1.843 7.977 ( -5.588 0.000 -9.186) 10.752 8.134 ( 4.716 0.000 6.401) 7.951 8.323 ( 0.373 0.000 -1.569) 1.613 8.493 ( 7.173 0.000 -2.665) 7.652 8.503 ( 0.772 0.000 -6.245) 6.293 8.513 ( -1.838 0.000 -1.374) 2.295 8.605 ( -7.376 0.000 5.566) 9.240 8.728 ( -1.586 0.000 -7.459) 7.626 8.765 ( 0.207 0.000 4.019) 4.024 8.885 ( -1.200 0.000 -5.913) 6.034 9.297 ( -5.203 0.000 -0.293) 5.211 9.388 ( 1.042 0.000 0.449) 1.135 9.432 ( 0.885 0.000 0.837) 1.218 9.531 ( 9.958 0.000 -8.814) 13.299 9.622 ( -0.838 0.000 -1.325) 1.567 9.777 ( 4.502 0.000 0.274) 4.511 9.904 ( 1.853 0.000 0.378) 1.891 10.185 ( -1.839 0.000 -2.318) 2.958 11.073 ( -8.680 0.000 12.738) 15.414 11.110 ( -2.082 0.000 3.571) 4.134 11.253 ( -7.590 0.000 6.296) 9.861 11.254 ( -15.080 0.000 23.765) 28.146 11.486 ( -2.422 0.000 -4.803) 5.380 11.747 ( 5.748 0.000 -5.457) 7.926 11.814 ( 3.575 0.000 -6.302) 7.245 12.207 ( -3.298 0.000 -2.451) 4.109 12.604 ( 2.822 0.000 -7.328) 7.852 12.803 ( 0.308 0.000 1.059) 1.103 13.124 ( -5.383 0.000 2.563) 5.963 13.185 ( 0.006 0.000 3.622) 3.622 13.216 ( -7.595 0.000 0.947) 7.653 13.326 ( 5.019 0.000 0.929) 5.104 13.428 ( 0.873 0.000 -3.141) 3.260 13.681 ( 7.451 0.000 -5.012) 8.979 13.693 ( -3.471 0.000 4.919) 6.020 13.873 ( 6.165 0.000 -0.462) 6.182 14.208 ( -7.224 0.000 6.669) 9.831 14.452 ( -5.783 0.000 -6.465) 8.674 14.802 ( -1.027 0.000 -0.982) 1.421 15.045 ( -7.785 0.000 1.538) 7.935 15.254 ( 4.150 0.000 -4.744) 6.303 15.650 ( -0.372 0.000 1.821) 1.859 15.707 ( 2.081 0.000 -1.145) 2.376 15.929 ( -6.933 0.000 12.377) 14.186 16.929 ( -1.909 0.000 0.840) 2.086 16.982 ( 0.576 0.000 -1.001) 1.155 17.255 ( -1.609 0.000 2.889) 3.307 17.360 ( -2.096 0.000 -0.650) 2.194 18.141 ( -8.182 0.000 1.783) 8.374 18.284 ( -4.486 0.000 -0.363) 4.500 18.799 ( 3.400 0.000 5.274) 6.275 18.919 ( 12.903 0.000 -3.676) 13.417 20.755 ( 0.318 0.000 1.859) 1.886 21.041 ( 6.650 0.000 5.857) 8.862 21.436 ( 1.363 0.000 0.992) 1.686 21.674 ( 14.918 0.000 0.559) 14.929 21.986 ( -5.271 0.000 3.279) 6.208 22.131 ( -1.142 0.000 -13.783) 13.831 23.038 ( -0.399 0.000 0.096) 0.410 23.175 ( 1.974 0.000 0.031) 1.974 23.455 ( 4.874 0.000 2.700) 5.572 23.874 ( 0.899 0.000 -3.536) 3.648 24.068 ( -8.372 0.000 5.139) 9.824 24.336 ( -3.110 0.000 0.234) 3.119 25.562 ( 0.622 0.000 -0.147) 0.639 26.160 ( -2.418 0.000 -0.104) 2.420 26.436 ( -1.651 0.000 -1.024) 1.943 26.552 ( 2.267 0.000 4.034) 4.628 ======================= Grid point 128 (66/78) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( 16.848 0.000 -5.858) 17.838 2.312 ( 5.937 0.000 8.616) 10.464 2.643 ( 2.682 0.000 23.097) 23.252 2.780 ( 22.233 0.000 -21.251) 30.756 3.106 ( 16.635 0.000 11.537) 20.244 3.382 ( 10.295 0.000 -15.827) 18.881 3.521 ( -3.741 0.000 11.520) 12.112 3.662 ( 4.985 0.000 -5.615) 7.509 3.711 ( 0.465 0.000 2.518) 2.561 4.166 ( 12.796 0.000 20.856) 24.468 4.213 ( 2.725 0.000 8.411) 8.842 4.313 ( -0.459 0.000 19.434) 19.440 4.363 ( 3.426 0.000 -6.348) 7.213 4.504 ( 4.418 0.000 9.725) 10.681 4.682 ( -6.216 0.000 -0.048) 6.217 4.853 ( 5.377 0.000 8.665) 10.198 4.921 ( -8.074 0.000 -0.979) 8.133 4.939 ( 6.973 0.000 -15.297) 16.811 5.005 ( -4.160 0.000 -1.814) 4.538 5.094 ( 4.048 0.000 0.237) 4.055 5.298 ( 0.269 0.000 0.159) 0.313 5.350 ( 1.080 0.000 14.018) 14.059 5.472 ( 3.048 0.000 2.418) 3.891 5.500 ( -4.309 0.000 -4.094) 5.944 5.618 ( 4.363 0.000 -5.741) 7.211 5.705 ( -1.689 0.000 -5.710) 5.954 5.783 ( 8.771 0.000 -2.691) 9.174 5.805 ( 0.974 0.000 10.203) 10.249 6.124 ( 4.133 0.000 -10.513) 11.296 6.159 ( 1.289 0.000 5.760) 5.902 6.256 ( -1.692 0.000 0.516) 1.769 6.406 ( -5.411 0.000 -4.232) 6.870 6.490 ( -6.295 0.000 1.210) 6.410 6.549 ( 1.517 0.000 -3.286) 3.619 6.772 ( -10.947 0.000 1.371) 11.033 6.810 ( 1.553 0.000 -9.893) 10.014 6.863 ( 2.983 0.000 1.359) 3.278 7.039 ( -4.298 0.000 -0.187) 4.303 7.080 ( -5.674 0.000 -4.855) 7.468 7.118 ( 0.562 0.000 -9.273) 9.290 7.295 ( 0.185 0.000 -1.202) 1.216 7.505 ( -2.580 0.000 -1.310) 2.893 7.527 ( 1.924 0.000 -0.138) 1.929 7.568 ( -4.333 0.000 -3.122) 5.341 7.590 ( -1.911 0.000 2.447) 3.105 7.898 ( -3.320 0.000 -10.055) 10.589 7.951 ( -2.222 0.000 1.869) 2.903 8.204 ( -1.679 0.000 3.361) 3.757 8.209 ( -9.524 0.000 -21.529) 23.542 8.362 ( -12.055 0.000 -6.578) 13.733 8.396 ( -2.811 0.000 4.135) 5.000 8.605 ( 2.634 0.000 4.766) 5.445 8.615 ( 5.883 0.000 0.132) 5.885 8.773 ( 5.647 0.000 -4.079) 6.966 8.817 ( 3.584 0.000 2.758) 4.522 8.933 ( 3.933 0.000 -8.258) 9.147 9.187 ( -4.871 0.000 0.279) 4.879 9.391 ( -0.049 0.000 2.347) 2.347 9.446 ( 0.549 0.000 0.230) 0.595 9.619 ( 1.997 0.000 -3.489) 4.020 9.688 ( 3.898 0.000 -13.945) 14.480 9.856 ( 2.692 0.000 0.800) 2.808 9.938 ( 1.129 0.000 0.538) 1.251 10.127 ( -3.412 0.000 -3.361) 4.789 10.850 ( -13.682 0.000 21.460) 25.450 10.925 ( -16.065 0.000 26.604) 31.078 11.004 ( -6.873 0.000 2.471) 7.304 11.148 ( -2.212 0.000 9.515) 9.769 11.489 ( 1.293 0.000 -6.764) 6.887 11.812 ( -2.192 0.000 -6.970) 7.306 11.839 ( 2.469 0.000 0.091) 2.470 12.080 ( -9.061 0.000 -2.539) 9.410 12.664 ( 3.759 0.000 -9.747) 10.447 12.815 ( 0.452 0.000 4.133) 4.158 13.024 ( -4.063 0.000 1.427) 4.306 13.100 ( -2.209 0.000 -1.125) 2.479 13.179 ( -0.637 0.000 -0.003) 0.637 13.436 ( 0.575 0.000 -4.719) 4.754 13.448 ( 6.017 0.000 1.991) 6.337 13.623 ( -3.261 0.000 8.056) 8.691 13.853 ( 8.659 0.000 -5.439) 10.226 14.023 ( 7.113 0.000 1.210) 7.215 14.040 ( -8.096 0.000 7.755) 11.211 14.264 ( -11.401 0.000 -5.778) 12.782 14.781 ( -2.141 0.000 -0.386) 2.175 14.886 ( -5.000 0.000 4.277) 6.579 15.342 ( 3.752 0.000 -5.549) 6.698 15.657 ( 0.765 0.000 1.097) 1.337 15.762 ( -9.078 0.000 9.623) 13.229 15.763 ( 3.654 0.000 0.261) 3.663 16.872 ( -3.473 0.000 0.830) 3.570 17.013 ( 2.560 0.000 -2.278) 3.427 17.230 ( -1.021 0.000 2.217) 2.441 17.297 ( -3.685 0.000 -0.846) 3.781 18.012 ( -3.434 0.000 0.050) 3.434 18.196 ( -4.056 0.000 0.820) 4.138 18.921 ( 6.994 0.000 5.397) 8.834 19.167 ( 10.454 0.000 -2.522) 10.754 20.764 ( -0.339 0.000 2.558) 2.580 21.111 ( -0.047 0.000 3.783) 3.783 21.477 ( 1.800 0.000 -0.028) 1.800 21.812 ( -8.081 0.000 -2.842) 8.566 21.965 ( 10.770 0.000 -1.100) 10.826 22.222 ( 8.669 0.000 -5.851) 10.459 23.036 ( 0.270 0.000 0.968) 1.005 23.232 ( 3.284 0.000 0.032) 3.284 23.574 ( 5.798 0.000 1.609) 6.017 23.861 ( -3.503 0.000 13.484) 13.932 23.950 ( -0.740 0.000 -10.664) 10.690 24.248 ( -4.920 0.000 0.318) 4.930 25.583 ( 1.343 0.000 -0.242) 1.365 26.093 ( -3.702 0.000 -0.100) 3.703 26.398 ( -1.857 0.000 0.509) 1.926 26.580 ( 0.161 0.000 1.845) 1.852 ======================= Grid point 129 (67/78) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.331 ( 6.794 0.000 -2.399) 7.205 2.464 ( 7.609 0.000 3.898) 8.550 2.726 ( 3.920 0.000 15.694) 16.176 3.076 ( 7.281 0.000 -9.007) 11.582 3.351 ( -9.090 0.000 6.484) 11.166 3.463 ( 14.076 0.000 16.241) 21.492 3.636 ( 15.266 0.000 -20.525) 25.580 3.755 ( 3.719 0.000 -6.180) 7.213 3.851 ( 5.929 0.000 8.663) 10.498 4.242 ( 2.096 0.000 6.936) 7.245 4.269 ( 1.646 0.000 9.575) 9.715 4.357 ( -3.596 0.000 -2.341) 4.290 4.471 ( 7.450 0.000 3.472) 8.219 4.568 ( -3.597 0.000 -0.171) 3.601 4.661 ( -14.167 0.000 -1.291) 14.226 4.721 ( 13.058 0.000 7.465) 15.041 4.900 ( 3.397 0.000 6.867) 7.661 4.956 ( -1.514 0.000 0.384) 1.562 5.080 ( 1.606 0.000 -8.527) 8.677 5.166 ( 1.434 0.000 -0.363) 1.479 5.287 ( -1.843 0.000 -3.143) 3.643 5.349 ( -8.692 0.000 -4.875) 9.966 5.504 ( 10.812 0.000 13.987) 17.679 5.530 ( 5.014 0.000 2.913) 5.799 5.621 ( -1.431 0.000 -4.117) 4.359 5.720 ( 3.213 0.000 -2.063) 3.818 5.878 ( 2.990 0.000 7.533) 8.105 6.058 ( 13.664 0.000 -2.859) 13.960 6.183 ( -2.643 0.000 7.468) 7.921 6.193 ( -11.820 0.000 -1.666) 11.937 6.218 ( -1.009 0.000 5.800) 5.887 6.273 ( 10.463 0.000 -7.094) 12.641 6.378 ( 1.091 0.000 -5.685) 5.788 6.529 ( -4.035 0.000 -3.856) 5.581 6.630 ( -3.686 0.000 0.913) 3.798 6.822 ( 1.183 0.000 0.313) 1.223 6.897 ( -0.989 0.000 -0.152) 1.000 6.947 ( -3.887 0.000 1.331) 4.109 7.026 ( 0.258 0.000 -5.088) 5.094 7.122 ( 0.210 0.000 -10.873) 10.875 7.322 ( -3.171 0.000 0.416) 3.198 7.412 ( -2.823 0.000 -7.090) 7.632 7.442 ( -4.756 0.000 3.943) 6.178 7.557 ( -0.914 0.000 -0.494) 1.039 7.574 ( -1.375 0.000 -1.148) 1.791 7.787 ( -3.132 0.000 -11.650) 12.063 7.894 ( -3.033 0.000 6.887) 7.525 8.019 ( -10.314 0.000 -6.418) 12.148 8.034 ( -5.724 0.000 -9.388) 10.996 8.204 ( -4.586 0.000 -3.638) 5.854 8.366 ( -0.783 0.000 0.526) 0.943 8.677 ( 3.551 0.000 3.373) 4.898 8.720 ( 3.590 0.000 5.121) 6.254 8.828 ( -1.725 0.000 -7.156) 7.361 8.877 ( 3.620 0.000 -1.654) 3.980 9.064 ( 7.826 0.000 -3.400) 8.533 9.108 ( -2.613 0.000 0.635) 2.689 9.386 ( -0.811 0.000 3.242) 3.342 9.457 ( 0.489 0.000 -0.246) 0.547 9.669 ( 2.202 0.000 -3.134) 3.830 9.707 ( -0.058 0.000 -13.453) 13.453 9.892 ( 0.952 0.000 1.219) 1.546 9.954 ( 0.669 0.000 1.044) 1.240 10.047 ( -3.665 0.000 -3.058) 4.773 10.570 ( -11.844 0.000 19.365) 22.700 10.693 ( -8.274 0.000 17.600) 19.448 10.903 ( -2.856 0.000 0.999) 3.025 11.127 ( -0.713 0.000 7.234) 7.269 11.501 ( 0.194 0.000 -5.156) 5.159 11.756 ( -2.027 0.000 -4.480) 4.917 11.827 ( -5.797 0.000 -0.758) 5.846 11.889 ( -4.396 0.000 3.650) 5.714 12.741 ( 3.455 0.000 -7.406) 8.172 12.822 ( -0.109 0.000 4.732) 4.734 12.964 ( -1.775 0.000 -0.314) 1.803 13.124 ( 3.744 0.000 -3.486) 5.116 13.166 ( -0.428 0.000 -1.636) 1.691 13.447 ( 0.801 0.000 -6.940) 6.986 13.559 ( 4.062 0.000 1.342) 4.278 13.578 ( -1.862 0.000 9.757) 9.933 13.907 ( -4.821 0.000 4.570) 6.643 14.011 ( 6.529 0.000 -4.741) 8.069 14.020 ( -10.066 0.000 -1.660) 10.202 14.131 ( 2.517 0.000 2.662) 3.664 14.714 ( -2.876 0.000 2.124) 3.576 14.850 ( -0.251 0.000 -0.614) 0.663 15.399 ( 2.468 0.000 -3.667) 4.420 15.590 ( -7.531 0.000 5.675) 9.429 15.671 ( 0.391 0.000 0.082) 0.400 15.863 ( 5.232 0.000 1.423) 5.422 16.793 ( -3.766 0.000 0.056) 3.766 17.076 ( 3.325 0.000 -1.742) 3.753 17.209 ( -1.234 0.000 0.662) 1.400 17.220 ( -3.138 0.000 -0.477) 3.174 17.995 ( 1.328 0.000 -1.428) 1.950 18.116 ( -3.726 0.000 1.764) 4.123 19.057 ( 4.925 0.000 3.045) 5.790 19.338 ( 5.798 0.000 -0.940) 5.874 20.745 ( -1.221 0.000 1.532) 1.959 21.073 ( -2.762 0.000 1.101) 2.974 21.499 ( 0.499 0.000 -0.579) 0.764 21.692 ( -3.017 0.000 -2.827) 4.135 22.158 ( 7.885 0.000 -1.350) 8.000 22.358 ( 3.259 0.000 -1.235) 3.486 23.048 ( 0.558 0.000 1.287) 1.403 23.301 ( 2.868 0.000 0.010) 2.868 23.678 ( 3.708 0.000 -0.760) 3.785 23.815 ( -1.153 0.000 12.808) 12.859 23.958 ( 1.011 0.000 -9.783) 9.835 24.150 ( -4.031 0.000 0.219) 4.037 25.614 ( 1.448 0.000 -0.207) 1.463 26.019 ( -3.006 0.000 -0.025) 3.006 26.364 ( -1.293 0.000 0.731) 1.485 26.573 ( -0.630 0.000 0.276) 0.687 ======================= Grid point 130 (68/78) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 39 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( -0.000 0.000 0.000) 0.000 2.556 ( -0.000 0.000 0.000) 0.000 2.790 ( -0.000 0.000 0.000) 0.000 3.140 ( -0.000 0.000 0.000) 0.000 3.240 ( -0.000 0.000 0.000) 0.000 3.641 ( -0.000 0.000 0.000) 0.000 3.777 ( -0.000 0.000 0.000) 0.000 3.863 ( -0.000 0.000 0.000) 0.000 3.887 ( -0.000 0.000 0.000) 0.000 4.290 ( -0.000 0.000 0.000) 0.000 4.300 ( -0.000 0.000 -0.000) 0.000 4.310 ( -0.000 0.000 0.000) 0.000 4.433 ( -0.000 0.000 0.000) 0.000 4.543 ( -0.000 0.000 -0.000) 0.000 4.549 ( -0.000 0.000 0.000) 0.000 4.932 ( -0.000 0.000 0.000) 0.000 4.940 ( -0.000 0.000 0.000) 0.000 5.006 ( 0.000 0.000 0.000) 0.000 5.028 ( -0.000 0.000 -0.000) 0.000 5.179 ( -0.000 0.000 0.000) 0.000 5.187 ( -0.000 0.000 0.000) 0.000 5.241 ( -0.000 0.000 0.000) 0.000 5.599 ( -0.000 0.000 0.000) 0.000 5.657 ( -0.000 0.000 -0.000) 0.000 5.663 ( -0.000 0.000 0.000) 0.000 5.763 ( -0.000 0.000 -0.000) 0.000 5.889 ( -0.000 0.000 -0.000) 0.000 5.982 ( -0.000 0.000 0.000) 0.000 6.156 ( -0.000 0.000 -0.000) 0.000 6.210 ( -0.000 0.000 0.000) 0.000 6.221 ( -0.000 0.000 0.000) 0.000 6.390 ( 0.000 0.000 -0.000) 0.000 6.492 ( -0.000 0.000 0.000) 0.000 6.540 ( -0.000 0.000 0.000) 0.000 6.556 ( -0.000 0.000 -0.000) 0.000 6.824 ( -0.000 0.000 0.000) 0.000 6.906 ( -0.000 0.000 -0.000) 0.000 6.942 ( -0.000 0.000 0.000) 0.000 7.032 ( -0.000 0.000 0.000) 0.000 7.043 ( -0.000 0.000 0.000) 0.000 7.134 ( -0.000 0.000 0.000) 0.000 7.358 ( -0.000 0.000 0.000) 0.000 7.512 ( -0.000 0.000 -0.000) 0.000 7.521 ( 0.000 0.000 0.000) 0.000 7.551 ( -0.000 0.000 0.000) 0.000 7.785 ( -0.000 0.000 0.000) 0.000 7.862 ( 0.000 0.000 0.000) 0.000 7.902 ( -0.000 0.000 -0.000) 0.000 7.943 ( -0.000 0.000 -0.000) 0.000 8.148 ( -0.000 0.000 0.000) 0.000 8.360 ( -0.000 0.000 0.000) 0.000 8.722 ( -0.000 0.000 -0.000) 0.000 8.778 ( -0.000 0.000 -0.000) 0.000 8.781 ( 0.000 0.000 0.000) 0.000 8.914 ( -0.000 0.000 0.000) 0.000 9.080 ( -0.000 0.000 -0.000) 0.000 9.165 ( -0.000 0.000 0.000) 0.000 9.371 ( -0.000 0.000 -0.000) 0.000 9.463 ( -0.000 0.000 0.000) 0.000 9.679 ( -0.000 0.000 -0.000) 0.000 9.706 ( -0.000 0.000 0.000) 0.000 9.905 ( -0.000 0.000 0.000) 0.000 9.974 ( -0.000 0.000 -0.000) 0.000 9.990 ( 0.000 0.000 0.000) 0.000 10.450 ( -0.000 0.000 0.000) 0.000 10.609 ( -0.000 0.000 -0.000) 0.000 10.875 ( -0.000 0.000 0.000) 0.000 11.124 ( -0.000 0.000 0.000) 0.000 11.498 ( -0.000 0.000 -0.000) 0.000 11.731 ( -0.000 0.000 -0.000) 0.000 11.733 ( -0.000 0.000 -0.000) 0.000 11.866 ( -0.000 0.000 -0.000) 0.000 12.775 ( -0.000 0.000 0.000) 0.000 12.821 ( -0.000 0.000 0.000) 0.000 12.946 ( -0.000 0.000 0.000) 0.000 13.161 ( -0.000 0.000 -0.000) 0.000 13.181 ( -0.000 0.000 -0.000) 0.000 13.459 ( -0.000 0.000 -0.000) 0.000 13.553 ( -0.000 0.000 0.000) 0.000 13.604 ( -0.000 0.000 0.000) 0.000 13.856 ( -0.000 0.000 -0.000) 0.000 13.905 ( -0.000 0.000 0.000) 0.000 14.095 ( -0.000 0.000 0.000) 0.000 14.141 ( 0.000 0.000 -0.000) 0.000 14.685 ( -0.000 0.000 -0.000) 0.000 14.848 ( -0.000 0.000 0.000) 0.000 15.449 ( -0.000 0.000 0.000) 0.000 15.481 ( -0.000 0.000 0.000) 0.000 15.675 ( -0.000 0.000 0.000) 0.000 15.931 ( -0.000 0.000 0.000) 0.000 16.745 ( -0.000 0.000 0.000) 0.000 17.122 ( -0.000 0.000 0.000) 0.000 17.184 ( -0.000 0.000 0.000) 0.000 17.187 ( -0.000 0.000 0.000) 0.000 18.040 ( 0.000 0.000 -0.000) 0.000 18.048 ( -0.000 0.000 0.000) 0.000 19.111 ( -0.000 0.000 0.000) 0.000 19.400 ( -0.000 0.000 0.000) 0.000 20.730 ( -0.000 0.000 0.000) 0.000 21.038 ( -0.000 0.000 0.000) 0.000 21.504 ( -0.000 0.000 0.000) 0.000 21.664 ( -0.000 0.000 -0.000) 0.000 22.257 ( -0.000 0.000 0.000) 0.000 22.375 ( 0.000 0.000 0.000) 0.000 23.054 ( -0.000 0.000 0.000) 0.000 23.334 ( -0.000 0.000 0.000) 0.000 23.717 ( -0.000 0.000 0.000) 0.000 23.814 ( -0.000 0.000 -0.000) 0.000 23.965 ( -0.000 0.000 0.000) 0.000 24.103 ( -0.000 0.000 0.000) 0.000 25.631 ( -0.000 0.000 0.000) 0.000 25.984 ( -0.000 0.000 0.000) 0.000 26.350 ( -0.000 0.000 0.000) 0.000 26.565 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 135 (69/78) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 65 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.877 ( 0.000 24.296 0.000) 24.296 2.147 ( 0.000 10.268 0.000) 10.268 2.262 ( -0.000 10.001 0.000) 10.001 2.694 ( 0.000 10.638 0.000) 10.638 2.921 ( -0.000 14.992 0.000) 14.992 3.221 ( 0.000 6.134 -0.000) 6.134 3.311 ( -0.000 3.685 0.000) 3.685 3.582 ( -0.000 -15.069 0.000) 15.069 3.655 ( -0.000 9.835 0.000) 9.835 3.961 ( -0.000 -9.143 0.000) 9.143 4.075 ( 0.000 -9.809 0.000) 9.809 4.235 ( -0.000 3.148 0.000) 3.148 4.381 ( 0.000 6.493 0.000) 6.493 4.390 ( 0.000 -10.041 -0.000) 10.041 4.662 ( -0.000 -4.607 -0.000) 4.607 4.712 ( 0.000 -1.334 0.000) 1.334 4.926 ( -0.000 3.478 0.000) 3.478 4.968 ( 0.000 -5.373 0.000) 5.373 5.148 ( 0.000 5.179 0.000) 5.179 5.228 ( -0.000 8.299 0.000) 8.299 5.307 ( 0.000 9.022 0.000) 9.022 5.402 ( 0.000 4.335 -0.000) 4.335 5.414 ( -0.000 6.130 0.000) 6.130 5.482 ( -0.000 6.706 0.000) 6.706 5.561 ( -0.000 9.005 0.000) 9.005 5.779 ( 0.000 -1.430 -0.000) 1.430 5.898 ( 0.000 7.344 -0.000) 7.344 5.903 ( -0.000 -0.128 0.000) 0.128 6.035 ( -0.000 -0.250 0.000) 0.250 6.200 ( 0.000 -4.229 -0.000) 4.229 6.345 ( 0.000 2.578 -0.000) 2.578 6.355 ( -0.000 -3.652 0.000) 3.652 6.405 ( 0.000 -12.429 0.000) 12.429 6.487 ( -0.000 2.544 0.000) 2.544 6.731 ( -0.000 -11.260 0.000) 11.260 6.775 ( 0.000 -10.799 0.000) 10.799 6.782 ( 0.000 4.833 -0.000) 4.833 6.900 ( 0.000 -15.765 0.000) 15.765 7.148 ( 0.000 -17.254 0.000) 17.254 7.259 ( 0.000 -13.910 0.000) 13.910 7.396 ( -0.000 12.291 0.000) 12.291 7.471 ( -0.000 -2.963 0.000) 2.963 7.545 ( 0.000 1.474 -0.000) 1.474 7.568 ( 0.000 -12.016 0.000) 12.016 7.642 ( 0.000 1.010 0.000) 1.010 7.920 ( 0.000 11.704 0.000) 11.704 8.040 ( 0.000 0.910 0.000) 0.910 8.287 ( -0.000 -4.661 0.000) 4.661 8.326 ( 0.000 7.063 0.000) 7.063 8.477 ( -0.000 -0.142 -0.000) 0.142 8.477 ( 0.000 7.548 0.000) 7.548 8.616 ( 0.000 7.771 0.000) 7.771 8.649 ( 0.000 -3.627 -0.000) 3.627 8.738 ( 0.000 0.782 0.000) 0.782 8.760 ( -0.000 -1.412 0.000) 1.412 8.916 ( 0.000 -8.568 0.000) 8.568 9.302 ( 0.000 3.310 0.000) 3.310 9.370 ( -0.000 0.878 0.000) 0.878 9.499 ( 0.000 7.056 0.000) 7.056 9.550 ( 0.000 6.179 0.000) 6.179 9.674 ( 0.000 3.407 0.000) 3.407 9.767 ( 0.000 4.810 0.000) 4.810 9.976 ( 0.000 8.496 0.000) 8.496 10.223 ( -0.000 1.389 0.000) 1.389 11.117 ( -0.000 -0.943 0.000) 0.943 11.196 ( -0.000 2.833 0.000) 2.833 11.210 ( 0.000 -7.841 0.000) 7.841 11.455 ( 0.000 -1.366 -0.000) 1.366 11.530 ( -0.000 -6.094 0.000) 6.094 11.581 ( -0.000 -3.051 0.000) 3.051 11.804 ( 0.000 5.412 0.000) 5.412 12.161 ( -0.000 -6.883 0.000) 6.883 12.565 ( 0.000 1.143 0.000) 1.143 12.837 ( -0.000 2.880 0.000) 2.880 13.185 ( 0.000 -0.249 -0.000) 0.249 13.195 ( -0.000 -5.113 0.000) 5.113 13.249 ( 0.000 1.936 0.000) 1.936 13.314 ( 0.000 -1.169 0.000) 1.169 13.421 ( -0.000 2.683 0.000) 2.683 13.648 ( 0.000 4.491 -0.000) 4.491 13.661 ( 0.000 -3.139 0.000) 3.139 13.927 ( 0.000 7.573 0.000) 7.573 14.355 ( -0.000 6.277 0.000) 6.277 14.509 ( -0.000 -12.742 0.000) 12.742 14.543 ( -0.000 -9.818 0.000) 9.818 14.852 ( -0.000 -18.241 0.000) 18.241 15.230 ( 0.000 1.199 0.000) 1.199 15.553 ( -0.000 -6.721 0.000) 6.721 15.923 ( 0.000 16.126 0.000) 16.126 16.180 ( -0.000 9.994 0.000) 9.994 16.964 ( 0.000 -0.183 0.000) 0.183 17.074 ( 0.000 10.583 0.000) 10.583 17.115 ( -0.000 -8.858 0.000) 8.858 17.507 ( -0.000 5.438 0.000) 5.438 18.251 ( -0.000 0.062 0.000) 0.062 18.366 ( -0.000 -1.091 0.000) 1.091 18.729 ( -0.000 0.238 0.000) 0.238 18.746 ( 0.000 -1.884 -0.000) 1.884 20.765 ( 0.000 -0.314 0.000) 0.314 20.887 ( -0.000 -1.681 0.000) 1.681 21.446 ( 0.000 -0.355 0.000) 0.355 21.461 ( 0.000 -0.691 0.000) 0.691 21.965 ( 0.000 -3.744 0.000) 3.744 22.136 ( 0.000 -4.588 0.000) 4.588 22.994 ( 0.000 0.038 0.000) 0.038 23.322 ( -0.000 8.809 -0.000) 8.809 23.380 ( 0.000 -2.140 0.000) 2.140 23.820 ( -0.000 -22.859 0.000) 22.859 23.945 ( 0.000 7.814 0.000) 7.814 24.402 ( -0.000 -1.574 0.000) 1.574 25.755 ( -0.000 14.452 0.000) 14.452 26.186 ( 0.000 -0.409 0.000) 0.409 26.468 ( 0.000 0.509 0.000) 0.509 26.500 ( -0.000 -0.771 -0.000) 0.771 ======================= Grid point 137 (70/78) ======================= q-point: ( 0.12 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( 10.249 19.715 0.217) 22.221 2.258 ( 3.118 5.446 4.597) 7.779 2.406 ( 18.573 11.430 -3.805) 22.138 2.705 ( 0.678 10.601 -1.287) 10.701 2.997 ( 7.956 13.561 8.576) 17.910 3.272 ( 5.850 5.165 -8.794) 11.757 3.427 ( 8.223 0.541 2.552) 8.627 3.607 ( 0.800 -4.121 6.964) 8.131 3.740 ( 5.627 4.117 0.268) 6.977 3.874 ( -3.410 -13.403 1.993) 13.973 4.115 ( 0.609 -5.116 6.362) 8.187 4.270 ( 5.828 6.013 19.558) 21.276 4.375 ( 0.595 -3.526 4.306) 5.597 4.411 ( -0.528 -1.785 7.299) 7.533 4.660 ( -0.950 -3.089 4.799) 5.786 4.721 ( 5.633 -0.087 -21.774) 22.491 4.889 ( -0.726 0.941 -2.861) 3.098 5.027 ( 0.014 -2.596 4.696) 5.366 5.158 ( 0.574 4.853 -0.308) 4.897 5.185 ( -2.228 6.420 4.288) 8.035 5.260 ( -5.512 10.218 4.806) 12.565 5.397 ( 0.067 -0.142 -4.327) 4.330 5.422 ( 2.570 2.791 3.222) 4.978 5.566 ( 6.232 9.903 -5.041) 12.741 5.615 ( 2.770 7.086 1.418) 7.739 5.738 ( -4.279 -0.994 7.587) 8.767 5.845 ( -1.556 4.182 5.313) 6.938 5.890 ( -3.001 5.663 -7.814) 10.107 6.015 ( 1.231 -1.311 -0.067) 1.800 6.201 ( -4.494 -2.325 6.252) 8.042 6.281 ( 2.244 1.638 -5.235) 5.926 6.411 ( 1.500 -14.153 -6.452) 15.626 6.424 ( -1.419 -1.316 -2.681) 3.306 6.522 ( 3.292 -1.968 -2.710) 4.696 6.720 ( -0.270 -8.719 -1.059) 8.787 6.725 ( -4.597 -7.196 0.090) 8.539 6.857 ( 4.599 -2.405 -4.569) 6.914 6.935 ( 4.021 -8.565 -4.918) 10.663 7.159 ( 0.079 -10.748 -1.484) 10.851 7.227 ( -3.574 -12.498 -2.726) 13.281 7.315 ( -5.874 4.721 -3.747) 8.416 7.387 ( -5.245 4.248 -0.486) 6.767 7.551 ( 0.376 -9.169 4.028) 10.022 7.571 ( 0.977 -0.539 -8.374) 8.448 7.683 ( 2.703 1.620 4.364) 5.383 7.919 ( -1.952 6.930 4.260) 8.366 8.018 ( -0.746 -1.646 -5.380) 5.675 8.175 ( -6.521 8.169 -4.087) 11.223 8.364 ( 1.540 -4.713 -3.108) 5.852 8.434 ( -4.608 -0.248 3.807) 5.982 8.462 ( -1.946 0.490 -3.331) 3.889 8.604 ( -6.037 -1.055 -2.338) 6.559 8.668 ( 1.283 2.116 -0.512) 2.527 8.729 ( 2.749 2.924 -4.007) 5.671 8.763 ( -1.404 0.214 1.419) 2.008 8.880 ( 2.462 -1.097 -3.628) 4.520 9.251 ( -4.366 0.387 -2.017) 4.824 9.426 ( 3.917 -0.483 -1.257) 4.142 9.527 ( -1.401 5.750 0.230) 5.923 9.548 ( 3.547 2.614 -5.123) 6.757 9.656 ( -0.818 4.538 -1.241) 4.775 9.833 ( 4.300 4.887 0.711) 6.548 9.983 ( 0.443 6.544 -0.370) 6.569 10.208 ( -1.486 1.690 -3.214) 3.924 11.043 ( -7.995 -2.039 12.621) 15.079 11.116 ( -6.137 -2.546 8.613) 10.878 11.196 ( -5.388 -0.117 10.278) 11.605 11.280 ( -10.403 0.291 9.106) 13.828 11.483 ( -3.246 -0.634 0.979) 3.449 11.626 ( 4.450 -7.217 -6.890) 10.925 11.894 ( 4.184 3.613 -4.227) 6.959 12.143 ( -1.959 -5.719 -2.011) 6.371 12.590 ( 2.046 0.630 -6.920) 7.243 12.842 ( 0.778 2.929 1.674) 3.462 13.060 ( -6.973 -4.763 3.814) 9.266 13.202 ( -0.992 2.244 -1.516) 2.885 13.264 ( -1.454 1.252 3.424) 3.925 13.331 ( 3.540 -0.213 -2.682) 4.446 13.445 ( 1.108 2.348 -1.473) 2.985 13.649 ( 1.031 -1.216 -0.136) 1.600 13.738 ( 5.077 2.530 -1.166) 5.791 13.947 ( 2.555 6.573 1.694) 7.253 14.261 ( -8.320 4.467 4.499) 10.461 14.442 ( -7.663 -3.744 -6.671) 10.828 14.547 ( 2.962 -18.293 2.732) 18.732 14.814 ( -4.227 -15.548 4.303) 16.677 15.255 ( 2.338 1.239 -3.320) 4.246 15.555 ( -0.023 -7.058 0.689) 7.092 15.897 ( -1.620 15.295 -1.875) 15.494 16.131 ( -4.440 10.831 6.262) 13.276 16.943 ( -2.298 0.249 1.474) 2.741 17.062 ( -0.586 8.154 -0.181) 8.177 17.115 ( -0.032 -7.486 0.480) 7.502 17.466 ( -3.997 4.458 1.945) 6.295 18.154 ( -7.399 1.183 1.157) 7.582 18.283 ( -4.787 -0.510 -0.177) 4.817 18.790 ( 5.119 -0.433 4.610) 6.903 18.901 ( 11.809 -1.681 -2.616) 12.212 20.771 ( 1.445 1.710 2.000) 3.002 21.015 ( 6.687 -2.707 5.170) 8.875 21.445 ( 2.050 1.014 0.685) 2.387 21.640 ( 13.743 -3.378 0.523) 14.161 21.933 ( -3.500 -3.441 -0.561) 4.940 22.072 ( -3.015 -4.731 -9.854) 11.339 22.992 ( -0.259 -0.431 0.194) 0.539 23.292 ( -1.706 4.047 -2.685) 5.147 23.455 ( 5.434 0.285 3.918) 6.705 23.781 ( -2.832 -16.000 8.250) 18.223 23.971 ( 1.937 5.961 -6.701) 9.175 24.367 ( -3.125 -0.635 -0.349) 3.208 25.726 ( -2.090 12.705 0.153) 12.877 26.160 ( -2.420 -0.434 -0.524) 2.514 26.442 ( -1.649 0.638 -0.779) 1.932 26.530 ( 1.412 -1.880 3.848) 4.509 ======================= Grid point 138 (71/78) ======================= q-point: ( 0.25 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( 10.935 11.231 -4.250) 16.241 2.339 ( 5.758 2.457 10.706) 12.402 2.715 ( 1.800 7.791 21.643) 23.073 2.850 ( 18.436 6.633 -18.303) 26.812 3.264 ( 15.170 12.848 15.258) 25.060 3.414 ( 7.038 2.475 -13.940) 15.811 3.535 ( -5.219 1.019 7.808) 9.446 3.645 ( 11.403 -2.154 -2.095) 11.792 3.744 ( 2.194 3.427 -1.500) 4.337 4.043 ( 8.445 -10.052 9.470) 16.187 4.116 ( 3.484 -4.268 7.758) 9.515 4.391 ( 1.966 -4.106 10.478) 11.424 4.432 ( 2.947 4.547 -6.277) 8.292 4.489 ( 8.596 7.923 14.141) 18.348 4.679 ( 2.147 -3.300 5.545) 6.801 4.833 ( -0.295 -3.645 -8.356) 9.121 4.928 ( 7.798 7.246 0.564) 10.660 4.967 ( -2.518 0.365 3.708) 4.497 5.048 ( -10.654 6.249 0.067) 12.352 5.143 ( -2.718 -1.176 5.299) 6.071 5.231 ( 3.974 7.597 2.320) 8.882 5.396 ( -0.575 -2.729 -2.900) 4.024 5.547 ( 7.420 3.831 2.821) 8.814 5.603 ( -3.278 5.195 -0.679) 6.180 5.615 ( 0.128 3.977 -2.168) 4.531 5.744 ( 1.733 2.383 0.611) 3.009 5.803 ( -2.518 3.956 3.698) 5.972 5.875 ( 5.566 4.030 -0.685) 6.906 6.061 ( 1.990 -4.866 -5.856) 7.869 6.164 ( -0.579 -1.595 4.877) 5.164 6.254 ( -3.105 -2.644 -1.433) 4.322 6.341 ( -3.520 0.073 -4.197) 5.478 6.428 ( -2.855 -9.161 -3.310) 10.150 6.613 ( -4.163 -8.167 0.253) 9.171 6.627 ( 5.541 1.065 -1.190) 5.767 6.724 ( -0.246 -6.840 0.046) 6.845 6.807 ( -7.240 1.237 -5.210) 9.004 7.029 ( 4.509 -7.981 -12.264) 15.311 7.107 ( -2.632 -2.685 -3.678) 5.260 7.164 ( -2.914 3.509 -2.680) 5.291 7.258 ( -0.458 -4.806 -2.850) 5.607 7.315 ( 0.264 2.616 -2.290) 3.487 7.529 ( -3.665 -2.878 1.165) 4.803 7.618 ( 2.906 -7.381 -5.984) 9.936 7.697 ( -2.482 5.553 2.344) 6.518 7.860 ( -2.729 5.565 6.543) 9.013 7.996 ( -0.758 -7.118 -10.789) 12.948 8.074 ( -3.847 5.960 -2.864) 7.650 8.244 ( -11.961 -3.568 1.158) 12.536 8.348 ( -3.995 -4.148 -6.943) 9.021 8.404 ( -5.653 0.694 -0.349) 5.706 8.436 ( -3.297 -2.376 -6.570) 7.725 8.695 ( 2.060 -2.865 -3.223) 4.780 8.780 ( 2.715 -4.660 5.609) 7.782 8.841 ( 5.958 4.167 -2.292) 7.623 8.954 ( 3.527 4.422 -5.302) 7.753 9.180 ( -1.776 2.311 -2.755) 4.010 9.471 ( 0.426 4.073 0.152) 4.098 9.515 ( 0.576 4.319 1.368) 4.567 9.604 ( 2.375 -5.924 -11.794) 13.410 9.657 ( 0.703 3.620 -1.909) 4.152 9.888 ( 0.204 3.172 0.854) 3.291 9.984 ( -0.257 3.656 -0.017) 3.665 10.154 ( -3.288 1.736 -3.867) 5.364 10.829 ( -13.313 -1.614 21.398) 25.253 10.881 ( -14.812 -3.437 24.558) 28.884 11.055 ( -6.498 4.002 3.028) 8.210 11.159 ( -2.729 0.901 9.338) 9.771 11.483 ( 1.580 -0.461 -4.595) 4.881 11.679 ( 1.072 -7.356 -5.344) 9.155 11.916 ( -1.513 2.360 -1.536) 3.196 12.050 ( -7.252 -2.969 -2.552) 8.241 12.623 ( 1.785 -0.941 -7.806) 8.062 12.878 ( 2.042 0.797 1.993) 2.963 12.969 ( -0.904 -0.868 2.540) 2.832 13.132 ( -3.736 5.337 -1.746) 6.745 13.277 ( 0.703 4.571 -2.039) 5.055 13.409 ( 4.078 -2.753 -2.061) 5.334 13.465 ( 1.585 2.038 -0.738) 2.685 13.644 ( -1.735 1.677 4.996) 5.549 13.848 ( 4.481 -0.278 0.217) 4.494 14.041 ( 4.772 3.070 2.073) 6.041 14.098 ( -4.848 4.548 4.014) 7.765 14.228 ( -11.933 -4.565 -5.040) 13.734 14.619 ( 3.164 -15.235 -0.122) 15.560 14.714 ( -4.553 -11.353 6.100) 13.669 15.302 ( 2.069 -0.117 -3.448) 4.022 15.543 ( -1.402 -6.324 1.060) 6.564 15.881 ( 0.518 12.285 -0.128) 12.297 16.035 ( -4.429 12.843 3.966) 14.152 16.868 ( -4.707 -0.024 1.913) 5.081 17.070 ( 1.536 5.069 -2.017) 5.668 17.112 ( -0.389 -7.181 0.707) 7.226 17.358 ( -5.741 1.754 1.341) 6.151 18.039 ( -2.890 2.558 -0.012) 3.860 18.192 ( -3.911 -0.552 0.628) 3.999 18.940 ( 7.966 1.926 4.698) 9.446 19.142 ( 10.568 -2.415 -1.691) 10.972 20.795 ( 0.156 3.093 2.434) 3.939 21.085 ( -0.086 -2.666 3.583) 4.467 21.496 ( 1.898 1.984 -0.439) 2.780 21.773 ( -5.920 -3.766 -2.894) 7.590 21.957 ( 10.230 -0.577 -0.992) 10.295 22.134 ( 9.248 -7.071 -4.939) 12.646 22.988 ( 0.083 -1.861 0.390) 1.903 23.253 ( -1.881 -1.883 -1.586) 3.098 23.583 ( 6.066 0.726 2.686) 6.674 23.751 ( -0.494 -7.464 11.133) 13.413 24.002 ( 1.606 5.890 -9.222) 11.059 24.283 ( -4.483 1.112 -0.493) 4.645 25.695 ( -0.619 9.571 0.342) 9.597 26.093 ( -3.671 -0.429 -0.384) 3.715 26.404 ( -1.958 0.575 0.502) 2.102 26.544 ( -0.324 -3.210 1.923) 3.756 ======================= Grid point 139 (72/78) ======================= q-point: ( 0.38 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( 4.017 3.029 1.049) 5.140 2.513 ( 7.398 3.007 4.046) 8.952 2.791 ( 4.011 6.656 13.560) 15.629 3.075 ( 4.679 0.210 -8.892) 10.050 3.325 ( -6.876 -1.084 8.008) 10.610 3.555 ( 5.592 0.978 11.045) 12.418 3.692 ( 15.983 8.632 -1.524) 18.229 3.792 ( 6.516 6.942 -10.466) 14.149 3.959 ( 7.158 8.265 -1.085) 10.987 4.086 ( 6.816 -6.533 4.930) 10.651 4.287 ( 4.340 -3.907 5.168) 7.798 4.450 ( -0.916 5.261 -4.703) 7.116 4.500 ( 5.670 4.049 3.440) 7.770 4.634 ( 2.889 0.328 5.287) 6.034 4.724 ( -10.299 2.995 4.365) 11.579 4.731 ( 1.744 3.763 -2.596) 4.893 4.847 ( 1.271 -5.638 3.563) 6.790 4.913 ( 0.326 4.802 1.901) 5.175 5.041 ( -2.280 0.133 -2.183) 3.159 5.189 ( 2.011 -5.569 -1.362) 6.076 5.315 ( -0.805 8.088 1.921) 8.352 5.375 ( 1.148 3.772 -1.689) 4.289 5.526 ( -1.319 0.681 0.016) 1.484 5.626 ( 4.929 5.134 6.990) 9.975 5.707 ( 3.000 3.326 -4.457) 6.319 5.768 ( 0.897 4.769 0.556) 4.884 5.811 ( 1.305 -2.555 9.448) 9.874 5.994 ( 4.790 -6.637 -4.053) 9.133 6.108 ( -3.071 -6.737 0.428) 7.416 6.136 ( 2.241 -5.580 -3.966) 7.203 6.239 ( -1.941 -0.573 2.526) 3.237 6.299 ( -2.959 -4.617 -1.863) 5.791 6.313 ( 3.924 1.075 2.509) 4.780 6.504 ( -5.094 -1.738 1.248) 5.525 6.656 ( -1.897 2.329 -3.294) 4.458 6.714 ( 0.279 -7.399 -1.311) 7.519 6.785 ( 3.718 -1.698 -0.384) 4.106 7.042 ( -5.497 1.809 -0.656) 5.824 7.086 ( 1.880 1.324 -2.776) 3.605 7.158 ( 4.900 1.589 -13.727) 14.662 7.256 ( 0.427 -5.829 -1.241) 5.975 7.357 ( -3.949 -2.284 -3.619) 5.823 7.375 ( -5.477 2.163 2.432) 6.371 7.588 ( -6.646 6.158 1.644) 9.208 7.643 ( 0.398 -2.632 -9.544) 9.908 7.829 ( -0.820 3.402 6.835) 7.679 7.966 ( -5.561 -1.315 -8.663) 10.378 7.981 ( -5.622 4.974 0.052) 7.507 8.001 ( -3.600 -4.691 -3.274) 6.759 8.186 ( -7.770 -0.727 -3.428) 8.523 8.371 ( -0.432 -0.817 -5.364) 5.443 8.455 ( 5.318 -12.208 2.687) 13.585 8.702 ( -1.917 -6.473 -5.712) 8.843 8.838 ( 1.997 -5.956 6.410) 8.975 8.930 ( 2.365 5.304 -5.192) 7.790 9.044 ( 5.094 5.857 0.930) 7.818 9.164 ( 0.059 5.537 -3.680) 6.648 9.471 ( 0.026 5.103 2.453) 5.662 9.531 ( 0.454 4.429 -0.834) 4.529 9.641 ( 1.704 -6.769 -16.229) 17.667 9.663 ( 0.218 -0.097 -0.269) 0.360 9.851 ( -2.836 -1.811 4.301) 5.461 9.983 ( 0.383 2.466 0.378) 2.524 10.075 ( -3.725 1.774 -2.920) 5.054 10.560 ( -11.403 -0.680 19.018) 22.185 10.649 ( -8.767 -3.641 17.211) 19.655 10.964 ( -2.543 4.998 0.849) 5.672 11.130 ( -0.922 0.061 6.942) 7.003 11.506 ( 0.700 0.474 -3.814) 3.906 11.680 ( 0.034 -5.304 -2.350) 5.801 11.847 ( -6.152 0.392 -3.013) 6.861 11.883 ( -5.062 -0.717 2.600) 5.736 12.653 ( 1.222 -2.225 -3.941) 4.688 12.919 ( 1.830 -5.131 -0.366) 5.460 13.005 ( 2.183 6.001 3.301) 7.188 13.075 ( -1.287 7.625 -3.388) 8.442 13.292 ( 1.961 4.622 -5.159) 7.199 13.450 ( 0.079 0.747 -4.790) 4.848 13.533 ( 3.711 -2.022 1.275) 4.414 13.611 ( -1.564 2.840 7.803) 8.449 13.864 ( -2.420 -3.046 4.906) 6.262 13.983 ( -9.793 -3.402 -2.785) 10.735 14.078 ( 3.376 5.272 -2.939) 6.916 14.147 ( 2.616 1.738 2.936) 4.299 14.632 ( -1.820 -7.669 1.824) 8.090 14.685 ( 1.252 -14.375 0.697) 14.446 15.335 ( 1.446 -1.470 -1.740) 2.698 15.495 ( -3.055 -2.782 0.907) 4.231 15.920 ( 2.486 9.032 2.270) 9.638 15.970 ( -1.583 12.201 0.150) 12.305 16.766 ( -4.617 -1.654 0.795) 4.968 17.089 ( -0.925 -4.535 -1.282) 4.803 17.122 ( 2.535 0.127 0.612) 2.611 17.255 ( -3.852 0.404 -0.363) 3.890 18.024 ( 0.997 2.598 -1.126) 3.002 18.120 ( -3.149 0.224 1.439) 3.469 19.090 ( 5.333 3.067 2.651) 6.699 19.318 ( 6.052 -1.970 -0.582) 6.391 20.784 ( -1.004 3.608 1.389) 3.994 21.047 ( -2.670 -2.491 1.071) 3.805 21.515 ( 0.256 1.598 -0.883) 1.843 21.675 ( -2.588 -1.634 -2.800) 4.148 22.143 ( 7.444 -1.186 -1.160) 7.626 22.312 ( 5.586 -4.153 -0.232) 6.964 23.002 ( 1.164 -3.233 0.656) 3.498 23.213 ( -1.686 -7.741 -0.601) 7.945 23.694 ( 4.030 1.012 0.873) 4.246 23.771 ( 1.189 -2.646 8.289) 8.782 24.023 ( 0.939 5.571 -7.152) 9.114 24.195 ( -3.545 2.731 -0.304) 4.486 25.697 ( 0.567 7.392 0.242) 7.417 26.020 ( -2.888 -0.168 -0.134) 2.896 26.367 ( -1.383 0.379 0.626) 1.565 26.530 ( -0.803 -3.839 0.401) 3.942 ======================= Grid point 140 (73/78) ======================= q-point: ( 0.50 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 65 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.420 ( -0.000 2.345 0.000) 2.345 2.598 ( -0.000 1.942 0.000) 1.942 2.851 ( -0.000 5.690 0.000) 5.690 3.106 ( -0.000 -1.806 0.000) 1.806 3.246 ( -0.000 0.844 0.000) 0.844 3.601 ( -0.000 -7.022 0.000) 7.022 3.869 ( -0.000 8.270 0.000) 8.270 3.917 ( -0.000 9.499 -0.000) 9.499 4.018 ( -0.000 10.334 0.000) 10.334 4.216 ( -0.000 -2.602 0.000) 2.602 4.324 ( -0.000 0.806 -0.000) 0.806 4.423 ( -0.000 6.339 0.000) 6.339 4.478 ( 0.000 4.077 0.000) 4.077 4.586 ( -0.000 4.976 -0.000) 4.976 4.645 ( -0.000 6.141 0.000) 6.141 4.872 ( -0.000 -5.979 -0.000) 5.979 4.886 ( 0.000 -4.321 0.000) 4.321 4.945 ( -0.000 -0.588 0.000) 0.588 5.003 ( -0.000 0.929 0.000) 0.929 5.131 ( -0.000 -4.393 0.000) 4.393 5.287 ( -0.000 7.269 0.000) 7.269 5.373 ( -0.000 10.061 -0.000) 10.061 5.601 ( -0.000 -3.776 -0.000) 3.776 5.631 ( 0.000 1.770 0.000) 1.770 5.743 ( -0.000 4.183 -0.000) 4.183 5.776 ( 0.000 0.435 0.000) 0.435 5.879 ( -0.000 0.337 -0.000) 0.337 5.945 ( 0.000 -0.574 0.000) 0.574 6.090 ( -0.000 -15.627 0.000) 15.627 6.120 ( -0.000 -9.119 0.000) 9.119 6.243 ( -0.000 1.383 0.000) 1.383 6.280 ( 0.000 -3.191 0.000) 3.191 6.451 ( -0.000 -4.641 0.000) 4.641 6.459 ( -0.000 -2.416 -0.000) 2.416 6.627 ( 0.000 4.299 0.000) 4.299 6.709 ( -0.000 -8.615 0.000) 8.615 6.953 ( -0.000 1.901 0.000) 1.901 6.984 ( 0.000 8.140 -0.000) 8.140 6.993 ( -0.000 -4.731 0.000) 4.731 7.134 ( -0.000 6.852 0.000) 6.852 7.237 ( -0.000 7.932 0.000) 7.932 7.267 ( -0.000 -11.894 -0.000) 11.894 7.406 ( -0.000 4.420 0.000) 4.420 7.503 ( -0.000 0.011 -0.000) 0.011 7.652 ( -0.000 1.608 0.000) 1.608 7.835 ( 0.000 0.704 0.001) 0.704 7.835 ( -0.000 -3.422 -0.001) 3.422 7.953 ( -0.000 8.881 -0.000) 8.881 7.974 ( -0.000 -1.493 0.000) 1.493 8.088 ( -0.000 -3.666 0.000) 3.666 8.364 ( -0.000 -0.669 0.000) 0.669 8.584 ( -0.000 -16.532 -0.000) 16.532 8.616 ( 0.000 -5.447 0.000) 5.447 8.865 ( -0.000 -6.808 -0.000) 6.808 8.951 ( -0.000 9.539 0.000) 9.539 9.104 ( -0.000 6.521 -0.000) 6.521 9.168 ( -0.000 4.127 0.000) 4.127 9.476 ( -0.000 4.710 -0.000) 4.710 9.533 ( -0.000 4.283 -0.000) 4.283 9.655 ( 0.000 -1.666 -0.000) 1.666 9.655 ( -0.000 -4.189 0.000) 4.189 9.822 ( -0.000 -6.202 0.000) 6.202 10.005 ( -0.000 2.504 -0.000) 2.504 10.013 ( 0.000 1.684 0.000) 1.684 10.444 ( -0.000 -0.387 -0.000) 0.387 10.559 ( -0.000 -4.228 -0.000) 4.228 10.939 ( -0.000 5.085 0.000) 5.085 11.125 ( -0.000 -0.180 0.000) 0.180 11.509 ( -0.000 1.146 -0.000) 1.146 11.694 ( -0.000 -3.419 -0.000) 3.419 11.742 ( -0.000 0.902 0.000) 0.902 11.844 ( -0.000 -2.128 -0.000) 2.128 12.664 ( -0.000 -2.291 0.000) 2.291 12.939 ( -0.000 -3.912 0.000) 3.912 13.030 ( -0.000 -1.308 -0.000) 1.308 13.062 ( -0.000 13.916 0.000) 13.916 13.339 ( -0.000 7.134 -0.000) 7.134 13.432 ( -0.000 -2.208 -0.000) 2.208 13.577 ( -0.000 -2.294 0.000) 2.294 13.594 ( -0.000 3.529 0.000) 3.529 13.831 ( -0.000 -2.413 -0.000) 2.413 13.872 ( -0.000 -2.771 0.000) 2.771 14.129 ( -0.000 3.611 0.000) 3.611 14.166 ( -0.000 2.083 -0.000) 2.083 14.612 ( -0.000 -6.736 -0.000) 6.736 14.701 ( -0.000 -13.666 0.000) 13.666 15.356 ( -0.000 -2.559 0.000) 2.559 15.451 ( -0.000 -0.083 0.000) 0.083 15.936 ( -0.000 14.582 0.000) 14.582 15.977 ( -0.000 4.239 -0.000) 4.239 16.710 ( -0.000 -2.351 0.000) 2.351 17.074 ( -0.000 -6.131 0.000) 6.131 17.170 ( -0.000 0.336 0.000) 0.336 17.199 ( -0.000 0.794 0.000) 0.794 18.060 ( 0.000 1.648 -0.000) 1.648 18.064 ( -0.000 1.308 0.000) 1.308 19.148 ( -0.000 3.429 0.000) 3.429 19.383 ( -0.000 -1.725 0.000) 1.725 20.772 ( -0.000 3.767 0.000) 3.767 21.014 ( -0.000 -2.279 0.000) 2.279 21.516 ( -0.000 1.307 0.000) 1.307 21.650 ( -0.000 -1.327 -0.000) 1.327 22.231 ( -0.000 -1.766 0.000) 1.766 22.360 ( -0.000 -1.649 0.000) 1.649 23.020 ( -0.000 -2.940 0.000) 2.940 23.193 ( -0.000 -10.954 0.000) 10.954 23.739 ( -0.000 1.219 -0.000) 1.219 23.790 ( -0.000 -1.552 0.000) 1.552 24.030 ( -0.000 5.381 0.000) 5.381 24.154 ( -0.000 3.432 0.000) 3.432 25.706 ( -0.000 6.644 0.000) 6.644 25.987 ( -0.000 0.031 0.000) 0.031 26.352 ( -0.000 0.284 0.000) 0.284 26.520 ( -0.000 -4.010 0.000) 4.010 ======================= Grid point 145 (74/78) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 65 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( 0.000 11.645 0.000) 11.645 2.342 ( -0.000 4.161 0.000) 4.161 2.535 ( -0.000 18.307 0.000) 18.307 2.840 ( 0.000 -3.498 0.000) 3.498 3.189 ( 0.000 7.354 0.000) 7.354 3.259 ( 0.000 -7.624 0.000) 7.624 3.397 ( -0.000 5.907 0.000) 5.907 3.422 ( -0.000 5.727 -0.000) 5.727 3.758 ( 0.000 -5.827 0.000) 5.827 3.803 ( -0.000 -6.890 -0.000) 6.890 3.941 ( 0.000 7.021 0.000) 7.021 4.147 ( 0.000 -11.884 0.000) 11.884 4.355 ( 0.000 10.478 0.000) 10.478 4.560 ( 0.000 3.359 0.000) 3.359 4.604 ( -0.000 -0.653 -0.000) 0.653 4.711 ( -0.000 -2.092 0.000) 2.092 4.908 ( -0.000 1.875 0.000) 1.875 4.933 ( -0.000 0.448 0.000) 0.448 5.261 ( -0.000 6.405 0.000) 6.405 5.365 ( -0.000 -4.381 0.000) 4.381 5.443 ( -0.000 4.253 0.000) 4.253 5.465 ( 0.000 6.192 -0.000) 6.192 5.590 ( 0.000 12.487 0.000) 12.487 5.685 ( -0.000 6.403 0.000) 6.403 5.706 ( 0.000 3.760 -0.000) 3.760 5.831 ( 0.000 4.510 0.000) 4.510 5.902 ( -0.000 2.789 0.000) 2.789 6.007 ( -0.000 -5.566 0.000) 5.566 6.033 ( -0.000 -0.699 0.000) 0.699 6.039 ( 0.000 -5.926 -0.000) 5.926 6.090 ( 0.000 -9.796 -0.000) 9.796 6.285 ( -0.000 -8.782 0.000) 8.782 6.338 ( 0.000 -15.705 0.000) 15.705 6.362 ( -0.000 -2.569 -0.000) 2.569 6.498 ( 0.000 -1.110 -0.000) 1.110 6.541 ( -0.000 -6.621 0.000) 6.621 6.738 ( 0.000 -2.805 0.000) 2.805 6.765 ( 0.000 -1.239 -0.000) 1.239 7.021 ( 0.000 6.463 0.000) 6.463 7.096 ( 0.000 -2.786 0.000) 2.786 7.319 ( 0.000 -9.224 0.000) 9.224 7.325 ( -0.000 -8.447 -0.000) 8.447 7.563 ( -0.000 3.717 0.000) 3.717 7.625 ( -0.000 -2.398 0.000) 2.398 7.791 ( -0.000 16.015 0.000) 16.015 8.022 ( 0.000 -4.794 0.000) 4.794 8.189 ( 0.000 7.962 0.000) 7.962 8.234 ( -0.000 -0.523 0.000) 0.523 8.390 ( 0.000 6.678 0.000) 6.678 8.478 ( 0.000 -1.960 0.000) 1.960 8.506 ( -0.000 -2.753 0.000) 2.753 8.600 ( 0.000 -9.889 -0.000) 9.889 8.651 ( 0.000 4.296 0.000) 4.296 8.722 ( -0.000 -2.324 0.000) 2.324 8.778 ( 0.000 2.806 0.000) 2.806 8.819 ( 0.000 -0.987 0.000) 0.987 9.362 ( 0.000 2.346 0.000) 2.346 9.387 ( -0.000 0.051 0.000) 0.051 9.613 ( 0.000 3.222 0.000) 3.222 9.627 ( 0.000 1.518 0.000) 1.518 9.791 ( 0.000 6.241 0.000) 6.241 9.848 ( 0.000 1.390 0.000) 1.390 10.156 ( 0.000 7.358 0.000) 7.358 10.237 ( -0.000 -0.864 0.000) 0.864 11.077 ( 0.000 -3.765 -0.000) 3.765 11.077 ( -0.000 -2.569 0.000) 2.569 11.268 ( 0.000 4.187 0.000) 4.187 11.367 ( 0.000 -5.506 -0.000) 5.506 11.470 ( 0.000 0.550 0.000) 0.550 11.521 ( -0.000 -3.252 0.000) 3.252 11.905 ( 0.000 4.799 0.000) 4.799 12.016 ( -0.000 -6.440 0.000) 6.440 12.662 ( 0.000 8.232 0.000) 8.232 12.838 ( -0.000 -5.689 0.000) 5.689 13.100 ( -0.000 -0.861 0.000) 0.861 13.148 ( -0.000 -3.244 -0.000) 3.244 13.272 ( -0.000 0.743 0.000) 0.743 13.290 ( 0.000 -1.079 0.000) 1.079 13.515 ( -0.000 5.625 0.000) 5.625 13.607 ( 0.000 -3.054 0.000) 3.054 13.755 ( 0.000 6.430 0.000) 6.430 13.945 ( 0.000 -10.570 0.000) 10.570 14.255 ( -0.000 5.120 0.000) 5.120 14.476 ( 0.000 1.161 0.000) 1.161 14.504 ( 0.000 -11.931 0.000) 11.931 14.534 ( -0.000 -0.672 0.000) 0.672 15.291 ( -0.000 4.941 0.000) 4.941 15.417 ( -0.000 -6.814 0.000) 6.814 16.186 ( 0.000 9.128 0.000) 9.128 16.285 ( -0.000 -0.134 0.000) 0.134 16.959 ( 0.000 -0.017 0.000) 0.017 16.986 ( -0.000 -3.470 0.000) 3.470 17.341 ( 0.000 13.428 0.000) 13.428 17.531 ( -0.000 -4.000 0.000) 4.000 18.260 ( -0.000 1.139 0.000) 1.139 18.310 ( -0.000 -3.594 0.000) 3.594 18.727 ( -0.000 0.046 0.000) 0.046 18.732 ( 0.000 -0.088 -0.000) 0.088 20.781 ( 0.000 2.039 0.000) 2.039 20.838 ( -0.000 -3.022 0.000) 3.022 21.441 ( 0.000 -0.035 -0.000) 0.035 21.447 ( 0.000 -0.605 0.000) 0.605 21.938 ( 0.000 1.594 0.000) 1.594 22.021 ( 0.000 -5.844 0.000) 5.844 23.062 ( 0.000 6.439 0.000) 6.439 23.249 ( -0.000 -10.805 -0.000) 10.805 23.439 ( 0.000 3.332 0.000) 3.332 23.511 ( -0.000 -6.112 -0.000) 6.112 24.139 ( -0.000 9.842 0.000) 9.842 24.312 ( -0.000 -6.773 0.000) 6.773 26.010 ( -0.000 9.653 0.000) 9.653 26.146 ( -0.000 -4.019 0.000) 4.019 26.478 ( 0.000 0.445 0.000) 0.445 26.486 ( -0.000 -0.483 -0.000) 0.483 ======================= Grid point 147 (75/78) ======================= q-point: ( 0.12 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.296 ( 3.084 8.473 5.055) 10.337 2.350 ( 0.138 2.155 3.303) 3.946 2.723 ( 15.345 18.338 4.750) 24.378 2.988 ( 7.828 12.345 -9.725) 17.557 3.093 ( 0.539 -6.781 15.223) 16.674 3.343 ( 0.318 -10.154 -8.104) 12.995 3.476 ( 9.296 5.245 11.260) 15.515 3.484 ( 7.555 2.955 1.342) 8.223 3.679 ( -3.710 0.556 -10.273) 10.936 3.837 ( 3.207 -4.263 1.444) 5.527 3.973 ( 1.228 0.635 8.056) 8.174 4.154 ( 0.796 -11.252 -1.219) 11.346 4.455 ( 6.661 7.968 -6.632) 12.322 4.577 ( 2.690 4.323 4.954) 7.104 4.647 ( 3.100 4.744 6.886) 8.918 4.758 ( 2.549 1.281 5.710) 6.383 4.842 ( -1.217 -0.773 3.248) 3.553 4.939 ( -1.662 -4.321 4.278) 6.303 5.275 ( -0.477 7.398 1.261) 7.520 5.358 ( 0.371 1.002 -2.156) 2.406 5.442 ( 0.837 6.056 -0.535) 6.137 5.474 ( 2.287 4.524 -1.831) 5.390 5.511 ( -6.713 11.323 -0.425) 13.170 5.711 ( -0.668 -0.008 5.008) 5.053 5.737 ( -5.059 1.499 5.909) 7.922 5.767 ( 4.440 6.372 -3.348) 8.457 5.885 ( -4.692 -2.349 7.000) 8.748 5.930 ( -1.369 3.403 -1.129) 3.838 6.016 ( -2.116 -15.056 -0.561) 15.215 6.074 ( -1.585 1.321 -6.241) 6.573 6.157 ( 0.670 -2.575 -0.848) 2.793 6.271 ( 4.737 -5.057 -2.505) 7.368 6.340 ( 2.282 -13.169 -3.223) 13.748 6.397 ( 2.465 -6.778 -0.848) 7.263 6.504 ( 2.005 1.835 -2.558) 3.732 6.612 ( 3.282 -7.870 -3.151) 9.091 6.744 ( 0.771 -3.839 -2.573) 4.685 6.796 ( 3.199 -3.860 -3.608) 6.177 7.081 ( 2.177 5.483 -5.258) 7.902 7.107 ( 2.813 2.078 -2.142) 4.101 7.292 ( -3.418 -6.655 0.987) 7.546 7.312 ( -0.783 -8.623 -6.721) 10.961 7.521 ( -3.110 4.572 0.806) 5.588 7.618 ( 0.068 -4.035 3.053) 5.060 7.757 ( -1.759 11.803 -4.422) 12.727 7.953 ( -5.053 -5.457 -4.328) 8.605 8.164 ( -4.060 10.761 4.661) 12.410 8.260 ( 0.337 0.916 -1.908) 2.143 8.348 ( -4.221 2.543 -0.890) 5.008 8.398 ( -6.116 -2.764 1.938) 6.986 8.440 ( -4.204 -1.052 -0.702) 4.390 8.544 ( -5.090 -6.704 -2.097) 8.675 8.648 ( -0.197 1.316 -4.727) 4.911 8.698 ( -1.774 -3.272 -2.846) 4.685 8.842 ( 3.109 3.146 -0.123) 4.425 8.869 ( 6.140 -0.164 -1.456) 6.312 9.307 ( -3.628 3.602 -3.594) 6.249 9.377 ( 0.211 -3.228 -3.711) 4.923 9.597 ( -1.145 2.032 -0.297) 2.352 9.607 ( -1.484 1.411 1.595) 2.595 9.800 ( 0.474 7.755 -0.910) 7.822 9.897 ( 2.737 -0.558 -0.455) 2.830 10.128 ( -2.140 6.788 -1.206) 7.219 10.218 ( -1.759 -1.584 -3.700) 4.393 11.005 ( -7.012 -0.967 12.063) 13.987 11.032 ( -6.533 -3.522 12.253) 14.325 11.242 ( -3.713 2.848 3.550) 5.873 11.280 ( -6.888 -0.570 7.184) 9.969 11.462 ( -1.198 -0.455 2.343) 2.671 11.503 ( 1.993 -4.336 -3.853) 6.133 11.950 ( 2.244 2.488 -2.428) 4.138 12.023 ( -0.039 -5.068 -1.203) 5.209 12.667 ( 0.178 6.610 -6.106) 9.000 12.818 ( -2.086 -6.517 -1.665) 7.042 13.056 ( -0.706 5.491 3.929) 6.789 13.188 ( 3.572 -5.304 4.109) 7.601 13.274 ( -0.725 1.618 -2.059) 2.717 13.310 ( 1.170 -1.538 -4.177) 4.603 13.533 ( 1.225 5.493 -1.766) 5.899 13.620 ( 1.471 -2.400 -1.689) 3.283 13.804 ( 3.776 4.809 1.321) 6.255 13.983 ( 3.081 -10.790 1.164) 11.282 14.220 ( -3.262 5.061 2.824) 6.651 14.364 ( -9.084 0.426 2.177) 9.351 14.450 ( -2.503 -1.503 -1.422) 3.248 14.529 ( -2.435 -9.914 4.883) 11.317 15.313 ( 1.738 4.432 -2.189) 5.240 15.424 ( 0.503 -6.103 -0.354) 6.134 16.158 ( -2.207 9.247 -2.322) 9.786 16.251 ( -2.758 0.499 0.629) 2.873 16.946 ( -1.440 0.494 1.456) 2.106 16.985 ( -0.231 -3.929 1.537) 4.225 17.292 ( -4.203 11.773 0.870) 12.531 17.471 ( -5.648 -4.549 2.355) 7.625 18.190 ( -5.231 2.506 0.492) 5.821 18.249 ( -4.441 -2.765 0.298) 5.240 18.803 ( 7.578 1.904 2.503) 8.204 18.855 ( 9.543 -2.717 -0.234) 9.925 20.832 ( 3.754 4.302 2.306) 6.158 20.933 ( 5.849 -5.034 3.449) 8.453 21.481 ( 4.356 2.618 -0.040) 5.082 21.553 ( 8.724 -4.370 -0.286) 9.762 21.907 ( -1.997 1.153 -3.375) 4.087 21.970 ( -2.849 -4.665 -5.490) 7.747 23.046 ( -1.477 5.636 -0.165) 5.829 23.210 ( -3.237 -9.434 -1.474) 10.082 23.491 ( 4.558 2.736 3.104) 6.155 23.560 ( 3.827 -5.117 3.881) 7.475 24.142 ( 0.327 8.900 -3.010) 9.401 24.296 ( -1.365 -5.879 -1.353) 6.186 25.968 ( -3.258 9.989 -0.384) 10.514 26.116 ( -2.660 -4.471 -0.936) 5.286 26.461 ( -1.371 1.165 0.543) 1.880 26.490 ( -0.295 -1.787 2.684) 3.238 ======================= Grid point 148 (76/78) ======================= q-point: ( 0.25 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.372 ( 2.087 3.093 5.553) 6.690 2.399 ( 5.465 1.319 6.989) 8.969 2.944 ( -0.913 12.129 13.365) 18.071 3.013 ( 6.505 6.901 -4.640) 10.558 3.361 ( 3.218 -4.233 1.196) 5.451 3.382 ( 11.830 -7.004 7.729) 15.772 3.645 ( 7.214 5.335 -0.719) 9.001 3.683 ( 9.620 9.798 2.484) 13.954 3.773 ( 15.503 -0.924 3.962) 16.028 3.987 ( 11.441 -0.248 -2.386) 11.690 4.000 ( 1.377 -1.216 4.449) 4.814 4.203 ( 5.728 -9.991 -4.527) 12.374 4.528 ( 1.883 5.180 -3.856) 6.727 4.613 ( -0.352 -2.153 1.501) 2.648 4.733 ( 3.408 9.353 7.811) 12.653 4.808 ( 0.212 0.561 6.417) 6.445 4.904 ( 2.087 -5.423 -0.508) 5.833 4.925 ( 4.090 -4.394 3.291) 6.846 5.263 ( 0.357 9.858 1.284) 9.948 5.279 ( -10.234 8.518 4.219) 13.968 5.384 ( -2.154 8.227 -0.278) 8.509 5.457 ( 1.263 6.330 1.682) 6.670 5.580 ( 3.048 3.033 -3.159) 5.336 5.655 ( -0.900 2.168 -2.438) 3.384 5.690 ( -1.407 -0.118 1.009) 1.735 5.797 ( -4.162 0.032 3.498) 5.437 5.829 ( -1.137 -7.751 8.337) 11.440 5.852 ( -4.009 -2.805 2.527) 5.507 5.954 ( 2.485 -2.610 -3.130) 4.773 6.044 ( -0.838 -6.407 -7.449) 9.861 6.217 ( 3.545 -0.508 2.861) 4.584 6.309 ( -3.342 -0.266 -5.912) 6.797 6.379 ( -2.525 -1.719 4.218) 5.208 6.423 ( 2.658 -2.305 -3.507) 4.967 6.620 ( 3.866 -3.841 -1.936) 5.783 6.670 ( 6.924 -0.564 -7.142) 9.963 6.780 ( 3.704 -8.453 -0.482) 9.241 6.844 ( -0.388 -2.556 0.112) 2.588 7.020 ( -2.771 1.896 -5.432) 6.386 7.186 ( -5.261 -9.023 0.120) 10.445 7.229 ( 5.239 5.259 -9.336) 11.927 7.339 ( 4.272 -3.741 -7.151) 9.131 7.454 ( -3.181 7.264 0.546) 7.949 7.619 ( 0.152 -2.979 -4.226) 5.173 7.746 ( -0.364 2.729 -0.393) 2.781 7.856 ( -3.265 -5.653 -6.322) 9.087 8.014 ( -8.680 8.066 7.959) 14.274 8.151 ( -11.734 -4.359 5.618) 13.721 8.210 ( -4.266 5.212 -7.499) 10.080 8.330 ( -4.605 2.184 2.474) 5.665 8.357 ( -2.325 -5.337 -12.073) 13.403 8.403 ( -7.955 -1.838 -5.536) 9.864 8.632 ( -0.800 -0.802 -3.661) 3.832 8.672 ( 0.168 -4.528 1.029) 4.647 8.931 ( 5.266 4.819 -2.312) 7.503 9.006 ( 6.770 -1.018 -3.124) 7.525 9.276 ( 1.319 5.783 -6.307) 8.658 9.407 ( 3.082 -7.243 -8.635) 11.685 9.568 ( -1.779 1.873 1.067) 2.795 9.581 ( -1.068 0.851 2.072) 2.482 9.785 ( -2.206 7.575 0.254) 7.894 9.905 ( -2.429 -2.949 0.824) 3.908 10.082 ( -2.017 5.455 -1.607) 6.034 10.161 ( -3.207 -1.687 -3.705) 5.182 10.802 ( -12.831 -0.598 21.139) 24.735 10.818 ( -13.672 -2.222 22.720) 26.610 11.136 ( -4.981 3.323 4.568) 7.531 11.171 ( -3.911 -0.167 7.839) 8.761 11.484 ( 2.178 1.095 -3.214) 4.034 11.547 ( 1.900 -5.164 -5.430) 7.731 11.941 ( -2.986 0.915 -1.646) 3.530 11.980 ( -4.261 -3.073 -1.642) 5.504 12.658 ( -0.015 3.979 -5.677) 6.932 12.769 ( -1.374 -6.597 -1.425) 6.888 13.119 ( 4.825 10.465 1.846) 11.670 13.241 ( -1.078 4.665 -1.181) 4.932 13.305 ( -1.022 -2.390 -4.091) 4.847 13.311 ( 6.672 -6.373 2.052) 9.452 13.550 ( 0.644 5.968 -3.729) 7.067 13.650 ( 0.903 -2.235 -2.508) 3.478 13.862 ( 0.139 2.568 6.530) 7.018 14.010 ( -3.396 -11.889 5.147) 13.394 14.171 ( 0.823 7.883 2.353) 8.268 14.212 ( -3.922 3.997 -1.916) 5.919 14.396 ( -1.635 -4.688 -0.268) 4.972 14.478 ( -2.334 -11.126 4.402) 12.190 15.344 ( 1.222 3.572 -1.801) 4.183 15.432 ( 0.271 -4.916 -0.004) 4.923 16.110 ( -1.891 8.830 -1.901) 9.229 16.192 ( -2.647 1.708 0.207) 3.157 16.888 ( -4.514 2.323 3.247) 6.026 16.971 ( -1.527 -5.811 2.693) 6.584 17.207 ( -2.949 7.294 -1.233) 7.964 17.332 ( -6.492 -4.231 1.047) 7.819 18.105 ( -2.453 3.510 0.179) 4.286 18.166 ( -3.201 -2.193 0.412) 3.902 18.998 ( 9.632 3.570 2.800) 10.647 19.076 ( 10.492 -3.840 0.376) 11.179 20.885 ( 0.686 5.478 2.328) 5.992 21.001 ( 0.279 -5.388 2.859) 6.106 21.562 ( 1.877 4.495 -1.546) 5.111 21.671 ( -0.535 -5.766 -2.659) 6.373 21.955 ( 8.423 0.756 -1.452) 8.581 22.006 ( 8.050 -4.536 -3.113) 9.750 23.005 ( -2.149 3.698 -0.291) 4.287 23.130 ( -4.045 -7.899 -0.800) 8.911 23.607 ( 5.686 1.716 3.284) 6.787 23.652 ( 4.260 -2.842 4.741) 6.978 24.145 ( 0.207 6.993 -4.656) 8.404 24.257 ( -2.081 -3.647 -2.198) 4.740 25.902 ( -2.611 9.512 0.128) 9.864 26.049 ( -3.316 -4.525 -0.567) 5.638 26.424 ( -2.044 1.583 0.931) 2.748 26.473 ( -1.441 -3.209 1.763) 3.935 ======================= Grid point 149 (77/78) ======================= q-point: ( 0.38 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 120 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.440 ( 3.449 3.600 4.886) 6.981 2.513 ( 4.676 -2.791 5.616) 7.823 2.967 ( 1.916 8.689 4.616) 10.024 3.074 ( 1.131 -1.508 -4.218) 4.620 3.335 ( -4.002 2.646 9.504) 10.646 3.448 ( -2.154 -7.606 12.628) 14.898 3.941 ( 13.692 10.217 4.448) 17.653 3.975 ( 14.951 7.134 -4.299) 17.115 4.031 ( 4.060 1.165 -2.005) 4.676 4.086 ( 11.184 -0.378 -2.931) 11.568 4.231 ( 10.734 4.117 -4.326) 12.284 4.422 ( 12.298 -11.426 -1.404) 16.846 4.558 ( 2.151 4.842 -4.509) 6.957 4.610 ( 0.575 0.778 2.440) 2.625 4.756 ( -2.328 0.606 -0.280) 2.422 4.792 ( -1.590 -1.461 6.438) 6.790 4.856 ( -6.687 6.428 0.715) 9.303 4.992 ( 1.528 -5.574 1.342) 5.934 5.121 ( -2.420 10.144 1.924) 10.605 5.251 ( -4.756 14.686 -1.694) 15.529 5.372 ( 2.216 -3.786 9.905) 10.833 5.524 ( 2.163 1.973 3.058) 4.234 5.535 ( -5.572 -0.247 0.562) 5.605 5.595 ( -1.534 -9.930 -2.725) 10.410 5.654 ( 0.011 0.882 2.385) 2.543 5.737 ( 0.429 -2.316 2.573) 3.489 5.855 ( 3.796 0.606 0.830) 3.933 5.907 ( 1.883 -0.146 -1.240) 2.259 6.015 ( 0.407 -5.008 -6.479) 8.199 6.041 ( -0.892 -3.079 -4.138) 5.235 6.166 ( -5.405 1.658 -3.804) 6.814 6.213 ( -2.458 -0.839 1.193) 2.859 6.360 ( -4.060 -1.740 2.999) 5.339 6.385 ( 1.279 -7.706 5.771) 9.712 6.680 ( -2.365 4.731 -4.064) 6.670 6.749 ( 2.035 4.284 -0.717) 4.797 6.803 ( 2.746 1.287 1.803) 3.528 6.964 ( 3.466 -9.615 -0.265) 10.224 7.015 ( 5.296 1.637 -5.121) 7.547 7.140 ( 3.983 -6.699 -6.307) 10.026 7.285 ( -0.925 5.335 -2.674) 6.039 7.351 ( -1.209 1.170 0.941) 1.928 7.476 ( 3.847 6.398 -2.823) 7.981 7.628 ( -0.678 -1.893 -6.376) 6.685 7.687 ( -4.103 4.071 1.014) 5.869 7.796 ( -2.211 -6.288 -3.501) 7.529 7.891 ( -3.538 -0.688 4.364) 5.660 7.924 ( -9.162 -3.014 2.734) 10.025 8.108 ( -3.953 6.490 -4.835) 9.007 8.205 ( -6.505 2.475 -2.864) 7.526 8.258 ( -3.833 -5.149 -4.693) 7.952 8.304 ( -2.166 -8.056 -8.135) 11.652 8.610 ( -1.231 0.478 -1.759) 2.199 8.697 ( 1.491 -6.504 1.217) 6.783 9.050 ( 5.981 6.955 -3.279) 9.742 9.146 ( 6.556 0.262 -0.255) 6.566 9.317 ( 1.669 7.552 -5.765) 9.647 9.462 ( 0.909 -7.907 -9.001) 12.015 9.542 ( 0.887 1.549 -1.656) 2.434 9.568 ( 0.091 -0.525 -1.903) 1.976 9.713 ( -4.197 4.734 3.574) 7.266 9.809 ( -6.114 -3.544 4.911) 8.606 10.047 ( -0.968 3.335 -1.139) 3.655 10.091 ( -2.925 -0.596 -2.466) 3.872 10.554 ( -10.555 0.224 17.981) 20.851 10.580 ( -9.670 -2.546 17.145) 19.848 11.063 ( -2.328 4.086 2.068) 5.137 11.119 ( -1.693 -1.427 5.026) 5.492 11.524 ( 1.823 1.569 -1.855) 3.037 11.580 ( 1.937 -4.044 -1.553) 4.746 11.846 ( -5.419 0.065 -2.633) 6.025 11.861 ( -5.759 -1.234 -0.461) 5.908 12.670 ( 1.279 3.475 -2.948) 4.733 12.777 ( 1.717 -6.697 -1.228) 7.022 13.140 ( -2.031 7.216 -0.732) 7.532 13.248 ( -1.327 0.517 -0.695) 1.585 13.328 ( 6.028 4.775 -2.255) 8.013 13.443 ( 4.810 -3.748 -0.476) 6.117 13.550 ( -0.521 5.502 -3.491) 6.537 13.650 ( -0.402 -1.224 -0.300) 1.322 13.818 ( -3.486 -0.153 6.987) 7.810 13.884 ( -6.444 -5.539 3.120) 9.052 14.203 ( 1.735 5.590 -2.757) 6.469 14.226 ( 2.248 7.219 2.630) 8.005 14.390 ( 0.760 -10.904 -0.546) 10.944 14.446 ( -0.961 -10.293 2.576) 10.654 15.365 ( 0.999 3.223 -0.618) 3.430 15.435 ( -0.006 -3.318 0.272) 3.329 16.083 ( -0.575 6.974 -0.620) 7.025 16.146 ( -1.715 2.437 -0.375) 3.003 16.781 ( -4.977 4.204 2.606) 7.017 16.926 ( -2.492 -8.804 2.485) 9.481 17.181 ( 0.205 3.255 -1.480) 3.582 17.237 ( -2.648 -2.037 -0.944) 3.471 18.081 ( -0.147 2.534 -0.288) 2.555 18.116 ( -1.748 -0.825 0.677) 2.048 19.170 ( 6.088 4.506 1.644) 7.751 19.258 ( 6.371 -3.842 0.407) 7.451 20.877 ( -1.008 5.097 1.120) 5.315 20.976 ( -1.942 -4.386 1.014) 4.903 21.565 ( -0.509 3.170 -1.725) 3.644 21.629 ( -1.612 -2.822 -2.538) 4.124 22.137 ( 7.611 1.414 -0.293) 7.746 22.210 ( 8.238 -5.159 0.522) 9.733 22.969 ( -0.958 0.841 -0.253) 1.300 23.049 ( -3.475 -6.833 -0.336) 7.674 23.712 ( 3.836 0.926 2.163) 4.500 23.734 ( 2.962 -1.225 3.413) 4.682 24.142 ( -0.083 5.300 -3.810) 6.528 24.213 ( -1.763 -1.324 -1.822) 2.860 25.866 ( -0.914 8.062 0.345) 8.121 25.989 ( -2.183 -3.569 -0.095) 4.185 26.385 ( -1.535 1.616 0.543) 2.294 26.442 ( -1.296 -4.011 0.591) 4.256 ======================= Grid point 150 (78/78) ======================= q-point: ( 0.50 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 0.00e+00 0.00e+00 2.01e-04 2.01e-04 2.01e-04 2.01e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 65 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.487 ( -0.000 4.077 0.000) 4.077 2.574 ( -0.000 -3.804 0.000) 3.804 2.990 ( -0.000 6.796 0.000) 6.796 3.082 ( -0.000 -1.891 0.000) 1.891 3.290 ( -0.000 3.932 0.000) 3.932 3.421 ( -0.000 -8.758 0.000) 8.758 4.049 ( -0.000 7.236 -0.000) 7.236 4.095 ( -0.000 3.849 0.000) 3.849 4.201 ( 0.000 1.136 0.000) 1.136 4.205 ( -0.000 3.596 0.000) 3.596 4.383 ( -0.000 7.822 0.000) 7.822 4.511 ( -0.000 -0.779 -0.000) 0.779 4.588 ( -0.000 6.549 0.000) 6.549 4.657 ( 0.000 0.083 -0.000) 0.083 4.692 ( -0.000 0.376 0.000) 0.376 4.742 ( -0.000 -6.459 0.000) 6.459 4.823 ( -0.000 3.121 0.000) 3.121 4.988 ( -0.000 -8.202 0.000) 8.202 5.113 ( -0.000 11.149 0.000) 11.149 5.168 ( -0.000 16.214 0.000) 16.214 5.416 ( -0.000 3.864 -0.000) 3.864 5.461 ( 0.000 -13.076 -0.000) 13.076 5.542 ( -0.000 -0.247 0.000) 0.247 5.560 ( -0.000 -9.473 -0.000) 9.473 5.744 ( -0.000 0.986 0.000) 0.986 5.796 ( 0.000 1.248 0.000) 1.248 5.829 ( -0.000 -1.398 -0.000) 1.398 5.899 ( 0.000 -3.888 0.000) 3.888 5.954 ( -0.000 0.762 -0.000) 0.762 6.002 ( -0.000 5.636 0.000) 5.636 6.139 ( -0.000 -9.681 0.000) 9.681 6.182 ( -0.000 -7.248 0.000) 7.248 6.394 ( 0.001 -2.622 -0.000) 2.622 6.395 ( -0.001 -2.315 0.000) 2.315 6.627 ( -0.000 3.082 0.000) 3.082 6.706 ( -0.000 -0.841 0.000) 0.841 6.907 ( -0.000 -1.487 -0.000) 1.487 6.937 ( 0.000 -2.055 0.000) 2.055 7.128 ( -0.000 0.729 0.000) 0.729 7.211 ( -0.000 -2.133 -0.000) 2.133 7.259 ( -0.000 13.966 0.000) 13.966 7.367 ( -0.000 3.818 0.000) 3.818 7.526 ( -0.000 6.203 0.000) 6.203 7.550 ( 0.000 3.810 -0.000) 3.810 7.659 ( -0.000 0.057 0.000) 0.057 7.754 ( -0.000 -6.575 0.000) 6.575 7.838 ( -0.000 -0.813 -0.000) 0.813 7.844 ( 0.000 -5.661 0.000) 5.661 8.080 ( -0.000 1.825 -0.000) 1.825 8.113 ( -0.000 6.855 0.000) 6.855 8.230 ( -0.000 -14.455 0.000) 14.455 8.268 ( -0.000 -8.000 0.000) 8.000 8.591 ( -0.000 3.819 0.000) 3.819 8.716 ( -0.000 -7.338 0.000) 7.338 9.132 ( -0.000 8.999 0.000) 8.999 9.231 ( -0.000 2.626 0.000) 2.626 9.322 ( -0.000 7.141 0.000) 7.141 9.437 ( -0.000 -6.676 -0.000) 6.676 9.573 ( -0.000 0.314 0.000) 0.314 9.593 ( -0.000 -1.583 0.000) 1.583 9.656 ( -0.000 2.077 0.000) 2.077 9.721 ( -0.000 -3.868 -0.000) 3.868 10.046 ( -0.000 1.256 -0.000) 1.256 10.049 ( 0.000 1.224 0.000) 1.224 10.443 ( -0.000 0.546 -0.000) 0.546 10.477 ( -0.000 -3.040 -0.000) 3.040 11.040 ( -0.000 4.260 0.000) 4.260 11.104 ( -0.000 -2.041 0.000) 2.041 11.547 ( -0.000 2.649 -0.000) 2.649 11.615 ( -0.000 -3.892 -0.000) 3.892 11.762 ( -0.000 1.110 0.000) 1.110 11.795 ( -0.000 -2.234 -0.000) 2.234 12.687 ( -0.000 3.934 0.000) 3.934 12.802 ( -0.000 -6.956 0.000) 6.956 13.111 ( -0.000 6.496 0.000) 6.496 13.225 ( -0.000 -1.949 0.000) 1.949 13.447 ( 0.000 3.474 -0.000) 3.474 13.456 ( -0.000 5.418 -0.000) 5.418 13.542 ( -0.000 1.261 0.000) 1.261 13.645 ( -0.000 -1.252 0.000) 1.252 13.776 ( -0.000 -1.335 -0.000) 1.335 13.810 ( -0.000 -3.025 0.000) 3.025 14.227 ( -0.000 4.600 0.000) 4.600 14.248 ( -0.000 7.848 -0.000) 7.848 14.403 ( -0.000 -12.706 0.000) 12.706 14.438 ( -0.000 -9.582 -0.000) 9.582 15.379 ( -0.000 3.006 0.000) 3.006 15.433 ( -0.000 -1.876 0.000) 1.876 16.080 ( -0.000 5.053 0.000) 5.053 16.125 ( -0.000 2.672 0.000) 2.672 16.723 ( -0.000 5.173 0.000) 5.173 16.897 ( -0.000 -10.089 0.000) 10.089 17.191 ( -0.000 1.167 0.000) 1.167 17.206 ( -0.000 -0.204 0.000) 0.204 18.089 ( 0.000 0.869 -0.000) 0.869 18.090 ( -0.000 0.878 0.000) 0.878 19.237 ( -0.000 4.805 0.000) 4.805 19.327 ( -0.000 -3.760 0.000) 3.760 20.864 ( -0.000 4.786 0.000) 4.786 20.952 ( -0.000 -3.741 0.000) 3.741 21.558 ( -0.000 2.657 0.000) 2.657 21.612 ( -0.000 -2.377 -0.000) 2.377 22.224 ( -0.000 1.799 0.000) 1.799 22.298 ( -0.000 -4.326 0.000) 4.326 22.966 ( 0.000 -1.416 0.000) 1.416 23.003 ( -0.000 -5.883 0.000) 5.883 23.756 ( -0.000 0.586 -0.000) 0.586 23.768 ( -0.000 -0.669 0.000) 0.669 24.139 ( -0.000 4.540 -0.000) 4.540 24.192 ( -0.000 -0.287 0.000) 0.287 25.858 ( -0.000 7.230 0.000) 7.230 25.965 ( -0.000 -2.877 0.000) 2.877 26.368 ( -0.000 1.578 0.000) 1.578 26.428 ( -0.000 -4.269 0.000) 4.269 =================== 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 3/27360 10.0 927.981 1249.704 1974.261 0.000 47.196 0.000 3/27360 20.0 277.570 211.813 319.011 0.000 -54.974 0.000 3/27360 30.0 89.334 67.613 106.215 0.000 -19.933 0.000 3/27360 40.0 44.207 34.054 49.674 0.000 -9.444 0.000 3/27360 50.0 27.165 21.381 29.200 0.000 -5.652 0.000 3/27360 60.0 18.918 15.226 19.789 0.000 -3.886 0.000 3/27360 70.0 14.287 11.734 14.706 0.000 -2.919 0.000 3/27360 80.0 11.405 9.530 11.630 0.000 -2.330 0.000 3/27360 90.0 9.472 8.028 9.609 0.000 -1.941 0.000 3/27360 100.0 8.099 6.943 8.193 0.000 -1.669 0.000 3/27360 110.0 7.078 6.125 7.153 0.000 -1.469 0.000 3/27360 120.0 6.292 5.485 6.358 0.000 -1.317 0.000 3/27360 130.0 5.669 4.972 5.732 0.000 -1.196 0.000 3/27360 140.0 5.162 4.551 5.226 0.000 -1.098 0.000 3/27360 150.0 4.743 4.200 4.807 0.000 -1.017 0.000 3/27360 160.0 4.391 3.902 4.456 0.000 -0.948 0.000 3/27360 170.0 4.090 3.646 4.156 0.000 -0.889 0.000 3/27360 180.0 3.829 3.423 3.897 0.000 -0.837 0.000 3/27360 190.0 3.602 3.228 3.671 0.000 -0.792 0.000 3/27360 200.0 3.402 3.056 3.471 0.000 -0.751 0.000 3/27360 210.0 3.224 2.902 3.294 0.000 -0.715 0.000 3/27360 220.0 3.065 2.764 3.135 0.000 -0.682 0.000 3/27360 230.0 2.922 2.639 2.992 0.000 -0.652 0.000 3/27360 240.0 2.792 2.526 2.862 0.000 -0.625 0.000 3/27360 250.0 2.674 2.423 2.743 0.000 -0.600 0.000 3/27360 260.0 2.566 2.328 2.635 0.000 -0.577 0.000 3/27360 270.0 2.467 2.241 2.535 0.000 -0.555 0.000 3/27360 280.0 2.376 2.161 2.443 0.000 -0.535 0.000 3/27360 290.0 2.291 2.086 2.358 0.000 -0.517 0.000 3/27360 300.0 2.213 2.017 2.278 0.000 -0.500 0.000 3/27360 310.0 2.140 1.952 2.204 0.000 -0.484 0.000 3/27360 320.0 2.071 1.892 2.135 0.000 -0.469 0.000 3/27360 330.0 2.008 1.835 2.071 0.000 -0.455 0.000 3/27360 340.0 1.948 1.782 2.010 0.000 -0.441 0.000 3/27360 350.0 1.891 1.732 1.953 0.000 -0.429 0.000 3/27360 360.0 1.838 1.684 1.899 0.000 -0.417 0.000 3/27360 370.0 1.788 1.640 1.848 0.000 -0.406 0.000 3/27360 380.0 1.741 1.597 1.800 0.000 -0.395 0.000 3/27360 390.0 1.696 1.557 1.754 0.000 -0.385 0.000 3/27360 400.0 1.654 1.519 1.710 0.000 -0.375 0.000 3/27360 410.0 1.613 1.483 1.669 0.000 -0.366 0.000 3/27360 420.0 1.575 1.448 1.630 0.000 -0.357 0.000 3/27360 430.0 1.538 1.415 1.593 0.000 -0.349 0.000 3/27360 440.0 1.503 1.384 1.557 0.000 -0.341 0.000 3/27360 450.0 1.470 1.354 1.523 0.000 -0.334 0.000 3/27360 460.0 1.438 1.325 1.490 0.000 -0.326 0.000 3/27360 470.0 1.408 1.298 1.459 0.000 -0.319 0.000 3/27360 480.0 1.378 1.271 1.429 0.000 -0.313 0.000 3/27360 490.0 1.350 1.246 1.400 0.000 -0.306 0.000 3/27360 500.0 1.324 1.222 1.372 0.000 -0.300 0.000 3/27360 510.0 1.298 1.198 1.346 0.000 -0.294 0.000 3/27360 520.0 1.273 1.176 1.320 0.000 -0.289 0.000 3/27360 530.0 1.249 1.154 1.296 0.000 -0.283 0.000 3/27360 540.0 1.226 1.133 1.272 0.000 -0.278 0.000 3/27360 550.0 1.204 1.113 1.249 0.000 -0.273 0.000 3/27360 560.0 1.183 1.094 1.227 0.000 -0.268 0.000 3/27360 570.0 1.162 1.075 1.206 0.000 -0.263 0.000 3/27360 580.0 1.142 1.057 1.186 0.000 -0.259 0.000 3/27360 590.0 1.123 1.040 1.166 0.000 -0.254 0.000 3/27360 600.0 1.104 1.023 1.147 0.000 -0.250 0.000 3/27360 610.0 1.086 1.006 1.128 0.000 -0.246 0.000 3/27360 620.0 1.069 0.990 1.110 0.000 -0.242 0.000 3/27360 630.0 1.052 0.975 1.093 0.000 -0.238 0.000 3/27360 640.0 1.036 0.960 1.076 0.000 -0.235 0.000 3/27360 650.0 1.020 0.946 1.060 0.000 -0.231 0.000 3/27360 660.0 1.005 0.932 1.044 0.000 -0.227 0.000 3/27360 670.0 0.990 0.918 1.029 0.000 -0.224 0.000 3/27360 680.0 0.975 0.905 1.014 0.000 -0.221 0.000 3/27360 690.0 0.961 0.892 0.999 0.000 -0.218 0.000 3/27360 700.0 0.948 0.879 0.985 0.000 -0.214 0.000 3/27360 710.0 0.935 0.867 0.971 0.000 -0.211 0.000 3/27360 720.0 0.922 0.855 0.958 0.000 -0.209 0.000 3/27360 730.0 0.909 0.844 0.945 0.000 -0.206 0.000 3/27360 740.0 0.897 0.833 0.932 0.000 -0.203 0.000 3/27360 750.0 0.885 0.822 0.920 0.000 -0.200 0.000 3/27360 760.0 0.874 0.811 0.908 0.000 -0.198 0.000 3/27360 770.0 0.862 0.801 0.897 0.000 -0.195 0.000 3/27360 780.0 0.851 0.791 0.885 0.000 -0.192 0.000 3/27360 790.0 0.841 0.781 0.874 0.000 -0.190 0.000 3/27360 800.0 0.830 0.771 0.863 0.000 -0.188 0.000 3/27360 810.0 0.820 0.762 0.853 0.000 -0.185 0.000 3/27360 820.0 0.810 0.753 0.842 0.000 -0.183 0.000 3/27360 830.0 0.800 0.744 0.832 0.000 -0.181 0.000 3/27360 840.0 0.791 0.735 0.823 0.000 -0.179 0.000 3/27360 850.0 0.782 0.727 0.813 0.000 -0.177 0.000 3/27360 860.0 0.773 0.719 0.804 0.000 -0.175 0.000 3/27360 870.0 0.764 0.710 0.795 0.000 -0.173 0.000 3/27360 880.0 0.755 0.702 0.786 0.000 -0.171 0.000 3/27360 890.0 0.747 0.695 0.777 0.000 -0.169 0.000 3/27360 900.0 0.739 0.687 0.768 0.000 -0.167 0.000 3/27360 910.0 0.730 0.680 0.760 0.000 -0.165 0.000 3/27360 920.0 0.723 0.672 0.752 0.000 -0.163 0.000 3/27360 930.0 0.715 0.665 0.744 0.000 -0.161 0.000 3/27360 940.0 0.707 0.658 0.736 0.000 -0.160 0.000 3/27360 950.0 0.700 0.651 0.728 0.000 -0.158 0.000 3/27360 960.0 0.693 0.645 0.721 0.000 -0.156 0.000 3/27360 970.0 0.686 0.638 0.713 0.000 -0.155 0.000 3/27360 980.0 0.679 0.632 0.706 0.000 -0.153 0.000 3/27360 990.0 0.672 0.625 0.699 0.000 -0.152 0.000 3/27360 1000.0 0.665 0.619 0.692 0.000 -0.150 0.000 3/27360 Thermal conductivity related properties were written into "kappa-m856.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 18:02:59]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|