----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 11:38:48]------------------------- Compiled with OpenMP support (max 48 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.175106610141363 0.000000000000000 0.000000000000000 b 0.000000000000000 13.034742140000001 0.000000000000000 c -7.061432315217563 0.000000000000000 9.712029566628393 Atomic positions (fractional): *1 Na 0.06097575920098 0.77631037687308 0.06164609404299 22.990 2 Na 0.93902424079902 0.27631037687308 0.43835390595701 22.990 3 Na 0.06097575920098 0.72368962312692 0.56164609404299 22.990 4 Na 0.93902424079902 0.22368962312692 0.93835390595701 22.990 *5 Y 0.46456691200114 0.71987293616961 0.47724618135452 88.906 6 Y 0.53543308799886 0.21987293616961 0.02275381864548 88.906 7 Y 0.53543308799886 0.28012706383039 0.52275381864548 88.906 8 Y 0.46456691200114 0.78012706383039 0.97724618135452 88.906 *9 P 0.99363590739115 0.89623606497197 0.24383735895350 30.974 *10 P 0.43598005116446 0.90755493297032 0.70309033783898 30.974 11 P 0.56401994883554 0.09244506702968 0.29690966216102 30.974 12 P 0.56401994883554 0.40755493297032 0.79690966216102 30.974 *13 P 0.65366243344309 0.62863743719865 0.80244361362214 30.974 *14 P 0.10963120332482 0.38424669160436 0.73578541658952 30.974 15 P 0.00636409260885 0.39623606497197 0.25616264104650 30.974 16 P 0.43598005116446 0.59244506702968 0.20309033783898 30.974 17 P 0.89036879667518 0.61575330839564 0.26421458341048 30.974 18 P 0.99363590739115 0.60376393502803 0.74383735895350 30.974 19 P 0.34633756655691 0.37136256280135 0.19755638637786 30.974 20 P 0.34633756655691 0.12863743719865 0.69755638637786 30.974 21 P 0.89036879667518 0.88424669160436 0.76421458341048 30.974 22 P 0.00636409260885 0.10376393502803 0.75616264104650 30.974 23 P 0.65366243344309 0.87136256280135 0.30244361362214 30.974 24 P 0.10963120332482 0.11575330839564 0.23578541658952 30.974 *25 O 0.10393063722352 0.64990275441333 0.39841144551392 15.999 *26 O 0.77891658485936 0.68905414086472 0.14630223319948 15.999 *27 O 0.80493474567151 0.88817764971748 0.09243169442173 15.999 *28 O 0.36754475180638 0.88724239227420 0.79729019309092 15.999 29 O 0.22108341514064 0.31094585913528 0.85369776680052 15.999 *30 O 0.79394327705061 0.16737478234748 0.70226521384453 15.999 *31 O 0.64433116242392 0.97935269079345 0.36296055119453 15.999 *32 O 0.65065245255848 0.16396300338172 0.41557683067150 15.999 *33 O 0.33333880944077 0.21141343687077 0.60672873624606 15.999 *34 O 0.47564662027007 0.63309589426892 0.65014101998574 15.999 *35 O 0.28798289904308 0.41834004133218 0.70300093479192 15.999 *36 O 0.90687646053443 0.87261726435986 0.33715919835164 15.999 *37 O 0.07157524134826 0.01253212147440 0.29031860192894 15.999 38 O 0.52435337972993 0.36690410573108 0.34985898001426 15.999 39 O 0.89606936277648 0.35009724558667 0.60158855448608 15.999 40 O 0.89606936277648 0.14990275441333 0.10158855448608 15.999 41 O 0.64433116242392 0.52064730920655 0.86296055119452 15.999 42 O 0.77891658485936 0.81094585913528 0.64630223319948 15.999 43 O 0.80493474567151 0.61182235028252 0.59243169442173 15.999 44 O 0.47564662027007 0.86690410573108 0.15014101998574 15.999 45 O 0.71201710095692 0.58165995866782 0.29699906520808 15.999 46 O 0.35566883757608 0.47935269079345 0.13703944880548 15.999 47 O 0.34934754744152 0.66396300338172 0.08442316932850 15.999 48 O 0.65065245255848 0.33603699661828 0.91557683067150 15.999 49 O 0.34934754744152 0.83603699661828 0.58442316932850 15.999 50 O 0.36754475180638 0.61275760772580 0.29729019309093 15.999 51 O 0.10393063722352 0.85009724558667 0.89841144551392 15.999 52 O 0.22108341514064 0.18905414086472 0.35369776680052 15.999 53 O 0.63245524819362 0.11275760772580 0.20270980690908 15.999 54 O 0.66666119055923 0.71141343687077 0.89327126375394 15.999 55 O 0.19506525432849 0.38817764971748 0.40756830557827 15.999 56 O 0.19506525432849 0.11182235028252 0.90756830557827 15.999 57 O 0.09312353946557 0.37261726435986 0.16284080164836 15.999 58 O 0.92842475865174 0.98746787852560 0.70968139807106 15.999 59 O 0.52435337972993 0.13309589426892 0.84985898001426 15.999 60 O 0.63245524819362 0.38724239227420 0.70270980690908 15.999 61 O 0.20605672294939 0.66737478234748 0.79773478615547 15.999 62 O 0.90687646053443 0.62738273564014 0.83715919835164 15.999 63 O 0.66666119055923 0.78858656312923 0.39327126375394 15.999 64 O 0.09312353946557 0.12738273564014 0.66284080164836 15.999 65 O 0.71201710095692 0.91834004133218 0.79699906520808 15.999 66 O 0.33333880944077 0.28858656312923 0.10672873624606 15.999 67 O 0.07157524134826 0.48746787852560 0.79031860192894 15.999 68 O 0.79394327705061 0.33262521765252 0.20226521384453 15.999 69 O 0.92842475865174 0.51253212147440 0.20968139807106 15.999 70 O 0.35566883757608 0.02064730920654 0.63703944880548 15.999 71 O 0.28798289904308 0.08165995866782 0.20300093479192 15.999 72 O 0.20605672294939 0.83262521765252 0.29773478615547 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 7.175106610141363 0.000000000000000 0.000000000000000 b 0.000000000000000 13.034742140000001 0.000000000000000 c -7.061432315217563 0.000000000000000 9.712029566628393 Atomic positions (fractional): *1 Na 0.06097575920098 0.77631037687308 0.06164609404299 22.990 > 1 2 Na 0.93902424079902 0.27631037687308 0.43835390595701 22.990 > 2 3 Na 0.06097575920098 0.72368962312692 0.56164609404299 22.990 > 3 4 Na 0.93902424079902 0.22368962312692 0.93835390595701 22.990 > 4 *5 Y 0.46456691200114 0.71987293616961 0.47724618135452 88.906 > 5 6 Y 0.53543308799886 0.21987293616961 0.02275381864548 88.906 > 6 7 Y 0.53543308799886 0.28012706383039 0.52275381864548 88.906 > 7 8 Y 0.46456691200114 0.78012706383039 0.97724618135452 88.906 > 8 *9 P 0.99363590739115 0.89623606497197 0.24383735895350 30.974 > 9 *10 P 0.43598005116446 0.90755493297032 0.70309033783898 30.974 > 10 11 P 0.56401994883554 0.09244506702968 0.29690966216102 30.974 > 11 12 P 0.56401994883554 0.40755493297032 0.79690966216102 30.974 > 12 *13 P 0.65366243344309 0.62863743719865 0.80244361362214 30.974 > 13 *14 P 0.10963120332482 0.38424669160436 0.73578541658952 30.974 > 14 15 P 0.00636409260885 0.39623606497197 0.25616264104650 30.974 > 15 16 P 0.43598005116446 0.59244506702968 0.20309033783898 30.974 > 16 17 P 0.89036879667518 0.61575330839564 0.26421458341048 30.974 > 17 18 P 0.99363590739115 0.60376393502803 0.74383735895350 30.974 > 18 19 P 0.34633756655691 0.37136256280135 0.19755638637786 30.974 > 19 20 P 0.34633756655691 0.12863743719865 0.69755638637786 30.974 > 20 21 P 0.89036879667518 0.88424669160436 0.76421458341048 30.974 > 21 22 P 0.00636409260885 0.10376393502803 0.75616264104650 30.974 > 22 23 P 0.65366243344309 0.87136256280135 0.30244361362214 30.974 > 23 24 P 0.10963120332482 0.11575330839564 0.23578541658952 30.974 > 24 *25 O 0.10393063722352 0.64990275441333 0.39841144551392 15.999 > 25 *26 O 0.77891658485936 0.68905414086472 0.14630223319948 15.999 > 26 *27 O 0.80493474567151 0.88817764971748 0.09243169442173 15.999 > 27 *28 O 0.36754475180638 0.88724239227420 0.79729019309092 15.999 > 28 29 O 0.22108341514064 0.31094585913528 0.85369776680052 15.999 > 29 *30 O 0.79394327705061 0.16737478234748 0.70226521384453 15.999 > 30 *31 O 0.64433116242392 0.97935269079345 0.36296055119453 15.999 > 31 *32 O 0.65065245255848 0.16396300338172 0.41557683067150 15.999 > 32 *33 O 0.33333880944077 0.21141343687077 0.60672873624606 15.999 > 33 *34 O 0.47564662027007 0.63309589426892 0.65014101998574 15.999 > 34 *35 O 0.28798289904308 0.41834004133218 0.70300093479192 15.999 > 35 *36 O 0.90687646053443 0.87261726435986 0.33715919835164 15.999 > 36 *37 O 0.07157524134826 0.01253212147440 0.29031860192894 15.999 > 37 38 O 0.52435337972993 0.36690410573108 0.34985898001426 15.999 > 38 39 O 0.89606936277648 0.35009724558667 0.60158855448608 15.999 > 39 40 O 0.89606936277648 0.14990275441333 0.10158855448608 15.999 > 40 41 O 0.64433116242392 0.52064730920655 0.86296055119452 15.999 > 41 42 O 0.77891658485936 0.81094585913528 0.64630223319948 15.999 > 42 43 O 0.80493474567151 0.61182235028252 0.59243169442173 15.999 > 43 44 O 0.47564662027007 0.86690410573108 0.15014101998574 15.999 > 44 45 O 0.71201710095692 0.58165995866782 0.29699906520808 15.999 > 45 46 O 0.35566883757608 0.47935269079345 0.13703944880548 15.999 > 46 47 O 0.34934754744152 0.66396300338172 0.08442316932850 15.999 > 47 48 O 0.65065245255848 0.33603699661828 0.91557683067150 15.999 > 48 49 O 0.34934754744152 0.83603699661828 0.58442316932850 15.999 > 49 50 O 0.36754475180638 0.61275760772580 0.29729019309093 15.999 > 50 51 O 0.10393063722352 0.85009724558667 0.89841144551392 15.999 > 51 52 O 0.22108341514064 0.18905414086472 0.35369776680052 15.999 > 52 53 O 0.63245524819362 0.11275760772580 0.20270980690908 15.999 > 53 54 O 0.66666119055923 0.71141343687077 0.89327126375394 15.999 > 54 55 O 0.19506525432849 0.38817764971748 0.40756830557827 15.999 > 55 56 O 0.19506525432849 0.11182235028252 0.90756830557827 15.999 > 56 57 O 0.09312353946557 0.37261726435986 0.16284080164836 15.999 > 57 58 O 0.92842475865174 0.98746787852560 0.70968139807106 15.999 > 58 59 O 0.52435337972993 0.13309589426892 0.84985898001426 15.999 > 59 60 O 0.63245524819362 0.38724239227420 0.70270980690908 15.999 > 60 61 O 0.20605672294939 0.66737478234748 0.79773478615547 15.999 > 61 62 O 0.90687646053443 0.62738273564014 0.83715919835164 15.999 > 62 63 O 0.66666119055923 0.78858656312923 0.39327126375394 15.999 > 63 64 O 0.09312353946557 0.12738273564014 0.66284080164836 15.999 > 64 65 O 0.71201710095692 0.91834004133218 0.79699906520808 15.999 > 65 66 O 0.33333880944077 0.28858656312923 0.10672873624606 15.999 > 66 67 O 0.07157524134826 0.48746787852560 0.79031860192894 15.999 > 67 68 O 0.79394327705061 0.33262521765252 0.20226521384453 15.999 > 68 69 O 0.92842475865174 0.51253212147440 0.20968139807106 15.999 > 69 70 O 0.35566883757608 0.02064730920654 0.63703944880548 15.999 > 70 71 O 0.28798289904308 0.08165995866782 0.20300093479192 15.999 > 71 72 O 0.20605672294939 0.83262521765252 0.29773478615547 15.999 > 72 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.350213220282726 0.000000000000000 0.000000000000000 b 0.000000000000000 13.034742140000001 0.000000000000000 c -7.061432315217563 0.000000000000000 9.712029566628393 Atomic positions (fractional): *1 Na 0.03048787960049 0.77631037687308 0.06164609404299 22.990 > 1 2 Na 0.53048787960049 0.77631037687308 0.06164609404299 22.990 > 1 3 Na 0.46951212039951 0.27631037687308 0.43835390595701 22.990 > 2 4 Na 0.96951212039951 0.27631037687308 0.43835390595701 22.990 > 2 5 Na 0.03048787960049 0.72368962312692 0.56164609404299 22.990 > 3 6 Na 0.53048787960049 0.72368962312692 0.56164609404299 22.990 > 3 7 Na 0.46951212039951 0.22368962312692 0.93835390595701 22.990 > 4 8 Na 0.96951212039951 0.22368962312692 0.93835390595701 22.990 > 4 *9 Y 0.23228345600057 0.71987293616961 0.47724618135452 88.906 > 5 10 Y 0.73228345600057 0.71987293616961 0.47724618135452 88.906 > 5 11 Y 0.26771654399943 0.21987293616961 0.02275381864548 88.906 > 6 12 Y 0.76771654399943 0.21987293616961 0.02275381864548 88.906 > 6 13 Y 0.26771654399943 0.28012706383039 0.52275381864548 88.906 > 7 14 Y 0.76771654399943 0.28012706383039 0.52275381864548 88.906 > 7 15 Y 0.23228345600057 0.78012706383039 0.97724618135452 88.906 > 8 16 Y 0.73228345600057 0.78012706383039 0.97724618135452 88.906 > 8 *17 P 0.49681795369557 0.89623606497197 0.24383735895350 30.974 > 9 18 P 0.99681795369557 0.89623606497197 0.24383735895350 30.974 > 9 *19 P 0.21799002558223 0.90755493297032 0.70309033783898 30.974 > 10 20 P 0.71799002558223 0.90755493297032 0.70309033783898 30.974 > 10 21 P 0.28200997441777 0.09244506702968 0.29690966216102 30.974 > 11 22 P 0.78200997441777 0.09244506702968 0.29690966216102 30.974 > 11 23 P 0.28200997441777 0.40755493297032 0.79690966216102 30.974 > 12 24 P 0.78200997441777 0.40755493297032 0.79690966216102 30.974 > 12 *25 P 0.32683121672155 0.62863743719865 0.80244361362214 30.974 > 13 26 P 0.82683121672155 0.62863743719865 0.80244361362214 30.974 > 13 *27 P 0.05481560166241 0.38424669160436 0.73578541658952 30.974 > 14 28 P 0.55481560166241 0.38424669160436 0.73578541658952 30.974 > 14 29 P 0.00318204630443 0.39623606497197 0.25616264104650 30.974 > 15 30 P 0.50318204630443 0.39623606497197 0.25616264104650 30.974 > 15 31 P 0.21799002558223 0.59244506702968 0.20309033783898 30.974 > 16 32 P 0.71799002558223 0.59244506702968 0.20309033783898 30.974 > 16 33 P 0.44518439833759 0.61575330839564 0.26421458341048 30.974 > 17 34 P 0.94518439833759 0.61575330839564 0.26421458341048 30.974 > 17 35 P 0.49681795369557 0.60376393502803 0.74383735895350 30.974 > 18 36 P 0.99681795369557 0.60376393502803 0.74383735895350 30.974 > 18 37 P 0.17316878327845 0.37136256280135 0.19755638637786 30.974 > 19 38 P 0.67316878327845 0.37136256280135 0.19755638637786 30.974 > 19 39 P 0.17316878327845 0.12863743719865 0.69755638637786 30.974 > 20 40 P 0.67316878327845 0.12863743719865 0.69755638637786 30.974 > 20 41 P 0.44518439833759 0.88424669160436 0.76421458341048 30.974 > 21 42 P 0.94518439833759 0.88424669160436 0.76421458341048 30.974 > 21 43 P 0.00318204630443 0.10376393502803 0.75616264104650 30.974 > 22 44 P 0.50318204630443 0.10376393502803 0.75616264104650 30.974 > 22 45 P 0.32683121672155 0.87136256280135 0.30244361362214 30.974 > 23 46 P 0.82683121672155 0.87136256280135 0.30244361362214 30.974 > 23 47 P 0.05481560166241 0.11575330839564 0.23578541658952 30.974 > 24 48 P 0.55481560166241 0.11575330839564 0.23578541658952 30.974 > 24 *49 O 0.05196531861176 0.64990275441333 0.39841144551392 15.999 > 25 50 O 0.55196531861176 0.64990275441333 0.39841144551392 15.999 > 25 *51 O 0.38945829242968 0.68905414086472 0.14630223319948 15.999 > 26 52 O 0.88945829242968 0.68905414086472 0.14630223319948 15.999 > 26 *53 O 0.40246737283575 0.88817764971748 0.09243169442173 15.999 > 27 54 O 0.90246737283575 0.88817764971748 0.09243169442173 15.999 > 27 *55 O 0.18377237590319 0.88724239227420 0.79729019309092 15.999 > 28 56 O 0.68377237590319 0.88724239227420 0.79729019309092 15.999 > 28 57 O 0.11054170757032 0.31094585913528 0.85369776680052 15.999 > 29 58 O 0.61054170757032 0.31094585913528 0.85369776680052 15.999 > 29 *59 O 0.39697163852530 0.16737478234748 0.70226521384453 15.999 > 30 60 O 0.89697163852530 0.16737478234748 0.70226521384453 15.999 > 30 *61 O 0.32216558121196 0.97935269079345 0.36296055119453 15.999 > 31 62 O 0.82216558121196 0.97935269079345 0.36296055119453 15.999 > 31 *63 O 0.32532622627924 0.16396300338172 0.41557683067150 15.999 > 32 64 O 0.82532622627924 0.16396300338172 0.41557683067150 15.999 > 32 *65 O 0.16666940472038 0.21141343687077 0.60672873624606 15.999 > 33 66 O 0.66666940472038 0.21141343687077 0.60672873624606 15.999 > 33 *67 O 0.23782331013504 0.63309589426892 0.65014101998574 15.999 > 34 68 O 0.73782331013504 0.63309589426892 0.65014101998574 15.999 > 34 *69 O 0.14399144952154 0.41834004133218 0.70300093479192 15.999 > 35 70 O 0.64399144952154 0.41834004133218 0.70300093479192 15.999 > 35 *71 O 0.45343823026722 0.87261726435986 0.33715919835164 15.999 > 36 72 O 0.95343823026722 0.87261726435986 0.33715919835164 15.999 > 36 *73 O 0.03578762067413 0.01253212147440 0.29031860192894 15.999 > 37 74 O 0.53578762067413 0.01253212147440 0.29031860192894 15.999 > 37 75 O 0.26217668986496 0.36690410573108 0.34985898001426 15.999 > 38 76 O 0.76217668986496 0.36690410573108 0.34985898001426 15.999 > 38 77 O 0.44803468138824 0.35009724558667 0.60158855448608 15.999 > 39 78 O 0.94803468138824 0.35009724558667 0.60158855448608 15.999 > 39 79 O 0.44803468138824 0.14990275441333 0.10158855448608 15.999 > 40 80 O 0.94803468138824 0.14990275441333 0.10158855448608 15.999 > 40 81 O 0.32216558121196 0.52064730920655 0.86296055119452 15.999 > 41 82 O 0.82216558121196 0.52064730920655 0.86296055119452 15.999 > 41 83 O 0.38945829242968 0.81094585913528 0.64630223319948 15.999 > 42 84 O 0.88945829242968 0.81094585913528 0.64630223319948 15.999 > 42 85 O 0.40246737283575 0.61182235028252 0.59243169442173 15.999 > 43 86 O 0.90246737283575 0.61182235028252 0.59243169442173 15.999 > 43 87 O 0.23782331013504 0.86690410573108 0.15014101998574 15.999 > 44 88 O 0.73782331013504 0.86690410573108 0.15014101998574 15.999 > 44 89 O 0.35600855047846 0.58165995866782 0.29699906520808 15.999 > 45 90 O 0.85600855047846 0.58165995866782 0.29699906520808 15.999 > 45 91 O 0.17783441878804 0.47935269079345 0.13703944880548 15.999 > 46 92 O 0.67783441878804 0.47935269079345 0.13703944880548 15.999 > 46 93 O 0.17467377372076 0.66396300338172 0.08442316932850 15.999 > 47 94 O 0.67467377372076 0.66396300338172 0.08442316932850 15.999 > 47 95 O 0.32532622627924 0.33603699661828 0.91557683067150 15.999 > 48 96 O 0.82532622627924 0.33603699661828 0.91557683067150 15.999 > 48 97 O 0.17467377372076 0.83603699661828 0.58442316932850 15.999 > 49 98 O 0.67467377372076 0.83603699661828 0.58442316932850 15.999 > 49 99 O 0.18377237590319 0.61275760772580 0.29729019309093 15.999 > 50 100 O 0.68377237590319 0.61275760772580 0.29729019309093 15.999 > 50 101 O 0.05196531861176 0.85009724558667 0.89841144551392 15.999 > 51 102 O 0.55196531861176 0.85009724558667 0.89841144551392 15.999 > 51 103 O 0.11054170757032 0.18905414086472 0.35369776680052 15.999 > 52 104 O 0.61054170757032 0.18905414086472 0.35369776680052 15.999 > 52 105 O 0.31622762409681 0.11275760772580 0.20270980690908 15.999 > 53 106 O 0.81622762409681 0.11275760772580 0.20270980690908 15.999 > 53 107 O 0.33333059527962 0.71141343687077 0.89327126375394 15.999 > 54 108 O 0.83333059527962 0.71141343687077 0.89327126375394 15.999 > 54 109 O 0.09753262716425 0.38817764971748 0.40756830557827 15.999 > 55 110 O 0.59753262716425 0.38817764971748 0.40756830557827 15.999 > 55 111 O 0.09753262716425 0.11182235028252 0.90756830557827 15.999 > 56 112 O 0.59753262716425 0.11182235028252 0.90756830557827 15.999 > 56 113 O 0.04656176973278 0.37261726435986 0.16284080164836 15.999 > 57 114 O 0.54656176973278 0.37261726435986 0.16284080164836 15.999 > 57 115 O 0.46421237932587 0.98746787852560 0.70968139807106 15.999 > 58 116 O 0.96421237932587 0.98746787852560 0.70968139807106 15.999 > 58 117 O 0.26217668986496 0.13309589426892 0.84985898001426 15.999 > 59 118 O 0.76217668986496 0.13309589426892 0.84985898001426 15.999 > 59 119 O 0.31622762409681 0.38724239227420 0.70270980690908 15.999 > 60 120 O 0.81622762409681 0.38724239227420 0.70270980690908 15.999 > 60 121 O 0.10302836147470 0.66737478234748 0.79773478615547 15.999 > 61 122 O 0.60302836147470 0.66737478234748 0.79773478615547 15.999 > 61 123 O 0.45343823026722 0.62738273564014 0.83715919835164 15.999 > 62 124 O 0.95343823026722 0.62738273564014 0.83715919835164 15.999 > 62 125 O 0.33333059527962 0.78858656312923 0.39327126375394 15.999 > 63 126 O 0.83333059527962 0.78858656312923 0.39327126375394 15.999 > 63 127 O 0.04656176973278 0.12738273564014 0.66284080164836 15.999 > 64 128 O 0.54656176973278 0.12738273564014 0.66284080164836 15.999 > 64 129 O 0.35600855047846 0.91834004133218 0.79699906520808 15.999 > 65 130 O 0.85600855047846 0.91834004133218 0.79699906520808 15.999 > 65 131 O 0.16666940472038 0.28858656312923 0.10672873624606 15.999 > 66 132 O 0.66666940472038 0.28858656312923 0.10672873624606 15.999 > 66 133 O 0.03578762067413 0.48746787852560 0.79031860192894 15.999 > 67 134 O 0.53578762067413 0.48746787852560 0.79031860192894 15.999 > 67 135 O 0.39697163852530 0.33262521765252 0.20226521384453 15.999 > 68 136 O 0.89697163852530 0.33262521765252 0.20226521384453 15.999 > 68 137 O 0.46421237932587 0.51253212147440 0.20968139807106 15.999 > 69 138 O 0.96421237932587 0.51253212147440 0.20968139807106 15.999 > 69 139 O 0.17783441878804 0.02064730920654 0.63703944880548 15.999 > 70 140 O 0.67783441878804 0.02064730920654 0.63703944880548 15.999 > 70 141 O 0.14399144952154 0.08165995866782 0.20300093479192 15.999 > 71 142 O 0.64399144952154 0.08165995866782 0.20300093479192 15.999 > 71 143 O 0.10302836147470 0.83262521765252 0.29773478615547 15.999 > 72 144 O 0.60302836147470 0.83262521765252 0.29773478615547 15.999 > 72 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7407708 0.0000000 0.0114165 0.0000000 2.7444004 0.0000000 0.0114175 0.0000000 2.6921206 -------------------------- Born effective charges -------------------------- 1 Na 1.1980226 -0.0517001 -0.0290967 0.0179065 1.0194946 0.0655150 -0.0083052 0.0274498 1.2236667 2 Na 1.1980226 0.0517001 -0.0290967 -0.0179065 1.0194946 -0.0655150 -0.0083052 -0.0274498 1.2236667 3 Na 1.1980226 0.0517001 -0.0290967 -0.0179065 1.0194946 -0.0655150 -0.0083052 -0.0274498 1.2236667 4 Na 1.1980226 -0.0517001 -0.0290967 0.0179065 1.0194946 0.0655150 -0.0083052 0.0274498 1.2236667 5 Y 3.9092657 -0.2148349 0.0194867 0.2218765 3.6984066 0.0796125 0.0544460 0.0927042 4.7462491 6 Y 3.9092657 0.2148349 0.0194867 -0.2218765 3.6984066 -0.0796125 0.0544460 -0.0927042 4.7462491 7 Y 3.9092657 -0.2148349 0.0194867 0.2218765 3.6984066 0.0796125 0.0544460 0.0927042 4.7462491 8 Y 3.9092657 0.2148349 0.0194867 -0.2218765 3.6984066 -0.0796125 0.0544460 -0.0927042 4.7462491 9 P 3.7031452 0.3464846 0.0405979 -0.0339050 3.9979269 0.6078197 0.3957568 -0.1944448 2.9573120 10 P 3.6828687 -0.3671741 0.2364629 0.0025571 3.8830188 -0.4461662 -0.4393325 0.3270876 2.9638254 11 P 3.6828687 -0.3671741 0.2364629 0.0025571 3.8830188 -0.4461662 -0.4393325 0.3270876 2.9638254 12 P 3.6828687 0.3671741 0.2364629 -0.0025571 3.8830188 0.4461662 -0.4393325 -0.3270876 2.9638254 13 P 3.7602564 0.0015373 -0.3222691 0.1147986 3.7988894 -0.5181850 -0.2408474 0.3609535 2.9935050 14 P 3.8412475 -0.1636580 0.2468039 -0.3417948 4.0214817 0.3670341 0.3964731 -0.1804152 3.0555992 15 P 3.7031452 -0.3464846 0.0405979 0.0339050 3.9979269 -0.6078197 0.3957568 0.1944448 2.9573120 16 P 3.6828687 0.3671741 0.2364629 -0.0025571 3.8830188 0.4461662 -0.4393325 -0.3270876 2.9638254 17 P 3.8412475 -0.1636580 0.2468039 -0.3417948 4.0214817 0.3670341 0.3964731 -0.1804152 3.0555992 18 P 3.7031452 -0.3464846 0.0405979 0.0339050 3.9979269 -0.6078197 0.3957568 0.1944448 2.9573120 19 P 3.7602564 0.0015373 -0.3222691 0.1147986 3.7988894 -0.5181850 -0.2408474 0.3609535 2.9935050 20 P 3.7602564 -0.0015373 -0.3222691 -0.1147986 3.7988894 0.5181850 -0.2408474 -0.3609535 2.9935050 21 P 3.8412475 0.1636580 0.2468039 0.3417948 4.0214817 -0.3670341 0.3964731 0.1804152 3.0555992 22 P 3.7031452 0.3464846 0.0405979 -0.0339050 3.9979269 0.6078197 0.3957568 -0.1944448 2.9573120 23 P 3.7602564 -0.0015373 -0.3222691 -0.1147986 3.7988894 0.5181850 -0.2408474 -0.3609535 2.9935050 24 P 3.8412475 0.1636580 0.2468039 0.3417948 4.0214817 -0.3670341 0.3964731 0.1804152 3.0555992 25 O -1.6855459 -0.2738854 -0.6292896 -0.3405323 -1.3085698 -0.5075259 -0.6080564 -0.3459950 -1.7725031 26 O -1.2009419 0.1246993 -0.2585799 0.1511788 -1.7235031 0.6596933 -0.2647088 0.6729147 -1.8751973 27 O -1.3073226 -0.2138629 -0.3340064 -0.2429852 -1.3088159 -0.4955837 -0.4126338 -0.2674573 -1.8515589 28 O -1.6761063 -0.2655418 0.6757273 -0.3382559 -1.4408549 0.6126228 0.6418882 0.3864461 -1.6940446 29 O -1.2009419 0.1246993 -0.2585799 0.1511788 -1.7235031 0.6596933 -0.2647088 0.6729147 -1.8751973 30 O -1.7209929 0.5186253 -0.4921414 0.5167646 -1.6167540 0.3947437 -0.4741230 0.5117397 -1.4997021 31 O -1.0706310 0.7428824 0.0803957 0.4137353 -3.1836301 0.0226762 0.1302003 0.0283893 -0.9742261 32 O -1.2692895 0.2855407 0.1868072 0.2701661 -1.5919743 -0.5491627 0.2965601 -0.6327269 -1.6626963 33 O -1.6433932 -0.4737174 0.4810128 -0.4243851 -1.6303306 0.4154600 0.4742478 0.5489031 -1.5020186 34 O -1.2127477 -0.0837492 0.1785907 -0.1365728 -1.2577330 0.6174867 0.1844569 0.2535942 -2.0639803 35 O -3.0298860 -0.2449143 -0.4604345 -0.1916257 -1.0470854 -0.0361249 -0.3079695 0.1331761 -1.0260832 36 O -3.0269608 -0.2432849 0.3880775 -0.1557168 -0.9767839 -0.0104092 0.2340391 0.1270652 -1.1336512 37 O -1.2509883 -0.9259534 -0.0081450 -0.7274773 -3.3331832 0.0054088 -0.0520917 0.0480236 -0.8844958 38 O -1.2127477 -0.0837492 0.1785907 -0.1365728 -1.2577330 0.6174867 0.1844569 0.2535942 -2.0639803 39 O -1.6855459 -0.2738854 -0.6292896 -0.3405323 -1.3085698 -0.5075259 -0.6080564 -0.3459950 -1.7725031 40 O -1.6855459 0.2738854 -0.6292896 0.3405323 -1.3085698 0.5075259 -0.6080564 0.3459950 -1.7725031 41 O -1.0706310 -0.7428824 0.0803957 -0.4137353 -3.1836301 -0.0226762 0.1302003 -0.0283893 -0.9742261 42 O -1.2009419 -0.1246993 -0.2585799 -0.1511788 -1.7235031 -0.6596933 -0.2647088 -0.6729147 -1.8751973 43 O -1.3073226 0.2138629 -0.3340064 0.2429852 -1.3088159 0.4955837 -0.4126338 0.2674573 -1.8515589 44 O -1.2127477 0.0837492 0.1785907 0.1365728 -1.2577330 -0.6174867 0.1844569 -0.2535942 -2.0639803 45 O -3.0298860 -0.2449143 -0.4604345 -0.1916257 -1.0470854 -0.0361249 -0.3079695 0.1331761 -1.0260832 46 O -1.0706310 -0.7428824 0.0803957 -0.4137353 -3.1836301 -0.0226762 0.1302003 -0.0283893 -0.9742261 47 O -1.2692895 -0.2855407 0.1868072 -0.2701661 -1.5919743 0.5491627 0.2965601 0.6327269 -1.6626963 48 O -1.2692895 -0.2855407 0.1868072 -0.2701661 -1.5919743 0.5491627 0.2965601 0.6327269 -1.6626963 49 O -1.2692895 0.2855407 0.1868072 0.2701661 -1.5919743 -0.5491627 0.2965601 -0.6327269 -1.6626963 50 O -1.6761063 0.2655418 0.6757273 0.3382559 -1.4408549 -0.6126228 0.6418882 -0.3864461 -1.6940446 51 O -1.6855459 0.2738854 -0.6292896 0.3405323 -1.3085698 0.5075259 -0.6080564 0.3459950 -1.7725031 52 O -1.2009419 -0.1246993 -0.2585799 -0.1511788 -1.7235031 -0.6596933 -0.2647088 -0.6729147 -1.8751973 53 O -1.6761063 -0.2655418 0.6757273 -0.3382559 -1.4408549 0.6126228 0.6418882 0.3864461 -1.6940446 54 O -1.6433932 0.4737174 0.4810128 0.4243851 -1.6303306 -0.4154600 0.4742478 -0.5489031 -1.5020186 55 O -1.3073226 0.2138629 -0.3340064 0.2429852 -1.3088159 0.4955837 -0.4126338 0.2674573 -1.8515589 56 O -1.3073226 -0.2138629 -0.3340064 -0.2429852 -1.3088159 -0.4955837 -0.4126338 -0.2674573 -1.8515589 57 O -3.0269608 0.2432849 0.3880775 0.1557168 -0.9767839 0.0104092 0.2340391 -0.1270652 -1.1336512 58 O -1.2509883 -0.9259534 -0.0081450 -0.7274773 -3.3331832 0.0054088 -0.0520917 0.0480236 -0.8844958 59 O -1.2127477 0.0837492 0.1785907 0.1365728 -1.2577330 -0.6174867 0.1844569 -0.2535942 -2.0639803 60 O -1.6761063 0.2655418 0.6757273 0.3382559 -1.4408549 -0.6126228 0.6418882 -0.3864461 -1.6940446 61 O -1.7209929 -0.5186253 -0.4921414 -0.5167646 -1.6167540 -0.3947437 -0.4741230 -0.5117397 -1.4997021 62 O -3.0269608 0.2432849 0.3880775 0.1557168 -0.9767839 0.0104092 0.2340391 -0.1270652 -1.1336512 63 O -1.6433932 -0.4737174 0.4810128 -0.4243851 -1.6303306 0.4154600 0.4742478 0.5489031 -1.5020186 64 O -3.0269608 -0.2432849 0.3880775 -0.1557168 -0.9767839 -0.0104092 0.2340391 0.1270652 -1.1336512 65 O -3.0298860 0.2449143 -0.4604345 0.1916257 -1.0470854 0.0361249 -0.3079695 -0.1331761 -1.0260832 66 O -1.6433932 0.4737174 0.4810128 0.4243851 -1.6303306 -0.4154600 0.4742478 -0.5489031 -1.5020186 67 O -1.2509883 0.9259534 -0.0081450 0.7274773 -3.3331832 -0.0054088 -0.0520917 -0.0480236 -0.8844958 68 O -1.7209929 -0.5186253 -0.4921414 -0.5167646 -1.6167540 -0.3947437 -0.4741230 -0.5117397 -1.4997021 69 O -1.2509883 0.9259534 -0.0081450 0.7274773 -3.3331832 -0.0054088 -0.0520917 -0.0480236 -0.8844958 70 O -1.0706310 0.7428824 0.0803957 0.4137353 -3.1836301 0.0226762 0.1302003 0.0283893 -0.9742261 71 O -3.0298860 0.2449143 -0.4604345 0.1916257 -1.0470854 0.0361249 -0.3079695 -0.1331761 -1.0260832 72 O -1.7209929 0.5186253 -0.4921414 0.5167646 -1.6167540 0.3947437 -0.4741230 0.5117397 -1.4997021 ---------------------------------------------------------------------------- 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: 432/432 Permutation basis: 46872/46872 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 11880 Number of blocks in projector: 11880 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: 2592 Use submatrix version of eigh solver. (1) Block: 500 / 2592 (2) Block: 250 / 500 (2) 214 eigenvectors found. (2) Block: 500 / 500 (2) 215 eigenvectors found. (2) Complementary block size: 71 (2) Compute compressed projector. (2) Use standard solver. (2) 35 eigenvectors found. (1) 464 eigenvectors found. (1) Block: 1000 / 2592 (2) Block: 250 / 500 (2) 222 eigenvectors found. (2) Block: 500 / 500 (2) 216 eigenvectors found. (2) Complementary block size: 62 (2) Compute compressed projector. (2) Use standard solver. (2) 28 eigenvectors found. (1) 466 eigenvectors found. (1) Block: 1500 / 2592 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 222 eigenvectors found. (2) Complementary block size: 58 (2) Compute compressed projector. (2) Use standard solver. (2) 28 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 2000 / 2592 (2) Block: 250 / 500 (2) 224 eigenvectors found. (2) Block: 500 / 500 (2) 228 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 2592 / 2592 (2) Block: 250 / 592 (2) 216 eigenvectors found. (2) Block: 500 / 592 (2) 221 eigenvectors found. (2) Block: 592 / 592 (2) 76 eigenvectors found. (2) Complementary block size: 79 (2) Compute compressed projector. (2) Use standard solver. (2) 45 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 160 (1) Compute compressed projector. (1) Use standard solver. (1) 124 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 2592 Use submatrix version of eigh solver. (1) Block: 500 / 2592 (2) Block: 250 / 500 (2) 214 eigenvectors found. (2) Block: 500 / 500 (2) 215 eigenvectors found. (2) Complementary block size: 71 (2) Compute compressed projector. (2) Use standard solver. (2) 35 eigenvectors found. (1) 464 eigenvectors found. (1) Block: 1000 / 2592 (2) Block: 250 / 500 (2) 222 eigenvectors found. (2) Block: 500 / 500 (2) 216 eigenvectors found. (2) Complementary block size: 62 (2) Compute compressed projector. (2) Use standard solver. (2) 28 eigenvectors found. (1) 466 eigenvectors found. (1) Block: 1500 / 2592 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 222 eigenvectors found. (2) Complementary block size: 58 (2) Compute compressed projector. (2) Use standard solver. (2) 28 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 2000 / 2592 (2) Block: 250 / 500 (2) 224 eigenvectors found. (2) Block: 500 / 500 (2) 228 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 2592 / 2592 (2) Block: 250 / 592 (2) 216 eigenvectors found. (2) Block: 500 / 592 (2) 221 eigenvectors found. (2) Block: 592 / 592 (2) 76 eigenvectors found. (2) Complementary block size: 79 (2) Compute compressed projector. (2) Use standard solver. (2) 45 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 160 (1) Compute compressed projector. (1) Use standard solver. (1) 124 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 2592 Use submatrix version of eigh solver. (1) Block: 500 / 2592 (2) Block: 250 / 500 (2) 215 eigenvectors found. (2) Block: 500 / 500 (2) 215 eigenvectors found. (2) Complementary block size: 70 (2) Compute compressed projector. (2) Use standard solver. (2) 35 eigenvectors found. (1) 465 eigenvectors found. (1) Block: 1000 / 2592 (2) Block: 250 / 500 (2) 217 eigenvectors found. (2) Block: 500 / 500 (2) 219 eigenvectors found. (2) Complementary block size: 64 (2) Compute compressed projector. (2) Use standard solver. (2) 31 eigenvectors found. (1) 467 eigenvectors found. (1) Block: 1500 / 2592 (2) Block: 250 / 500 (2) 221 eigenvectors found. (2) Block: 500 / 500 (2) 225 eigenvectors found. (2) Complementary block size: 54 (2) Compute compressed projector. (2) Use standard solver. (2) 25 eigenvectors found. (1) 471 eigenvectors found. (1) Block: 2000 / 2592 (2) Block: 250 / 500 (2) 227 eigenvectors found. (2) Block: 500 / 500 (2) 229 eigenvectors found. (2) Complementary block size: 44 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found. (1) 477 eigenvectors found. (1) Block: 2592 / 2592 (2) Block: 250 / 592 (2) 233 eigenvectors found. (2) Block: 500 / 592 (2) 237 eigenvectors found. (2) Block: 592 / 592 (2) 85 eigenvectors found. (2) Complementary block size: 37 (2) Compute compressed projector. (2) Use standard solver. (2) 20 eigenvectors found. (1) 575 eigenvectors found. (1) Complementary block size: 137 (1) Compute compressed projector. (1) Use standard solver. (1) 102 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 1368 Use submatrix version of eigh solver. (1) Block: 500 / 1368 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1368 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1368 / 1368 (1) 350 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 1368 Use submatrix version of eigh solver. (1) Block: 500 / 1368 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1368 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1368 / 1368 (1) 350 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 1368 Use submatrix version of eigh solver. (1) Block: 500 / 1368 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1368 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1368 / 1368 (1) 350 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. Tree of FC basis block matrices: - (11880, 11719), data: False |-- (1368, 1350), data: False |-- (1368, 33), data: (1368, 51) @ (51, 33) |-- (368, 350), data: True |-- (500, 485), data: False |-- (500, 12), data: (500, 27) @ (27, 12) |-- (250, 238), data: True |-- (250, 235), data: True |-- (500, 482), data: False |-- (500, 17), data: (500, 35) @ (35, 17) |-- (250, 233), data: True |-- (250, 232), data: True |-- (1368, 1350), data: False |-- (1368, 33), data: (1368, 51) @ (51, 33) |-- (368, 350), data: True |-- (500, 485), data: False |-- (500, 12), data: (500, 27) @ (27, 12) |-- (250, 238), data: True |-- (250, 235), data: True |-- (500, 482), data: False |-- (500, 17), data: (500, 35) @ (35, 17) |-- (250, 233), data: True |-- (250, 232), data: True |-- (1368, 1350), data: False |-- (1368, 33), data: (1368, 51) @ (51, 33) |-- (368, 350), data: True |-- (500, 485), data: False |-- (500, 12), data: (500, 27) @ (27, 12) |-- (250, 238), data: True |-- (250, 235), data: True |-- (500, 482), data: False |-- (500, 17), data: (500, 35) @ (35, 17) |-- (250, 233), data: True |-- (250, 232), data: True |-- (2592, 2557), data: False |-- (2592, 102), data: (2592, 137) @ (137, 102) |-- (592, 575), data: False |-- (592, 20), data: (592, 37) @ (37, 20) |-- (92, 85), data: True |-- (250, 237), data: True |-- (250, 233), data: True |-- (500, 477), data: False |-- (500, 21), data: (500, 44) @ (44, 21) |-- (250, 229), data: True |-- (250, 227), data: True |-- (500, 471), data: False |-- (500, 25), data: (500, 54) @ (54, 25) |-- (250, 225), data: True |-- (250, 221), data: True |-- (500, 467), data: False |-- (500, 31), data: (500, 64) @ (64, 31) |-- (250, 219), data: True |-- (250, 217), data: True |-- (500, 465), data: False |-- (500, 35), data: (500, 70) @ (70, 35) |-- (250, 215), data: True |-- (250, 215), data: True |-- (2592, 2556), data: False |-- (2592, 124), data: (2592, 160) @ (160, 124) |-- (592, 558), data: False |-- (592, 45), data: (592, 79) @ (79, 45) |-- (92, 76), data: True |-- (250, 221), data: True |-- (250, 216), data: True |-- (500, 474), data: False |-- (500, 22), data: (500, 48) @ (48, 22) |-- (250, 228), data: True |-- (250, 224), data: True |-- (500, 470), data: False |-- (500, 28), data: (500, 58) @ (58, 28) |-- (250, 222), data: True |-- (250, 220), data: True |-- (500, 466), data: False |-- (500, 28), data: (500, 62) @ (62, 28) |-- (250, 216), data: True |-- (250, 222), data: True |-- (500, 464), data: False |-- (500, 35), data: (500, 71) @ (71, 35) |-- (250, 215), data: True |-- (250, 214), data: True |-- (2592, 2556), data: False |-- (2592, 124), data: (2592, 160) @ (160, 124) |-- (592, 558), data: False |-- (592, 45), data: (592, 79) @ (79, 45) |-- (92, 76), data: True |-- (250, 221), data: True |-- (250, 216), data: True |-- (500, 474), data: False |-- (500, 22), data: (500, 48) @ (48, 22) |-- (250, 228), data: True |-- (250, 224), data: True |-- (500, 470), data: False |-- (500, 28), data: (500, 58) @ (58, 28) |-- (250, 222), data: True |-- (250, 220), data: True |-- (500, 466), data: False |-- (500, 28), data: (500, 62) @ (62, 28) |-- (250, 216), data: True |-- (250, 222), data: True |-- (500, 464), data: False |-- (500, 35), data: (500, 71) @ (71, 35) |-- (250, 215), data: True |-- (250, 214), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 2160 - Time: 5.228 Solver_block: 200 / 2160 - Time: 4.764 Solver_block: 300 / 2160 - Time: 4.773 Solver_block: 400 / 2160 - Time: 4.781 Solver_block: 500 / 2160 - Time: 4.785 Solver_block: 600 / 2160 - Time: 4.785 Solver_block: 700 / 2160 - Time: 4.778 Solver_block: 800 / 2160 - Time: 4.778 Solver_block: 900 / 2160 - Time: 4.774 Solver_block: 1000 / 2160 - Time: 4.777 Solver_block: 1100 / 2160 - Time: 4.776 Solver_block: 1200 / 2160 - Time: 4.777 Solver_block: 1300 / 2160 - Time: 4.778 Solver_block: 1400 / 2160 - Time: 4.783 Solver_block: 1500 / 2160 - Time: 4.784 Solver_block: 1600 / 2160 - Time: 4.786 Solver_block: 1700 / 2160 - Time: 4.788 Solver_block: 1800 / 2160 - Time: 4.780 Solver_block: 1900 / 2160 - Time: 4.778 Solver_block: 2000 / 2160 - Time: 4.777 Solver_block: 2100 / 2160 - Time: 4.776 Solver_block: 2160 / 2160 - Time: 2.986 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 107.162 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (zz) 0.00000000 (zz) Permutation basis: 432/432 Permutation basis: 46872/46872 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 11880 Number of blocks in projector: 11880 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: 2592 Use submatrix version of eigh solver. (1) Block: 500 / 2592 (2) Block: 250 / 500 (2) 214 eigenvectors found. (2) Block: 500 / 500 (2) 215 eigenvectors found. (2) Complementary block size: 71 (2) Compute compressed projector. (2) Use standard solver. (2) 35 eigenvectors found. (1) 464 eigenvectors found. (1) Block: 1000 / 2592 (2) Block: 250 / 500 (2) 222 eigenvectors found. (2) Block: 500 / 500 (2) 216 eigenvectors found. (2) Complementary block size: 62 (2) Compute compressed projector. (2) Use standard solver. (2) 28 eigenvectors found. (1) 466 eigenvectors found. (1) Block: 1500 / 2592 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 222 eigenvectors found. (2) Complementary block size: 58 (2) Compute compressed projector. (2) Use standard solver. (2) 28 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 2000 / 2592 (2) Block: 250 / 500 (2) 224 eigenvectors found. (2) Block: 500 / 500 (2) 228 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 2592 / 2592 (2) Block: 250 / 592 (2) 216 eigenvectors found. (2) Block: 500 / 592 (2) 221 eigenvectors found. (2) Block: 592 / 592 (2) 76 eigenvectors found. (2) Complementary block size: 79 (2) Compute compressed projector. (2) Use standard solver. (2) 45 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 160 (1) Compute compressed projector. (1) Use standard solver. (1) 124 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 2592 Use submatrix version of eigh solver. (1) Block: 500 / 2592 (2) Block: 250 / 500 (2) 214 eigenvectors found. (2) Block: 500 / 500 (2) 215 eigenvectors found. (2) Complementary block size: 71 (2) Compute compressed projector. (2) Use standard solver. (2) 35 eigenvectors found. (1) 464 eigenvectors found. (1) Block: 1000 / 2592 (2) Block: 250 / 500 (2) 222 eigenvectors found. (2) Block: 500 / 500 (2) 216 eigenvectors found. (2) Complementary block size: 62 (2) Compute compressed projector. (2) Use standard solver. (2) 28 eigenvectors found. (1) 466 eigenvectors found. (1) Block: 1500 / 2592 (2) Block: 250 / 500 (2) 220 eigenvectors found. (2) Block: 500 / 500 (2) 222 eigenvectors found. (2) Complementary block size: 58 (2) Compute compressed projector. (2) Use standard solver. (2) 28 eigenvectors found. (1) 470 eigenvectors found. (1) Block: 2000 / 2592 (2) Block: 250 / 500 (2) 224 eigenvectors found. (2) Block: 500 / 500 (2) 228 eigenvectors found. (2) Complementary block size: 48 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 474 eigenvectors found. (1) Block: 2592 / 2592 (2) Block: 250 / 592 (2) 216 eigenvectors found. (2) Block: 500 / 592 (2) 221 eigenvectors found. (2) Block: 592 / 592 (2) 76 eigenvectors found. (2) Complementary block size: 79 (2) Compute compressed projector. (2) Use standard solver. (2) 45 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 160 (1) Compute compressed projector. (1) Use standard solver. (1) 124 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 2592 Use submatrix version of eigh solver. (1) Block: 500 / 2592 (2) Block: 250 / 500 (2) 215 eigenvectors found. (2) Block: 500 / 500 (2) 215 eigenvectors found. (2) Complementary block size: 70 (2) Compute compressed projector. (2) Use standard solver. (2) 35 eigenvectors found. (1) 465 eigenvectors found. (1) Block: 1000 / 2592 (2) Block: 250 / 500 (2) 217 eigenvectors found. (2) Block: 500 / 500 (2) 219 eigenvectors found. (2) Complementary block size: 64 (2) Compute compressed projector. (2) Use standard solver. (2) 31 eigenvectors found. (1) 467 eigenvectors found. (1) Block: 1500 / 2592 (2) Block: 250 / 500 (2) 221 eigenvectors found. (2) Block: 500 / 500 (2) 225 eigenvectors found. (2) Complementary block size: 54 (2) Compute compressed projector. (2) Use standard solver. (2) 25 eigenvectors found. (1) 471 eigenvectors found. (1) Block: 2000 / 2592 (2) Block: 250 / 500 (2) 227 eigenvectors found. (2) Block: 500 / 500 (2) 229 eigenvectors found. (2) Complementary block size: 44 (2) Compute compressed projector. (2) Use standard solver. (2) 21 eigenvectors found. (1) 477 eigenvectors found. (1) Block: 2592 / 2592 (2) Block: 250 / 592 (2) 233 eigenvectors found. (2) Block: 500 / 592 (2) 237 eigenvectors found. (2) Block: 592 / 592 (2) 85 eigenvectors found. (2) Complementary block size: 37 (2) Compute compressed projector. (2) Use standard solver. (2) 20 eigenvectors found. (1) 575 eigenvectors found. (1) Complementary block size: 137 (1) Compute compressed projector. (1) Use standard solver. (1) 102 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 1368 Use submatrix version of eigh solver. (1) Block: 500 / 1368 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1368 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1368 / 1368 (1) 350 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 1368 Use submatrix version of eigh solver. (1) Block: 500 / 1368 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1368 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1368 / 1368 (1) 350 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 1368 Use submatrix version of eigh solver. (1) Block: 500 / 1368 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1368 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 27 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1368 / 1368 (1) 350 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. Tree of FC basis block matrices: - (11880, 11719), data: False |-- (1368, 1350), data: False |-- (1368, 33), data: (1368, 51) @ (51, 33) |-- (368, 350), data: True |-- (500, 485), data: False |-- (500, 12), data: (500, 27) @ (27, 12) |-- (250, 238), data: True |-- (250, 235), data: True |-- (500, 482), data: False |-- (500, 17), data: (500, 35) @ (35, 17) |-- (250, 233), data: True |-- (250, 232), data: True |-- (1368, 1350), data: False |-- (1368, 33), data: (1368, 51) @ (51, 33) |-- (368, 350), data: True |-- (500, 485), data: False |-- (500, 12), data: (500, 27) @ (27, 12) |-- (250, 238), data: True |-- (250, 235), data: True |-- (500, 482), data: False |-- (500, 17), data: (500, 35) @ (35, 17) |-- (250, 233), data: True |-- (250, 232), data: True |-- (1368, 1350), data: False |-- (1368, 33), data: (1368, 51) @ (51, 33) |-- (368, 350), data: True |-- (500, 485), data: False |-- (500, 12), data: (500, 27) @ (27, 12) |-- (250, 238), data: True |-- (250, 235), data: True |-- (500, 482), data: False |-- (500, 17), data: (500, 35) @ (35, 17) |-- (250, 233), data: True |-- (250, 232), data: True |-- (2592, 2557), data: False |-- (2592, 102), data: (2592, 137) @ (137, 102) |-- (592, 575), data: False |-- (592, 20), data: (592, 37) @ (37, 20) |-- (92, 85), data: True |-- (250, 237), data: True |-- (250, 233), data: True |-- (500, 477), data: False |-- (500, 21), data: (500, 44) @ (44, 21) |-- (250, 229), data: True |-- (250, 227), data: True |-- (500, 471), data: False |-- (500, 25), data: (500, 54) @ (54, 25) |-- (250, 225), data: True |-- (250, 221), data: True |-- (500, 467), data: False |-- (500, 31), data: (500, 64) @ (64, 31) |-- (250, 219), data: True |-- (250, 217), data: True |-- (500, 465), data: False |-- (500, 35), data: (500, 70) @ (70, 35) |-- (250, 215), data: True |-- (250, 215), data: True |-- (2592, 2556), data: False |-- (2592, 124), data: (2592, 160) @ (160, 124) |-- (592, 558), data: False |-- (592, 45), data: (592, 79) @ (79, 45) |-- (92, 76), data: True |-- (250, 221), data: True |-- (250, 216), data: True |-- (500, 474), data: False |-- (500, 22), data: (500, 48) @ (48, 22) |-- (250, 228), data: True |-- (250, 224), data: True |-- (500, 470), data: False |-- (500, 28), data: (500, 58) @ (58, 28) |-- (250, 222), data: True |-- (250, 220), data: True |-- (500, 466), data: False |-- (500, 28), data: (500, 62) @ (62, 28) |-- (250, 216), data: True |-- (250, 222), data: True |-- (500, 464), data: False |-- (500, 35), data: (500, 71) @ (71, 35) |-- (250, 215), data: True |-- (250, 214), data: True |-- (2592, 2556), data: False |-- (2592, 124), data: (2592, 160) @ (160, 124) |-- (592, 558), data: False |-- (592, 45), data: (592, 79) @ (79, 45) |-- (92, 76), data: True |-- (250, 221), data: True |-- (250, 216), data: True |-- (500, 474), data: False |-- (500, 22), data: (500, 48) @ (48, 22) |-- (250, 228), data: True |-- (250, 224), data: True |-- (500, 470), data: False |-- (500, 28), data: (500, 58) @ (58, 28) |-- (250, 222), data: True |-- (250, 220), data: True |-- (500, 466), data: False |-- (500, 28), data: (500, 62) @ (62, 28) |-- (250, 216), data: True |-- (250, 222), data: True |-- (500, 464), data: False |-- (500, 35), data: (500, 71) @ (71, 35) |-- (250, 215), data: True |-- (250, 214), data: True Max drift after symmetrization by symfc projector: 0.00000000 (zz) 0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 11:42:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 11:42:15]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.175106610141363 0.000000000000000 0.000000000000000 b 0.000000000000000 13.034742140000001 0.000000000000000 c -7.061432315217563 0.000000000000000 9.712029566628393 Atomic positions (fractional): 1 Na 0.06097575920098 0.77631037687308 0.06164609404299 22.990 2 Na 0.93902424079902 0.27631037687308 0.43835390595701 22.990 3 Na 0.06097575920098 0.72368962312692 0.56164609404299 22.990 4 Na 0.93902424079902 0.22368962312692 0.93835390595701 22.990 5 Y 0.46456691200114 0.71987293616961 0.47724618135452 88.906 6 Y 0.53543308799886 0.21987293616961 0.02275381864548 88.906 7 Y 0.53543308799886 0.28012706383039 0.52275381864548 88.906 8 Y 0.46456691200114 0.78012706383039 0.97724618135452 88.906 9 P 0.99363590739115 0.89623606497197 0.24383735895350 30.974 10 P 0.43598005116446 0.90755493297032 0.70309033783898 30.974 11 P 0.56401994883554 0.09244506702968 0.29690966216102 30.974 12 P 0.56401994883554 0.40755493297032 0.79690966216102 30.974 13 P 0.65366243344309 0.62863743719865 0.80244361362214 30.974 14 P 0.10963120332482 0.38424669160436 0.73578541658952 30.974 15 P 0.00636409260885 0.39623606497197 0.25616264104650 30.974 16 P 0.43598005116446 0.59244506702968 0.20309033783898 30.974 17 P 0.89036879667518 0.61575330839564 0.26421458341048 30.974 18 P 0.99363590739115 0.60376393502803 0.74383735895350 30.974 19 P 0.34633756655691 0.37136256280135 0.19755638637786 30.974 20 P 0.34633756655691 0.12863743719865 0.69755638637786 30.974 21 P 0.89036879667518 0.88424669160436 0.76421458341048 30.974 22 P 0.00636409260885 0.10376393502803 0.75616264104650 30.974 23 P 0.65366243344309 0.87136256280135 0.30244361362214 30.974 24 P 0.10963120332482 0.11575330839564 0.23578541658952 30.974 25 O 0.10393063722352 0.64990275441333 0.39841144551392 15.999 26 O 0.77891658485936 0.68905414086472 0.14630223319948 15.999 27 O 0.80493474567151 0.88817764971748 0.09243169442173 15.999 28 O 0.36754475180638 0.88724239227420 0.79729019309092 15.999 29 O 0.22108341514064 0.31094585913528 0.85369776680052 15.999 30 O 0.79394327705061 0.16737478234748 0.70226521384453 15.999 31 O 0.64433116242392 0.97935269079345 0.36296055119453 15.999 32 O 0.65065245255848 0.16396300338172 0.41557683067150 15.999 33 O 0.33333880944077 0.21141343687077 0.60672873624606 15.999 34 O 0.47564662027007 0.63309589426892 0.65014101998574 15.999 35 O 0.28798289904308 0.41834004133218 0.70300093479192 15.999 36 O 0.90687646053443 0.87261726435986 0.33715919835164 15.999 37 O 0.07157524134826 0.01253212147440 0.29031860192894 15.999 38 O 0.52435337972993 0.36690410573108 0.34985898001426 15.999 39 O 0.89606936277648 0.35009724558667 0.60158855448608 15.999 40 O 0.89606936277648 0.14990275441333 0.10158855448608 15.999 41 O 0.64433116242392 0.52064730920655 0.86296055119452 15.999 42 O 0.77891658485936 0.81094585913528 0.64630223319948 15.999 43 O 0.80493474567151 0.61182235028252 0.59243169442173 15.999 44 O 0.47564662027007 0.86690410573108 0.15014101998574 15.999 45 O 0.71201710095692 0.58165995866782 0.29699906520808 15.999 46 O 0.35566883757608 0.47935269079345 0.13703944880548 15.999 47 O 0.34934754744152 0.66396300338172 0.08442316932850 15.999 48 O 0.65065245255848 0.33603699661828 0.91557683067150 15.999 49 O 0.34934754744152 0.83603699661828 0.58442316932850 15.999 50 O 0.36754475180638 0.61275760772580 0.29729019309093 15.999 51 O 0.10393063722352 0.85009724558667 0.89841144551392 15.999 52 O 0.22108341514064 0.18905414086472 0.35369776680052 15.999 53 O 0.63245524819362 0.11275760772580 0.20270980690908 15.999 54 O 0.66666119055923 0.71141343687077 0.89327126375394 15.999 55 O 0.19506525432849 0.38817764971748 0.40756830557827 15.999 56 O 0.19506525432849 0.11182235028252 0.90756830557827 15.999 57 O 0.09312353946557 0.37261726435986 0.16284080164836 15.999 58 O 0.92842475865174 0.98746787852560 0.70968139807106 15.999 59 O 0.52435337972993 0.13309589426892 0.84985898001426 15.999 60 O 0.63245524819362 0.38724239227420 0.70270980690908 15.999 61 O 0.20605672294939 0.66737478234748 0.79773478615547 15.999 62 O 0.90687646053443 0.62738273564014 0.83715919835164 15.999 63 O 0.66666119055923 0.78858656312923 0.39327126375394 15.999 64 O 0.09312353946557 0.12738273564014 0.66284080164836 15.999 65 O 0.71201710095692 0.91834004133218 0.79699906520808 15.999 66 O 0.33333880944077 0.28858656312923 0.10672873624606 15.999 67 O 0.07157524134826 0.48746787852560 0.79031860192894 15.999 68 O 0.79394327705061 0.33262521765252 0.20226521384453 15.999 69 O 0.92842475865174 0.51253212147440 0.20968139807106 15.999 70 O 0.35566883757608 0.02064730920654 0.63703944880548 15.999 71 O 0.28798289904308 0.08165995866782 0.20300093479192 15.999 72 O 0.20605672294939 0.83262521765252 0.29773478615547 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.350213220282726 0.000000000000000 0.000000000000000 b 0.000000000000000 13.034742140000001 0.000000000000000 c -7.061432315217563 0.000000000000000 9.712029566628393 Atomic positions (fractional): 1 Na 0.03048787960049 0.77631037687308 0.06164609404299 22.990 > 1 2 Na 0.53048787960049 0.77631037687308 0.06164609404299 22.990 > 1 3 Na 0.46951212039951 0.27631037687308 0.43835390595701 22.990 > 3 4 Na 0.96951212039951 0.27631037687308 0.43835390595701 22.990 > 3 5 Na 0.03048787960049 0.72368962312692 0.56164609404299 22.990 > 5 6 Na 0.53048787960049 0.72368962312692 0.56164609404299 22.990 > 5 7 Na 0.46951212039951 0.22368962312692 0.93835390595701 22.990 > 7 8 Na 0.96951212039951 0.22368962312692 0.93835390595701 22.990 > 7 9 Y 0.23228345600057 0.71987293616961 0.47724618135452 88.906 > 9 10 Y 0.73228345600057 0.71987293616961 0.47724618135452 88.906 > 9 11 Y 0.26771654399943 0.21987293616961 0.02275381864548 88.906 > 11 12 Y 0.76771654399943 0.21987293616961 0.02275381864548 88.906 > 11 13 Y 0.26771654399943 0.28012706383039 0.52275381864548 88.906 > 13 14 Y 0.76771654399943 0.28012706383039 0.52275381864548 88.906 > 13 15 Y 0.23228345600057 0.78012706383039 0.97724618135452 88.906 > 15 16 Y 0.73228345600057 0.78012706383039 0.97724618135452 88.906 > 15 17 P 0.49681795369557 0.89623606497197 0.24383735895350 30.974 > 17 18 P 0.99681795369557 0.89623606497197 0.24383735895350 30.974 > 17 19 P 0.21799002558223 0.90755493297032 0.70309033783898 30.974 > 19 20 P 0.71799002558223 0.90755493297032 0.70309033783898 30.974 > 19 21 P 0.28200997441777 0.09244506702968 0.29690966216102 30.974 > 21 22 P 0.78200997441777 0.09244506702968 0.29690966216102 30.974 > 21 23 P 0.28200997441777 0.40755493297032 0.79690966216102 30.974 > 23 24 P 0.78200997441777 0.40755493297032 0.79690966216102 30.974 > 23 25 P 0.32683121672155 0.62863743719865 0.80244361362214 30.974 > 25 26 P 0.82683121672155 0.62863743719865 0.80244361362214 30.974 > 25 27 P 0.05481560166241 0.38424669160436 0.73578541658952 30.974 > 27 28 P 0.55481560166241 0.38424669160436 0.73578541658952 30.974 > 27 29 P 0.00318204630443 0.39623606497197 0.25616264104650 30.974 > 29 30 P 0.50318204630443 0.39623606497197 0.25616264104650 30.974 > 29 31 P 0.21799002558223 0.59244506702968 0.20309033783898 30.974 > 31 32 P 0.71799002558223 0.59244506702968 0.20309033783898 30.974 > 31 33 P 0.44518439833759 0.61575330839564 0.26421458341048 30.974 > 33 34 P 0.94518439833759 0.61575330839564 0.26421458341048 30.974 > 33 35 P 0.49681795369557 0.60376393502803 0.74383735895350 30.974 > 35 36 P 0.99681795369557 0.60376393502803 0.74383735895350 30.974 > 35 37 P 0.17316878327845 0.37136256280135 0.19755638637786 30.974 > 37 38 P 0.67316878327845 0.37136256280135 0.19755638637786 30.974 > 37 39 P 0.17316878327845 0.12863743719865 0.69755638637786 30.974 > 39 40 P 0.67316878327845 0.12863743719865 0.69755638637786 30.974 > 39 41 P 0.44518439833759 0.88424669160436 0.76421458341048 30.974 > 41 42 P 0.94518439833759 0.88424669160436 0.76421458341048 30.974 > 41 43 P 0.00318204630443 0.10376393502803 0.75616264104650 30.974 > 43 44 P 0.50318204630443 0.10376393502803 0.75616264104650 30.974 > 43 45 P 0.32683121672155 0.87136256280135 0.30244361362214 30.974 > 45 46 P 0.82683121672155 0.87136256280135 0.30244361362214 30.974 > 45 47 P 0.05481560166241 0.11575330839564 0.23578541658952 30.974 > 47 48 P 0.55481560166241 0.11575330839564 0.23578541658952 30.974 > 47 49 O 0.05196531861176 0.64990275441333 0.39841144551392 15.999 > 49 50 O 0.55196531861176 0.64990275441333 0.39841144551392 15.999 > 49 51 O 0.38945829242968 0.68905414086472 0.14630223319948 15.999 > 51 52 O 0.88945829242968 0.68905414086472 0.14630223319948 15.999 > 51 53 O 0.40246737283575 0.88817764971748 0.09243169442173 15.999 > 53 54 O 0.90246737283575 0.88817764971748 0.09243169442173 15.999 > 53 55 O 0.18377237590319 0.88724239227420 0.79729019309092 15.999 > 55 56 O 0.68377237590319 0.88724239227420 0.79729019309092 15.999 > 55 57 O 0.11054170757032 0.31094585913528 0.85369776680052 15.999 > 57 58 O 0.61054170757032 0.31094585913528 0.85369776680052 15.999 > 57 59 O 0.39697163852530 0.16737478234748 0.70226521384453 15.999 > 59 60 O 0.89697163852530 0.16737478234748 0.70226521384453 15.999 > 59 61 O 0.32216558121196 0.97935269079345 0.36296055119453 15.999 > 61 62 O 0.82216558121196 0.97935269079345 0.36296055119453 15.999 > 61 63 O 0.32532622627924 0.16396300338172 0.41557683067150 15.999 > 63 64 O 0.82532622627924 0.16396300338172 0.41557683067150 15.999 > 63 65 O 0.16666940472038 0.21141343687077 0.60672873624606 15.999 > 65 66 O 0.66666940472038 0.21141343687077 0.60672873624606 15.999 > 65 67 O 0.23782331013504 0.63309589426892 0.65014101998574 15.999 > 67 68 O 0.73782331013504 0.63309589426892 0.65014101998574 15.999 > 67 69 O 0.14399144952154 0.41834004133218 0.70300093479192 15.999 > 69 70 O 0.64399144952154 0.41834004133218 0.70300093479192 15.999 > 69 71 O 0.45343823026722 0.87261726435986 0.33715919835164 15.999 > 71 72 O 0.95343823026722 0.87261726435986 0.33715919835164 15.999 > 71 73 O 0.03578762067413 0.01253212147440 0.29031860192894 15.999 > 73 74 O 0.53578762067413 0.01253212147440 0.29031860192894 15.999 > 73 75 O 0.26217668986496 0.36690410573108 0.34985898001426 15.999 > 75 76 O 0.76217668986496 0.36690410573108 0.34985898001426 15.999 > 75 77 O 0.44803468138824 0.35009724558667 0.60158855448608 15.999 > 77 78 O 0.94803468138824 0.35009724558667 0.60158855448608 15.999 > 77 79 O 0.44803468138824 0.14990275441333 0.10158855448608 15.999 > 79 80 O 0.94803468138824 0.14990275441333 0.10158855448608 15.999 > 79 81 O 0.32216558121196 0.52064730920655 0.86296055119452 15.999 > 81 82 O 0.82216558121196 0.52064730920655 0.86296055119452 15.999 > 81 83 O 0.38945829242968 0.81094585913528 0.64630223319948 15.999 > 83 84 O 0.88945829242968 0.81094585913528 0.64630223319948 15.999 > 83 85 O 0.40246737283575 0.61182235028252 0.59243169442173 15.999 > 85 86 O 0.90246737283575 0.61182235028252 0.59243169442173 15.999 > 85 87 O 0.23782331013504 0.86690410573108 0.15014101998574 15.999 > 87 88 O 0.73782331013504 0.86690410573108 0.15014101998574 15.999 > 87 89 O 0.35600855047846 0.58165995866782 0.29699906520808 15.999 > 89 90 O 0.85600855047846 0.58165995866782 0.29699906520808 15.999 > 89 91 O 0.17783441878804 0.47935269079345 0.13703944880548 15.999 > 91 92 O 0.67783441878804 0.47935269079345 0.13703944880548 15.999 > 91 93 O 0.17467377372076 0.66396300338172 0.08442316932850 15.999 > 93 94 O 0.67467377372076 0.66396300338172 0.08442316932850 15.999 > 93 95 O 0.32532622627924 0.33603699661828 0.91557683067150 15.999 > 95 96 O 0.82532622627924 0.33603699661828 0.91557683067150 15.999 > 95 97 O 0.17467377372076 0.83603699661828 0.58442316932850 15.999 > 97 98 O 0.67467377372076 0.83603699661828 0.58442316932850 15.999 > 97 99 O 0.18377237590319 0.61275760772580 0.29729019309093 15.999 > 99 100 O 0.68377237590319 0.61275760772580 0.29729019309093 15.999 > 99 101 O 0.05196531861176 0.85009724558667 0.89841144551392 15.999 > 101 102 O 0.55196531861176 0.85009724558667 0.89841144551392 15.999 > 101 103 O 0.11054170757032 0.18905414086472 0.35369776680052 15.999 > 103 104 O 0.61054170757032 0.18905414086472 0.35369776680052 15.999 > 103 105 O 0.31622762409681 0.11275760772580 0.20270980690908 15.999 > 105 106 O 0.81622762409681 0.11275760772580 0.20270980690908 15.999 > 105 107 O 0.33333059527962 0.71141343687077 0.89327126375394 15.999 > 107 108 O 0.83333059527962 0.71141343687077 0.89327126375394 15.999 > 107 109 O 0.09753262716425 0.38817764971748 0.40756830557827 15.999 > 109 110 O 0.59753262716425 0.38817764971748 0.40756830557827 15.999 > 109 111 O 0.09753262716425 0.11182235028252 0.90756830557827 15.999 > 111 112 O 0.59753262716425 0.11182235028252 0.90756830557827 15.999 > 111 113 O 0.04656176973278 0.37261726435986 0.16284080164836 15.999 > 113 114 O 0.54656176973278 0.37261726435986 0.16284080164836 15.999 > 113 115 O 0.46421237932587 0.98746787852560 0.70968139807106 15.999 > 115 116 O 0.96421237932587 0.98746787852560 0.70968139807106 15.999 > 115 117 O 0.26217668986496 0.13309589426892 0.84985898001426 15.999 > 117 118 O 0.76217668986496 0.13309589426892 0.84985898001426 15.999 > 117 119 O 0.31622762409681 0.38724239227420 0.70270980690908 15.999 > 119 120 O 0.81622762409681 0.38724239227420 0.70270980690908 15.999 > 119 121 O 0.10302836147470 0.66737478234748 0.79773478615547 15.999 > 121 122 O 0.60302836147470 0.66737478234748 0.79773478615547 15.999 > 121 123 O 0.45343823026722 0.62738273564014 0.83715919835164 15.999 > 123 124 O 0.95343823026722 0.62738273564014 0.83715919835164 15.999 > 123 125 O 0.33333059527962 0.78858656312923 0.39327126375394 15.999 > 125 126 O 0.83333059527962 0.78858656312923 0.39327126375394 15.999 > 125 127 O 0.04656176973278 0.12738273564014 0.66284080164836 15.999 > 127 128 O 0.54656176973278 0.12738273564014 0.66284080164836 15.999 > 127 129 O 0.35600855047846 0.91834004133218 0.79699906520808 15.999 > 129 130 O 0.85600855047846 0.91834004133218 0.79699906520808 15.999 > 129 131 O 0.16666940472038 0.28858656312923 0.10672873624606 15.999 > 131 132 O 0.66666940472038 0.28858656312923 0.10672873624606 15.999 > 131 133 O 0.03578762067413 0.48746787852560 0.79031860192894 15.999 > 133 134 O 0.53578762067413 0.48746787852560 0.79031860192894 15.999 > 133 135 O 0.39697163852530 0.33262521765252 0.20226521384453 15.999 > 135 136 O 0.89697163852530 0.33262521765252 0.20226521384453 15.999 > 135 137 O 0.46421237932587 0.51253212147440 0.20968139807106 15.999 > 137 138 O 0.96421237932587 0.51253212147440 0.20968139807106 15.999 > 137 139 O 0.17783441878804 0.02064730920654 0.63703944880548 15.999 > 139 140 O 0.67783441878804 0.02064730920654 0.63703944880548 15.999 > 139 141 O 0.14399144952154 0.08165995866782 0.20300093479192 15.999 > 141 142 O 0.64399144952154 0.08165995866782 0.20300093479192 15.999 > 141 143 O 0.10302836147470 0.83262521765252 0.29773478615547 15.999 > 143 144 O 0.60302836147470 0.83262521765252 0.29773478615547 15.999 > 143 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7407708 0.0000000 0.0114165 0.0000000 2.7444004 0.0000000 0.0114175 0.0000000 2.6921206 -------------------------- Born effective charges -------------------------- 1 Na 1.1980226 -0.0517001 -0.0290967 0.0179065 1.0194946 0.0655150 -0.0083052 0.0274498 1.2236667 2 Na 1.1980226 0.0517001 -0.0290967 -0.0179065 1.0194946 -0.0655150 -0.0083052 -0.0274498 1.2236667 3 Na 1.1980226 0.0517001 -0.0290967 -0.0179065 1.0194946 -0.0655150 -0.0083052 -0.0274498 1.2236667 4 Na 1.1980226 -0.0517001 -0.0290967 0.0179065 1.0194946 0.0655150 -0.0083052 0.0274498 1.2236667 5 Y 3.9092657 -0.2148349 0.0194867 0.2218765 3.6984066 0.0796125 0.0544460 0.0927042 4.7462491 6 Y 3.9092657 0.2148349 0.0194867 -0.2218765 3.6984066 -0.0796125 0.0544460 -0.0927042 4.7462491 7 Y 3.9092657 -0.2148349 0.0194867 0.2218765 3.6984066 0.0796125 0.0544460 0.0927042 4.7462491 8 Y 3.9092657 0.2148349 0.0194867 -0.2218765 3.6984066 -0.0796125 0.0544460 -0.0927042 4.7462491 9 P 3.7031452 0.3464846 0.0405979 -0.0339050 3.9979269 0.6078197 0.3957568 -0.1944448 2.9573120 10 P 3.6828687 -0.3671741 0.2364629 0.0025571 3.8830188 -0.4461662 -0.4393325 0.3270876 2.9638254 11 P 3.6828687 -0.3671741 0.2364629 0.0025571 3.8830188 -0.4461662 -0.4393325 0.3270876 2.9638254 12 P 3.6828687 0.3671741 0.2364629 -0.0025571 3.8830188 0.4461662 -0.4393325 -0.3270876 2.9638254 13 P 3.7602564 0.0015373 -0.3222691 0.1147986 3.7988894 -0.5181850 -0.2408474 0.3609535 2.9935050 14 P 3.8412475 -0.1636580 0.2468039 -0.3417948 4.0214817 0.3670341 0.3964731 -0.1804152 3.0555992 15 P 3.7031452 -0.3464846 0.0405979 0.0339050 3.9979269 -0.6078197 0.3957568 0.1944448 2.9573120 16 P 3.6828687 0.3671741 0.2364629 -0.0025571 3.8830188 0.4461662 -0.4393325 -0.3270876 2.9638254 17 P 3.8412475 -0.1636580 0.2468039 -0.3417948 4.0214817 0.3670341 0.3964731 -0.1804152 3.0555992 18 P 3.7031452 -0.3464846 0.0405979 0.0339050 3.9979269 -0.6078197 0.3957568 0.1944448 2.9573120 19 P 3.7602564 0.0015373 -0.3222691 0.1147986 3.7988894 -0.5181850 -0.2408474 0.3609535 2.9935050 20 P 3.7602564 -0.0015373 -0.3222691 -0.1147986 3.7988894 0.5181850 -0.2408474 -0.3609535 2.9935050 21 P 3.8412475 0.1636580 0.2468039 0.3417948 4.0214817 -0.3670341 0.3964731 0.1804152 3.0555992 22 P 3.7031452 0.3464846 0.0405979 -0.0339050 3.9979269 0.6078197 0.3957568 -0.1944448 2.9573120 23 P 3.7602564 -0.0015373 -0.3222691 -0.1147986 3.7988894 0.5181850 -0.2408474 -0.3609535 2.9935050 24 P 3.8412475 0.1636580 0.2468039 0.3417948 4.0214817 -0.3670341 0.3964731 0.1804152 3.0555992 25 O -1.6855459 -0.2738854 -0.6292896 -0.3405323 -1.3085698 -0.5075259 -0.6080564 -0.3459950 -1.7725031 26 O -1.2009419 0.1246993 -0.2585799 0.1511788 -1.7235031 0.6596933 -0.2647088 0.6729147 -1.8751973 27 O -1.3073226 -0.2138629 -0.3340064 -0.2429852 -1.3088159 -0.4955837 -0.4126338 -0.2674573 -1.8515589 28 O -1.6761063 -0.2655418 0.6757273 -0.3382559 -1.4408549 0.6126228 0.6418882 0.3864461 -1.6940446 29 O -1.2009419 0.1246993 -0.2585799 0.1511788 -1.7235031 0.6596933 -0.2647088 0.6729147 -1.8751973 30 O -1.7209929 0.5186253 -0.4921414 0.5167646 -1.6167540 0.3947437 -0.4741230 0.5117397 -1.4997021 31 O -1.0706310 0.7428824 0.0803957 0.4137353 -3.1836301 0.0226762 0.1302003 0.0283893 -0.9742261 32 O -1.2692895 0.2855407 0.1868072 0.2701661 -1.5919743 -0.5491627 0.2965601 -0.6327269 -1.6626963 33 O -1.6433932 -0.4737174 0.4810128 -0.4243851 -1.6303306 0.4154600 0.4742478 0.5489031 -1.5020186 34 O -1.2127477 -0.0837492 0.1785907 -0.1365728 -1.2577330 0.6174867 0.1844569 0.2535942 -2.0639803 35 O -3.0298860 -0.2449143 -0.4604345 -0.1916257 -1.0470854 -0.0361249 -0.3079695 0.1331761 -1.0260832 36 O -3.0269608 -0.2432849 0.3880775 -0.1557168 -0.9767839 -0.0104092 0.2340391 0.1270652 -1.1336512 37 O -1.2509883 -0.9259534 -0.0081450 -0.7274773 -3.3331832 0.0054088 -0.0520917 0.0480236 -0.8844958 38 O -1.2127477 -0.0837492 0.1785907 -0.1365728 -1.2577330 0.6174867 0.1844569 0.2535942 -2.0639803 39 O -1.6855459 -0.2738854 -0.6292896 -0.3405323 -1.3085698 -0.5075259 -0.6080564 -0.3459950 -1.7725031 40 O -1.6855459 0.2738854 -0.6292896 0.3405323 -1.3085698 0.5075259 -0.6080564 0.3459950 -1.7725031 41 O -1.0706310 -0.7428824 0.0803957 -0.4137353 -3.1836301 -0.0226762 0.1302003 -0.0283893 -0.9742261 42 O -1.2009419 -0.1246993 -0.2585799 -0.1511788 -1.7235031 -0.6596933 -0.2647088 -0.6729147 -1.8751973 43 O -1.3073226 0.2138629 -0.3340064 0.2429852 -1.3088159 0.4955837 -0.4126338 0.2674573 -1.8515589 44 O -1.2127477 0.0837492 0.1785907 0.1365728 -1.2577330 -0.6174867 0.1844569 -0.2535942 -2.0639803 45 O -3.0298860 -0.2449143 -0.4604345 -0.1916257 -1.0470854 -0.0361249 -0.3079695 0.1331761 -1.0260832 46 O -1.0706310 -0.7428824 0.0803957 -0.4137353 -3.1836301 -0.0226762 0.1302003 -0.0283893 -0.9742261 47 O -1.2692895 -0.2855407 0.1868072 -0.2701661 -1.5919743 0.5491627 0.2965601 0.6327269 -1.6626963 48 O -1.2692895 -0.2855407 0.1868072 -0.2701661 -1.5919743 0.5491627 0.2965601 0.6327269 -1.6626963 49 O -1.2692895 0.2855407 0.1868072 0.2701661 -1.5919743 -0.5491627 0.2965601 -0.6327269 -1.6626963 50 O -1.6761063 0.2655418 0.6757273 0.3382559 -1.4408549 -0.6126228 0.6418882 -0.3864461 -1.6940446 51 O -1.6855459 0.2738854 -0.6292896 0.3405323 -1.3085698 0.5075259 -0.6080564 0.3459950 -1.7725031 52 O -1.2009419 -0.1246993 -0.2585799 -0.1511788 -1.7235031 -0.6596933 -0.2647088 -0.6729147 -1.8751973 53 O -1.6761063 -0.2655418 0.6757273 -0.3382559 -1.4408549 0.6126228 0.6418882 0.3864461 -1.6940446 54 O -1.6433932 0.4737174 0.4810128 0.4243851 -1.6303306 -0.4154600 0.4742478 -0.5489031 -1.5020186 55 O -1.3073226 0.2138629 -0.3340064 0.2429852 -1.3088159 0.4955837 -0.4126338 0.2674573 -1.8515589 56 O -1.3073226 -0.2138629 -0.3340064 -0.2429852 -1.3088159 -0.4955837 -0.4126338 -0.2674573 -1.8515589 57 O -3.0269608 0.2432849 0.3880775 0.1557168 -0.9767839 0.0104092 0.2340391 -0.1270652 -1.1336512 58 O -1.2509883 -0.9259534 -0.0081450 -0.7274773 -3.3331832 0.0054088 -0.0520917 0.0480236 -0.8844958 59 O -1.2127477 0.0837492 0.1785907 0.1365728 -1.2577330 -0.6174867 0.1844569 -0.2535942 -2.0639803 60 O -1.6761063 0.2655418 0.6757273 0.3382559 -1.4408549 -0.6126228 0.6418882 -0.3864461 -1.6940446 61 O -1.7209929 -0.5186253 -0.4921414 -0.5167646 -1.6167540 -0.3947437 -0.4741230 -0.5117397 -1.4997021 62 O -3.0269608 0.2432849 0.3880775 0.1557168 -0.9767839 0.0104092 0.2340391 -0.1270652 -1.1336512 63 O -1.6433932 -0.4737174 0.4810128 -0.4243851 -1.6303306 0.4154600 0.4742478 0.5489031 -1.5020186 64 O -3.0269608 -0.2432849 0.3880775 -0.1557168 -0.9767839 -0.0104092 0.2340391 0.1270652 -1.1336512 65 O -3.0298860 0.2449143 -0.4604345 0.1916257 -1.0470854 0.0361249 -0.3079695 -0.1331761 -1.0260832 66 O -1.6433932 0.4737174 0.4810128 0.4243851 -1.6303306 -0.4154600 0.4742478 -0.5489031 -1.5020186 67 O -1.2509883 0.9259534 -0.0081450 0.7274773 -3.3331832 -0.0054088 -0.0520917 -0.0480236 -0.8844958 68 O -1.7209929 -0.5186253 -0.4921414 -0.5167646 -1.6167540 -0.3947437 -0.4741230 -0.5117397 -1.4997021 69 O -1.2509883 0.9259534 -0.0081450 0.7274773 -3.3331832 -0.0054088 -0.0520917 -0.0480236 -0.8844958 70 O -1.0706310 0.7428824 0.0803957 0.4137353 -3.1836301 0.0226762 0.1302003 0.0283893 -0.9742261 71 O -3.0298860 0.2449143 -0.4604345 0.1916257 -1.0470854 0.0361249 -0.3079695 -0.1331761 -1.0260832 72 O -1.7209929 0.5186253 -0.4921414 0.5167646 -1.6167540 0.3947437 -0.4741230 0.5117397 -1.4997021 ---------------------------------------------------------------------------- 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 19, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 27, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 53, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 55, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 59, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 61, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 63, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 67, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 69, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 71, 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (xz) 0.00000001 (xz) 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 11:43:59]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 11:44:00]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.175106610141363 0.000000000000000 0.000000000000000 b 0.000000000000000 13.034742140000001 0.000000000000000 c -7.061432315217563 0.000000000000000 9.712029566628393 Atomic positions (fractional): 1 Na 0.06097575920098 0.77631037687308 0.06164609404299 22.990 2 Na 0.93902424079902 0.27631037687308 0.43835390595701 22.990 3 Na 0.06097575920098 0.72368962312692 0.56164609404299 22.990 4 Na 0.93902424079902 0.22368962312692 0.93835390595701 22.990 5 Y 0.46456691200114 0.71987293616961 0.47724618135452 88.906 6 Y 0.53543308799886 0.21987293616961 0.02275381864548 88.906 7 Y 0.53543308799886 0.28012706383039 0.52275381864548 88.906 8 Y 0.46456691200114 0.78012706383039 0.97724618135452 88.906 9 P 0.99363590739115 0.89623606497197 0.24383735895350 30.974 10 P 0.43598005116446 0.90755493297032 0.70309033783898 30.974 11 P 0.56401994883554 0.09244506702968 0.29690966216102 30.974 12 P 0.56401994883554 0.40755493297032 0.79690966216102 30.974 13 P 0.65366243344309 0.62863743719865 0.80244361362214 30.974 14 P 0.10963120332482 0.38424669160436 0.73578541658952 30.974 15 P 0.00636409260885 0.39623606497197 0.25616264104650 30.974 16 P 0.43598005116446 0.59244506702968 0.20309033783898 30.974 17 P 0.89036879667518 0.61575330839564 0.26421458341048 30.974 18 P 0.99363590739115 0.60376393502803 0.74383735895350 30.974 19 P 0.34633756655691 0.37136256280135 0.19755638637786 30.974 20 P 0.34633756655691 0.12863743719865 0.69755638637786 30.974 21 P 0.89036879667518 0.88424669160436 0.76421458341048 30.974 22 P 0.00636409260885 0.10376393502803 0.75616264104650 30.974 23 P 0.65366243344309 0.87136256280135 0.30244361362214 30.974 24 P 0.10963120332482 0.11575330839564 0.23578541658952 30.974 25 O 0.10393063722352 0.64990275441333 0.39841144551392 15.999 26 O 0.77891658485936 0.68905414086472 0.14630223319948 15.999 27 O 0.80493474567151 0.88817764971748 0.09243169442173 15.999 28 O 0.36754475180638 0.88724239227420 0.79729019309092 15.999 29 O 0.22108341514064 0.31094585913528 0.85369776680052 15.999 30 O 0.79394327705061 0.16737478234748 0.70226521384453 15.999 31 O 0.64433116242392 0.97935269079345 0.36296055119453 15.999 32 O 0.65065245255848 0.16396300338172 0.41557683067150 15.999 33 O 0.33333880944077 0.21141343687077 0.60672873624606 15.999 34 O 0.47564662027007 0.63309589426892 0.65014101998574 15.999 35 O 0.28798289904308 0.41834004133218 0.70300093479192 15.999 36 O 0.90687646053443 0.87261726435986 0.33715919835164 15.999 37 O 0.07157524134826 0.01253212147440 0.29031860192894 15.999 38 O 0.52435337972993 0.36690410573108 0.34985898001426 15.999 39 O 0.89606936277648 0.35009724558667 0.60158855448608 15.999 40 O 0.89606936277648 0.14990275441333 0.10158855448608 15.999 41 O 0.64433116242392 0.52064730920655 0.86296055119452 15.999 42 O 0.77891658485936 0.81094585913528 0.64630223319948 15.999 43 O 0.80493474567151 0.61182235028252 0.59243169442173 15.999 44 O 0.47564662027007 0.86690410573108 0.15014101998574 15.999 45 O 0.71201710095692 0.58165995866782 0.29699906520808 15.999 46 O 0.35566883757608 0.47935269079345 0.13703944880548 15.999 47 O 0.34934754744152 0.66396300338172 0.08442316932850 15.999 48 O 0.65065245255848 0.33603699661828 0.91557683067150 15.999 49 O 0.34934754744152 0.83603699661828 0.58442316932850 15.999 50 O 0.36754475180638 0.61275760772580 0.29729019309093 15.999 51 O 0.10393063722352 0.85009724558667 0.89841144551392 15.999 52 O 0.22108341514064 0.18905414086472 0.35369776680052 15.999 53 O 0.63245524819362 0.11275760772580 0.20270980690908 15.999 54 O 0.66666119055923 0.71141343687077 0.89327126375394 15.999 55 O 0.19506525432849 0.38817764971748 0.40756830557827 15.999 56 O 0.19506525432849 0.11182235028252 0.90756830557827 15.999 57 O 0.09312353946557 0.37261726435986 0.16284080164836 15.999 58 O 0.92842475865174 0.98746787852560 0.70968139807106 15.999 59 O 0.52435337972993 0.13309589426892 0.84985898001426 15.999 60 O 0.63245524819362 0.38724239227420 0.70270980690908 15.999 61 O 0.20605672294939 0.66737478234748 0.79773478615547 15.999 62 O 0.90687646053443 0.62738273564014 0.83715919835164 15.999 63 O 0.66666119055923 0.78858656312923 0.39327126375394 15.999 64 O 0.09312353946557 0.12738273564014 0.66284080164836 15.999 65 O 0.71201710095692 0.91834004133218 0.79699906520808 15.999 66 O 0.33333880944077 0.28858656312923 0.10672873624606 15.999 67 O 0.07157524134826 0.48746787852560 0.79031860192894 15.999 68 O 0.79394327705061 0.33262521765252 0.20226521384453 15.999 69 O 0.92842475865174 0.51253212147440 0.20968139807106 15.999 70 O 0.35566883757608 0.02064730920654 0.63703944880548 15.999 71 O 0.28798289904308 0.08165995866782 0.20300093479192 15.999 72 O 0.20605672294939 0.83262521765252 0.29773478615547 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.350213220282726 0.000000000000000 0.000000000000000 b 0.000000000000000 13.034742140000001 0.000000000000000 c -7.061432315217563 0.000000000000000 9.712029566628393 Atomic positions (fractional): 1 Na 0.03048787960049 0.77631037687308 0.06164609404299 22.990 > 1 2 Na 0.53048787960049 0.77631037687308 0.06164609404299 22.990 > 1 3 Na 0.46951212039951 0.27631037687308 0.43835390595701 22.990 > 3 4 Na 0.96951212039951 0.27631037687308 0.43835390595701 22.990 > 3 5 Na 0.03048787960049 0.72368962312692 0.56164609404299 22.990 > 5 6 Na 0.53048787960049 0.72368962312692 0.56164609404299 22.990 > 5 7 Na 0.46951212039951 0.22368962312692 0.93835390595701 22.990 > 7 8 Na 0.96951212039951 0.22368962312692 0.93835390595701 22.990 > 7 9 Y 0.23228345600057 0.71987293616961 0.47724618135452 88.906 > 9 10 Y 0.73228345600057 0.71987293616961 0.47724618135452 88.906 > 9 11 Y 0.26771654399943 0.21987293616961 0.02275381864548 88.906 > 11 12 Y 0.76771654399943 0.21987293616961 0.02275381864548 88.906 > 11 13 Y 0.26771654399943 0.28012706383039 0.52275381864548 88.906 > 13 14 Y 0.76771654399943 0.28012706383039 0.52275381864548 88.906 > 13 15 Y 0.23228345600057 0.78012706383039 0.97724618135452 88.906 > 15 16 Y 0.73228345600057 0.78012706383039 0.97724618135452 88.906 > 15 17 P 0.49681795369557 0.89623606497197 0.24383735895350 30.974 > 17 18 P 0.99681795369557 0.89623606497197 0.24383735895350 30.974 > 17 19 P 0.21799002558223 0.90755493297032 0.70309033783898 30.974 > 19 20 P 0.71799002558223 0.90755493297032 0.70309033783898 30.974 > 19 21 P 0.28200997441777 0.09244506702968 0.29690966216102 30.974 > 21 22 P 0.78200997441777 0.09244506702968 0.29690966216102 30.974 > 21 23 P 0.28200997441777 0.40755493297032 0.79690966216102 30.974 > 23 24 P 0.78200997441777 0.40755493297032 0.79690966216102 30.974 > 23 25 P 0.32683121672155 0.62863743719865 0.80244361362214 30.974 > 25 26 P 0.82683121672155 0.62863743719865 0.80244361362214 30.974 > 25 27 P 0.05481560166241 0.38424669160436 0.73578541658952 30.974 > 27 28 P 0.55481560166241 0.38424669160436 0.73578541658952 30.974 > 27 29 P 0.00318204630443 0.39623606497197 0.25616264104650 30.974 > 29 30 P 0.50318204630443 0.39623606497197 0.25616264104650 30.974 > 29 31 P 0.21799002558223 0.59244506702968 0.20309033783898 30.974 > 31 32 P 0.71799002558223 0.59244506702968 0.20309033783898 30.974 > 31 33 P 0.44518439833759 0.61575330839564 0.26421458341048 30.974 > 33 34 P 0.94518439833759 0.61575330839564 0.26421458341048 30.974 > 33 35 P 0.49681795369557 0.60376393502803 0.74383735895350 30.974 > 35 36 P 0.99681795369557 0.60376393502803 0.74383735895350 30.974 > 35 37 P 0.17316878327845 0.37136256280135 0.19755638637786 30.974 > 37 38 P 0.67316878327845 0.37136256280135 0.19755638637786 30.974 > 37 39 P 0.17316878327845 0.12863743719865 0.69755638637786 30.974 > 39 40 P 0.67316878327845 0.12863743719865 0.69755638637786 30.974 > 39 41 P 0.44518439833759 0.88424669160436 0.76421458341048 30.974 > 41 42 P 0.94518439833759 0.88424669160436 0.76421458341048 30.974 > 41 43 P 0.00318204630443 0.10376393502803 0.75616264104650 30.974 > 43 44 P 0.50318204630443 0.10376393502803 0.75616264104650 30.974 > 43 45 P 0.32683121672155 0.87136256280135 0.30244361362214 30.974 > 45 46 P 0.82683121672155 0.87136256280135 0.30244361362214 30.974 > 45 47 P 0.05481560166241 0.11575330839564 0.23578541658952 30.974 > 47 48 P 0.55481560166241 0.11575330839564 0.23578541658952 30.974 > 47 49 O 0.05196531861176 0.64990275441333 0.39841144551392 15.999 > 49 50 O 0.55196531861176 0.64990275441333 0.39841144551392 15.999 > 49 51 O 0.38945829242968 0.68905414086472 0.14630223319948 15.999 > 51 52 O 0.88945829242968 0.68905414086472 0.14630223319948 15.999 > 51 53 O 0.40246737283575 0.88817764971748 0.09243169442173 15.999 > 53 54 O 0.90246737283575 0.88817764971748 0.09243169442173 15.999 > 53 55 O 0.18377237590319 0.88724239227420 0.79729019309092 15.999 > 55 56 O 0.68377237590319 0.88724239227420 0.79729019309092 15.999 > 55 57 O 0.11054170757032 0.31094585913528 0.85369776680052 15.999 > 57 58 O 0.61054170757032 0.31094585913528 0.85369776680052 15.999 > 57 59 O 0.39697163852530 0.16737478234748 0.70226521384453 15.999 > 59 60 O 0.89697163852530 0.16737478234748 0.70226521384453 15.999 > 59 61 O 0.32216558121196 0.97935269079345 0.36296055119453 15.999 > 61 62 O 0.82216558121196 0.97935269079345 0.36296055119453 15.999 > 61 63 O 0.32532622627924 0.16396300338172 0.41557683067150 15.999 > 63 64 O 0.82532622627924 0.16396300338172 0.41557683067150 15.999 > 63 65 O 0.16666940472038 0.21141343687077 0.60672873624606 15.999 > 65 66 O 0.66666940472038 0.21141343687077 0.60672873624606 15.999 > 65 67 O 0.23782331013504 0.63309589426892 0.65014101998574 15.999 > 67 68 O 0.73782331013504 0.63309589426892 0.65014101998574 15.999 > 67 69 O 0.14399144952154 0.41834004133218 0.70300093479192 15.999 > 69 70 O 0.64399144952154 0.41834004133218 0.70300093479192 15.999 > 69 71 O 0.45343823026722 0.87261726435986 0.33715919835164 15.999 > 71 72 O 0.95343823026722 0.87261726435986 0.33715919835164 15.999 > 71 73 O 0.03578762067413 0.01253212147440 0.29031860192894 15.999 > 73 74 O 0.53578762067413 0.01253212147440 0.29031860192894 15.999 > 73 75 O 0.26217668986496 0.36690410573108 0.34985898001426 15.999 > 75 76 O 0.76217668986496 0.36690410573108 0.34985898001426 15.999 > 75 77 O 0.44803468138824 0.35009724558667 0.60158855448608 15.999 > 77 78 O 0.94803468138824 0.35009724558667 0.60158855448608 15.999 > 77 79 O 0.44803468138824 0.14990275441333 0.10158855448608 15.999 > 79 80 O 0.94803468138824 0.14990275441333 0.10158855448608 15.999 > 79 81 O 0.32216558121196 0.52064730920655 0.86296055119452 15.999 > 81 82 O 0.82216558121196 0.52064730920655 0.86296055119452 15.999 > 81 83 O 0.38945829242968 0.81094585913528 0.64630223319948 15.999 > 83 84 O 0.88945829242968 0.81094585913528 0.64630223319948 15.999 > 83 85 O 0.40246737283575 0.61182235028252 0.59243169442173 15.999 > 85 86 O 0.90246737283575 0.61182235028252 0.59243169442173 15.999 > 85 87 O 0.23782331013504 0.86690410573108 0.15014101998574 15.999 > 87 88 O 0.73782331013504 0.86690410573108 0.15014101998574 15.999 > 87 89 O 0.35600855047846 0.58165995866782 0.29699906520808 15.999 > 89 90 O 0.85600855047846 0.58165995866782 0.29699906520808 15.999 > 89 91 O 0.17783441878804 0.47935269079345 0.13703944880548 15.999 > 91 92 O 0.67783441878804 0.47935269079345 0.13703944880548 15.999 > 91 93 O 0.17467377372076 0.66396300338172 0.08442316932850 15.999 > 93 94 O 0.67467377372076 0.66396300338172 0.08442316932850 15.999 > 93 95 O 0.32532622627924 0.33603699661828 0.91557683067150 15.999 > 95 96 O 0.82532622627924 0.33603699661828 0.91557683067150 15.999 > 95 97 O 0.17467377372076 0.83603699661828 0.58442316932850 15.999 > 97 98 O 0.67467377372076 0.83603699661828 0.58442316932850 15.999 > 97 99 O 0.18377237590319 0.61275760772580 0.29729019309093 15.999 > 99 100 O 0.68377237590319 0.61275760772580 0.29729019309093 15.999 > 99 101 O 0.05196531861176 0.85009724558667 0.89841144551392 15.999 > 101 102 O 0.55196531861176 0.85009724558667 0.89841144551392 15.999 > 101 103 O 0.11054170757032 0.18905414086472 0.35369776680052 15.999 > 103 104 O 0.61054170757032 0.18905414086472 0.35369776680052 15.999 > 103 105 O 0.31622762409681 0.11275760772580 0.20270980690908 15.999 > 105 106 O 0.81622762409681 0.11275760772580 0.20270980690908 15.999 > 105 107 O 0.33333059527962 0.71141343687077 0.89327126375394 15.999 > 107 108 O 0.83333059527962 0.71141343687077 0.89327126375394 15.999 > 107 109 O 0.09753262716425 0.38817764971748 0.40756830557827 15.999 > 109 110 O 0.59753262716425 0.38817764971748 0.40756830557827 15.999 > 109 111 O 0.09753262716425 0.11182235028252 0.90756830557827 15.999 > 111 112 O 0.59753262716425 0.11182235028252 0.90756830557827 15.999 > 111 113 O 0.04656176973278 0.37261726435986 0.16284080164836 15.999 > 113 114 O 0.54656176973278 0.37261726435986 0.16284080164836 15.999 > 113 115 O 0.46421237932587 0.98746787852560 0.70968139807106 15.999 > 115 116 O 0.96421237932587 0.98746787852560 0.70968139807106 15.999 > 115 117 O 0.26217668986496 0.13309589426892 0.84985898001426 15.999 > 117 118 O 0.76217668986496 0.13309589426892 0.84985898001426 15.999 > 117 119 O 0.31622762409681 0.38724239227420 0.70270980690908 15.999 > 119 120 O 0.81622762409681 0.38724239227420 0.70270980690908 15.999 > 119 121 O 0.10302836147470 0.66737478234748 0.79773478615547 15.999 > 121 122 O 0.60302836147470 0.66737478234748 0.79773478615547 15.999 > 121 123 O 0.45343823026722 0.62738273564014 0.83715919835164 15.999 > 123 124 O 0.95343823026722 0.62738273564014 0.83715919835164 15.999 > 123 125 O 0.33333059527962 0.78858656312923 0.39327126375394 15.999 > 125 126 O 0.83333059527962 0.78858656312923 0.39327126375394 15.999 > 125 127 O 0.04656176973278 0.12738273564014 0.66284080164836 15.999 > 127 128 O 0.54656176973278 0.12738273564014 0.66284080164836 15.999 > 127 129 O 0.35600855047846 0.91834004133218 0.79699906520808 15.999 > 129 130 O 0.85600855047846 0.91834004133218 0.79699906520808 15.999 > 129 131 O 0.16666940472038 0.28858656312923 0.10672873624606 15.999 > 131 132 O 0.66666940472038 0.28858656312923 0.10672873624606 15.999 > 131 133 O 0.03578762067413 0.48746787852560 0.79031860192894 15.999 > 133 134 O 0.53578762067413 0.48746787852560 0.79031860192894 15.999 > 133 135 O 0.39697163852530 0.33262521765252 0.20226521384453 15.999 > 135 136 O 0.89697163852530 0.33262521765252 0.20226521384453 15.999 > 135 137 O 0.46421237932587 0.51253212147440 0.20968139807106 15.999 > 137 138 O 0.96421237932587 0.51253212147440 0.20968139807106 15.999 > 137 139 O 0.17783441878804 0.02064730920654 0.63703944880548 15.999 > 139 140 O 0.67783441878804 0.02064730920654 0.63703944880548 15.999 > 139 141 O 0.14399144952154 0.08165995866782 0.20300093479192 15.999 > 141 142 O 0.64399144952154 0.08165995866782 0.20300093479192 15.999 > 141 143 O 0.10302836147470 0.83262521765252 0.29773478615547 15.999 > 143 144 O 0.60302836147470 0.83262521765252 0.29773478615547 15.999 > 143 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.7407708 0.0000000 0.0114165 0.0000000 2.7444004 0.0000000 0.0114175 0.0000000 2.6921206 -------------------------- Born effective charges -------------------------- 1 Na 1.1980226 -0.0517001 -0.0290967 0.0179065 1.0194946 0.0655150 -0.0083052 0.0274498 1.2236667 2 Na 1.1980226 0.0517001 -0.0290967 -0.0179065 1.0194946 -0.0655150 -0.0083052 -0.0274498 1.2236667 3 Na 1.1980226 0.0517001 -0.0290967 -0.0179065 1.0194946 -0.0655150 -0.0083052 -0.0274498 1.2236667 4 Na 1.1980226 -0.0517001 -0.0290967 0.0179065 1.0194946 0.0655150 -0.0083052 0.0274498 1.2236667 5 Y 3.9092657 -0.2148349 0.0194867 0.2218765 3.6984066 0.0796125 0.0544460 0.0927042 4.7462491 6 Y 3.9092657 0.2148349 0.0194867 -0.2218765 3.6984066 -0.0796125 0.0544460 -0.0927042 4.7462491 7 Y 3.9092657 -0.2148349 0.0194867 0.2218765 3.6984066 0.0796125 0.0544460 0.0927042 4.7462491 8 Y 3.9092657 0.2148349 0.0194867 -0.2218765 3.6984066 -0.0796125 0.0544460 -0.0927042 4.7462491 9 P 3.7031452 0.3464846 0.0405979 -0.0339050 3.9979269 0.6078197 0.3957568 -0.1944448 2.9573120 10 P 3.6828687 -0.3671741 0.2364629 0.0025571 3.8830188 -0.4461662 -0.4393325 0.3270876 2.9638254 11 P 3.6828687 -0.3671741 0.2364629 0.0025571 3.8830188 -0.4461662 -0.4393325 0.3270876 2.9638254 12 P 3.6828687 0.3671741 0.2364629 -0.0025571 3.8830188 0.4461662 -0.4393325 -0.3270876 2.9638254 13 P 3.7602564 0.0015373 -0.3222691 0.1147986 3.7988894 -0.5181850 -0.2408474 0.3609535 2.9935050 14 P 3.8412475 -0.1636580 0.2468039 -0.3417948 4.0214817 0.3670341 0.3964731 -0.1804152 3.0555992 15 P 3.7031452 -0.3464846 0.0405979 0.0339050 3.9979269 -0.6078197 0.3957568 0.1944448 2.9573120 16 P 3.6828687 0.3671741 0.2364629 -0.0025571 3.8830188 0.4461662 -0.4393325 -0.3270876 2.9638254 17 P 3.8412475 -0.1636580 0.2468039 -0.3417948 4.0214817 0.3670341 0.3964731 -0.1804152 3.0555992 18 P 3.7031452 -0.3464846 0.0405979 0.0339050 3.9979269 -0.6078197 0.3957568 0.1944448 2.9573120 19 P 3.7602564 0.0015373 -0.3222691 0.1147986 3.7988894 -0.5181850 -0.2408474 0.3609535 2.9935050 20 P 3.7602564 -0.0015373 -0.3222691 -0.1147986 3.7988894 0.5181850 -0.2408474 -0.3609535 2.9935050 21 P 3.8412475 0.1636580 0.2468039 0.3417948 4.0214817 -0.3670341 0.3964731 0.1804152 3.0555992 22 P 3.7031452 0.3464846 0.0405979 -0.0339050 3.9979269 0.6078197 0.3957568 -0.1944448 2.9573120 23 P 3.7602564 -0.0015373 -0.3222691 -0.1147986 3.7988894 0.5181850 -0.2408474 -0.3609535 2.9935050 24 P 3.8412475 0.1636580 0.2468039 0.3417948 4.0214817 -0.3670341 0.3964731 0.1804152 3.0555992 25 O -1.6855459 -0.2738854 -0.6292896 -0.3405323 -1.3085698 -0.5075259 -0.6080564 -0.3459950 -1.7725031 26 O -1.2009419 0.1246993 -0.2585799 0.1511788 -1.7235031 0.6596933 -0.2647088 0.6729147 -1.8751973 27 O -1.3073226 -0.2138629 -0.3340064 -0.2429852 -1.3088159 -0.4955837 -0.4126338 -0.2674573 -1.8515589 28 O -1.6761063 -0.2655418 0.6757273 -0.3382559 -1.4408549 0.6126228 0.6418882 0.3864461 -1.6940446 29 O -1.2009419 0.1246993 -0.2585799 0.1511788 -1.7235031 0.6596933 -0.2647088 0.6729147 -1.8751973 30 O -1.7209929 0.5186253 -0.4921414 0.5167646 -1.6167540 0.3947437 -0.4741230 0.5117397 -1.4997021 31 O -1.0706310 0.7428824 0.0803957 0.4137353 -3.1836301 0.0226762 0.1302003 0.0283893 -0.9742261 32 O -1.2692895 0.2855407 0.1868072 0.2701661 -1.5919743 -0.5491627 0.2965601 -0.6327269 -1.6626963 33 O -1.6433932 -0.4737174 0.4810128 -0.4243851 -1.6303306 0.4154600 0.4742478 0.5489031 -1.5020186 34 O -1.2127477 -0.0837492 0.1785907 -0.1365728 -1.2577330 0.6174867 0.1844569 0.2535942 -2.0639803 35 O -3.0298860 -0.2449143 -0.4604345 -0.1916257 -1.0470854 -0.0361249 -0.3079695 0.1331761 -1.0260832 36 O -3.0269608 -0.2432849 0.3880775 -0.1557168 -0.9767839 -0.0104092 0.2340391 0.1270652 -1.1336512 37 O -1.2509883 -0.9259534 -0.0081450 -0.7274773 -3.3331832 0.0054088 -0.0520917 0.0480236 -0.8844958 38 O -1.2127477 -0.0837492 0.1785907 -0.1365728 -1.2577330 0.6174867 0.1844569 0.2535942 -2.0639803 39 O -1.6855459 -0.2738854 -0.6292896 -0.3405323 -1.3085698 -0.5075259 -0.6080564 -0.3459950 -1.7725031 40 O -1.6855459 0.2738854 -0.6292896 0.3405323 -1.3085698 0.5075259 -0.6080564 0.3459950 -1.7725031 41 O -1.0706310 -0.7428824 0.0803957 -0.4137353 -3.1836301 -0.0226762 0.1302003 -0.0283893 -0.9742261 42 O -1.2009419 -0.1246993 -0.2585799 -0.1511788 -1.7235031 -0.6596933 -0.2647088 -0.6729147 -1.8751973 43 O -1.3073226 0.2138629 -0.3340064 0.2429852 -1.3088159 0.4955837 -0.4126338 0.2674573 -1.8515589 44 O -1.2127477 0.0837492 0.1785907 0.1365728 -1.2577330 -0.6174867 0.1844569 -0.2535942 -2.0639803 45 O -3.0298860 -0.2449143 -0.4604345 -0.1916257 -1.0470854 -0.0361249 -0.3079695 0.1331761 -1.0260832 46 O -1.0706310 -0.7428824 0.0803957 -0.4137353 -3.1836301 -0.0226762 0.1302003 -0.0283893 -0.9742261 47 O -1.2692895 -0.2855407 0.1868072 -0.2701661 -1.5919743 0.5491627 0.2965601 0.6327269 -1.6626963 48 O -1.2692895 -0.2855407 0.1868072 -0.2701661 -1.5919743 0.5491627 0.2965601 0.6327269 -1.6626963 49 O -1.2692895 0.2855407 0.1868072 0.2701661 -1.5919743 -0.5491627 0.2965601 -0.6327269 -1.6626963 50 O -1.6761063 0.2655418 0.6757273 0.3382559 -1.4408549 -0.6126228 0.6418882 -0.3864461 -1.6940446 51 O -1.6855459 0.2738854 -0.6292896 0.3405323 -1.3085698 0.5075259 -0.6080564 0.3459950 -1.7725031 52 O -1.2009419 -0.1246993 -0.2585799 -0.1511788 -1.7235031 -0.6596933 -0.2647088 -0.6729147 -1.8751973 53 O -1.6761063 -0.2655418 0.6757273 -0.3382559 -1.4408549 0.6126228 0.6418882 0.3864461 -1.6940446 54 O -1.6433932 0.4737174 0.4810128 0.4243851 -1.6303306 -0.4154600 0.4742478 -0.5489031 -1.5020186 55 O -1.3073226 0.2138629 -0.3340064 0.2429852 -1.3088159 0.4955837 -0.4126338 0.2674573 -1.8515589 56 O -1.3073226 -0.2138629 -0.3340064 -0.2429852 -1.3088159 -0.4955837 -0.4126338 -0.2674573 -1.8515589 57 O -3.0269608 0.2432849 0.3880775 0.1557168 -0.9767839 0.0104092 0.2340391 -0.1270652 -1.1336512 58 O -1.2509883 -0.9259534 -0.0081450 -0.7274773 -3.3331832 0.0054088 -0.0520917 0.0480236 -0.8844958 59 O -1.2127477 0.0837492 0.1785907 0.1365728 -1.2577330 -0.6174867 0.1844569 -0.2535942 -2.0639803 60 O -1.6761063 0.2655418 0.6757273 0.3382559 -1.4408549 -0.6126228 0.6418882 -0.3864461 -1.6940446 61 O -1.7209929 -0.5186253 -0.4921414 -0.5167646 -1.6167540 -0.3947437 -0.4741230 -0.5117397 -1.4997021 62 O -3.0269608 0.2432849 0.3880775 0.1557168 -0.9767839 0.0104092 0.2340391 -0.1270652 -1.1336512 63 O -1.6433932 -0.4737174 0.4810128 -0.4243851 -1.6303306 0.4154600 0.4742478 0.5489031 -1.5020186 64 O -3.0269608 -0.2432849 0.3880775 -0.1557168 -0.9767839 -0.0104092 0.2340391 0.1270652 -1.1336512 65 O -3.0298860 0.2449143 -0.4604345 0.1916257 -1.0470854 0.0361249 -0.3079695 -0.1331761 -1.0260832 66 O -1.6433932 0.4737174 0.4810128 0.4243851 -1.6303306 -0.4154600 0.4742478 -0.5489031 -1.5020186 67 O -1.2509883 0.9259534 -0.0081450 0.7274773 -3.3331832 -0.0054088 -0.0520917 -0.0480236 -0.8844958 68 O -1.7209929 -0.5186253 -0.4921414 -0.5167646 -1.6167540 -0.3947437 -0.4741230 -0.5117397 -1.4997021 69 O -1.2509883 0.9259534 -0.0081450 0.7274773 -3.3331832 -0.0054088 -0.0520917 -0.0480236 -0.8844958 70 O -1.0706310 0.7428824 0.0803957 0.4137353 -3.1836301 0.0226762 0.1302003 0.0283893 -0.9742261 71 O -3.0298860 0.2449143 -0.4604345 0.1916257 -1.0470854 0.0361249 -0.3079695 -0.1331761 -1.0260832 72 O -1.7209929 0.5186253 -0.4921414 0.5167646 -1.6167540 0.3947437 -0.4741230 0.5117397 -1.4997021 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) Max drift of fc2: 0.00000000 (zz) 0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 4 5 ] 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: 0.43, Number of G-points: 301, Lambda: 0.07 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/69) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 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 1.788 ( 0.000 0.000 0.000) 0.000 1.816 ( 0.000 0.000 0.000) 0.000 2.147 ( 0.000 0.000 0.000) 0.000 2.361 ( 0.000 0.000 0.000) 0.000 2.378 ( 0.000 0.000 0.000) 0.000 2.426 ( 0.000 0.000 0.000) 0.000 2.639 ( 0.000 0.000 0.000) 0.000 2.658 ( 0.000 0.000 0.000) 0.000 2.724 ( 0.000 0.000 0.000) 0.000 2.896 ( 0.000 0.000 0.000) 0.000 2.974 ( 0.000 0.000 0.000) 0.000 3.114 ( 0.000 0.000 0.000) 0.000 3.122 ( 0.000 0.000 0.000) 0.000 3.150 ( 0.000 0.000 0.000) 0.000 3.219 ( 0.000 0.000 0.000) 0.000 3.242 ( 0.000 0.000 0.000) 0.000 3.387 ( 0.000 0.000 0.000) 0.000 3.488 ( 0.000 0.000 0.000) 0.000 3.605 ( 0.000 0.000 0.000) 0.000 3.633 ( 0.000 0.000 0.000) 0.000 3.643 ( 0.000 0.000 0.000) 0.000 3.680 ( 0.000 0.000 0.000) 0.000 3.707 ( 0.000 0.000 0.000) 0.000 3.864 ( 0.000 0.000 0.000) 0.000 3.867 ( 0.000 0.000 0.000) 0.000 3.879 ( 0.000 0.000 0.000) 0.000 3.937 ( 0.000 0.000 0.000) 0.000 4.001 ( 0.000 0.000 0.000) 0.000 4.164 ( 0.000 0.000 0.000) 0.000 4.200 ( 0.000 0.000 0.000) 0.000 4.376 ( 0.000 0.000 0.000) 0.000 4.454 ( 0.000 0.000 0.000) 0.000 4.458 ( 0.000 0.000 0.000) 0.000 4.693 ( 0.000 0.000 0.000) 0.000 4.725 ( 0.000 0.000 0.000) 0.000 4.863 ( 0.000 0.000 0.000) 0.000 5.061 ( 0.000 0.000 0.000) 0.000 5.088 ( 0.000 0.000 0.000) 0.000 5.124 ( 0.000 0.000 0.000) 0.000 5.193 ( 0.000 0.000 0.000) 0.000 5.221 ( 0.000 0.000 0.000) 0.000 5.287 ( 0.000 0.000 0.000) 0.000 5.379 ( 0.000 0.000 0.000) 0.000 5.415 ( 0.000 0.000 0.000) 0.000 5.416 ( 0.000 0.000 0.000) 0.000 5.533 ( 0.000 0.000 0.000) 0.000 5.589 ( 0.000 0.000 0.000) 0.000 5.737 ( 0.000 0.000 0.000) 0.000 5.781 ( 0.000 0.000 0.000) 0.000 5.786 ( 0.000 0.000 0.000) 0.000 5.989 ( 0.000 0.000 0.000) 0.000 6.020 ( 0.000 0.000 0.000) 0.000 6.091 ( 0.000 0.000 0.000) 0.000 6.108 ( 0.000 0.000 0.000) 0.000 6.203 ( 0.000 0.000 0.000) 0.000 6.341 ( 0.000 0.000 0.000) 0.000 6.342 ( 0.000 0.000 0.000) 0.000 6.365 ( 0.000 0.000 0.000) 0.000 6.396 ( 0.000 0.000 0.000) 0.000 6.467 ( 0.000 0.000 0.000) 0.000 6.609 ( 0.000 0.000 0.000) 0.000 6.726 ( 0.000 0.000 0.000) 0.000 6.747 ( 0.000 0.000 0.000) 0.000 6.858 ( 0.000 0.000 0.000) 0.000 6.877 ( 0.000 0.000 0.000) 0.000 6.901 ( 0.000 0.000 0.000) 0.000 7.051 ( 0.000 0.000 0.000) 0.000 7.258 ( 0.000 0.000 0.000) 0.000 7.267 ( 0.000 0.000 0.000) 0.000 7.278 ( 0.000 0.000 0.000) 0.000 7.385 ( 0.000 0.000 0.000) 0.000 7.534 ( 0.000 0.000 0.000) 0.000 7.602 ( 0.000 0.000 0.000) 0.000 8.533 ( 0.000 0.000 0.000) 0.000 8.778 ( 0.000 0.000 0.000) 0.000 8.816 ( 0.000 0.000 0.000) 0.000 8.887 ( 0.000 0.000 0.000) 0.000 8.993 ( 0.000 0.000 0.000) 0.000 8.998 ( 0.000 0.000 0.000) 0.000 9.020 ( 0.000 0.000 0.000) 0.000 9.233 ( 0.000 0.000 0.000) 0.000 9.234 ( 0.000 0.000 0.000) 0.000 9.242 ( 0.000 0.000 0.000) 0.000 9.334 ( 0.000 0.000 0.000) 0.000 9.369 ( 0.000 0.000 0.000) 0.000 9.400 ( 0.000 0.000 0.000) 0.000 9.439 ( 0.000 0.000 0.000) 0.000 9.448 ( 0.000 0.000 0.000) 0.000 9.702 ( 0.000 0.000 0.000) 0.000 9.774 ( 0.000 0.000 0.000) 0.000 10.173 ( 0.000 0.000 0.000) 0.000 10.183 ( 0.000 0.000 0.000) 0.000 10.378 ( 0.000 0.000 0.000) 0.000 10.406 ( 0.000 0.000 0.000) 0.000 10.664 ( 0.000 0.000 0.000) 0.000 10.772 ( 0.000 0.000 0.000) 0.000 10.783 ( 0.000 0.000 0.000) 0.000 10.814 ( 0.000 0.000 0.000) 0.000 11.000 ( 0.000 0.000 0.000) 0.000 11.010 ( 0.000 0.000 0.000) 0.000 11.155 ( 0.000 0.000 0.000) 0.000 11.202 ( 0.000 0.000 0.000) 0.000 11.228 ( 0.000 0.000 0.000) 0.000 11.630 ( 0.000 0.000 0.000) 0.000 11.644 ( 0.000 0.000 0.000) 0.000 11.863 ( 0.000 0.000 0.000) 0.000 12.156 ( 0.000 0.000 0.000) 0.000 12.224 ( 0.000 0.000 0.000) 0.000 12.318 ( 0.000 0.000 0.000) 0.000 12.370 ( 0.000 0.000 0.000) 0.000 12.407 ( 0.000 0.000 0.000) 0.000 12.411 ( 0.000 0.000 0.000) 0.000 12.430 ( 0.000 0.000 0.000) 0.000 12.542 ( 0.000 0.000 0.000) 0.000 12.579 ( 0.000 0.000 0.000) 0.000 12.946 ( 0.000 0.000 0.000) 0.000 12.993 ( 0.000 0.000 0.000) 0.000 13.221 ( 0.000 0.000 0.000) 0.000 13.330 ( 0.000 0.000 0.000) 0.000 13.352 ( 0.000 0.000 0.000) 0.000 13.436 ( 0.000 0.000 0.000) 0.000 14.007 ( 0.000 0.000 0.000) 0.000 14.113 ( 0.000 0.000 0.000) 0.000 14.218 ( 0.000 0.000 0.000) 0.000 14.244 ( 0.000 0.000 0.000) 0.000 14.385 ( 0.000 0.000 0.000) 0.000 14.456 ( 0.000 0.000 0.000) 0.000 14.583 ( 0.000 0.000 0.000) 0.000 14.615 ( 0.000 0.000 0.000) 0.000 14.849 ( 0.000 0.000 0.000) 0.000 14.901 ( 0.000 0.000 0.000) 0.000 15.011 ( 0.000 0.000 0.000) 0.000 15.037 ( 0.000 0.000 0.000) 0.000 15.094 ( 0.000 0.000 0.000) 0.000 15.196 ( 0.000 0.000 0.000) 0.000 15.753 ( 0.000 0.000 0.000) 0.000 15.771 ( 0.000 0.000 0.000) 0.000 15.838 ( 0.000 0.000 0.000) 0.000 15.861 ( 0.000 0.000 0.000) 0.000 15.969 ( 0.000 0.000 0.000) 0.000 16.347 ( 0.000 0.000 0.000) 0.000 16.501 ( 0.000 0.000 0.000) 0.000 16.511 ( 0.000 0.000 0.000) 0.000 16.621 ( 0.000 0.000 0.000) 0.000 16.635 ( 0.000 0.000 0.000) 0.000 17.282 ( 0.000 0.000 0.000) 0.000 17.339 ( 0.000 0.000 0.000) 0.000 17.343 ( 0.000 0.000 0.000) 0.000 17.402 ( 0.000 0.000 0.000) 0.000 19.657 ( 0.000 0.000 0.000) 0.000 19.919 ( 0.000 0.000 0.000) 0.000 20.052 ( 0.000 0.000 0.000) 0.000 20.073 ( 0.000 0.000 0.000) 0.000 20.512 ( 0.000 0.000 0.000) 0.000 20.569 ( 0.000 0.000 0.000) 0.000 20.799 ( 0.000 0.000 0.000) 0.000 20.875 ( 0.000 0.000 0.000) 0.000 21.853 ( 0.000 0.000 0.000) 0.000 21.948 ( 0.000 0.000 0.000) 0.000 22.058 ( 0.000 0.000 0.000) 0.000 22.153 ( 0.000 0.000 0.000) 0.000 23.081 ( 0.000 0.000 0.000) 0.000 23.237 ( 0.000 0.000 0.000) 0.000 23.317 ( 0.000 0.000 0.000) 0.000 23.351 ( 0.000 0.000 0.000) 0.000 26.544 ( 0.000 0.000 0.000) 0.000 26.556 ( 0.000 0.000 0.000) 0.000 26.558 ( 0.000 0.000 0.000) 0.000 26.580 ( 0.000 0.000 0.000) 0.000 29.125 ( 0.000 0.000 0.000) 0.000 29.210 ( 0.000 0.000 0.000) 0.000 29.292 ( 0.000 0.000 0.000) 0.000 29.631 ( 0.000 0.000 0.000) 0.000 29.639 ( 0.000 0.000 0.000) 0.000 29.870 ( 0.000 0.000 0.000) 0.000 30.263 ( 0.000 0.000 0.000) 0.000 30.705 ( 0.000 0.000 0.000) 0.000 30.728 ( 0.000 0.000 0.000) 0.000 30.885 ( 0.000 0.000 0.000) 0.000 31.027 ( 0.000 0.000 0.000) 0.000 31.039 ( 0.000 0.000 0.000) 0.000 31.494 ( 0.000 0.000 0.000) 0.000 31.505 ( 0.000 0.000 0.000) 0.000 31.820 ( 0.000 0.000 0.000) 0.000 32.121 ( 0.000 0.000 0.000) 0.000 32.192 ( 0.000 0.000 0.000) 0.000 32.302 ( 0.000 0.000 0.000) 0.000 32.318 ( 0.000 0.000 0.000) 0.000 32.532 ( 0.000 0.000 0.000) 0.000 32.532 ( 0.000 0.000 0.000) 0.000 32.559 ( 0.000 0.000 0.000) 0.000 32.772 ( 0.000 0.000 0.000) 0.000 33.468 ( 0.000 0.000 0.000) 0.000 33.599 ( 0.000 0.000 0.000) 0.000 34.218 ( 0.000 0.000 0.000) 0.000 34.269 ( 0.000 0.000 0.000) 0.000 34.633 ( 0.000 0.000 0.000) 0.000 34.885 ( 0.000 0.000 0.000) 0.000 34.925 ( 0.000 0.000 0.000) 0.000 34.971 ( 0.000 0.000 0.000) 0.000 34.978 ( 0.000 0.000 0.000) 0.000 35.586 ( 0.000 0.000 0.000) 0.000 35.621 ( 0.000 0.000 0.000) 0.000 35.672 ( 0.000 0.000 0.000) 0.000 35.722 ( 0.000 0.000 0.000) 0.000 35.799 ( 0.000 0.000 0.000) 0.000 35.920 ( 0.000 0.000 0.000) 0.000 36.017 ( 0.000 0.000 0.000) 0.000 36.225 ( 0.000 0.000 0.000) 0.000 36.597 ( 0.000 0.000 0.000) 0.000 36.605 ( 0.000 0.000 0.000) 0.000 38.291 ( 0.000 0.000 0.000) 0.000 38.971 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/69) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.582 ( 29.430 0.000 10.056) 31.100 0.639 ( 22.367 0.000 26.070) 34.350 1.085 ( 49.980 0.000 25.288) 56.014 1.875 ( 10.350 0.000 -3.093) 10.803 1.916 ( -1.404 0.000 12.650) 12.728 2.120 ( -2.209 0.000 4.934) 5.406 2.357 ( -2.538 0.000 3.308) 4.169 2.410 ( 6.183 0.000 -2.094) 6.528 2.487 ( 7.198 0.000 7.252) 10.218 2.563 ( -5.176 0.000 -2.259) 5.647 2.693 ( -2.189 0.000 0.766) 2.319 2.734 ( -0.731 0.000 6.522) 6.562 2.914 ( -4.073 0.000 3.951) 5.674 2.916 ( -2.422 0.000 -1.979) 3.128 3.055 ( -5.757 0.000 -8.224) 10.039 3.126 ( -0.571 0.000 2.963) 3.018 3.181 ( 1.441 0.000 -2.790) 3.140 3.270 ( -9.700 0.000 -2.191) 9.944 3.326 ( 8.330 0.000 2.167) 8.607 3.329 ( 5.896 0.000 -0.121) 5.897 3.481 ( -9.084 0.000 3.073) 9.590 3.569 ( 1.735 0.000 -1.591) 2.354 3.656 ( -2.493 0.000 -0.204) 2.501 3.677 ( -3.140 0.000 -6.827) 7.514 3.713 ( 15.185 0.000 0.241) 15.187 3.718 ( 5.578 0.000 0.546) 5.605 3.848 ( 0.300 0.000 -3.146) 3.160 3.852 ( 14.064 0.000 -2.366) 14.262 3.947 ( 0.883 0.000 2.336) 2.498 4.028 ( 1.377 0.000 -2.003) 2.431 4.128 ( -1.642 0.000 4.532) 4.821 4.199 ( 10.747 0.000 8.534) 13.723 4.300 ( 2.982 0.000 -1.296) 3.251 4.377 ( 4.939 0.000 0.231) 4.944 4.442 ( -1.172 0.000 -0.164) 1.184 4.531 ( 2.276 0.000 -4.537) 5.076 4.641 ( -2.395 0.000 -1.210) 2.683 4.774 ( 4.419 0.000 -2.217) 4.943 4.810 ( -8.485 0.000 -2.751) 8.920 4.972 ( 0.378 0.000 -0.348) 0.513 5.073 ( -2.397 0.000 -3.093) 3.913 5.144 ( -3.700 0.000 2.547) 4.492 5.144 ( -2.847 0.000 2.516) 3.800 5.268 ( -4.272 0.000 -5.251) 6.770 5.324 ( 12.559 0.000 -8.769) 15.318 5.390 ( -1.356 0.000 -0.895) 1.625 5.403 ( -0.870 0.000 3.124) 3.243 5.493 ( -2.198 0.000 -8.354) 8.638 5.542 ( 1.634 0.000 -5.569) 5.804 5.610 ( 5.604 0.000 -0.763) 5.656 5.709 ( -1.837 0.000 -2.477) 3.084 5.793 ( -0.771 0.000 2.647) 2.757 5.920 ( 9.061 0.000 -4.913) 10.307 5.984 ( 2.338 0.000 -4.513) 5.083 6.024 ( 0.540 0.000 0.034) 0.541 6.065 ( -2.775 0.000 -4.623) 5.392 6.100 ( 1.117 0.000 -0.852) 1.405 6.155 ( 4.741 0.000 -6.624) 8.146 6.259 ( -2.166 0.000 -5.962) 6.344 6.387 ( -1.495 0.000 2.671) 3.061 6.449 ( 0.416 0.000 3.858) 3.880 6.523 ( 4.292 0.000 3.206) 5.357 6.584 ( -2.727 0.000 0.152) 2.731 6.603 ( -5.505 0.000 4.326) 7.001 6.678 ( -2.615 0.000 -3.616) 4.463 6.854 ( -3.314 0.000 4.312) 5.438 6.882 ( -0.581 0.000 0.746) 0.946 6.922 ( -0.486 0.000 4.303) 4.330 6.971 ( -14.631 0.000 15.646) 21.421 7.157 ( 2.701 0.000 4.675) 5.399 7.235 ( -5.639 0.000 2.762) 6.279 7.282 ( -1.306 0.000 3.703) 3.926 7.393 ( -0.366 0.000 1.992) 2.025 7.444 ( -22.599 0.000 29.414) 37.093 7.495 ( -5.645 0.000 0.342) 5.655 7.614 ( 0.825 0.000 1.212) 1.466 8.465 ( -8.995 0.000 0.475) 9.007 8.622 ( -18.375 0.000 -2.868) 18.597 8.781 ( -9.134 0.000 -1.498) 9.256 8.796 ( -12.286 0.000 2.291) 12.497 8.902 ( -3.945 0.000 2.191) 4.513 8.982 ( 0.494 0.000 -2.767) 2.811 9.092 ( 5.592 0.000 -0.923) 5.668 9.170 ( -2.715 0.000 -3.469) 4.405 9.253 ( 1.190 0.000 0.248) 1.215 9.339 ( 7.822 0.000 -0.139) 7.824 9.349 ( 0.088 0.000 2.970) 2.972 9.377 ( 3.126 0.000 -1.965) 3.692 9.394 ( 0.598 0.000 -1.163) 1.308 9.469 ( 3.319 0.000 -0.519) 3.359 9.538 ( 7.558 0.000 0.021) 7.558 9.742 ( 3.679 0.000 0.645) 3.735 9.800 ( 1.573 0.000 2.101) 2.624 10.128 ( -5.101 0.000 -0.151) 5.103 10.185 ( -1.220 0.000 0.850) 1.487 10.305 ( -8.708 0.000 -0.222) 8.711 10.397 ( -6.530 0.000 2.292) 6.921 10.572 ( -9.703 0.000 -1.037) 9.759 10.696 ( -6.329 0.000 -1.606) 6.530 10.701 ( -10.947 0.000 -0.785) 10.975 10.789 ( -1.846 0.000 1.075) 2.136 10.871 ( -7.991 0.000 -5.476) 9.687 11.025 ( -2.366 0.000 2.625) 3.534 11.111 ( -3.645 0.000 -1.611) 3.985 11.338 ( 13.322 0.000 0.060) 13.322 11.421 ( 10.858 0.000 -1.622) 10.979 11.629 ( 0.392 0.000 0.584) 0.704 11.644 ( 0.838 0.000 -0.561) 1.008 11.911 ( 5.166 0.000 0.121) 5.168 12.145 ( -0.959 0.000 -0.061) 0.961 12.250 ( 2.420 0.000 -0.483) 2.468 12.269 ( -4.998 0.000 -0.775) 5.058 12.345 ( -1.304 0.000 0.044) 1.305 12.407 ( -0.480 0.000 -0.253) 0.543 12.417 ( 0.569 0.000 0.638) 0.855 12.475 ( 3.874 0.000 1.667) 4.217 12.549 ( 1.190 0.000 -1.481) 1.900 12.621 ( 4.266 0.000 -0.047) 4.266 12.966 ( 1.668 0.000 0.641) 1.787 12.986 ( -0.757 0.000 -0.085) 0.762 13.228 ( 1.066 0.000 -0.266) 1.099 13.315 ( -1.376 0.000 -0.057) 1.377 13.537 ( 13.082 0.000 -0.253) 13.084 13.937 ( 12.808 0.000 -15.199) 19.876 13.976 ( -5.562 0.000 -0.438) 5.579 14.027 ( -9.956 0.000 -0.068) 9.957 14.231 ( 2.397 0.000 -0.261) 2.411 14.248 ( 4.036 0.000 0.725) 4.100 14.378 ( -4.541 0.000 0.885) 4.627 14.470 ( -3.250 0.000 -0.164) 3.254 14.655 ( 7.755 0.000 0.374) 7.764 14.761 ( -1.501 0.000 0.783) 1.693 14.924 ( 2.786 0.000 -0.047) 2.787 14.976 ( 10.316 0.000 0.995) 10.364 15.112 ( 11.191 0.000 0.275) 11.194 15.175 ( 7.879 0.000 0.384) 7.889 15.275 ( 12.803 0.000 -3.572) 13.291 15.540 ( 6.024 0.000 -9.027) 10.852 15.714 ( -5.120 0.000 -0.205) 5.125 15.733 ( -4.101 0.000 1.328) 4.311 15.808 ( -0.922 0.000 -0.702) 1.158 15.970 ( -1.732 0.000 2.161) 2.769 16.042 ( 14.910 0.000 -14.455) 20.767 16.334 ( -3.537 0.000 -4.045) 5.373 16.530 ( 3.472 0.000 0.551) 3.515 16.549 ( 2.377 0.000 1.733) 2.941 16.632 ( 3.214 0.000 -2.157) 3.871 16.876 ( 15.939 0.000 -28.063) 32.274 17.287 ( -0.049 0.000 0.893) 0.894 17.337 ( 0.170 0.000 -0.250) 0.302 17.347 ( 0.032 0.000 -0.222) 0.224 17.415 ( 1.550 0.000 -0.010) 1.550 19.681 ( 2.001 0.000 1.285) 2.378 19.944 ( 4.456 0.000 -1.895) 4.842 20.045 ( -1.081 0.000 0.620) 1.246 20.085 ( 2.431 0.000 -1.372) 2.792 20.478 ( -3.737 0.000 -0.593) 3.783 20.558 ( -1.971 0.000 0.695) 2.090 20.825 ( -1.026 0.000 -0.574) 1.176 20.871 ( -0.645 0.000 0.084) 0.650 21.906 ( 5.042 0.000 2.031) 5.435 22.022 ( -3.521 0.000 6.946) 7.787 22.104 ( 5.090 0.000 -0.058) 5.090 22.167 ( 2.291 0.000 -0.567) 2.360 23.040 ( -4.462 0.000 -0.937) 4.560 23.198 ( -3.106 0.000 -2.825) 4.199 23.241 ( -10.496 0.000 2.715) 10.842 23.320 ( -4.295 0.000 0.271) 4.303 26.611 ( 8.594 0.000 0.034) 8.594 26.651 ( 12.493 0.000 -0.404) 12.500 26.674 ( 13.411 0.000 0.706) 13.429 27.735 ( 47.806 0.000 -64.733) 80.472 28.973 ( -17.405 0.000 0.611) 17.415 29.085 ( -17.711 0.000 0.564) 17.720 29.196 ( -10.208 0.000 1.780) 10.362 29.496 ( -13.791 0.000 -1.325) 13.855 29.831 ( 17.218 0.000 0.510) 17.226 29.987 ( 13.897 0.000 -1.646) 13.995 30.384 ( 9.526 0.000 3.314) 10.086 30.748 ( 2.272 0.000 1.050) 2.503 30.756 ( 0.728 0.000 -1.145) 1.357 30.892 ( 2.159 0.000 -1.499) 2.628 31.087 ( 5.840 0.000 0.028) 5.840 31.455 ( 23.488 0.000 -36.224) 43.172 31.519 ( 7.439 0.000 -8.422) 11.237 31.526 ( 2.268 0.000 0.583) 2.342 31.871 ( 3.007 0.000 2.704) 4.044 32.029 ( -8.026 0.000 1.343) 8.137 32.103 ( -8.772 0.000 -1.473) 8.895 32.254 ( -6.578 0.000 -4.825) 8.158 32.351 ( -2.739 0.000 -1.790) 3.272 32.533 ( 8.660 0.000 -1.126) 8.733 32.618 ( 8.590 0.000 0.980) 8.646 32.725 ( 14.374 0.000 -1.484) 14.451 32.882 ( 10.992 0.000 0.039) 10.992 33.444 ( -4.276 0.000 -0.739) 4.339 33.595 ( -2.218 0.000 2.427) 3.288 34.148 ( -4.478 0.000 -5.181) 6.849 34.215 ( -4.460 0.000 -3.290) 5.542 34.289 ( -13.736 0.000 -32.244) 35.048 34.920 ( -0.363 0.000 -0.382) 0.526 34.987 ( -0.009 0.000 2.274) 2.274 35.000 ( 3.085 0.000 5.258) 6.096 35.081 ( -0.410 0.000 2.053) 2.094 35.641 ( 2.583 0.000 -0.061) 2.584 35.715 ( 3.848 0.000 1.961) 4.319 35.720 ( 7.888 0.000 -12.908) 15.127 35.839 ( 1.501 0.000 4.909) 5.133 35.841 ( 9.475 0.000 -10.908) 14.449 35.941 ( 0.570 0.000 3.088) 3.140 36.221 ( -2.380 0.000 27.408) 27.511 36.536 ( -7.853 0.000 9.127) 12.041 36.647 ( 6.581 0.000 1.292) 6.707 37.665 ( -48.737 0.000 69.907) 85.219 38.209 ( -6.363 0.000 -5.469) 8.391 38.888 ( -9.413 0.000 -1.482) 9.529 ======================= Grid point 2 (3/69) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.113 ( 24.199 0.000 9.313) 25.930 1.265 ( 21.320 0.000 23.959) 32.071 1.912 ( 1.371 0.000 5.195) 5.373 2.058 ( 36.708 0.000 18.989) 41.329 2.079 ( 16.811 0.000 1.553) 16.882 2.324 ( 0.062 0.000 -11.751) 11.751 2.360 ( -2.199 0.000 4.632) 5.127 2.386 ( 11.196 0.000 19.066) 22.110 2.643 ( -3.500 0.000 4.958) 6.069 2.729 ( 5.325 0.000 0.710) 5.372 2.746 ( 8.495 0.000 12.707) 15.285 2.816 ( 4.176 0.000 8.985) 9.908 2.839 ( 1.791 0.000 -11.577) 11.715 2.924 ( 2.077 0.000 -0.419) 2.119 2.943 ( -2.035 0.000 -2.894) 3.538 3.038 ( -7.385 0.000 0.332) 7.392 3.105 ( -2.869 0.000 4.998) 5.763 3.264 ( -2.047 0.000 9.135) 9.362 3.371 ( 0.697 0.000 -0.186) 0.721 3.379 ( -0.865 0.000 6.290) 6.350 3.442 ( 1.399 0.000 3.509) 3.777 3.576 ( -3.952 0.000 -2.560) 4.709 3.607 ( 1.493 0.000 -4.440) 4.684 3.647 ( -7.607 0.000 -9.703) 12.330 3.716 ( 6.193 0.000 -5.315) 8.161 3.807 ( 0.631 0.000 -4.185) 4.232 3.911 ( 9.703 0.000 -12.610) 15.911 3.923 ( 0.453 0.000 4.175) 4.199 4.022 ( 0.624 0.000 3.235) 3.295 4.052 ( 13.081 0.000 1.343) 13.150 4.195 ( -0.027 0.000 6.248) 6.248 4.288 ( 6.664 0.000 -8.769) 11.014 4.404 ( 2.517 0.000 -1.829) 3.111 4.455 ( 1.869 0.000 9.488) 9.671 4.513 ( 6.460 0.000 2.135) 6.803 4.518 ( 3.882 0.000 -5.359) 6.617 4.612 ( -0.049 0.000 1.146) 1.147 4.758 ( 0.115 0.000 7.188) 7.189 4.823 ( 10.886 0.000 -8.124) 13.583 4.967 ( -0.532 0.000 -2.332) 2.392 5.015 ( -2.348 0.000 -0.753) 2.466 5.069 ( -10.284 0.000 -3.891) 10.996 5.119 ( -2.112 0.000 0.088) 2.114 5.128 ( -2.665 0.000 1.723) 3.174 5.327 ( -1.701 0.000 -11.124) 11.253 5.338 ( 1.167 0.000 -5.611) 5.732 5.373 ( -2.980 0.000 1.661) 3.412 5.452 ( 3.614 0.000 -13.684) 14.153 5.503 ( 6.283 0.000 1.558) 6.473 5.643 ( -4.927 0.000 -3.158) 5.852 5.723 ( 7.000 0.000 0.433) 7.013 5.823 ( -0.189 0.000 3.918) 3.922 5.915 ( -6.023 0.000 1.012) 6.107 5.953 ( -1.566 0.000 -6.026) 6.226 5.975 ( 4.990 0.000 -6.570) 8.250 6.030 ( 0.730 0.000 -0.807) 1.088 6.146 ( -0.228 0.000 -3.202) 3.210 6.181 ( 5.723 0.000 -3.922) 6.938 6.188 ( 4.430 0.000 -4.150) 6.070 6.401 ( 3.136 0.000 1.491) 3.472 6.505 ( -0.204 0.000 5.404) 5.408 6.539 ( -2.773 0.000 -1.077) 2.975 6.595 ( 1.307 0.000 2.635) 2.941 6.599 ( -3.424 0.000 -0.577) 3.472 6.622 ( 1.133 0.000 3.987) 4.145 6.855 ( -1.574 0.000 -2.110) 2.633 6.858 ( -5.031 0.000 7.505) 9.035 6.894 ( -10.526 0.000 6.590) 12.418 6.954 ( -4.773 0.000 4.033) 6.249 7.141 ( -8.689 0.000 3.121) 9.233 7.214 ( 3.216 0.000 -1.186) 3.427 7.279 ( -4.645 0.000 2.774) 5.411 7.396 ( -5.896 0.000 -0.591) 5.925 7.399 ( -2.347 0.000 1.242) 2.655 7.453 ( -5.987 0.000 10.686) 12.248 7.619 ( -2.917 0.000 0.816) 3.029 8.266 ( -20.360 0.000 -4.767) 20.911 8.289 ( -13.695 0.000 0.776) 13.717 8.536 ( -16.000 0.000 -3.474) 16.373 8.610 ( -14.292 0.000 2.461) 14.503 8.926 ( 0.778 0.000 3.220) 3.312 8.961 ( 0.024 0.000 -1.106) 1.106 9.073 ( -1.573 0.000 -5.761) 5.972 9.174 ( 5.507 0.000 -0.055) 5.507 9.279 ( 1.737 0.000 -0.086) 1.739 9.384 ( 2.956 0.000 -1.069) 3.143 9.386 ( 1.816 0.000 -1.597) 2.418 9.446 ( 4.966 0.000 2.836) 5.718 9.463 ( 6.625 0.000 -0.486) 6.643 9.506 ( 2.390 0.000 -1.303) 2.722 9.642 ( 6.390 0.000 -1.542) 6.574 9.790 ( 0.973 0.000 0.502) 1.095 9.872 ( 3.115 0.000 3.886) 4.980 10.011 ( -9.543 0.000 -0.218) 9.546 10.147 ( -5.285 0.000 0.313) 5.294 10.149 ( -12.234 0.000 1.831) 12.371 10.273 ( -11.536 0.000 1.802) 11.676 10.391 ( -10.190 0.000 -1.573) 10.311 10.547 ( -7.752 0.000 1.520) 7.900 10.561 ( -7.451 0.000 -2.712) 7.929 10.674 ( -8.294 0.000 -5.167) 9.772 10.753 ( -4.118 0.000 0.986) 4.234 10.990 ( -5.394 0.000 1.643) 5.639 11.025 ( -4.779 0.000 -1.360) 4.969 11.555 ( 13.919 0.000 0.004) 13.919 11.594 ( 12.011 0.000 -0.582) 12.025 11.665 ( 3.221 0.000 0.319) 3.237 11.675 ( 3.990 0.000 -0.311) 4.002 12.003 ( 5.638 0.000 0.735) 5.685 12.124 ( -1.580 0.000 -0.794) 1.769 12.184 ( -4.570 0.000 0.461) 4.593 12.247 ( -1.903 0.000 0.259) 1.921 12.380 ( 4.605 0.000 0.348) 4.619 12.393 ( -0.754 0.000 -0.824) 1.117 12.441 ( 2.241 0.000 0.418) 2.280 12.528 ( -0.439 0.000 -2.319) 2.360 12.576 ( 4.991 0.000 2.226) 5.465 12.688 ( 4.060 0.000 -0.084) 4.061 12.973 ( -1.117 0.000 0.346) 1.170 12.994 ( 0.729 0.000 0.015) 0.729 13.251 ( 2.596 0.000 -0.394) 2.626 13.306 ( 0.529 0.000 0.395) 0.661 13.797 ( 13.773 0.000 1.118) 13.818 13.840 ( -9.718 0.000 0.496) 9.730 13.874 ( -4.537 0.000 0.231) 4.543 13.999 ( 10.245 0.000 -6.679) 12.230 14.301 ( 1.692 0.000 -0.080) 1.693 14.306 ( 0.592 0.000 0.932) 1.104 14.327 ( 3.144 0.000 -0.087) 3.145 14.391 ( -5.087 0.000 -0.009) 5.087 14.751 ( -1.797 0.000 1.167) 2.143 14.783 ( 5.594 0.000 -0.778) 5.647 14.983 ( 5.696 0.000 -0.240) 5.701 15.148 ( 9.244 0.000 0.800) 9.278 15.295 ( 7.449 0.000 -0.244) 7.453 15.299 ( 11.040 0.000 0.179) 11.042 15.481 ( 15.890 0.000 -2.257) 16.050 15.540 ( 1.202 0.000 -0.654) 1.368 15.648 ( -2.750 0.000 0.183) 2.756 15.649 ( -5.933 0.000 -0.193) 5.936 15.862 ( 6.335 0.000 1.812) 6.589 15.964 ( -2.098 0.000 2.860) 3.546 16.077 ( 4.687 0.000 -7.503) 8.847 16.217 ( -2.716 0.000 -5.907) 6.502 16.576 ( 0.846 0.000 0.565) 1.017 16.622 ( 3.269 0.000 2.798) 4.303 16.673 ( 4.727 0.000 -1.990) 5.129 16.787 ( 1.344 0.000 -10.794) 10.878 17.296 ( -0.102 0.000 0.927) 0.932 17.345 ( 1.230 0.000 -0.310) 1.268 17.345 ( -0.243 0.000 0.329) 0.409 17.441 ( 1.572 0.000 -0.051) 1.573 19.753 ( 5.379 0.000 1.320) 5.538 19.996 ( 5.231 0.000 -4.070) 6.627 20.054 ( 2.044 0.000 1.658) 2.632 20.116 ( 4.277 0.000 -2.443) 4.925 20.393 ( -6.292 0.000 -0.200) 6.295 20.520 ( -4.392 0.000 0.954) 4.495 20.786 ( -2.296 0.000 -1.737) 2.879 20.853 ( -1.718 0.000 -0.205) 1.730 22.037 ( 8.075 0.000 2.214) 8.373 22.072 ( 2.931 0.000 2.347) 3.755 22.206 ( 8.105 0.000 0.150) 8.106 22.217 ( 5.422 0.000 -0.765) 5.475 22.930 ( -7.688 0.000 -1.347) 7.805 23.067 ( -10.000 0.000 -0.696) 10.025 23.109 ( -9.651 0.000 1.522) 9.770 23.222 ( -8.467 0.000 0.077) 8.468 26.806 ( 15.690 0.000 0.638) 15.703 26.908 ( 19.980 0.000 -1.357) 20.026 26.963 ( 21.666 0.000 2.769) 21.843 27.760 ( 25.077 0.000 -30.889) 39.786 28.669 ( -21.687 0.000 0.951) 21.708 28.774 ( -20.740 0.000 -0.884) 20.759 29.028 ( -15.103 0.000 2.165) 15.258 29.229 ( -17.491 0.000 -2.234) 17.633 30.107 ( 16.663 0.000 1.074) 16.698 30.199 ( 14.676 0.000 -1.672) 14.771 30.549 ( 6.698 0.000 2.333) 7.092 30.757 ( 0.908 0.000 -0.979) 1.336 30.834 ( 6.565 0.000 2.138) 6.905 30.921 ( 4.542 0.000 -2.339) 5.109 31.208 ( 9.420 0.000 -0.221) 9.423 31.401 ( 8.396 0.000 -17.418) 19.336 31.522 ( -0.514 0.000 -1.114) 1.227 31.572 ( -0.382 0.000 2.991) 3.015 31.883 ( -2.396 0.000 0.950) 2.578 31.940 ( -8.568 0.000 -1.991) 8.797 31.977 ( -4.559 0.000 1.086) 4.687 32.136 ( -3.781 0.000 -1.699) 4.145 32.287 ( 3.129 0.000 -2.610) 4.075 32.723 ( 12.910 0.000 1.065) 12.954 32.783 ( 9.509 0.000 1.604) 9.643 32.881 ( 8.531 0.000 -6.511) 10.732 33.066 ( 12.806 0.000 -0.782) 12.830 33.311 ( -3.449 0.000 -9.987) 10.566 33.588 ( -3.448 0.000 4.339) 5.542 33.797 ( -8.869 0.000 -17.322) 19.460 33.991 ( -6.898 0.000 -6.041) 9.170 34.067 ( -7.939 0.000 -5.330) 9.562 34.904 ( -0.805 0.000 -0.898) 1.206 35.004 ( -0.909 0.000 1.565) 1.810 35.095 ( 2.850 0.000 3.334) 4.386 35.119 ( 1.001 0.000 4.098) 4.218 35.680 ( 3.560 0.000 -9.522) 10.166 35.693 ( 3.735 0.000 0.076) 3.736 35.816 ( 6.439 0.000 0.431) 6.453 35.867 ( 5.404 0.000 -5.487) 7.702 35.948 ( 2.053 0.000 8.867) 9.102 36.021 ( 2.441 0.000 8.102) 8.462 36.356 ( -6.183 0.000 9.771) 11.563 36.515 ( -3.345 0.000 2.593) 4.232 36.890 ( 10.417 0.000 14.397) 17.771 37.707 ( -20.570 0.000 32.544) 38.500 37.986 ( -10.871 0.000 -9.604) 14.505 38.655 ( -16.405 0.000 -3.631) 16.802 ======================= Grid point 3 (4/69) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 18.195 0.000 7.160) 19.553 1.809 ( 17.979 0.000 17.425) 25.038 2.135 ( 15.813 0.000 7.133) 17.347 2.225 ( 1.315 0.000 -2.936) 3.217 2.340 ( 1.603 0.000 4.093) 4.396 2.390 ( 0.915 0.000 4.791) 4.878 2.534 ( 0.012 0.000 -9.115) 9.115 2.594 ( 12.252 0.000 11.361) 16.709 2.654 ( -8.321 0.000 -6.697) 10.681 2.720 ( 5.757 0.000 5.570) 8.011 2.824 ( 0.423 0.000 -6.850) 6.863 2.835 ( -0.873 0.000 -1.545) 1.775 2.839 ( 4.483 0.000 1.619) 4.766 2.955 ( 2.463 0.000 5.943) 6.433 3.106 ( 7.135 0.000 12.406) 14.311 3.112 ( 0.856 0.000 1.593) 1.808 3.270 ( -15.483 0.000 -3.410) 15.854 3.308 ( 8.230 0.000 9.404) 12.496 3.332 ( 2.063 0.000 14.629) 14.773 3.410 ( -3.833 0.000 -9.193) 9.960 3.464 ( 7.796 0.000 -3.272) 8.455 3.528 ( 5.673 0.000 15.644) 16.641 3.553 ( 2.927 0.000 -4.422) 5.303 3.624 ( 5.525 0.000 -0.727) 5.572 3.756 ( 12.963 0.000 1.984) 13.114 3.858 ( 1.109 0.000 -7.781) 7.860 3.884 ( 6.144 0.000 2.531) 6.645 4.006 ( -1.485 0.000 6.164) 6.340 4.109 ( 6.159 0.000 -13.271) 14.630 4.164 ( 7.248 0.000 0.166) 7.250 4.229 ( -1.087 0.000 3.983) 4.129 4.300 ( 5.303 0.000 -3.272) 6.232 4.401 ( -0.945 0.000 -0.027) 0.945 4.491 ( 1.551 0.000 -3.008) 3.384 4.545 ( -2.116 0.000 3.469) 4.063 4.576 ( 1.019 0.000 -0.052) 1.020 4.731 ( 6.478 0.000 8.277) 10.510 4.766 ( -7.663 0.000 -9.501) 12.206 4.875 ( 2.160 0.000 6.173) 6.540 4.925 ( -0.794 0.000 -0.502) 0.939 5.005 ( 7.384 0.000 -8.112) 10.969 5.034 ( 7.000 0.000 -7.114) 9.980 5.076 ( -6.979 0.000 0.258) 6.983 5.085 ( -3.849 0.000 6.339) 7.416 5.231 ( 1.262 0.000 -0.847) 1.520 5.265 ( -0.382 0.000 -5.970) 5.983 5.347 ( -4.465 0.000 2.037) 4.908 5.367 ( 4.597 0.000 -12.083) 12.928 5.519 ( -3.398 0.000 -1.207) 3.606 5.567 ( 1.916 0.000 -2.861) 3.443 5.798 ( 1.144 0.000 1.726) 2.070 5.804 ( -7.790 0.000 -0.016) 7.790 5.874 ( 0.699 0.000 3.105) 3.183 5.902 ( 1.133 0.000 -3.078) 3.280 5.970 ( 2.203 0.000 -6.337) 6.709 6.058 ( 4.306 0.000 -1.134) 4.453 6.081 ( 0.457 0.000 -4.357) 4.381 6.180 ( -1.091 0.000 -0.223) 1.113 6.228 ( -0.052 0.000 -1.032) 1.033 6.444 ( -2.509 0.000 -7.848) 8.239 6.497 ( -9.759 0.000 5.315) 11.112 6.553 ( 12.073 0.000 3.030) 12.448 6.585 ( -2.509 0.000 4.899) 5.504 6.637 ( -1.736 0.000 2.335) 2.910 6.695 ( 5.285 0.000 3.328) 6.246 6.787 ( -5.546 0.000 -3.312) 6.460 6.819 ( -6.733 0.000 -2.850) 7.311 6.852 ( -2.167 0.000 7.767) 8.064 6.916 ( 5.804 0.000 0.261) 5.810 7.099 ( -5.420 0.000 6.420) 8.402 7.216 ( -5.318 0.000 -0.002) 5.318 7.238 ( 1.016 0.000 -4.111) 4.235 7.316 ( -2.600 0.000 -0.680) 2.688 7.354 ( -1.284 0.000 0.645) 1.437 7.467 ( -4.804 0.000 5.868) 7.584 7.524 ( -8.202 0.000 -2.554) 8.591 7.927 ( -14.983 0.000 -5.146) 15.842 8.076 ( -13.743 0.000 -0.876) 13.770 8.254 ( -13.707 0.000 -3.821) 14.230 8.429 ( -11.302 0.000 1.240) 11.370 8.959 ( -0.972 0.000 2.159) 2.367 8.979 ( 1.488 0.000 2.772) 3.146 9.031 ( 3.859 0.000 -4.842) 6.191 9.250 ( 3.222 0.000 0.795) 3.319 9.308 ( 3.122 0.000 -0.855) 3.237 9.408 ( 2.551 0.000 -1.057) 2.761 9.417 ( 2.433 0.000 -0.587) 2.503 9.475 ( -0.804 0.000 -2.854) 2.965 9.562 ( 4.773 0.000 -0.602) 4.810 9.577 ( 6.961 0.000 3.097) 7.618 9.696 ( 2.931 0.000 -1.430) 3.261 9.784 ( -2.212 0.000 0.384) 2.245 9.846 ( -10.931 0.000 0.604) 10.947 9.931 ( -5.407 0.000 -0.164) 5.409 10.014 ( -3.733 0.000 5.292) 6.476 10.041 ( -6.398 0.000 -0.914) 6.462 10.116 ( -9.934 0.000 1.864) 10.107 10.252 ( -5.617 0.000 -1.417) 5.793 10.412 ( -7.049 0.000 -3.694) 7.958 10.497 ( -2.738 0.000 1.562) 3.152 10.531 ( -4.510 0.000 -0.956) 4.610 10.698 ( -3.890 0.000 0.946) 4.003 10.910 ( -5.209 0.000 -0.187) 5.213 10.946 ( -3.324 0.000 -1.148) 3.517 11.716 ( 2.873 0.000 0.111) 2.875 11.735 ( 5.459 0.000 0.288) 5.467 11.756 ( 8.625 0.000 -0.317) 8.630 11.757 ( 9.088 0.000 0.069) 9.088 12.077 ( -2.487 0.000 -1.253) 2.785 12.092 ( 4.418 0.000 0.713) 4.476 12.153 ( -1.581 0.000 2.093) 2.623 12.218 ( -2.100 0.000 0.034) 2.101 12.368 ( -0.978 0.000 -0.512) 1.104 12.457 ( 3.598 0.000 1.391) 3.858 12.487 ( -0.678 0.000 -2.454) 2.546 12.509 ( 5.857 0.000 0.176) 5.860 12.676 ( 4.857 0.000 1.446) 5.068 12.731 ( 1.218 0.000 -0.135) 1.226 12.956 ( -1.816 0.000 0.782) 1.977 12.966 ( -3.967 0.000 -0.868) 4.061 13.310 ( 5.812 0.000 -0.298) 5.819 13.348 ( 4.040 0.000 0.585) 4.082 13.704 ( -8.686 0.000 0.484) 8.700 13.707 ( -8.434 0.000 -0.091) 8.435 14.091 ( 7.693 0.000 -2.422) 8.066 14.132 ( 16.703 0.000 2.446) 16.881 14.289 ( -0.689 0.000 0.338) 0.767 14.309 ( 0.093 0.000 -0.646) 0.653 14.331 ( -2.105 0.000 0.336) 2.132 14.440 ( 8.051 0.000 -0.253) 8.055 14.728 ( -3.507 0.000 2.035) 4.055 14.757 ( -5.697 0.000 -1.944) 6.020 15.114 ( 9.787 0.000 0.495) 9.800 15.255 ( 4.705 0.000 -0.524) 4.734 15.388 ( 3.017 0.000 0.534) 3.064 15.433 ( 4.431 0.000 1.129) 4.572 15.536 ( -2.077 0.000 1.280) 2.439 15.573 ( -0.455 0.000 -0.890) 0.999 15.644 ( 1.673 0.000 -0.702) 1.814 15.663 ( 5.801 0.000 0.290) 5.808 15.967 ( 2.672 0.000 2.881) 3.929 16.029 ( 8.372 0.000 0.760) 8.406 16.032 ( -1.188 0.000 -2.030) 2.352 16.153 ( 3.361 0.000 -7.146) 7.897 16.583 ( -0.139 0.000 0.563) 0.580 16.678 ( -2.618 0.000 -3.784) 4.601 16.680 ( -0.200 0.000 2.551) 2.559 16.729 ( 3.152 0.000 -1.991) 3.728 17.309 ( 0.578 0.000 0.851) 1.029 17.355 ( 0.871 0.000 0.766) 1.160 17.362 ( 1.213 0.000 -0.489) 1.308 17.454 ( 0.439 0.000 -0.583) 0.730 19.876 ( 7.926 0.000 2.034) 8.182 20.019 ( 4.582 0.000 -3.617) 5.837 20.145 ( 6.356 0.000 1.043) 6.441 20.156 ( 4.261 0.000 -2.845) 5.124 20.289 ( -7.377 0.000 0.978) 7.442 20.441 ( -6.696 0.000 0.576) 6.721 20.725 ( -2.867 0.000 -1.345) 3.166 20.811 ( -2.871 0.000 -0.856) 2.996 22.157 ( 5.789 0.000 0.452) 5.807 22.179 ( 7.724 0.000 0.394) 7.734 22.327 ( 9.212 0.000 -0.133) 9.213 22.352 ( 9.956 0.000 0.094) 9.957 22.784 ( -8.804 0.000 -1.196) 8.884 22.908 ( -10.954 0.000 1.876) 11.113 22.967 ( -9.187 0.000 -0.381) 9.195 23.069 ( -10.640 0.000 -0.320) 10.645 27.097 ( 19.536 0.000 1.588) 19.601 27.195 ( 19.457 0.000 -2.660) 19.638 27.402 ( 26.652 0.000 7.042) 27.566 27.818 ( 16.844 0.000 -16.921) 23.876 28.350 ( -20.578 0.000 1.510) 20.634 28.441 ( -19.355 0.000 -2.371) 19.499 28.790 ( -17.863 0.000 2.427) 18.027 28.904 ( -19.475 0.000 -4.879) 20.077 30.360 ( 13.513 0.000 1.993) 13.659 30.383 ( 10.828 0.000 -1.400) 10.918 30.645 ( 3.127 0.000 1.657) 3.539 30.753 ( -0.054 0.000 -1.421) 1.422 30.985 ( 7.160 0.000 -2.496) 7.583 30.987 ( 9.665 0.000 2.157) 9.903 31.320 ( -2.030 0.000 -5.757) 6.104 31.354 ( 10.134 0.000 -1.269) 10.213 31.484 ( -0.855 0.000 -2.522) 2.663 31.538 ( -8.609 0.000 3.452) 9.275 31.806 ( -6.493 0.000 -1.304) 6.623 31.830 ( -10.480 0.000 -2.043) 10.677 31.925 ( 4.851 0.000 1.061) 4.966 32.102 ( -0.096 0.000 1.087) 1.091 32.386 ( 8.829 0.000 -0.846) 8.870 32.680 ( -5.476 0.000 -20.003) 20.739 32.918 ( 9.545 0.000 1.808) 9.715 32.998 ( 9.041 0.000 4.599) 10.144 33.252 ( 12.285 0.000 -1.245) 12.347 33.281 ( 9.505 0.000 -5.371) 10.918 33.589 ( -3.018 0.000 4.650) 5.544 33.610 ( -5.149 0.000 -1.404) 5.337 33.817 ( -7.786 0.000 -4.038) 8.771 33.863 ( -9.819 0.000 -5.627) 11.317 34.877 ( -0.991 0.000 -1.072) 1.460 34.993 ( -1.452 0.000 0.009) 1.452 35.160 ( 1.607 0.000 2.809) 3.236 35.198 ( 2.252 0.000 4.018) 4.606 35.623 ( 1.059 0.000 -6.567) 6.652 35.749 ( 2.923 0.000 0.278) 2.937 35.878 ( 2.712 0.000 -3.657) 4.553 35.895 ( 4.654 0.000 -1.818) 4.997 36.103 ( 2.965 0.000 11.552) 11.926 36.195 ( 5.843 0.000 9.771) 11.385 36.334 ( -3.896 0.000 2.251) 4.499 36.493 ( -1.446 0.000 0.217) 1.462 37.189 ( 6.969 0.000 12.511) 14.321 37.688 ( -11.488 0.000 -10.691) 15.693 37.752 ( -9.940 0.000 17.010) 19.701 38.329 ( -17.514 0.000 -5.659) 18.406 ======================= Grid point 4 (5/69) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 9.887 0.000 2.923) 10.310 2.147 ( 5.353 0.000 3.005) 6.139 2.230 ( 3.938 0.000 3.679) 5.389 2.247 ( -5.505 0.000 -0.897) 5.578 2.324 ( -7.044 0.000 1.893) 7.294 2.440 ( 0.899 0.000 -10.081) 10.121 2.506 ( 16.602 0.000 4.736) 17.264 2.677 ( -4.292 0.000 -4.921) 6.529 2.711 ( 3.169 0.000 5.497) 6.345 2.715 ( -0.206 0.000 -1.862) 1.874 2.761 ( -6.415 0.000 3.228) 7.181 2.853 ( -1.995 0.000 -1.147) 2.302 2.909 ( 4.769 0.000 7.789) 9.133 3.001 ( -0.802 0.000 0.100) 0.808 3.137 ( -0.362 0.000 2.223) 2.253 3.174 ( 2.630 0.000 -2.362) 3.535 3.283 ( -0.604 0.000 -3.804) 3.851 3.325 ( 3.251 0.000 9.996) 10.511 3.370 ( 1.204 0.000 -0.682) 1.384 3.445 ( 2.470 0.000 -1.685) 2.989 3.541 ( -0.006 0.000 -1.844) 1.844 3.620 ( 6.609 0.000 0.858) 6.664 3.700 ( 0.953 0.000 2.534) 2.707 3.754 ( -5.125 0.000 2.505) 5.704 3.825 ( 8.871 0.000 2.403) 9.190 3.937 ( 0.972 0.000 5.738) 5.820 3.976 ( -2.673 0.000 -2.162) 3.438 4.083 ( 8.303 0.000 -1.455) 8.429 4.117 ( 0.833 0.000 -0.922) 1.242 4.171 ( 10.543 0.000 -2.402) 10.813 4.278 ( -1.461 0.000 2.513) 2.907 4.376 ( 0.495 0.000 -1.922) 1.985 4.410 ( 5.007 0.000 3.524) 6.123 4.439 ( -3.824 0.000 -3.817) 5.403 4.567 ( 0.717 0.000 4.372) 4.430 4.578 ( 0.455 0.000 -0.537) 0.704 4.619 ( -1.221 0.000 0.023) 1.222 4.797 ( -7.409 0.000 -11.478) 13.661 4.837 ( -6.726 0.000 -1.499) 6.891 4.896 ( -0.532 0.000 2.170) 2.235 4.974 ( 6.637 0.000 5.026) 8.325 5.045 ( 0.100 0.000 4.858) 4.859 5.097 ( 9.061 0.000 -9.603) 13.203 5.144 ( -9.511 0.000 11.116) 14.629 5.158 ( -2.672 0.000 -7.764) 8.211 5.280 ( 5.417 0.000 3.512) 6.456 5.369 ( 6.783 0.000 -5.569) 8.776 5.406 ( 8.098 0.000 -0.097) 8.099 5.504 ( -4.471 0.000 -1.665) 4.771 5.514 ( 0.194 0.000 1.668) 1.679 5.702 ( -3.660 0.000 -0.415) 3.683 5.819 ( -11.118 0.000 -2.968) 11.508 5.835 ( 1.419 0.000 1.606) 2.144 5.903 ( 0.478 0.000 -0.237) 0.534 5.923 ( 2.114 0.000 -2.648) 3.389 6.060 ( 0.280 0.000 -1.413) 1.441 6.078 ( -0.771 0.000 -0.220) 0.802 6.167 ( -0.748 0.000 0.463) 0.880 6.179 ( -1.514 0.000 -0.714) 1.673 6.322 ( -2.462 0.000 -4.519) 5.146 6.434 ( -2.526 0.000 1.815) 3.111 6.596 ( -1.934 0.000 2.754) 3.365 6.621 ( -2.375 0.000 1.473) 2.795 6.630 ( -2.592 0.000 -2.788) 3.807 6.755 ( -0.573 0.000 -1.426) 1.537 6.803 ( 3.316 0.000 1.807) 3.777 6.845 ( 17.277 0.000 0.899) 17.300 6.930 ( 1.293 0.000 5.526) 5.676 7.032 ( 8.240 0.000 -3.241) 8.855 7.090 ( -6.659 0.000 -1.677) 6.867 7.128 ( -4.466 0.000 8.749) 9.823 7.131 ( -6.473 0.000 -1.286) 6.599 7.294 ( -2.260 0.000 -1.965) 2.995 7.332 ( -6.571 0.000 -4.437) 7.929 7.430 ( 6.876 0.000 -0.351) 6.885 7.440 ( -4.239 0.000 3.337) 5.394 7.727 ( -4.605 0.000 -2.372) 5.180 7.860 ( -9.767 0.000 -1.792) 9.930 8.065 ( -5.445 0.000 -1.960) 5.787 8.306 ( -4.701 0.000 0.119) 4.703 8.984 ( 0.206 0.000 2.444) 2.453 9.023 ( 0.906 0.000 1.166) 1.477 9.044 ( 2.141 0.000 -2.577) 3.350 9.282 ( 0.366 0.000 0.491) 0.612 9.357 ( 3.015 0.000 -0.232) 3.024 9.406 ( 0.252 0.000 -2.221) 2.236 9.443 ( 1.142 0.000 -0.151) 1.152 9.456 ( 0.136 0.000 0.504) 0.522 9.609 ( 1.976 0.000 -0.582) 2.060 9.699 ( 3.993 0.000 0.635) 4.044 9.714 ( -4.353 0.000 -0.038) 4.353 9.717 ( 2.048 0.000 0.175) 2.055 9.756 ( -2.605 0.000 0.896) 2.755 9.793 ( -7.164 0.000 -0.135) 7.165 9.961 ( -2.166 0.000 -0.917) 2.352 9.979 ( -4.650 0.000 0.261) 4.658 10.131 ( 3.871 0.000 4.932) 6.270 10.183 ( -1.915 0.000 -0.381) 1.952 10.263 ( -6.171 0.000 -4.267) 7.503 10.453 ( -1.165 0.000 -0.950) 1.503 10.522 ( -0.671 0.000 2.019) 2.127 10.665 ( -1.345 0.000 0.534) 1.447 10.846 ( -1.945 0.000 -0.578) 2.029 10.900 ( -1.208 0.000 -0.582) 1.341 11.746 ( 0.892 0.000 0.086) 0.896 11.784 ( 1.422 0.000 0.167) 1.431 11.849 ( 3.492 0.000 -0.251) 3.501 11.873 ( 4.169 0.000 0.038) 4.170 12.035 ( -1.125 0.000 -0.609) 1.280 12.134 ( 0.129 0.000 0.339) 0.362 12.165 ( 0.278 0.000 1.072) 1.107 12.188 ( -1.308 0.000 -0.001) 1.308 12.367 ( 0.355 0.000 0.575) 0.675 12.463 ( 0.552 0.000 -1.577) 1.671 12.515 ( 1.691 0.000 0.886) 1.909 12.599 ( 4.386 0.000 -0.005) 4.386 12.721 ( -1.516 0.000 -0.195) 1.529 12.755 ( 3.812 0.000 0.574) 3.855 12.874 ( -5.280 0.000 -0.738) 5.331 12.938 ( -1.141 0.000 0.471) 1.235 13.417 ( 7.536 0.000 -0.223) 7.539 13.427 ( 4.402 0.000 0.222) 4.407 13.578 ( -7.879 0.000 0.344) 7.886 13.596 ( -5.258 0.000 0.045) 5.258 14.165 ( 3.289 0.000 -0.340) 3.306 14.271 ( -0.226 0.000 -0.335) 0.404 14.284 ( -0.406 0.000 0.054) 0.409 14.313 ( 0.324 0.000 0.903) 0.960 14.417 ( 11.931 0.000 0.790) 11.958 14.548 ( 6.010 0.000 -1.302) 6.149 14.611 ( -9.805 0.000 -1.269) 9.887 14.692 ( -3.861 0.000 2.180) 4.434 15.258 ( 7.613 0.000 0.204) 7.616 15.315 ( 5.542 0.000 -1.666) 5.787 15.375 ( -4.506 0.000 0.478) 4.532 15.405 ( -7.091 0.000 1.556) 7.260 15.576 ( 3.118 0.000 1.601) 3.505 15.605 ( 4.163 0.000 -0.559) 4.201 15.638 ( -0.953 0.000 -1.459) 1.743 15.683 ( -2.488 0.000 0.787) 2.609 16.027 ( 1.242 0.000 -0.441) 1.317 16.048 ( 3.353 0.000 0.801) 3.448 16.138 ( 1.487 0.000 -2.638) 3.028 16.140 ( 3.845 0.000 0.354) 3.861 16.597 ( 1.033 0.000 0.382) 1.102 16.609 ( -1.779 0.000 -1.101) 2.092 16.675 ( -2.171 0.000 0.981) 2.382 16.748 ( 0.925 0.000 -0.622) 1.115 17.329 ( 0.612 0.000 0.552) 0.824 17.367 ( 0.237 0.000 -0.392) 0.458 17.386 ( 1.476 0.000 0.985) 1.775 17.441 ( -0.764 0.000 -0.914) 1.191 20.030 ( 7.865 0.000 2.524) 8.260 20.063 ( 4.891 0.000 -2.527) 5.505 20.154 ( -1.684 0.000 -2.792) 3.260 20.193 ( -5.458 0.000 1.606) 5.689 20.246 ( 3.356 0.000 0.806) 3.452 20.354 ( -3.614 0.000 0.198) 3.620 20.679 ( -1.458 0.000 -0.453) 1.526 20.758 ( -2.000 0.000 -0.777) 2.145 22.248 ( 4.302 0.000 0.299) 4.313 22.277 ( 4.183 0.000 -0.188) 4.187 22.461 ( 6.564 0.000 -0.428) 6.578 22.478 ( 4.798 0.000 -0.945) 4.890 22.669 ( -3.390 0.000 0.327) 3.405 22.794 ( -5.606 0.000 2.637) 6.195 22.832 ( -6.006 0.000 -1.469) 6.183 22.914 ( -7.164 0.000 -0.429) 7.177 27.401 ( 14.332 0.000 1.524) 14.413 27.422 ( 11.167 0.000 -1.751) 11.303 27.863 ( 3.112 0.000 -5.194) 6.055 27.888 ( 21.395 0.000 7.876) 22.799 28.101 ( -11.267 0.000 1.307) 11.343 28.171 ( -8.232 0.000 -3.011) 8.765 28.528 ( -18.272 0.000 -6.710) 19.465 28.580 ( -10.072 0.000 1.739) 10.221 30.491 ( 4.254 0.000 -0.658) 4.304 30.560 ( 8.450 0.000 2.412) 8.788 30.687 ( 0.683 0.000 0.776) 1.034 30.708 ( -3.319 0.000 -2.095) 3.924 31.084 ( 8.829 0.000 -2.377) 9.144 31.170 ( 9.862 0.000 1.883) 10.041 31.211 ( -8.241 0.000 0.972) 8.298 31.407 ( -9.778 0.000 0.375) 9.785 31.461 ( 1.259 0.000 -2.016) 2.377 31.492 ( 10.227 0.000 -2.069) 10.434 31.645 ( -10.950 0.000 0.096) 10.951 31.712 ( -3.581 0.000 -0.520) 3.619 32.012 ( 3.095 0.000 0.850) 3.209 32.146 ( 1.380 0.000 3.426) 3.693 32.412 ( -3.413 0.000 -11.194) 11.702 32.482 ( 3.794 0.000 -0.615) 3.844 33.041 ( 3.542 0.000 1.187) 3.736 33.167 ( 5.096 0.000 3.372) 6.111 33.378 ( 7.291 0.000 -2.953) 7.866 33.398 ( 7.205 0.000 -1.243) 7.312 33.551 ( -2.777 0.000 1.460) 3.138 33.599 ( -0.796 0.000 2.641) 2.759 33.664 ( -7.546 0.000 -3.368) 8.264 33.674 ( -5.867 0.000 -1.471) 6.049 34.856 ( -0.473 0.000 -0.495) 0.685 34.971 ( -0.728 0.000 -0.307) 0.790 35.205 ( 0.685 0.000 1.481) 1.632 35.259 ( 1.065 0.000 1.614) 1.934 35.576 ( 0.082 0.000 -2.649) 2.650 35.783 ( 1.052 0.000 0.164) 1.065 35.873 ( 0.632 0.000 -1.441) 1.573 35.927 ( 1.479 0.000 -0.782) 1.673 36.260 ( 2.404 0.000 6.156) 6.609 36.307 ( -1.225 0.000 0.388) 1.285 36.367 ( 3.649 0.000 4.743) 5.984 36.478 ( -0.399 0.000 -0.196) 0.445 37.362 ( 2.577 0.000 4.559) 5.238 37.446 ( -5.586 0.000 -5.507) 7.844 37.777 ( -3.179 0.000 5.444) 6.305 38.055 ( -8.402 0.000 -3.518) 9.108 ======================= Grid point 9 (6/69) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 46 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.525 ( 0.000 29.030 0.000) 29.030 0.681 ( 0.000 35.254 0.000) 35.254 1.218 ( 0.000 61.626 0.000) 61.626 1.603 ( 0.000 -19.870 0.000) 19.870 1.886 ( 0.000 7.135 0.000) 7.135 1.944 ( 0.000 -26.314 0.000) 26.314 2.254 ( 0.000 -3.912 0.000) 3.912 2.465 ( 0.000 7.644 0.000) 7.644 2.477 ( 0.000 6.279 0.000) 6.279 2.633 ( 0.000 -1.159 0.000) 1.159 2.691 ( 0.000 1.557 0.000) 1.557 2.853 ( 0.000 8.779 0.000) 8.779 2.875 ( 0.000 -2.035 0.000) 2.035 3.009 ( 0.000 3.086 0.000) 3.086 3.078 ( 0.000 0.789 0.000) 0.789 3.126 ( 0.000 -6.889 0.000) 6.889 3.181 ( 0.000 2.391 0.000) 2.391 3.209 ( 0.000 -1.457 0.000) 1.457 3.320 ( 0.000 3.845 0.000) 3.845 3.382 ( 0.000 -1.769 0.000) 1.769 3.440 ( 0.000 -19.048 0.000) 19.048 3.491 ( 0.000 0.771 0.000) 0.771 3.615 ( 0.000 -4.642 0.000) 4.642 3.649 ( 0.000 6.929 0.000) 6.929 3.728 ( 0.000 -11.460 0.000) 11.460 3.770 ( 0.000 4.679 0.000) 4.679 3.835 ( 0.000 7.700 0.000) 7.700 3.860 ( 0.000 -4.483 0.000) 4.483 3.969 ( 0.000 -2.428 0.000) 2.428 3.984 ( 0.000 13.744 0.000) 13.744 4.024 ( 0.000 16.592 0.000) 16.592 4.151 ( 0.000 -10.418 0.000) 10.418 4.192 ( 0.000 2.565 0.000) 2.565 4.291 ( 0.000 -3.997 0.000) 3.997 4.414 ( 0.000 -2.472 0.000) 2.472 4.477 ( 0.000 2.572 0.000) 2.572 4.665 ( 0.000 1.008 0.000) 1.008 4.760 ( 0.000 -14.461 0.000) 14.461 4.781 ( 0.000 1.340 0.000) 1.340 4.925 ( 0.000 -13.565 0.000) 13.565 5.053 ( 0.000 -2.933 0.000) 2.933 5.103 ( 0.000 -6.799 0.000) 6.799 5.173 ( 0.000 4.320 0.000) 4.320 5.240 ( 0.000 1.502 0.000) 1.502 5.307 ( 0.000 6.387 0.000) 6.387 5.401 ( 0.000 5.770 0.000) 5.770 5.456 ( 0.000 5.238 0.000) 5.238 5.541 ( 0.000 0.737 0.000) 0.737 5.639 ( 0.000 1.355 0.000) 1.355 5.660 ( 0.000 3.996 0.000) 3.996 5.760 ( 0.000 -0.848 0.000) 0.848 5.794 ( 0.000 7.562 0.000) 7.562 5.796 ( 0.000 0.785 0.000) 0.785 5.972 ( 0.000 -1.882 0.000) 1.882 6.007 ( 0.000 0.390 0.000) 0.390 6.064 ( 0.000 -1.672 0.000) 1.672 6.149 ( 0.000 -1.888 0.000) 1.888 6.206 ( 0.000 -8.646 0.000) 8.646 6.263 ( 0.000 -6.947 0.000) 6.947 6.353 ( 0.000 -9.088 0.000) 9.088 6.431 ( 0.000 3.151 0.000) 3.151 6.455 ( 0.000 -0.334 0.000) 0.334 6.480 ( 0.000 0.861 0.000) 0.861 6.564 ( 0.000 2.958 0.000) 2.958 6.777 ( 0.000 1.483 0.000) 1.483 6.843 ( 0.000 -0.722 0.000) 0.722 6.895 ( 0.000 0.779 0.000) 0.779 6.965 ( 0.000 6.043 0.000) 6.043 7.056 ( 0.000 -3.768 0.000) 3.768 7.083 ( 0.000 -0.212 0.000) 0.212 7.212 ( 0.000 0.210 0.000) 0.210 7.347 ( 0.000 -4.986 0.000) 4.986 7.445 ( 0.000 -4.617 0.000) 4.617 7.450 ( 0.000 7.849 0.000) 7.849 7.543 ( 0.000 -4.533 0.000) 4.533 7.634 ( 0.000 -2.356 0.000) 2.356 8.597 ( 0.000 5.765 0.000) 5.765 8.776 ( 0.000 -0.715 0.000) 0.715 8.865 ( 0.000 -1.858 0.000) 1.858 8.870 ( 0.000 2.998 0.000) 2.998 8.944 ( 0.000 -0.425 0.000) 0.425 8.999 ( 0.000 0.388 0.000) 0.388 9.068 ( 0.000 3.477 0.000) 3.477 9.136 ( 0.000 -6.615 0.000) 6.615 9.176 ( 0.000 -4.990 0.000) 4.990 9.278 ( 0.000 1.147 0.000) 1.147 9.313 ( 0.000 -5.182 0.000) 5.182 9.346 ( 0.000 -2.495 0.000) 2.495 9.356 ( 0.000 0.773 0.000) 0.773 9.445 ( 0.000 -2.119 0.000) 2.119 9.531 ( 0.000 5.071 0.000) 5.071 9.696 ( 0.000 -3.502 0.000) 3.502 9.796 ( 0.000 3.039 0.000) 3.039 10.083 ( 0.000 -10.278 0.000) 10.278 10.301 ( 0.000 10.977 0.000) 10.977 10.443 ( 0.000 2.288 0.000) 2.288 10.446 ( 0.000 5.763 0.000) 5.763 10.675 ( 0.000 1.370 0.000) 1.370 10.722 ( 0.000 -5.181 0.000) 5.181 10.795 ( 0.000 -2.509 0.000) 2.509 10.818 ( 0.000 3.394 0.000) 3.394 10.987 ( 0.000 -3.697 0.000) 3.697 11.025 ( 0.000 2.746 0.000) 2.746 11.147 ( 0.000 -1.380 0.000) 1.380 11.247 ( 0.000 4.673 0.000) 4.673 11.256 ( 0.000 2.965 0.000) 2.965 11.512 ( 0.000 -9.398 0.000) 9.398 11.579 ( 0.000 -9.124 0.000) 9.124 11.920 ( 0.000 5.554 0.000) 5.554 12.169 ( 0.000 -4.990 0.000) 4.990 12.199 ( 0.000 4.093 0.000) 4.093 12.348 ( 0.000 -0.037 0.000) 0.037 12.393 ( 0.000 2.212 0.000) 2.212 12.444 ( 0.000 1.955 0.000) 1.955 12.461 ( 0.000 4.647 0.000) 4.647 12.516 ( 0.000 5.495 0.000) 5.495 12.597 ( 0.000 6.424 0.000) 6.424 12.810 ( 0.000 1.273 0.000) 1.273 12.903 ( 0.000 -4.663 0.000) 4.663 12.942 ( 0.000 -4.631 0.000) 4.631 13.269 ( 0.000 4.222 0.000) 4.222 13.311 ( 0.000 -1.661 0.000) 1.661 13.342 ( 0.000 -1.009 0.000) 1.009 13.417 ( 0.000 -2.108 0.000) 2.108 14.150 ( 0.000 11.961 0.000) 11.961 14.231 ( 0.000 2.296 0.000) 2.296 14.322 ( 0.000 7.982 0.000) 7.982 14.352 ( 0.000 -2.912 0.000) 2.912 14.452 ( 0.000 -2.237 0.000) 2.237 14.556 ( 0.000 -0.507 0.000) 0.507 14.645 ( 0.000 1.633 0.000) 1.633 14.688 ( 0.000 -1.633 0.000) 1.633 14.823 ( 0.000 -1.816 0.000) 1.816 14.955 ( 0.000 -7.827 0.000) 7.827 15.022 ( 0.000 1.518 0.000) 1.518 15.141 ( 0.000 10.721 0.000) 10.721 15.155 ( 0.000 -3.787 0.000) 3.787 15.678 ( 0.000 -9.029 0.000) 9.029 15.781 ( 0.000 1.130 0.000) 1.130 15.826 ( 0.000 1.640 0.000) 1.640 15.847 ( 0.000 -1.520 0.000) 1.520 15.915 ( 0.000 -3.798 0.000) 3.798 16.220 ( 0.000 3.426 0.000) 3.426 16.336 ( 0.000 -1.330 0.000) 1.330 16.510 ( 0.000 1.159 0.000) 1.159 16.530 ( 0.000 1.052 0.000) 1.052 16.597 ( 0.000 -2.224 0.000) 2.224 16.612 ( 0.000 -2.213 0.000) 2.213 17.312 ( 0.000 0.907 0.000) 0.907 17.340 ( 0.000 -0.223 0.000) 0.223 17.350 ( 0.000 0.907 0.000) 0.907 17.393 ( 0.000 -0.823 0.000) 0.823 19.705 ( 0.000 4.902 0.000) 4.902 19.941 ( 0.000 2.230 0.000) 2.230 19.982 ( 0.000 -6.556 0.000) 6.556 20.052 ( 0.000 -2.274 0.000) 2.274 20.522 ( 0.000 0.950 0.000) 0.950 20.563 ( 0.000 -0.676 0.000) 0.676 20.812 ( 0.000 1.244 0.000) 1.244 20.874 ( 0.000 -1.277 0.000) 1.277 21.927 ( 0.000 0.097 0.000) 0.097 21.943 ( 0.000 -0.521 0.000) 0.521 22.070 ( 0.000 1.255 0.000) 1.255 22.137 ( 0.000 -1.519 0.000) 1.519 23.101 ( 0.000 2.057 0.000) 2.057 23.214 ( 0.000 -2.632 0.000) 2.632 23.323 ( 0.000 0.581 0.000) 0.581 23.347 ( 0.000 -0.390 0.000) 0.390 26.546 ( 0.000 0.189 0.000) 0.189 26.556 ( 0.000 -0.217 0.000) 0.217 26.578 ( 0.000 0.068 0.000) 0.068 26.580 ( 0.000 0.011 0.000) 0.011 29.139 ( 0.000 1.379 0.000) 1.379 29.201 ( 0.000 -1.044 0.000) 1.044 29.336 ( 0.000 4.346 0.000) 4.346 29.569 ( 0.000 -5.332 0.000) 5.332 29.751 ( 0.000 10.224 0.000) 10.224 30.190 ( 0.000 -7.614 0.000) 7.614 30.696 ( 0.000 0.155 0.000) 0.155 30.704 ( 0.000 -0.159 0.000) 0.159 30.904 ( 0.000 1.842 0.000) 1.842 30.935 ( 0.000 1.432 0.000) 1.432 31.003 ( 0.000 -2.397 0.000) 2.397 31.017 ( 0.000 -2.007 0.000) 2.007 31.544 ( 0.000 4.918 0.000) 4.918 31.776 ( 0.000 -4.464 0.000) 4.464 32.138 ( 0.000 2.457 0.000) 2.457 32.213 ( 0.000 2.070 0.000) 2.070 32.261 ( 0.000 -3.176 0.000) 3.176 32.312 ( 0.000 -1.529 0.000) 1.529 32.521 ( 0.000 -0.247 0.000) 0.247 32.531 ( 0.000 -0.172 0.000) 0.172 32.583 ( 0.000 1.451 0.000) 1.451 32.606 ( 0.000 0.004 0.000) 0.004 33.466 ( 0.000 -0.114 0.000) 0.114 33.467 ( 0.000 -0.138 0.000) 0.138 34.224 ( 0.000 0.648 0.000) 0.648 34.261 ( 0.000 -0.835 0.000) 0.835 34.641 ( 0.000 0.695 0.000) 0.695 34.672 ( 0.000 -0.609 0.000) 0.609 34.888 ( 0.000 0.348 0.000) 0.348 34.914 ( 0.000 -0.864 0.000) 0.864 34.990 ( 0.000 0.948 0.000) 0.948 35.019 ( 0.000 -0.403 0.000) 0.403 35.605 ( 0.000 1.824 0.000) 1.824 35.635 ( 0.000 1.425 0.000) 1.425 35.680 ( 0.000 -1.159 0.000) 1.159 35.707 ( 0.000 -1.471 0.000) 1.471 35.804 ( 0.000 0.533 0.000) 0.533 35.873 ( 0.000 -3.324 0.000) 3.324 36.080 ( 0.000 4.473 0.000) 4.473 36.209 ( 0.000 -1.727 0.000) 1.727 36.593 ( 0.000 -0.270 0.000) 0.270 36.599 ( 0.000 -0.536 0.000) 0.536 38.553 ( 0.000 7.021 0.000) 7.021 38.898 ( 0.000 -7.155 0.000) 7.155 ======================= Grid point 10 (7/69) ======================= q-point: ( 0.11 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.808 ( 13.336 24.501 12.613) 30.614 1.063 ( 23.708 19.299 24.553) 39.210 1.478 ( 27.198 41.561 5.176) 49.938 1.758 ( 1.729 -15.396 13.184) 20.343 1.898 ( 6.233 -10.548 4.120) 12.926 1.970 ( 5.542 -3.292 1.100) 6.539 2.244 ( -0.033 -6.508 2.686) 7.041 2.402 ( -1.677 3.126 -1.982) 4.064 2.564 ( -3.273 2.764 -2.100) 4.771 2.615 ( -0.584 2.478 -0.107) 2.548 2.692 ( 6.845 4.152 5.014) 9.446 2.828 ( -1.195 3.725 4.387) 5.878 2.898 ( -0.839 -1.012 -0.860) 1.571 3.004 ( -1.624 7.189 3.690) 8.242 3.057 ( -4.299 3.657 -4.152) 7.007 3.147 ( 0.280 -3.708 -3.196) 4.903 3.189 ( -2.875 3.936 -2.309) 5.394 3.204 ( -0.863 -4.199 0.871) 4.375 3.300 ( 4.722 -4.051 -0.526) 6.244 3.357 ( 2.077 0.523 -0.216) 2.153 3.442 ( -1.493 -12.943 1.461) 13.111 3.574 ( -1.343 1.784 -0.571) 2.305 3.631 ( 0.737 -5.059 -0.623) 5.150 3.681 ( 5.373 1.504 0.405) 5.594 3.704 ( 6.938 -1.416 0.880) 7.135 3.745 ( -2.659 1.803 -4.001) 5.131 3.777 ( -0.279 -0.952 4.919) 5.018 3.942 ( 3.076 3.869 -1.136) 5.071 3.952 ( 3.061 1.406 1.626) 3.741 4.058 ( -0.660 -0.249 2.005) 2.125 4.072 ( 4.021 9.192 -0.850) 10.069 4.212 ( 8.107 1.633 1.507) 8.406 4.261 ( 4.738 -4.235 -5.012) 8.093 4.297 ( 5.067 -10.119 1.134) 11.374 4.458 ( -0.492 0.818 0.540) 1.097 4.482 ( 4.591 0.949 1.766) 5.009 4.636 ( 1.855 4.792 -5.993) 7.895 4.723 ( 0.497 -4.704 -1.751) 5.044 4.809 ( 2.100 -6.333 2.523) 7.133 4.947 ( -3.666 -0.917 2.166) 4.356 5.032 ( -3.262 -2.072 3.582) 5.269 5.173 ( -0.254 1.593 0.752) 1.779 5.181 ( -2.335 -10.489 6.382) 12.498 5.247 ( 2.069 1.538 -4.964) 5.594 5.313 ( -3.877 4.332 -3.504) 6.788 5.347 ( 5.062 4.402 -3.366) 7.505 5.442 ( -0.118 3.083 -2.421) 3.922 5.514 ( 2.244 -1.842 -9.100) 9.551 5.574 ( -3.937 1.242 -4.975) 6.464 5.660 ( 0.849 0.478 -0.471) 1.083 5.721 ( -0.053 4.120 -1.609) 4.423 5.792 ( 1.357 0.900 0.614) 1.741 5.904 ( 5.063 0.549 -0.283) 5.101 5.940 ( -3.057 -1.038 1.075) 3.403 6.004 ( 4.103 -1.731 -4.732) 6.498 6.066 ( -1.596 -0.449 1.016) 1.945 6.140 ( 4.026 -0.817 -3.770) 5.576 6.238 ( -4.868 5.312 -11.404) 13.490 6.251 ( 1.088 -6.722 2.935) 7.415 6.332 ( 3.064 -5.971 2.974) 7.341 6.372 ( 0.148 -4.260 0.508) 4.293 6.419 ( -2.142 0.675 1.003) 2.460 6.515 ( 0.430 0.738 0.958) 1.283 6.574 ( -0.406 -5.244 2.496) 5.822 6.768 ( -4.211 4.457 2.994) 6.824 6.861 ( -0.206 -0.205 0.783) 0.835 6.880 ( -1.856 1.073 -1.417) 2.570 6.959 ( -1.798 4.336 1.974) 5.092 7.039 ( -7.889 -1.005 3.952) 8.881 7.147 ( 3.974 -0.687 4.313) 5.905 7.234 ( -1.655 -1.286 -1.039) 2.339 7.267 ( -9.851 -0.942 4.175) 10.741 7.383 ( -1.267 -0.810 1.530) 2.145 7.447 ( -7.854 -3.783 1.631) 8.869 7.504 ( -2.030 2.539 4.532) 5.578 7.611 ( -1.993 -0.237 1.871) 2.744 8.492 ( -10.824 4.358 1.002) 11.711 8.611 ( -16.666 -0.506 -1.803) 16.771 8.734 ( -14.543 -3.855 0.083) 15.045 8.767 ( -12.871 -3.551 1.281) 13.413 8.945 ( -0.005 5.062 1.926) 5.416 9.030 ( -1.539 3.151 -0.506) 3.543 9.084 ( 6.056 -0.222 -1.493) 6.242 9.125 ( 0.338 -2.266 -2.492) 3.385 9.238 ( 3.274 -1.808 -1.089) 3.895 9.295 ( 3.973 -3.717 -0.943) 5.522 9.317 ( 4.378 -2.650 -1.224) 5.261 9.369 ( 1.225 1.288 1.206) 2.148 9.385 ( 3.771 -2.790 -2.205) 5.183 9.459 ( 1.810 -1.826 0.080) 2.572 9.571 ( 4.650 3.030 -0.289) 5.558 9.711 ( 1.788 -3.197 0.667) 3.723 9.824 ( 2.146 2.587 1.576) 3.712 10.075 ( -1.754 -8.395 1.338) 8.680 10.255 ( -6.880 9.086 1.117) 11.452 10.350 ( -8.956 2.974 0.156) 9.438 10.410 ( -7.410 2.184 1.256) 7.826 10.583 ( -9.842 0.449 -0.825) 9.887 10.648 ( -8.530 -3.505 -0.511) 9.236 10.706 ( -5.938 0.017 -2.038) 6.278 10.790 ( -4.690 2.491 0.332) 5.321 10.919 ( -5.457 3.119 -3.996) 7.448 10.985 ( -4.655 -3.180 1.695) 5.887 11.099 ( -3.836 -2.139 -0.946) 4.493 11.363 ( 11.744 2.482 -0.194) 12.005 11.373 ( 11.669 -0.555 -0.020) 11.683 11.546 ( 3.819 -7.308 0.893) 8.294 11.583 ( 2.501 -6.300 -0.976) 6.848 11.953 ( 3.624 4.652 0.276) 5.903 12.173 ( -1.127 -0.240 1.232) 1.687 12.212 ( 3.768 -0.524 -1.610) 4.131 12.319 ( -3.348 2.485 -0.468) 4.196 12.366 ( -3.692 2.759 0.303) 4.619 12.402 ( -1.149 -0.479 -0.374) 1.300 12.464 ( -0.961 2.183 0.323) 2.407 12.516 ( -0.095 2.970 -0.035) 2.971 12.599 ( 1.123 7.676 -0.398) 7.768 12.770 ( -0.502 6.148 0.528) 6.191 12.914 ( 0.766 -4.869 -0.380) 4.943 12.962 ( 0.693 -3.205 0.673) 3.347 13.276 ( 1.925 5.316 -0.205) 5.658 13.307 ( 1.130 1.118 0.108) 1.593 13.492 ( 9.347 -4.083 -0.371) 10.207 13.577 ( 16.249 -12.958 -1.306) 20.824 14.155 ( -4.768 14.472 1.380) 15.299 14.196 ( -5.696 4.739 0.086) 7.410 14.214 ( -1.761 3.228 -1.209) 3.871 14.349 ( -1.035 -1.854 0.328) 2.149 14.392 ( -5.202 -0.243 -0.664) 5.250 14.545 ( 1.710 5.363 -2.187) 6.039 14.695 ( 6.231 1.343 -0.175) 6.377 14.761 ( 4.064 -0.641 1.647) 4.432 14.876 ( 5.496 -0.870 1.113) 5.675 15.031 ( 9.429 0.127 0.332) 9.436 15.129 ( 8.567 -0.304 -0.386) 8.581 15.162 ( 6.849 -1.241 -0.604) 6.987 15.282 ( 13.405 3.449 -3.216) 14.210 15.661 ( -5.615 -5.613 1.674) 8.114 15.676 ( -8.297 6.659 -3.937) 11.344 15.741 ( -6.010 1.375 0.799) 6.217 15.813 ( -2.294 0.685 0.159) 2.399 15.893 ( -1.229 -4.521 1.545) 4.933 16.088 ( 8.032 3.827 -12.358) 15.228 16.293 ( -4.173 -4.031 -3.588) 6.822 16.536 ( 3.774 0.624 0.229) 3.832 16.568 ( 3.633 1.724 -0.349) 4.036 16.608 ( 3.090 -1.716 -0.581) 3.582 16.761 ( 11.187 -7.355 -10.118) 16.781 17.307 ( -0.340 1.349 0.375) 1.441 17.343 ( -0.041 -0.405 0.108) 0.421 17.354 ( 0.537 1.343 -0.220) 1.463 17.405 ( 1.206 -0.926 0.325) 1.555 19.723 ( 2.164 4.400 0.336) 4.915 19.959 ( 4.063 -0.051 -3.574) 5.411 19.987 ( -0.083 -4.120 1.870) 4.525 20.062 ( 3.050 -2.104 -2.244) 4.332 20.496 ( -3.102 1.471 -0.543) 3.475 20.551 ( -2.007 -0.849 0.426) 2.220 20.822 ( -0.145 0.335 -0.024) 0.366 20.864 ( -0.916 -0.924 -0.141) 1.309 21.941 ( 4.481 2.466 0.737) 5.168 22.013 ( 1.133 -1.082 5.425) 5.646 22.095 ( 4.557 0.158 -1.597) 4.831 22.156 ( 2.473 -1.540 -0.413) 2.943 23.059 ( -4.197 1.993 -1.488) 4.879 23.170 ( -3.654 -2.620 -2.378) 5.086 23.242 ( -10.524 0.155 2.054) 10.723 23.272 ( -7.325 -2.386 1.443) 7.837 26.618 ( 9.098 0.636 0.063) 9.121 26.648 ( 11.895 -0.519 -0.014) 11.906 26.695 ( 15.325 2.521 0.015) 15.531 27.061 ( 43.236 -26.291 -10.023) 51.586 29.037 ( -14.023 3.253 -0.313) 14.399 29.109 ( -12.467 2.123 1.118) 12.696 29.192 ( -13.967 0.792 1.299) 14.050 29.430 ( -14.598 -6.266 -0.966) 15.915 29.919 ( 16.106 9.141 0.723) 18.533 30.291 ( 8.791 -4.912 0.596) 10.087 30.565 ( -6.642 13.176 -3.828) 15.244 30.713 ( 0.419 -1.580 -0.028) 1.635 30.849 ( 1.138 7.010 -1.876) 7.346 30.913 ( 2.184 2.057 -1.468) 3.340 31.048 ( 5.527 -3.193 -0.516) 6.403 31.164 ( 10.447 -8.894 -2.230) 13.900 31.563 ( 2.421 4.917 -0.538) 5.508 31.804 ( 1.798 -4.606 1.456) 5.154 32.047 ( -9.383 2.012 1.180) 9.668 32.112 ( -12.183 4.786 -4.043) 13.700 32.139 ( -6.670 3.641 -1.827) 7.816 32.311 ( -3.262 -3.736 -1.754) 5.261 32.462 ( 1.947 12.967 -16.368) 20.972 32.570 ( 8.395 2.391 -3.351) 9.350 32.649 ( 7.785 5.219 -8.348) 12.552 32.725 ( 13.326 -0.085 -1.618) 13.424 33.089 ( -4.269 23.636 -28.638) 37.377 33.432 ( -4.377 -1.408 -2.392) 5.183 33.674 ( -6.552 10.340 -9.062) 15.230 34.142 ( -6.159 -1.497 -10.108) 11.931 34.207 ( -4.606 -0.740 -3.624) 5.907 34.235 ( -13.389 -5.017 -29.164) 32.480 34.925 ( -0.183 0.500 0.040) 0.533 34.962 ( 0.798 -1.407 2.373) 2.872 35.030 ( 1.701 1.793 4.346) 4.999 35.077 ( -0.035 -0.485 2.549) 2.595 35.654 ( 2.717 1.342 -0.329) 3.048 35.710 ( 4.130 -0.415 0.222) 4.156 35.728 ( 7.602 0.545 -8.441) 11.373 35.790 ( 6.753 -3.470 -6.528) 10.013 35.856 ( 2.700 1.269 4.054) 5.033 35.934 ( 3.225 -1.304 0.416) 3.503 36.274 ( -4.729 5.268 29.332) 30.174 36.511 ( -9.786 -3.073 14.539) 17.793 36.653 ( 8.140 1.236 3.348) 8.888 37.093 ( -0.729 -31.146 56.071) 64.145 38.412 ( -11.900 11.271 -3.985) 16.868 38.812 ( -9.295 -7.528 -2.151) 12.152 ======================= Grid point 11 (8/69) ======================= q-point: ( 0.22 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( 21.316 13.373 14.413) 28.999 1.576 ( 16.069 23.255 12.066) 30.734 1.830 ( 5.938 -7.799 7.523) 12.356 2.040 ( 21.198 2.253 6.709) 22.348 2.198 ( 12.070 2.822 11.825) 17.131 2.268 ( 18.085 -4.035 15.446) 24.123 2.280 ( 2.236 -5.390 2.514) 6.354 2.353 ( 0.879 1.883 -6.327) 6.660 2.552 ( 4.735 -4.821 5.299) 8.587 2.643 ( 1.762 -3.614 2.380) 4.672 2.798 ( -6.656 4.421 -4.803) 9.323 2.804 ( -1.786 -1.134 0.110) 2.118 2.937 ( 1.084 3.210 2.036) 3.953 2.973 ( 6.706 0.941 4.110) 7.922 2.996 ( -5.252 1.208 -2.329) 5.871 3.110 ( 2.407 8.621 2.765) 9.368 3.151 ( 0.900 4.079 1.675) 4.500 3.232 ( -2.055 -5.968 4.497) 7.750 3.297 ( 2.288 -2.337 -3.170) 4.554 3.389 ( -0.754 4.214 7.922) 9.005 3.486 ( 2.153 -4.071 2.003) 5.022 3.582 ( 2.085 2.553 -1.114) 3.480 3.628 ( -2.714 -0.792 -0.291) 2.842 3.645 ( -4.559 -0.177 -2.665) 5.284 3.764 ( 3.257 3.315 0.392) 4.664 3.804 ( 7.032 -3.895 -3.525) 8.778 3.858 ( -2.905 2.071 -4.795) 5.976 3.951 ( 5.696 -1.340 2.079) 6.210 4.008 ( 5.858 4.392 -4.149) 8.415 4.024 ( -0.049 -6.592 5.406) 8.525 4.180 ( 6.450 7.042 2.437) 9.855 4.260 ( 9.324 -1.417 -6.064) 11.213 4.340 ( 6.273 -1.220 -4.826) 8.008 4.443 ( 7.535 -11.609 0.959) 13.874 4.503 ( 2.047 0.680 5.257) 5.682 4.574 ( 5.012 2.798 1.775) 6.009 4.678 ( 7.113 9.483 -0.257) 11.857 4.719 ( -0.543 -1.591 -0.517) 1.759 4.846 ( 1.760 -1.708 -3.340) 4.143 4.940 ( 0.668 0.528 2.831) 2.956 5.004 ( -2.466 -2.360 3.674) 5.015 5.109 ( -7.755 6.354 -7.155) 12.317 5.156 ( -3.156 -9.362 -4.339) 10.790 5.189 ( -4.341 4.251 0.517) 6.098 5.212 ( 0.010 5.329 0.843) 5.396 5.374 ( -4.591 0.091 -3.572) 5.818 5.406 ( 2.874 -1.367 -8.237) 8.831 5.421 ( -1.252 -4.145 -2.507) 5.003 5.485 ( 5.338 2.054 -7.653) 9.554 5.675 ( 0.243 -1.803 0.890) 2.026 5.736 ( 3.449 3.219 -3.141) 5.667 5.802 ( -0.284 -3.026 -0.477) 3.077 5.869 ( -1.896 -3.601 -3.252) 5.209 5.926 ( -4.160 2.139 0.359) 4.692 6.017 ( -4.375 2.833 -3.578) 6.322 6.046 ( 6.528 -0.556 -4.424) 7.905 6.096 ( 1.547 -1.517 -2.699) 3.461 6.179 ( 2.560 -3.718 -0.965) 4.616 6.294 ( -2.850 7.356 -6.058) 9.946 6.337 ( 4.116 -3.640 2.239) 5.933 6.411 ( 3.096 -5.705 3.407) 7.331 6.475 ( -0.109 -2.926 5.849) 6.541 6.534 ( -0.273 -3.153 0.360) 3.185 6.573 ( 0.533 -4.779 -2.689) 5.509 6.706 ( -2.840 5.100 0.957) 5.915 6.826 ( -5.497 -0.681 5.584) 7.866 6.855 ( -3.716 -0.697 -0.107) 3.782 6.940 ( -5.812 2.224 1.289) 6.355 6.960 ( -5.090 0.277 3.912) 6.426 7.085 ( -6.951 -4.402 1.999) 8.467 7.229 ( 2.713 0.927 -0.592) 2.927 7.269 ( -3.338 -0.773 2.266) 4.108 7.359 ( -4.053 -1.423 1.944) 4.715 7.398 ( -2.036 -1.443 1.028) 2.699 7.506 ( -4.301 3.172 4.653) 7.085 7.592 ( -3.287 -2.156 0.298) 3.942 8.280 ( -18.388 1.608 -2.312) 18.602 8.322 ( -14.593 3.538 0.013) 15.015 8.478 ( -16.329 -5.006 -2.088) 17.207 8.558 ( -15.028 -5.057 1.668) 15.944 8.970 ( 0.629 4.300 1.935) 4.757 9.002 ( -0.503 2.739 -0.860) 2.915 9.080 ( -0.155 1.679 -3.986) 4.328 9.163 ( 4.479 -0.880 -0.018) 4.565 9.270 ( 2.938 -0.590 -0.916) 3.133 9.333 ( 3.569 -3.589 -1.582) 5.303 9.381 ( 4.100 -0.819 -2.182) 4.716 9.424 ( 3.159 -2.334 0.261) 3.936 9.444 ( 6.566 -1.244 1.228) 6.795 9.492 ( 2.099 -1.713 -0.178) 2.715 9.637 ( 4.458 0.027 -1.712) 4.776 9.742 ( 0.901 -4.301 0.073) 4.395 9.885 ( 1.836 1.572 2.826) 3.719 10.033 ( -6.697 -3.160 0.709) 7.439 10.144 ( -9.116 4.762 3.421) 10.839 10.193 ( -11.250 2.617 0.950) 11.590 10.267 ( -11.356 -0.159 0.574) 11.372 10.401 ( -10.542 -0.555 -0.856) 10.592 10.508 ( -7.931 -1.065 0.389) 8.011 10.583 ( -6.931 0.195 -2.507) 7.373 10.677 ( -7.052 3.069 -2.576) 8.111 10.809 ( -4.372 4.170 -1.104) 6.142 10.918 ( -5.524 -5.171 1.058) 7.640 11.021 ( -5.131 -2.657 -0.634) 5.813 11.546 ( 11.759 -0.500 -0.255) 11.772 11.569 ( 12.480 -0.504 -0.234) 12.492 11.642 ( 6.138 -2.726 0.515) 6.736 11.646 ( 6.855 -2.823 -0.186) 7.416 12.025 ( 4.521 3.176 0.915) 5.600 12.154 ( -2.139 2.358 -0.175) 3.189 12.249 ( -3.529 3.781 0.772) 5.229 12.257 ( -0.026 1.797 0.004) 1.797 12.333 ( 0.429 -2.179 0.139) 2.225 12.387 ( -0.545 -1.407 -0.841) 1.727 12.444 ( -1.092 -1.224 -0.309) 1.669 12.503 ( -0.914 -1.613 -0.846) 2.038 12.642 ( 3.837 7.046 1.092) 8.097 12.785 ( 1.195 5.486 0.091) 5.615 12.918 ( -0.104 -4.926 0.337) 4.938 12.971 ( -0.495 -3.298 -0.085) 3.336 13.321 ( 4.388 7.429 -0.508) 8.643 13.353 ( 4.055 5.995 0.588) 7.261 13.645 ( 8.161 -7.879 -0.048) 11.344 13.727 ( 5.091 -9.393 -0.782) 10.712 14.086 ( -1.786 13.225 1.002) 13.383 14.100 ( -1.315 5.423 -1.871) 5.885 14.244 ( 1.627 -2.284 0.632) 2.875 14.319 ( -2.171 -0.036 -0.224) 2.183 14.381 ( 1.103 5.533 2.223) 6.063 14.538 ( 1.106 9.839 -2.166) 10.135 14.773 ( 2.003 1.263 0.159) 2.374 14.814 ( 0.310 0.832 0.350) 0.954 14.980 ( 6.613 1.909 0.343) 6.892 15.174 ( 7.788 2.036 0.064) 8.050 15.267 ( 7.454 -1.941 -0.417) 7.713 15.287 ( 9.825 -2.111 0.012) 10.049 15.450 ( 9.787 -0.678 -1.062) 9.867 15.570 ( 1.177 1.105 -1.160) 1.988 15.597 ( -4.565 -4.191 0.044) 6.197 15.650 ( -6.252 -0.607 0.005) 6.282 15.865 ( 6.072 0.097 2.272) 6.484 15.913 ( 1.793 -3.623 2.265) 4.634 16.082 ( 3.344 0.614 -6.852) 7.649 16.182 ( -1.778 -3.360 -5.820) 6.951 16.594 ( 1.756 1.802 -0.278) 2.531 16.627 ( 3.370 0.639 1.893) 3.918 16.658 ( 4.232 -1.281 -0.754) 4.486 16.744 ( 1.097 -3.755 -7.002) 8.021 17.310 ( -0.189 1.091 0.654) 1.286 17.341 ( -0.206 -0.305 0.141) 0.394 17.364 ( 1.160 1.687 -0.192) 2.057 17.430 ( 1.476 -1.111 -0.003) 1.847 19.783 ( 4.947 3.183 0.630) 5.916 19.969 ( 2.659 -3.750 -2.804) 5.385 20.042 ( 5.302 0.066 -0.043) 5.303 20.096 ( 4.895 -1.733 -2.866) 5.932 20.419 ( -5.984 2.322 -0.085) 6.419 20.506 ( -4.669 -1.427 0.693) 4.932 20.795 ( -2.086 0.906 -1.253) 2.597 20.843 ( -1.766 -1.041 -0.302) 2.072 22.061 ( 7.867 2.396 2.110) 8.491 22.094 ( 4.088 1.963 1.947) 4.936 22.178 ( 7.827 -1.992 -0.900) 8.126 22.209 ( 5.475 -1.633 -0.360) 5.724 22.949 ( -7.377 1.901 -1.645) 7.794 23.055 ( -6.857 -1.852 -2.729) 7.609 23.090 ( -12.470 -0.864 3.313) 12.931 23.165 ( -9.004 -4.416 1.363) 10.121 26.824 ( 16.590 1.847 0.803) 16.711 26.915 ( 21.242 -1.126 0.884) 21.290 26.982 ( 20.926 4.138 -0.654) 21.341 27.461 ( 28.949 -21.122 -15.610) 39.088 28.743 ( -21.284 6.168 -0.308) 22.162 28.846 ( -20.632 6.149 -0.149) 21.529 28.980 ( -16.663 -4.446 2.094) 17.372 29.156 ( -18.246 -7.091 -1.734) 19.653 30.185 ( 15.613 7.924 1.672) 17.589 30.393 ( 6.648 7.550 -1.996) 10.256 30.562 ( 5.592 3.373 0.688) 6.567 30.725 ( 1.475 -2.431 -0.421) 2.875 30.901 ( 6.178 5.475 -0.045) 8.255 30.944 ( 4.715 2.431 -2.162) 5.728 31.144 ( 7.459 -4.607 -1.707) 8.932 31.271 ( 7.068 -8.204 -2.000) 11.012 31.578 ( -0.905 5.691 -0.575) 5.791 31.810 ( -4.528 2.682 -1.514) 5.476 31.859 ( -8.645 5.378 -2.961) 10.603 31.948 ( -4.238 3.571 0.315) 5.551 32.044 ( -5.221 3.082 -2.179) 6.443 32.203 ( -2.723 4.223 -8.586) 9.948 32.274 ( 4.809 5.821 -8.506) 11.374 32.721 ( 10.323 -1.299 -1.145) 10.468 32.773 ( 9.885 -0.346 0.377) 9.898 32.859 ( 7.726 -2.343 -6.812) 10.563 33.087 ( 11.433 2.384 -2.315) 11.906 33.272 ( -2.040 -4.177 -11.330) 12.246 33.603 ( -3.515 1.700 2.691) 4.742 33.749 ( -7.343 -4.448 -13.071) 15.639 34.002 ( -7.244 1.059 -6.256) 9.630 34.055 ( -7.877 -1.174 -5.573) 9.720 34.916 ( -0.743 1.203 -0.433) 1.479 34.983 ( -0.609 -1.813 1.318) 2.322 35.106 ( 2.201 0.837 3.392) 4.130 35.120 ( 1.067 0.041 3.915) 4.058 35.693 ( 3.367 1.459 -3.900) 5.355 35.722 ( 4.403 2.770 -4.864) 7.122 35.793 ( 5.124 -2.612 -1.528) 5.951 35.834 ( 5.535 -2.143 -2.447) 6.420 35.969 ( 3.067 1.211 7.486) 8.180 36.008 ( 2.206 -1.200 7.646) 8.048 36.382 ( -6.127 2.651 8.698) 10.964 36.498 ( -3.867 -1.834 3.294) 5.401 36.945 ( 9.292 6.108 17.681) 20.887 37.462 ( -8.091 -18.283 29.349) 35.512 38.145 ( -14.284 11.494 -6.609) 19.489 38.575 ( -15.890 -8.007 -4.534) 18.362 ======================= Grid point 12 (9/69) ======================= q-point: ( 0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( 15.877 12.983 10.937) 23.243 1.919 ( 15.186 12.319 7.669) 21.004 2.062 ( 10.549 -7.051 8.793) 15.437 2.187 ( -4.099 -1.063 -2.514) 4.925 2.321 ( -1.504 -3.464 -6.089) 7.165 2.401 ( 11.992 0.704 6.953) 13.880 2.483 ( 7.694 -6.015 -0.923) 9.809 2.560 ( -6.088 -3.215 2.068) 7.189 2.596 ( 2.288 -1.208 0.896) 2.738 2.636 ( 10.533 -5.545 4.676) 12.789 2.779 ( -2.947 -0.843 4.763) 5.664 2.856 ( 3.826 6.759 -1.462) 7.903 2.913 ( 2.887 -2.659 1.396) 4.166 3.045 ( 3.475 -2.997 6.375) 7.854 3.123 ( 7.226 5.091 1.904) 9.042 3.172 ( 1.972 2.822 -0.673) 3.508 3.210 ( -0.721 0.514 2.661) 2.804 3.318 ( -12.227 0.467 -1.811) 12.369 3.340 ( 2.097 -3.293 0.135) 3.906 3.402 ( 8.021 7.039 13.766) 17.418 3.477 ( 0.361 -0.934 -1.708) 1.980 3.557 ( 1.760 2.304 8.906) 9.366 3.637 ( 3.174 5.828 0.544) 6.658 3.652 ( 5.990 0.984 -2.539) 6.580 3.811 ( 4.511 -2.034 3.829) 6.256 3.845 ( 4.433 3.536 -3.458) 6.642 3.915 ( 6.410 0.791 -5.482) 8.471 4.012 ( 5.772 3.372 8.749) 11.010 4.110 ( 3.386 -1.162 3.657) 5.118 4.160 ( 9.130 3.520 -1.819) 9.952 4.244 ( 2.983 1.715 -0.613) 3.495 4.297 ( 2.682 6.871 -6.352) 9.734 4.390 ( 3.306 0.134 -1.721) 3.730 4.513 ( 0.663 -1.070 1.701) 2.116 4.611 ( 1.425 1.666 -1.198) 2.498 4.630 ( -2.423 -5.993 -1.523) 6.641 4.654 ( 3.796 -3.204 3.413) 6.027 4.779 ( -0.937 -1.646 -4.524) 4.904 4.799 ( -0.239 -1.007 3.414) 3.568 4.916 ( -3.873 4.412 -7.670) 9.659 4.980 ( 0.462 -2.771 -8.007) 8.486 5.062 ( -1.923 -0.333 4.300) 4.722 5.085 ( -2.234 1.032 3.094) 3.954 5.132 ( 3.428 3.115 -0.848) 4.709 5.212 ( -1.170 3.549 -0.883) 3.840 5.274 ( 0.598 1.816 -2.108) 2.846 5.367 ( 2.770 -2.226 -6.229) 7.172 5.402 ( 1.463 0.620 -0.270) 1.612 5.491 ( 0.808 0.332 -1.689) 1.901 5.661 ( -2.167 7.230 -4.426) 8.750 5.732 ( -0.003 -5.846 0.605) 5.878 5.779 ( -1.747 -7.040 2.946) 7.829 5.835 ( 0.095 -3.534 -3.542) 5.004 5.864 ( 1.897 -0.604 -4.072) 4.533 5.936 ( -2.436 -0.098 -2.302) 3.353 6.057 ( -0.003 -1.373 -1.830) 2.288 6.121 ( 0.693 -3.566 -2.053) 4.173 6.137 ( -4.693 3.037 -4.076) 6.918 6.192 ( 0.039 -1.946 -0.536) 2.019 6.396 ( -7.595 -6.256 2.359) 10.119 6.433 ( -1.015 -3.299 -2.650) 4.351 6.491 ( -3.884 -5.272 4.092) 7.722 6.539 ( 8.081 -0.371 -1.727) 8.272 6.618 ( 4.341 -3.163 1.544) 5.589 6.751 ( 3.168 4.094 3.742) 6.387 6.795 ( -1.835 -1.001 -1.174) 2.398 6.815 ( -5.019 0.309 0.544) 5.058 6.854 ( -3.000 -0.577 5.568) 6.351 6.956 ( 3.162 3.663 -0.007) 4.839 7.059 ( -3.628 -2.542 4.888) 6.597 7.234 ( -1.175 0.721 -0.339) 1.420 7.245 ( -2.608 1.599 -1.159) 3.271 7.308 ( -1.151 -1.251 -1.738) 2.431 7.355 ( -2.704 -0.548 0.643) 2.832 7.474 ( -5.592 0.438 2.827) 6.281 7.498 ( -7.342 -1.729 -1.846) 7.765 7.971 ( -14.959 3.832 -4.052) 15.965 8.115 ( -12.684 4.020 -0.107) 13.307 8.204 ( -13.902 -4.692 -3.500) 15.084 8.362 ( -11.634 -5.944 0.790) 13.088 9.001 ( 0.073 3.114 1.357) 3.398 9.006 ( 1.203 2.399 1.328) 2.994 9.054 ( 2.581 2.881 -3.576) 5.268 9.214 ( 1.537 -3.517 0.556) 3.878 9.318 ( 4.447 0.938 -0.551) 4.578 9.376 ( 3.896 -2.593 -1.145) 4.818 9.409 ( 1.586 -0.465 -0.796) 1.834 9.457 ( 1.290 -2.048 -2.545) 3.512 9.534 ( 4.510 -1.618 -0.105) 4.793 9.567 ( 5.872 -1.557 2.962) 6.759 9.661 ( 1.153 -1.821 -1.522) 2.639 9.738 ( -1.073 -4.400 0.160) 4.532 9.870 ( -9.058 1.326 0.619) 9.175 9.908 ( -7.162 -1.652 -0.519) 7.369 10.020 ( -8.897 1.260 1.300) 9.079 10.102 ( -10.009 -1.096 0.822) 10.102 10.121 ( -1.655 6.027 4.646) 7.788 10.268 ( -5.554 0.927 -1.105) 5.739 10.416 ( -6.191 -1.154 -0.754) 6.342 10.461 ( -4.311 -2.521 0.447) 5.014 10.563 ( -3.629 5.545 -1.996) 6.921 10.745 ( -3.022 3.538 -0.184) 4.657 10.852 ( -3.882 -4.837 0.294) 6.209 10.931 ( -4.468 -2.631 -1.427) 5.378 11.695 ( 6.713 -1.200 -0.916) 6.881 11.716 ( 6.233 0.283 0.784) 6.289 11.744 ( 7.955 -1.562 -0.367) 8.116 11.769 ( 6.509 -0.710 0.859) 6.604 12.094 ( 0.187 2.784 0.194) 2.797 12.121 ( 1.309 2.326 0.340) 2.691 12.209 ( -2.312 5.418 1.690) 6.128 12.246 ( -1.501 2.557 0.190) 2.971 12.339 ( -0.636 -2.796 -1.185) 3.103 12.389 ( 1.408 -4.921 0.863) 5.191 12.437 ( 0.927 -4.038 -0.864) 4.233 12.493 ( 1.655 -3.246 -0.398) 3.665 12.719 ( 3.687 4.545 1.004) 5.938 12.795 ( 0.045 3.914 -0.314) 3.927 12.915 ( -1.351 -3.877 0.551) 4.142 12.935 ( -3.460 -2.863 -0.335) 4.504 13.401 ( 6.543 8.903 -0.468) 11.059 13.437 ( 5.543 8.594 0.603) 10.244 13.692 ( -1.408 -2.063 0.216) 2.507 13.731 ( -3.019 -0.865 0.069) 3.141 14.117 ( 4.738 3.291 -1.434) 5.945 14.163 ( 8.056 3.030 1.010) 8.666 14.282 ( 2.941 -2.171 -0.001) 3.655 14.313 ( 1.746 -1.411 -0.187) 2.253 14.412 ( -0.300 9.774 1.692) 9.924 14.536 ( 1.209 9.432 -0.580) 9.527 14.756 ( -5.339 0.176 -1.679) 5.600 14.761 ( -5.255 1.342 1.718) 5.689 15.099 ( 7.875 -0.377 0.436) 7.896 15.252 ( 2.910 0.292 -0.516) 2.969 15.331 ( -0.039 -5.586 0.677) 5.627 15.417 ( 4.040 -2.590 0.635) 4.841 15.521 ( -0.982 -1.067 1.623) 2.176 15.563 ( 1.834 -1.401 -0.093) 2.310 15.592 ( 0.500 -3.510 0.139) 3.548 15.637 ( 5.770 -2.687 -1.084) 6.456 15.977 ( 4.448 1.148 2.409) 5.187 16.026 ( 8.232 -0.417 1.230) 8.334 16.046 ( 0.536 1.363 -2.416) 2.825 16.131 ( 3.399 -2.191 -6.381) 7.555 16.594 ( -0.529 1.149 -0.111) 1.270 16.661 ( -2.296 -1.597 -3.144) 4.208 16.685 ( 0.239 0.466 2.261) 2.321 16.719 ( 2.729 -0.960 -0.813) 3.005 17.320 ( 0.648 0.949 0.767) 1.381 17.349 ( 0.943 -0.377 0.582) 1.170 17.379 ( 0.904 1.505 -0.459) 1.815 17.443 ( 0.448 -1.156 -0.587) 1.371 19.891 ( 7.427 1.570 1.219) 7.689 19.994 ( 4.777 -2.527 -2.854) 6.112 20.136 ( 6.265 -0.578 -0.326) 6.300 20.144 ( 4.878 -0.913 -1.988) 5.346 20.319 ( -7.007 2.669 0.773) 7.538 20.423 ( -6.743 -1.838 0.584) 7.014 20.740 ( -2.900 1.357 -1.219) 3.426 20.799 ( -2.878 -1.166 -0.891) 3.231 22.182 ( 6.091 2.568 0.263) 6.615 22.204 ( 7.917 2.364 0.017) 8.262 22.302 ( 8.827 -2.302 0.140) 9.123 22.330 ( 9.223 -2.384 0.165) 9.528 22.805 ( -8.549 2.166 -1.347) 8.922 22.917 ( -10.306 1.039 1.683) 10.494 22.932 ( -9.089 -3.242 -0.652) 9.672 23.025 ( -10.033 -3.834 0.532) 10.754 27.134 ( 20.643 3.745 1.908) 21.066 27.249 ( 20.869 4.992 -3.010) 21.668 27.356 ( 24.891 -3.756 5.385) 25.742 27.674 ( 19.934 -12.412 -12.033) 26.386 28.411 ( -20.922 6.262 0.561) 21.846 28.510 ( -20.757 6.270 -1.447) 21.732 28.723 ( -18.861 -6.494 2.242) 20.073 28.827 ( -20.227 -7.381 -3.911) 21.884 30.421 ( 11.550 6.165 1.850) 13.222 30.487 ( 7.103 6.982 -0.422) 9.969 30.655 ( 4.226 0.858 1.098) 4.450 30.741 ( 1.285 -1.470 -1.106) 2.244 31.005 ( 7.148 2.192 -2.083) 7.761 31.036 ( 8.978 4.570 1.306) 10.159 31.209 ( 3.277 -5.579 -2.417) 6.907 31.350 ( 4.552 -6.737 -0.520) 8.148 31.524 ( -3.719 7.154 -0.077) 8.063 31.656 ( -7.969 8.772 -3.282) 12.297 31.735 ( -8.937 -4.123 1.004) 9.893 31.875 ( -8.355 -0.111 -2.636) 8.762 31.989 ( 4.705 6.645 -0.551) 8.161 32.132 ( 1.146 3.921 -2.479) 4.778 32.333 ( 7.832 -4.457 -3.060) 9.517 32.597 ( -4.052 -8.420 -19.044) 21.213 32.934 ( 9.199 1.306 1.845) 9.472 32.986 ( 9.056 -1.127 4.071) 9.993 33.255 ( 11.836 0.346 -1.482) 11.933 33.276 ( 10.056 -0.504 -4.231) 10.921 33.591 ( -3.128 0.210 3.839) 4.956 33.605 ( -4.618 -0.390 -0.399) 4.652 33.820 ( -8.058 0.407 -4.329) 9.156 33.853 ( -9.531 -0.935 -5.466) 11.027 34.894 ( -1.042 1.588 -0.832) 2.074 34.974 ( -1.322 -1.821 -0.037) 2.250 35.168 ( 1.516 0.701 2.895) 3.342 35.194 ( 2.025 -0.432 3.769) 4.300 35.660 ( 1.207 3.640 -5.785) 6.941 35.763 ( 3.044 1.554 -0.326) 3.434 35.828 ( 2.572 -3.820 -2.512) 5.245 35.880 ( 3.928 -2.559 -2.834) 5.478 36.122 ( 3.464 1.599 10.837) 11.488 36.181 ( 5.664 -1.225 9.920) 11.489 36.362 ( -3.320 2.636 2.098) 4.729 36.475 ( -1.725 -1.898 0.491) 2.612 37.242 ( 5.508 5.517 13.263) 15.385 37.579 ( -5.702 -8.793 9.948) 14.449 37.858 ( -12.983 8.762 -3.209) 15.989 38.250 ( -16.732 -7.811 -6.248) 19.494 ======================= Grid point 13 (10/69) ======================= q-point: ( 0.44 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 0.914 5.023 -0.992) 5.201 2.094 ( -2.558 -7.245 -2.736) 8.156 2.130 ( 1.593 -1.662 1.400) 2.694 2.217 ( -0.602 -2.741 3.512) 4.495 2.295 ( 8.202 0.195 1.984) 8.441 2.493 ( 3.560 4.078 -0.383) 5.426 2.586 ( 5.987 3.247 2.462) 7.243 2.615 ( 2.731 -5.843 3.118) 7.164 2.719 ( -0.816 4.603 0.254) 4.681 2.743 ( 1.459 -4.985 2.388) 5.717 2.802 ( -1.790 -1.148 3.844) 4.393 2.854 ( 3.579 4.290 -2.585) 6.156 2.996 ( 1.385 8.939 -0.240) 9.049 3.040 ( -1.992 2.864 -1.437) 3.773 3.151 ( -0.032 0.014 1.799) 1.799 3.172 ( 5.175 -2.381 -3.145) 6.507 3.229 ( -4.222 -1.037 4.830) 6.498 3.301 ( -1.704 -3.436 -1.657) 4.178 3.336 ( 3.210 -0.980 2.092) 3.955 3.465 ( 2.739 2.601 2.453) 4.504 3.604 ( 1.039 6.704 -1.155) 6.882 3.689 ( 0.153 0.154 4.245) 4.251 3.705 ( 2.985 4.334 -1.682) 5.525 3.749 ( -3.295 -2.026 2.748) 4.745 3.811 ( 7.044 3.698 3.368) 8.639 3.960 ( 5.766 0.822 0.693) 5.866 4.050 ( 10.916 -3.639 5.188) 12.622 4.083 ( -2.720 0.596 -6.780) 7.329 4.187 ( 0.159 12.880 2.925) 13.209 4.242 ( 1.664 5.589 2.832) 6.483 4.288 ( 4.539 4.758 -1.932) 6.854 4.336 ( 2.627 -2.318 4.263) 5.518 4.376 ( -0.174 -1.452 -1.389) 2.017 4.470 ( -2.917 0.982 -4.002) 5.048 4.518 ( -1.565 -3.090 -6.253) 7.148 4.601 ( -0.005 -1.473 4.575) 4.806 4.710 ( -5.948 -8.631 -4.704) 11.490 4.756 ( -3.491 1.957 -7.407) 8.419 4.775 ( 1.916 1.634 4.202) 4.898 4.859 ( 0.241 -0.620 0.985) 1.188 4.900 ( 3.493 -4.381 -0.148) 5.605 5.018 ( -3.552 -3.001 -1.397) 4.855 5.071 ( -2.967 1.565 1.959) 3.884 5.200 ( 4.103 3.812 0.542) 5.627 5.236 ( 3.466 2.454 -2.317) 4.838 5.300 ( -0.244 5.416 3.957) 6.712 5.400 ( 2.582 -2.613 -0.491) 3.706 5.465 ( 6.344 4.418 1.005) 7.796 5.492 ( 1.462 1.950 -1.765) 3.009 5.569 ( -2.707 3.136 0.240) 4.150 5.707 ( -5.351 -6.472 -1.770) 8.582 5.739 ( -3.701 3.753 -0.593) 5.304 5.806 ( -0.401 -6.854 -3.352) 7.640 5.872 ( 0.530 -2.434 1.983) 3.184 5.928 ( 7.047 -4.631 -3.384) 9.086 6.007 ( -4.539 -2.778 0.271) 5.328 6.069 ( -0.114 -0.754 -1.522) 1.703 6.112 ( -0.533 -1.338 -0.089) 1.443 6.145 ( -3.104 0.489 -2.188) 3.829 6.301 ( -2.229 -3.494 -0.356) 4.160 6.406 ( -0.844 -3.127 0.143) 3.242 6.448 ( -4.372 -9.817 1.827) 10.901 6.605 ( -1.179 -1.589 -1.031) 2.231 6.653 ( 2.249 -1.004 -0.733) 2.569 6.739 ( -0.740 1.723 0.623) 1.976 6.803 ( 0.158 -0.375 1.552) 1.604 6.869 ( 5.481 0.221 1.382) 5.657 6.968 ( 5.777 -0.409 2.861) 6.460 7.019 ( 5.147 2.435 -0.079) 5.695 7.095 ( 2.077 0.348 1.806) 2.775 7.144 ( -5.920 3.663 0.498) 6.979 7.174 ( -4.883 1.223 0.769) 5.092 7.280 ( -3.937 -1.487 -3.001) 5.169 7.308 ( -3.570 -2.940 -2.109) 5.083 7.412 ( -0.941 -0.708 -0.297) 1.215 7.433 ( 0.415 -0.289 2.106) 2.166 7.760 ( -6.407 3.536 -2.480) 7.727 7.943 ( -6.971 7.431 -0.801) 10.221 8.012 ( -5.583 -5.612 -2.078) 8.184 8.232 ( -4.900 -6.486 -0.038) 8.129 9.023 ( -0.023 3.180 1.971) 3.741 9.036 ( 0.995 0.910 0.824) 1.581 9.061 ( 1.757 2.303 -2.494) 3.822 9.229 ( 0.138 -4.656 0.219) 4.664 9.380 ( 3.085 1.659 -0.251) 3.512 9.412 ( 2.157 -0.581 -2.021) 3.013 9.417 ( -0.139 -1.374 0.094) 1.384 9.442 ( 0.349 -1.548 0.339) 1.623 9.597 ( 2.767 -0.772 -0.493) 2.915 9.646 ( -0.754 -3.469 0.544) 3.592 9.683 ( 4.458 -0.844 1.327) 4.727 9.718 ( -1.276 -1.713 -0.517) 2.198 9.757 ( -3.774 -0.392 0.398) 3.815 9.776 ( -7.575 -1.702 -0.281) 7.769 9.941 ( -1.477 -0.370 0.258) 1.545 9.988 ( -5.283 -0.655 0.008) 5.323 10.175 ( 0.498 4.061 1.416) 4.329 10.205 ( -0.762 2.376 1.648) 2.990 10.296 ( -4.451 2.388 -3.017) 5.884 10.449 ( -1.001 -4.813 1.347) 5.097 10.525 ( -0.201 6.433 -0.085) 6.437 10.715 ( -0.922 3.378 0.165) 3.506 10.802 ( -2.002 -4.508 -0.583) 4.967 10.871 ( -1.453 -3.131 -0.704) 3.522 11.745 ( 1.528 0.515 -0.225) 1.629 11.793 ( 2.480 0.700 0.370) 2.603 11.835 ( 1.559 -1.377 0.038) 2.080 11.841 ( 3.733 -2.730 -0.124) 4.627 12.069 ( -0.734 3.667 -0.345) 3.755 12.159 ( 0.306 2.502 0.543) 2.579 12.212 ( 0.513 4.250 0.883) 4.371 12.228 ( -1.291 3.503 0.521) 3.770 12.321 ( -0.154 -3.850 -0.533) 3.890 12.411 ( 1.253 -3.593 -0.537) 3.842 12.457 ( 0.982 -5.645 0.712) 5.774 12.535 ( 2.587 -5.828 -0.103) 6.377 12.744 ( -0.697 2.545 -0.512) 2.688 12.806 ( 2.123 2.325 0.236) 3.157 12.856 ( -4.072 -1.287 -0.486) 4.298 12.910 ( -1.005 -2.316 0.616) 2.598 13.501 ( 5.860 8.155 -0.289) 10.046 13.520 ( 3.805 7.998 0.238) 8.860 13.643 ( -4.312 4.917 0.230) 6.544 13.678 ( -2.693 4.634 0.157) 5.362 14.173 ( 2.688 1.975 -0.403) 3.360 14.269 ( 4.208 -0.453 0.106) 4.234 14.317 ( -0.761 2.149 -0.011) 2.280 14.345 ( 1.665 1.053 0.153) 1.976 14.449 ( 5.166 4.871 0.809) 7.147 14.574 ( 2.833 2.189 -0.935) 3.701 14.624 ( -5.811 1.414 -1.251) 6.110 14.692 ( -6.481 0.026 1.947) 6.767 15.213 ( 6.178 -3.832 -0.153) 7.271 15.280 ( -0.275 -4.094 -0.040) 4.104 15.303 ( -0.695 -4.261 0.529) 4.350 15.374 ( -6.294 -4.451 0.215) 7.711 15.569 ( 3.040 -0.123 0.712) 3.125 15.606 ( -0.154 -1.936 -0.142) 1.948 15.623 ( 4.587 1.175 -0.049) 4.735 15.677 ( -0.381 -0.966 0.169) 1.052 16.035 ( 1.716 1.311 -0.395) 2.195 16.074 ( 2.899 1.992 0.157) 3.521 16.123 ( 1.327 -1.628 -1.755) 2.737 16.134 ( 3.392 -0.673 0.283) 3.470 16.592 ( 0.283 -0.330 -0.032) 0.436 16.602 ( -1.560 -0.625 -0.821) 1.870 16.687 ( -1.425 1.160 0.837) 2.019 16.739 ( 0.646 -0.921 -0.236) 1.149 17.344 ( 0.877 1.301 0.767) 1.746 17.374 ( 0.401 0.551 -0.357) 0.769 17.385 ( 1.071 -0.040 0.712) 1.286 17.430 ( -0.818 -1.142 -0.966) 1.705 20.023 ( 6.335 -0.521 1.448) 6.520 20.045 ( 4.728 -1.498 -2.243) 5.444 20.158 ( -0.675 0.928 -0.956) 1.493 20.214 ( -0.951 0.030 0.756) 1.215 20.245 ( -0.279 1.318 0.450) 1.420 20.337 ( -3.537 -1.685 0.237) 3.925 20.691 ( -1.607 1.164 -0.538) 2.056 20.746 ( -1.962 -1.131 -0.752) 2.387 22.276 ( 4.549 2.787 0.234) 5.340 22.304 ( 4.506 2.613 -0.277) 5.216 22.426 ( 5.232 -3.198 -0.201) 6.135 22.450 ( 5.071 -2.896 -0.536) 5.865 22.686 ( -4.191 1.729 -0.156) 4.536 22.790 ( -6.838 -1.776 2.100) 7.371 22.818 ( -4.022 0.170 -1.270) 4.222 22.891 ( -6.221 -2.133 -0.060) 6.576 27.451 ( 13.930 5.282 0.397) 14.903 27.493 ( 13.194 6.789 -0.549) 14.848 27.769 ( 12.193 -7.779 -0.343) 14.467 27.840 ( 15.897 -6.737 1.891) 17.369 28.139 ( -12.514 4.948 0.084) 13.457 28.218 ( -11.836 4.825 -1.169) 12.835 28.451 ( -17.548 -7.434 -5.147) 19.740 28.504 ( -11.298 -7.090 1.405) 13.412 30.541 ( 3.388 4.602 -0.390) 5.728 30.616 ( 6.365 3.946 2.938) 8.045 30.699 ( 0.120 1.081 -1.181) 1.606 30.732 ( -0.540 1.625 -0.562) 1.802 31.097 ( 7.468 1.473 -2.097) 7.896 31.187 ( -3.708 -1.473 0.557) 4.029 31.209 ( 9.052 2.972 2.061) 9.747 31.371 ( -2.708 -3.168 0.575) 4.208 31.490 ( -4.921 2.243 -0.495) 5.430 31.530 ( 3.798 2.918 -5.169) 7.047 31.622 ( -7.628 -0.549 2.996) 8.214 31.732 ( -4.588 -0.203 -2.236) 5.108 32.064 ( 2.977 5.730 0.796) 6.506 32.153 ( 1.297 1.670 1.409) 2.541 32.349 ( -1.208 -5.890 -7.599) 9.690 32.423 ( 2.308 -6.081 -3.275) 7.282 33.061 ( 3.807 1.885 1.464) 4.494 33.147 ( 4.916 -1.863 2.924) 6.015 33.381 ( 7.036 0.336 -2.339) 7.422 33.396 ( 7.054 -0.186 -1.380) 7.190 33.556 ( -2.500 0.555 1.341) 2.891 33.590 ( -1.340 -0.876 2.140) 2.672 33.665 ( -6.869 0.102 -2.793) 7.416 33.672 ( -5.880 -0.175 -1.599) 6.096 34.872 ( -0.515 1.648 -0.441) 1.782 34.953 ( -0.694 -1.748 -0.296) 1.904 35.213 ( 0.687 0.736 1.439) 1.756 35.250 ( 0.961 -0.839 1.558) 2.014 35.621 ( 0.133 4.367 -2.382) 4.976 35.795 ( 1.118 1.251 0.011) 1.678 35.826 ( 0.518 -4.219 -1.334) 4.455 35.898 ( 1.248 -2.969 -0.886) 3.340 36.279 ( 2.709 1.792 5.674) 6.538 36.333 ( -0.009 2.172 1.520) 2.651 36.360 ( 2.532 -0.486 3.863) 4.644 36.459 ( -0.553 -1.972 -0.052) 2.048 37.401 ( 1.902 3.827 4.514) 6.216 37.495 ( -4.656 3.478 -3.583) 6.828 37.754 ( -3.435 -0.976 3.699) 5.141 37.983 ( -7.938 -7.010 -3.578) 11.178 ======================= Grid point 18 (11/69) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 46 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.101 ( 0.000 -29.890 0.000) 29.890 1.101 ( 0.000 29.890 0.000) 29.890 1.344 ( 0.000 -33.478 0.000) 33.478 1.344 ( 0.000 33.478 0.000) 33.478 2.067 ( 0.000 -9.897 0.000) 9.897 2.067 ( 0.000 9.897 0.000) 9.897 2.319 ( 0.000 -44.378 0.000) 44.378 2.319 ( 0.000 44.378 0.000) 44.378 2.606 ( 0.000 -4.000 0.000) 4.000 2.606 ( 0.000 4.000 0.000) 4.000 2.686 ( 0.000 -9.140 0.000) 9.140 2.686 ( 0.000 9.140 0.000) 9.140 2.928 ( 0.000 -0.633 0.000) 0.633 2.928 ( 0.000 0.633 0.000) 0.633 3.089 ( 0.000 -4.372 0.000) 4.372 3.089 ( 0.000 4.372 0.000) 4.372 3.220 ( 0.000 -8.133 0.000) 8.133 3.220 ( 0.000 8.133 0.000) 8.133 3.357 ( 0.000 -1.359 0.000) 1.359 3.357 ( 0.000 1.359 0.000) 1.359 3.415 ( 0.000 -15.378 0.000) 15.378 3.415 ( 0.000 15.378 0.000) 15.378 3.559 ( 0.000 -6.305 0.000) 6.305 3.559 ( 0.000 6.305 0.000) 6.305 3.798 ( 0.000 -5.411 0.000) 5.411 3.798 ( 0.000 5.411 0.000) 5.411 3.831 ( 0.000 -6.076 0.000) 6.076 3.831 ( 0.000 6.076 0.000) 6.076 3.974 ( 0.000 -6.874 0.000) 6.874 3.974 ( 0.000 6.874 0.000) 6.874 4.231 ( 0.000 -3.194 0.000) 3.194 4.231 ( 0.000 3.194 0.000) 3.194 4.329 ( 0.000 -12.892 0.000) 12.892 4.329 ( 0.000 12.892 0.000) 12.892 4.394 ( 0.000 -20.465 0.000) 20.465 4.394 ( 0.000 20.465 0.000) 20.465 4.571 ( 0.000 -9.266 0.000) 9.266 4.571 ( 0.000 9.266 0.000) 9.266 4.775 ( 0.000 -1.346 0.000) 1.346 4.775 ( 0.000 1.346 0.000) 1.346 5.042 ( 0.000 -1.464 0.000) 1.464 5.042 ( 0.000 1.464 0.000) 1.464 5.243 ( 0.000 -1.982 0.000) 1.982 5.243 ( 0.000 1.982 0.000) 1.982 5.418 ( 0.000 -4.586 0.000) 4.586 5.418 ( 0.000 4.586 0.000) 4.586 5.567 ( 0.000 -3.178 0.000) 3.178 5.567 ( 0.000 3.178 0.000) 3.178 5.600 ( 0.000 -7.435 0.000) 7.435 5.600 ( 0.000 7.435 0.000) 7.435 5.790 ( 0.000 -2.035 0.000) 2.035 5.790 ( 0.000 2.035 0.000) 2.035 5.968 ( 0.000 -2.844 0.000) 2.844 5.968 ( 0.000 2.844 0.000) 2.844 5.993 ( 0.000 -10.188 0.000) 10.188 5.993 ( 0.000 10.188 0.000) 10.188 6.112 ( 0.000 -2.144 0.000) 2.144 6.112 ( 0.000 2.144 0.000) 2.144 6.199 ( 0.000 -2.858 0.000) 2.858 6.199 ( 0.000 2.858 0.000) 2.858 6.477 ( 0.000 -1.464 0.000) 1.464 6.477 ( 0.000 1.464 0.000) 1.464 6.554 ( 0.000 -4.888 0.000) 4.888 6.554 ( 0.000 4.888 0.000) 4.888 6.825 ( 0.000 -1.901 0.000) 1.901 6.825 ( 0.000 1.901 0.000) 1.901 6.945 ( 0.000 -5.288 0.000) 5.288 6.945 ( 0.000 5.288 0.000) 5.288 7.068 ( 0.000 -4.248 0.000) 4.248 7.068 ( 0.000 4.248 0.000) 4.248 7.232 ( 0.000 -2.713 0.000) 2.713 7.232 ( 0.000 2.713 0.000) 2.713 7.427 ( 0.000 -2.862 0.000) 2.862 7.427 ( 0.000 2.862 0.000) 2.862 7.586 ( 0.000 -3.535 0.000) 3.535 7.586 ( 0.000 3.535 0.000) 3.535 8.715 ( 0.000 -5.545 0.000) 5.545 8.715 ( 0.000 5.545 0.000) 5.545 8.858 ( 0.000 -1.153 0.000) 1.153 8.858 ( 0.000 1.153 0.000) 1.153 9.030 ( 0.000 -3.348 0.000) 3.348 9.030 ( 0.000 3.348 0.000) 3.348 9.050 ( 0.000 -7.645 0.000) 7.645 9.050 ( 0.000 7.645 0.000) 7.645 9.180 ( 0.000 -7.296 0.000) 7.296 9.180 ( 0.000 7.296 0.000) 7.296 9.304 ( 0.000 -1.398 0.000) 1.398 9.304 ( 0.000 1.398 0.000) 1.398 9.393 ( 0.000 -2.712 0.000) 2.712 9.393 ( 0.000 2.712 0.000) 2.712 9.618 ( 0.000 -4.259 0.000) 4.259 9.618 ( 0.000 4.259 0.000) 4.259 9.901 ( 0.000 -7.786 0.000) 7.786 9.901 ( 0.000 7.786 0.000) 7.786 10.456 ( 0.000 -2.396 0.000) 2.396 10.456 ( 0.000 2.396 0.000) 2.396 10.582 ( 0.000 -8.762 0.000) 8.762 10.582 ( 0.000 8.762 0.000) 8.762 10.728 ( 0.000 -3.991 0.000) 3.991 10.728 ( 0.000 3.991 0.000) 3.991 10.901 ( 0.000 -4.844 0.000) 4.844 10.901 ( 0.000 4.844 0.000) 4.844 11.095 ( 0.000 -3.802 0.000) 3.802 11.095 ( 0.000 3.802 0.000) 3.802 11.347 ( 0.000 -6.820 0.000) 6.820 11.347 ( 0.000 6.820 0.000) 6.820 11.385 ( 0.000 -9.534 0.000) 9.534 11.385 ( 0.000 9.534 0.000) 9.534 12.049 ( 0.000 -7.127 0.000) 7.127 12.049 ( 0.000 7.127 0.000) 7.127 12.292 ( 0.000 -4.828 0.000) 4.828 12.292 ( 0.000 4.828 0.000) 4.828 12.441 ( 0.000 -2.088 0.000) 2.088 12.441 ( 0.000 2.088 0.000) 2.088 12.545 ( 0.000 -2.591 0.000) 2.591 12.545 ( 0.000 2.591 0.000) 2.591 12.762 ( 0.000 -9.269 0.000) 9.269 12.762 ( 0.000 9.269 0.000) 9.269 12.858 ( 0.000 -3.631 0.000) 3.631 12.858 ( 0.000 3.631 0.000) 3.631 13.315 ( 0.000 -1.580 0.000) 1.580 13.315 ( 0.000 1.580 0.000) 1.580 13.356 ( 0.000 -4.109 0.000) 4.109 13.356 ( 0.000 4.109 0.000) 4.109 14.286 ( 0.000 -3.762 0.000) 3.762 14.286 ( 0.000 3.762 0.000) 3.762 14.351 ( 0.000 -7.593 0.000) 7.593 14.351 ( 0.000 7.593 0.000) 7.593 14.522 ( 0.000 -7.691 0.000) 7.691 14.522 ( 0.000 7.691 0.000) 7.691 14.656 ( 0.000 -0.592 0.000) 0.592 14.656 ( 0.000 0.592 0.000) 0.592 14.817 ( 0.000 -3.120 0.000) 3.120 14.817 ( 0.000 3.120 0.000) 3.120 15.075 ( 0.000 -3.927 0.000) 3.927 15.075 ( 0.000 3.927 0.000) 3.927 15.413 ( 0.000 -16.286 0.000) 16.286 15.413 ( 0.000 16.286 0.000) 16.286 15.811 ( 0.000 -1.874 0.000) 1.874 15.811 ( 0.000 1.874 0.000) 1.874 15.863 ( 0.000 -2.096 0.000) 2.096 15.863 ( 0.000 2.096 0.000) 2.096 16.291 ( 0.000 -3.356 0.000) 3.356 16.291 ( 0.000 3.356 0.000) 3.356 16.547 ( 0.000 -2.552 0.000) 2.552 16.547 ( 0.000 2.552 0.000) 2.552 16.563 ( 0.000 -2.363 0.000) 2.363 16.563 ( 0.000 2.363 0.000) 2.363 17.330 ( 0.000 -0.791 0.000) 0.791 17.330 ( 0.000 0.791 0.000) 0.791 17.372 ( 0.000 -1.285 0.000) 1.285 17.372 ( 0.000 1.285 0.000) 1.285 19.834 ( 0.000 -7.989 0.000) 7.989 19.834 ( 0.000 7.989 0.000) 7.989 19.996 ( 0.000 -3.216 0.000) 3.216 19.996 ( 0.000 3.216 0.000) 3.216 20.544 ( 0.000 -1.234 0.000) 1.234 20.544 ( 0.000 1.234 0.000) 1.234 20.843 ( 0.000 -1.821 0.000) 1.821 20.843 ( 0.000 1.821 0.000) 1.821 21.932 ( 0.000 -0.481 0.000) 0.481 21.932 ( 0.000 0.481 0.000) 0.481 22.102 ( 0.000 -1.930 0.000) 1.930 22.102 ( 0.000 1.930 0.000) 1.930 23.154 ( 0.000 -3.213 0.000) 3.213 23.154 ( 0.000 3.213 0.000) 3.213 23.336 ( 0.000 -0.698 0.000) 0.698 23.336 ( 0.000 0.698 0.000) 0.698 26.551 ( 0.000 -0.274 0.000) 0.274 26.551 ( 0.000 0.274 0.000) 0.274 26.579 ( 0.000 -0.046 0.000) 0.046 26.579 ( 0.000 0.046 0.000) 0.046 29.172 ( 0.000 -1.822 0.000) 1.822 29.172 ( 0.000 1.822 0.000) 1.822 29.446 ( 0.000 -6.707 0.000) 6.707 29.446 ( 0.000 6.707 0.000) 6.707 29.986 ( 0.000 -12.723 0.000) 12.723 29.986 ( 0.000 12.723 0.000) 12.723 30.700 ( 0.000 -0.224 0.000) 0.224 30.700 ( 0.000 0.224 0.000) 0.224 30.949 ( 0.000 -2.797 0.000) 2.797 30.949 ( 0.000 2.797 0.000) 2.797 30.973 ( 0.000 -2.378 0.000) 2.378 30.973 ( 0.000 2.378 0.000) 2.378 31.663 ( 0.000 -6.760 0.000) 6.760 31.663 ( 0.000 6.760 0.000) 6.760 32.196 ( 0.000 -3.386 0.000) 3.386 32.196 ( 0.000 3.386 0.000) 3.386 32.264 ( 0.000 -3.004 0.000) 3.004 32.264 ( 0.000 3.004 0.000) 3.004 32.525 ( 0.000 -0.414 0.000) 0.414 32.525 ( 0.000 0.414 0.000) 0.414 32.602 ( 0.000 -0.529 0.000) 0.529 32.602 ( 0.000 0.529 0.000) 0.529 33.465 ( 0.000 -0.011 0.000) 0.011 33.465 ( 0.000 0.011 0.000) 0.011 34.241 ( 0.000 -1.064 0.000) 1.064 34.241 ( 0.000 1.064 0.000) 1.064 34.657 ( 0.000 -0.893 0.000) 0.893 34.657 ( 0.000 0.893 0.000) 0.893 34.898 ( 0.000 -0.697 0.000) 0.697 34.898 ( 0.000 0.697 0.000) 0.697 35.007 ( 0.000 -0.807 0.000) 0.807 35.007 ( 0.000 0.807 0.000) 0.807 35.647 ( 0.000 -2.222 0.000) 2.222 35.647 ( 0.000 2.222 0.000) 2.222 35.671 ( 0.000 -2.087 0.000) 2.087 35.671 ( 0.000 2.087 0.000) 2.087 35.824 ( 0.000 -1.715 0.000) 1.715 35.824 ( 0.000 1.715 0.000) 1.715 36.159 ( 0.000 -3.504 0.000) 3.504 36.159 ( 0.000 3.504 0.000) 3.504 36.591 ( 0.000 -0.150 0.000) 0.150 36.591 ( 0.000 0.150 0.000) 0.150 38.724 ( 0.000 -9.990 0.000) 9.990 38.724 ( 0.000 9.990 0.000) 9.990 ======================= Grid point 20 (12/69) ======================= q-point: ( 0.11 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 4.300 -24.251 13.566) 28.118 1.306 ( 4.300 24.251 13.566) 28.118 1.476 ( 17.240 -22.140 11.293) 30.248 1.476 ( 17.240 22.140 11.293) 30.248 2.070 ( 1.521 -10.109 0.609) 10.240 2.070 ( 1.521 10.109 0.609) 10.240 2.388 ( 7.385 -33.020 -1.753) 33.881 2.388 ( 7.385 33.020 -1.753) 33.881 2.554 ( -3.338 -6.655 -0.231) 7.449 2.554 ( -3.338 6.655 -0.231) 7.449 2.750 ( 5.721 -8.723 -0.030) 10.431 2.750 ( 5.721 8.723 -0.030) 10.431 2.916 ( -3.335 -5.978 3.841) 7.849 2.916 ( -3.335 5.978 3.841) 7.849 3.108 ( 4.019 -3.738 -1.011) 5.581 3.108 ( 4.019 3.738 -1.011) 5.581 3.202 ( -4.966 -3.419 -1.223) 6.152 3.202 ( -4.966 3.419 -1.223) 6.152 3.329 ( -2.724 -6.148 0.257) 6.729 3.329 ( -2.724 6.148 0.257) 6.729 3.428 ( 5.640 -9.993 -2.094) 11.665 3.428 ( 5.640 9.993 -2.094) 11.665 3.617 ( 4.047 -3.689 1.028) 5.571 3.617 ( 4.047 3.689 1.028) 5.571 3.768 ( -4.075 -4.079 4.899) 7.566 3.768 ( -4.075 4.079 4.899) 7.566 3.870 ( 3.455 -7.745 2.119) 8.742 3.870 ( 3.455 7.745 2.119) 8.742 3.987 ( 0.852 -3.627 -1.436) 3.993 3.987 ( 0.852 3.627 -1.436) 3.993 4.190 ( 0.459 -2.594 -2.084) 3.358 4.190 ( 0.459 2.594 -2.084) 3.358 4.340 ( 2.771 -3.593 -3.902) 5.985 4.340 ( 2.771 3.593 -3.902) 5.985 4.486 ( 4.003 -6.575 -2.380) 8.057 4.486 ( 4.003 6.575 -2.380) 8.057 4.567 ( 7.277 -0.951 3.435) 8.103 4.567 ( 7.277 0.951 3.435) 8.103 4.870 ( 3.241 -8.395 5.236) 10.411 4.870 ( 3.241 8.395 5.236) 10.411 5.021 ( -4.643 -1.928 1.694) 5.305 5.021 ( -4.643 1.928 1.694) 5.305 5.246 ( 1.879 -1.808 -1.289) 2.909 5.246 ( 1.879 1.808 -1.289) 2.909 5.394 ( -3.891 -2.576 -0.676) 4.715 5.394 ( -3.891 2.576 -0.676) 4.715 5.502 ( 0.029 -2.102 -9.446) 9.677 5.502 ( 0.029 2.102 -9.446) 9.677 5.573 ( -2.287 -6.283 0.412) 6.699 5.573 ( -2.287 6.283 0.412) 6.699 5.786 ( 1.851 -2.021 -4.481) 5.252 5.786 ( 1.851 2.021 -4.481) 5.252 5.962 ( 0.614 -2.703 0.080) 2.773 5.962 ( 0.614 2.703 0.080) 2.773 6.013 ( -0.059 -8.102 1.208) 8.192 6.013 ( -0.059 8.102 1.208) 8.192 6.126 ( -0.772 -5.790 -0.962) 5.920 6.126 ( -0.772 5.790 -0.962) 5.920 6.237 ( 5.827 -2.147 1.683) 6.434 6.237 ( 5.827 2.147 1.683) 6.434 6.434 ( -2.847 -4.112 -4.577) 6.780 6.434 ( -2.847 4.112 -4.577) 6.780 6.518 ( -0.968 -1.009 1.088) 1.772 6.518 ( -0.968 1.009 1.088) 1.772 6.844 ( -0.554 -2.045 3.275) 3.901 6.844 ( -0.554 2.045 3.275) 3.901 6.954 ( -4.182 -6.528 1.204) 7.845 6.954 ( -4.182 6.528 1.204) 7.845 7.057 ( -2.241 -6.350 -0.355) 6.743 7.057 ( -2.241 6.350 -0.355) 6.743 7.233 ( 0.084 -2.219 1.143) 2.498 7.233 ( 0.084 2.219 1.143) 2.498 7.379 ( -3.723 -1.596 0.395) 4.070 7.379 ( -3.723 1.596 0.395) 4.070 7.578 ( -1.330 -3.407 0.669) 3.718 7.578 ( -1.330 3.407 0.669) 3.718 8.595 ( -13.615 -3.515 -0.049) 14.061 8.595 ( -13.615 3.515 -0.049) 14.061 8.689 ( -15.900 -1.514 0.334) 15.975 8.689 ( -15.900 1.514 0.334) 15.975 9.031 ( 0.264 -2.450 -0.084) 2.466 9.031 ( 0.264 2.450 -0.084) 2.466 9.119 ( 3.433 -3.173 -0.819) 4.746 9.119 ( 3.433 3.173 -0.819) 4.746 9.216 ( 4.856 -3.473 -0.669) 6.008 9.216 ( 4.856 3.473 -0.669) 6.008 9.317 ( 3.727 -2.596 -2.236) 5.062 9.317 ( 3.727 2.596 -2.236) 5.062 9.410 ( 1.631 -2.660 0.496) 3.160 9.410 ( 1.631 2.660 0.496) 3.160 9.637 ( 2.253 -3.861 -0.244) 4.477 9.637 ( 2.253 3.861 -0.244) 4.477 9.915 ( 0.428 -6.946 1.812) 7.191 9.915 ( 0.428 6.946 1.812) 7.191 10.370 ( -10.092 -1.676 1.068) 10.286 10.370 ( -10.092 1.676 1.068) 10.286 10.505 ( -9.405 -6.864 -0.277) 11.647 10.505 ( -9.405 6.864 -0.277) 11.647 10.671 ( -5.649 -3.381 -1.071) 6.670 10.671 ( -5.649 3.381 -1.071) 6.670 10.872 ( -3.997 -5.207 -0.321) 6.572 10.872 ( -3.997 5.207 -0.321) 6.572 11.027 ( -5.935 -4.874 -1.345) 7.797 11.027 ( -5.935 4.874 -1.345) 7.797 11.415 ( 8.382 -4.524 -0.147) 9.526 11.415 ( 8.382 4.524 -0.147) 9.526 11.451 ( 7.631 -5.788 0.156) 9.579 11.451 ( 7.631 5.788 0.156) 9.579 12.072 ( 2.424 -6.925 0.540) 7.357 12.072 ( 2.424 6.925 0.540) 7.357 12.285 ( 0.389 -4.587 -1.233) 4.766 12.285 ( 0.389 4.587 -1.233) 4.766 12.408 ( -3.579 -0.968 0.674) 3.768 12.408 ( -3.579 0.968 0.674) 3.768 12.513 ( -3.495 -2.993 -0.393) 4.618 12.513 ( -3.495 2.993 -0.393) 4.618 12.769 ( 0.524 -8.483 0.511) 8.514 12.769 ( 0.524 8.483 0.511) 8.514 12.876 ( 0.958 -4.678 0.084) 4.775 12.876 ( 0.958 4.678 0.084) 4.775 13.387 ( 6.668 -6.073 0.136) 9.020 13.387 ( 6.668 6.073 0.136) 9.020 13.402 ( 6.621 -6.814 0.018) 9.501 13.402 ( 6.621 6.814 0.018) 9.501 14.239 ( -4.644 -2.049 -0.043) 5.077 14.239 ( -4.644 2.049 -0.043) 5.077 14.341 ( -4.408 -3.277 0.451) 5.511 14.341 ( -4.408 3.277 0.451) 5.511 14.494 ( 2.373 -12.462 -0.446) 12.693 14.494 ( 2.373 12.462 -0.446) 12.693 14.711 ( 5.475 -2.632 1.028) 6.161 14.711 ( 5.475 2.632 1.028) 6.161 14.951 ( 11.885 -6.575 0.385) 13.588 14.951 ( 11.885 6.575 0.385) 13.588 15.131 ( 6.995 -1.812 -0.669) 7.257 15.131 ( 6.995 1.812 -0.669) 7.257 15.452 ( 3.936 -12.537 -0.122) 13.140 15.452 ( 3.936 12.537 -0.122) 13.140 15.747 ( -6.425 -1.459 -0.284) 6.595 15.747 ( -6.425 1.459 -0.284) 6.595 15.843 ( -3.981 -1.734 1.494) 4.592 15.843 ( -3.981 1.734 1.494) 4.592 16.191 ( -2.571 -6.145 -6.547) 9.341 16.191 ( -2.571 6.145 -6.547) 9.341 16.557 ( 4.176 -1.604 -1.010) 4.586 16.557 ( 4.176 1.604 -1.010) 4.586 16.647 ( 5.306 -4.691 -1.368) 7.214 16.647 ( 5.306 4.691 -1.368) 7.214 17.330 ( -0.280 -0.971 0.412) 1.092 17.330 ( -0.280 0.971 0.412) 1.092 17.382 ( 0.908 -1.445 0.212) 1.720 17.382 ( 0.908 1.445 0.212) 1.720 19.841 ( 1.276 -7.348 -0.371) 7.468 19.841 ( 1.276 7.348 -0.371) 7.468 20.013 ( 3.632 -2.700 -2.015) 4.954 20.013 ( 3.632 2.700 -2.015) 4.954 20.526 ( -2.345 -1.589 -0.074) 2.833 20.526 ( -2.345 1.589 -0.074) 2.833 20.840 ( -0.544 -1.358 -0.084) 1.466 20.840 ( -0.544 1.358 -0.084) 1.466 21.983 ( 4.718 -1.890 2.143) 5.516 21.983 ( 4.718 1.890 2.143) 5.516 22.118 ( 2.617 -1.962 -0.872) 3.385 22.118 ( 2.617 1.962 -0.872) 3.385 23.111 ( -3.977 -3.196 -2.040) 5.494 23.111 ( -3.977 3.196 -2.040) 5.494 23.248 ( -10.274 -0.537 1.553) 10.404 23.248 ( -10.274 0.537 1.553) 10.404 26.633 ( 10.407 -0.876 0.105) 10.444 26.633 ( 10.407 0.876 0.105) 10.444 26.783 ( 23.122 -7.392 -1.424) 24.317 26.783 ( 23.122 7.392 -1.424) 24.317 29.095 ( -10.539 -2.695 0.874) 10.913 29.095 ( -10.539 2.695 0.874) 10.913 29.287 ( -16.787 -7.666 -0.140) 18.455 29.287 ( -16.787 7.666 -0.140) 18.455 30.126 ( 13.077 -10.984 1.598) 17.153 30.126 ( 13.077 10.984 1.598) 17.153 30.678 ( -1.454 -2.494 -0.709) 2.973 30.678 ( -1.454 2.494 -0.709) 2.973 30.943 ( 3.144 -1.777 -3.402) 4.961 30.943 ( 3.144 1.777 -3.402) 4.961 31.034 ( 4.892 -4.440 1.312) 6.735 31.034 ( 4.892 4.440 1.312) 6.735 31.685 ( 1.704 -7.047 0.927) 7.309 31.685 ( 1.704 7.047 0.927) 7.309 32.096 ( -9.610 -2.587 0.947) 9.997 32.096 ( -9.610 2.587 0.947) 9.997 32.226 ( -5.194 -4.681 -1.576) 7.168 32.226 ( -5.194 4.681 -1.576) 7.168 32.558 ( 7.364 -2.367 -0.934) 7.791 32.558 ( 7.364 2.367 -0.934) 7.791 32.716 ( 11.274 -1.249 -3.798) 11.962 32.716 ( 11.274 1.249 -3.798) 11.962 33.374 ( -6.006 -5.781 -11.321) 14.059 33.374 ( -6.006 5.781 -11.321) 14.059 33.978 ( -15.962 -15.661 -34.890) 41.441 33.978 ( -15.962 15.661 -34.890) 41.441 34.193 ( -5.376 -0.385 -5.895) 7.988 34.193 ( -5.376 0.385 -5.895) 7.988 34.939 ( 0.285 -0.956 1.115) 1.496 34.939 ( 0.285 0.956 1.115) 1.496 35.060 ( 0.848 -1.277 3.597) 3.910 35.060 ( 0.848 1.277 3.597) 3.910 35.689 ( 3.235 -1.894 -0.238) 3.756 35.689 ( 3.235 1.894 -0.238) 3.756 35.742 ( 7.135 -1.244 -4.945) 8.770 35.742 ( 7.135 1.244 -4.945) 8.770 35.893 ( 3.599 -2.467 1.623) 4.656 35.893 ( 3.599 2.467 1.623) 4.656 36.404 ( -9.813 -7.461 29.335) 31.820 36.404 ( -9.813 7.461 29.335) 31.820 36.733 ( 11.682 -8.715 17.432) 22.722 36.733 ( 11.682 8.715 17.432) 22.722 38.626 ( -9.525 -11.058 -3.535) 15.017 38.626 ( -9.525 11.058 -3.535) 15.017 ======================= Grid point 22 (13/69) ======================= q-point: ( 0.22 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( 14.533 -15.732 7.808) 22.797 1.548 ( 14.533 15.732 7.808) 22.797 1.978 ( 16.967 -13.749 18.529) 28.640 1.978 ( 16.967 13.749 18.529) 28.640 2.160 ( 8.262 -7.328 1.638) 11.164 2.160 ( 8.262 7.328 1.638) 11.164 2.410 ( -1.566 -1.109 -0.135) 1.923 2.410 ( -1.566 1.109 -0.135) 1.923 2.566 ( 2.890 -6.336 -1.199) 7.066 2.566 ( 2.890 6.336 -1.199) 7.066 2.786 ( -0.627 -2.751 0.805) 2.934 2.786 ( -0.627 2.751 0.805) 2.934 2.961 ( -2.899 -1.944 5.426) 6.451 2.961 ( -2.899 1.944 5.426) 6.451 3.077 ( 1.656 -5.782 -3.425) 6.921 3.077 ( 1.656 5.782 -3.425) 6.921 3.188 ( 4.107 -4.163 1.825) 6.126 3.188 ( 4.107 4.163 1.825) 6.126 3.326 ( 1.760 -8.253 4.245) 9.446 3.326 ( 1.760 8.253 4.245) 9.446 3.525 ( 4.396 -7.224 -3.661) 9.215 3.525 ( 4.396 7.224 -3.661) 9.215 3.674 ( 5.434 -1.415 1.231) 5.749 3.674 ( 5.434 1.415 1.231) 5.749 3.791 ( -8.315 -1.957 5.122) 9.960 3.791 ( -8.315 1.957 5.122) 9.960 3.894 ( 1.637 -5.127 1.879) 5.700 3.894 ( 1.637 5.127 1.879) 5.700 4.038 ( 10.046 -4.556 0.675) 11.051 4.038 ( 10.046 4.556 0.675) 11.051 4.196 ( 5.303 -4.017 -5.006) 8.326 4.196 ( 5.303 4.017 -5.006) 8.326 4.400 ( 5.825 -6.725 1.938) 9.105 4.400 ( 5.825 6.725 1.938) 9.105 4.521 ( 4.806 -8.739 -3.226) 10.482 4.521 ( 4.806 8.739 -3.226) 10.482 4.734 ( 4.589 -3.479 -0.177) 5.761 4.734 ( 4.589 3.479 -0.177) 5.761 4.918 ( 1.891 -9.030 -1.172) 9.300 4.918 ( 1.891 9.030 -1.172) 9.300 4.980 ( -2.457 -3.745 5.147) 6.822 4.980 ( -2.457 3.745 5.147) 6.822 5.226 ( -5.735 -1.283 -4.359) 7.317 5.226 ( -5.735 1.283 -4.359) 7.317 5.297 ( -1.295 -5.329 -1.648) 5.726 5.297 ( -1.295 5.329 -1.648) 5.726 5.413 ( -0.442 -3.283 -4.376) 5.489 5.413 ( -0.442 3.283 -4.376) 5.489 5.547 ( -1.365 -8.297 -1.326) 8.512 5.547 ( -1.365 8.297 -1.326) 8.512 5.759 ( 3.641 -0.561 -6.007) 7.047 5.759 ( 3.641 0.561 -6.007) 7.047 5.936 ( -4.199 -5.169 -4.596) 8.091 5.936 ( -4.199 5.169 -4.596) 8.091 6.030 ( 0.844 -1.799 1.787) 2.673 6.030 ( 0.844 1.799 1.787) 2.673 6.077 ( -1.038 -3.958 -0.946) 4.200 6.077 ( -1.038 3.958 -0.946) 4.200 6.356 ( 2.090 -2.625 0.629) 3.414 6.356 ( 2.090 2.625 0.629) 3.414 6.403 ( 3.312 -5.747 1.448) 6.789 6.403 ( 3.312 5.747 1.448) 6.789 6.501 ( -1.027 -3.729 -2.460) 4.584 6.501 ( -1.027 3.729 -2.460) 4.584 6.804 ( -6.488 -3.715 -1.275) 7.585 6.804 ( -6.488 3.715 -1.275) 7.585 6.874 ( -3.728 -3.887 2.535) 5.953 6.874 ( -3.728 3.887 2.535) 5.953 7.015 ( -3.381 -2.845 2.336) 4.999 7.015 ( -3.381 2.845 2.336) 4.999 7.249 ( 0.442 -1.262 -0.033) 1.338 7.249 ( 0.442 1.262 -0.033) 1.338 7.360 ( -2.408 -1.642 2.352) 3.745 7.360 ( -2.408 1.642 2.352) 3.745 7.553 ( -3.388 -2.083 0.644) 4.029 7.553 ( -3.388 2.083 0.644) 4.029 8.340 ( -17.250 -4.054 -0.995) 17.748 8.340 ( -17.250 4.054 -0.995) 17.748 8.450 ( -15.099 -4.933 0.463) 15.891 8.450 ( -15.099 4.933 0.463) 15.891 9.027 ( 0.203 -0.514 -0.544) 0.776 9.027 ( 0.203 0.514 -0.544) 0.776 9.138 ( 0.975 -2.910 -1.030) 3.237 9.138 ( 0.975 2.910 -1.030) 3.237 9.279 ( 4.496 -2.087 -1.277) 5.119 9.279 ( 4.496 2.087 -1.277) 5.119 9.372 ( 5.634 -1.786 -1.810) 6.181 9.372 ( 5.634 1.786 -1.810) 6.181 9.453 ( 2.603 -1.803 1.277) 3.414 9.453 ( 2.603 1.803 1.277) 3.414 9.663 ( 1.767 -2.971 -1.406) 3.732 9.663 ( 1.767 2.971 -1.406) 3.732 9.943 ( -1.040 -4.360 2.615) 5.189 9.943 ( -1.040 4.360 2.615) 5.189 10.210 ( -12.094 -1.445 2.178) 12.374 10.210 ( -12.094 1.445 2.178) 12.374 10.327 ( -11.451 -5.572 0.179) 12.736 10.327 ( -11.451 5.572 0.179) 12.736 10.552 ( -7.256 -3.190 -1.644) 8.095 10.552 ( -7.256 3.190 -1.644) 8.095 10.781 ( -5.488 -6.520 -1.162) 8.601 10.781 ( -5.488 6.520 -1.162) 8.601 10.929 ( -5.268 -5.848 -0.301) 7.877 10.929 ( -5.268 5.848 -0.301) 7.877 11.567 ( 10.586 -2.373 -0.499) 10.860 11.567 ( 10.586 2.373 -0.499) 10.860 11.597 ( 9.781 -1.787 0.523) 9.956 11.597 ( 9.781 1.787 0.523) 9.956 12.122 ( 1.871 -5.700 1.576) 6.203 12.122 ( 1.871 5.700 1.576) 6.203 12.278 ( 0.543 -3.121 -1.273) 3.414 12.278 ( 0.543 3.121 -1.273) 3.414 12.360 ( -3.463 -1.322 0.392) 3.728 12.360 ( -3.463 1.322 0.392) 3.728 12.445 ( -3.697 -3.250 -0.648) 4.965 12.445 ( -3.697 3.250 -0.648) 4.965 12.792 ( 1.424 -7.768 0.776) 7.935 12.792 ( 1.424 7.768 0.776) 7.935 12.882 ( 0.009 -5.128 -0.158) 5.130 12.882 ( 0.009 5.128 -0.158) 5.130 13.488 ( 6.927 -8.695 -0.272) 11.121 13.488 ( 6.927 8.695 -0.272) 11.121 13.530 ( 7.774 -10.888 0.094) 13.379 13.530 ( 7.774 10.888 0.094) 13.379 14.184 ( -1.659 -3.741 0.242) 4.100 14.184 ( -1.659 3.741 0.242) 4.100 14.261 ( -3.550 -5.620 -0.191) 6.650 14.261 ( -3.550 5.620 -0.191) 6.650 14.580 ( 4.727 -8.537 1.578) 9.885 14.580 ( 4.727 8.537 1.578) 9.885 14.777 ( 1.459 -0.346 -0.453) 1.567 14.777 ( 1.459 0.346 -0.453) 1.567 15.114 ( 7.093 -8.853 0.603) 11.360 15.114 ( 7.093 8.853 0.603) 11.360 15.253 ( 7.988 -1.160 0.171) 8.074 15.253 ( 7.988 1.160 0.171) 8.074 15.490 ( 1.178 -4.530 -0.108) 4.682 15.490 ( 1.178 4.530 -0.108) 4.682 15.616 ( -7.120 -2.805 -0.999) 7.718 15.616 ( -7.120 2.805 -0.999) 7.718 15.871 ( 5.682 -0.941 2.033) 6.108 15.871 ( 5.682 0.941 2.033) 6.108 16.114 ( 1.129 -2.946 -6.100) 6.867 16.114 ( 1.129 2.946 -6.100) 6.867 16.627 ( 4.587 -1.310 -0.345) 4.782 16.627 ( 4.587 1.310 -0.345) 4.782 16.670 ( 0.704 -3.384 -1.472) 3.757 16.670 ( 0.704 3.384 -1.472) 3.757 17.330 ( -0.270 -0.884 0.388) 1.003 17.330 ( -0.270 0.884 0.388) 1.003 17.401 ( 1.294 -1.862 -0.091) 2.269 17.401 ( 1.294 1.862 -0.091) 2.269 19.870 ( 3.457 -5.539 -0.682) 6.565 19.870 ( 3.457 5.539 -0.682) 6.565 20.062 ( 5.820 -1.629 -2.547) 6.558 20.062 ( 5.820 1.629 -2.547) 6.558 20.468 ( -5.296 -2.474 0.244) 5.850 20.468 ( -5.296 2.474 0.244) 5.850 20.818 ( -1.858 -1.388 -0.610) 2.398 20.818 ( -1.858 1.388 -0.610) 2.398 22.112 ( 8.011 -1.790 2.412) 8.555 22.112 ( 8.011 1.790 2.412) 8.555 22.163 ( 5.046 -1.953 -1.461) 5.605 22.163 ( 5.046 1.953 -1.461) 5.605 22.999 ( -6.646 -3.156 -2.297) 7.707 22.999 ( -6.646 3.156 -2.297) 7.707 23.101 ( -11.513 -1.914 2.589) 11.955 23.101 ( -11.513 1.914 2.589) 11.955 26.870 ( 18.889 -2.750 1.273) 19.131 26.870 ( 18.889 2.750 1.273) 19.131 27.138 ( 25.342 -12.134 -5.117) 28.559 27.138 ( 25.342 12.134 -5.117) 28.559 28.871 ( -18.997 -6.522 0.875) 20.104 28.871 ( -18.997 6.522 0.875) 20.104 28.994 ( -19.887 -8.795 -0.544) 21.752 28.994 ( -19.887 8.795 -0.544) 21.752 30.352 ( 11.937 -7.673 2.493) 14.407 30.352 ( 11.937 7.673 2.493) 14.407 30.664 ( 1.356 -4.421 -1.123) 4.758 30.664 ( 1.356 4.421 -1.123) 4.758 30.979 ( 5.907 -1.736 -2.496) 6.644 30.979 ( 5.907 1.736 -2.496) 6.644 31.128 ( 5.890 -5.179 -0.218) 7.846 31.128 ( 5.890 5.179 -0.218) 7.846 31.706 ( -2.389 -6.995 1.968) 7.649 31.706 ( -2.389 6.995 1.968) 7.649 31.962 ( -8.886 -2.690 0.867) 9.324 31.962 ( -8.886 2.690 0.867) 9.324 32.132 ( -1.063 -5.692 -4.163) 7.132 32.132 ( -1.063 5.692 -4.163) 7.132 32.589 ( 1.701 -14.124 -16.649) 21.899 32.589 ( 1.701 14.124 -16.649) 21.899 32.801 ( 9.127 -2.892 -2.860) 9.992 32.801 ( 9.127 2.892 -2.860) 9.992 33.166 ( 5.044 -5.744 -8.544) 11.464 33.166 ( 5.044 5.744 -8.544) 11.464 33.659 ( -4.594 -4.123 -3.510) 7.101 33.659 ( -4.594 4.123 -3.510) 7.101 34.027 ( -7.658 -1.513 -6.055) 9.879 34.027 ( -7.658 1.513 -6.055) 9.879 34.946 ( -0.597 -1.877 0.535) 2.041 34.946 ( -0.597 1.877 0.535) 2.041 35.118 ( 1.445 -0.318 3.608) 3.899 35.118 ( 1.445 0.318 3.608) 3.899 35.735 ( 3.734 -2.864 -2.065) 5.139 35.735 ( 3.734 2.864 -2.065) 5.139 35.784 ( 5.420 -3.210 -4.577) 7.787 35.784 ( 5.420 3.210 -4.577) 7.787 35.986 ( 2.698 -0.859 7.875) 8.368 35.986 ( 2.698 0.859 7.875) 8.368 36.445 ( -5.161 -3.423 5.742) 8.445 36.445 ( -5.161 3.423 5.742) 8.445 37.138 ( 3.941 -14.011 24.891) 28.834 37.138 ( 3.941 14.011 24.891) 28.834 38.375 ( -14.951 -11.965 -6.198) 20.127 38.375 ( -14.951 11.965 -6.198) 20.127 ======================= Grid point 24 (14/69) ======================= q-point: ( 0.33 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( 13.596 -8.643 10.988) 19.501 1.900 ( 13.596 8.643 10.988) 19.501 2.206 ( -0.689 -5.300 -4.389) 6.916 2.206 ( -0.689 5.300 -4.389) 6.916 2.269 ( 5.066 -14.431 -3.202) 15.626 2.269 ( 5.066 14.431 -3.202) 15.626 2.483 ( 7.420 -6.980 5.535) 11.593 2.483 ( 7.420 6.980 5.535) 11.593 2.578 ( 1.330 -1.102 6.531) 6.756 2.578 ( 1.330 1.102 6.531) 6.756 2.813 ( 1.277 -4.641 0.971) 4.911 2.813 ( 1.277 4.641 0.971) 4.911 2.978 ( 3.759 -5.197 4.581) 7.882 2.978 ( 3.759 5.197 4.581) 7.882 3.164 ( 4.576 -0.726 1.139) 4.771 3.164 ( 4.576 0.726 1.139) 4.771 3.274 ( 1.929 -4.134 1.066) 4.685 3.274 ( 1.929 4.134 1.066) 4.685 3.404 ( -5.834 -6.863 -5.171) 10.386 3.404 ( -5.834 6.863 -5.171) 10.386 3.507 ( 6.916 -3.543 9.554) 12.315 3.507 ( 6.916 3.543 9.554) 12.315 3.697 ( 1.752 -4.441 6.253) 7.867 3.697 ( 1.752 4.441 6.253) 7.867 3.814 ( 3.699 -5.054 -3.961) 7.410 3.814 ( 3.699 5.054 -3.961) 7.410 4.045 ( 6.408 -6.340 2.897) 9.468 4.045 ( 6.408 6.340 2.897) 9.468 4.154 ( 6.367 -3.846 1.423) 7.573 4.154 ( 6.367 3.846 1.423) 7.573 4.323 ( 10.634 -9.427 2.639) 14.454 4.323 ( 10.634 9.427 2.639) 14.454 4.452 ( -0.345 -5.599 -2.266) 6.049 4.452 ( -0.345 5.599 -2.266) 6.049 4.546 ( 0.727 -7.687 -2.392) 8.083 4.546 ( 0.727 7.687 -2.392) 8.083 4.673 ( -2.615 -4.605 -3.224) 6.200 4.673 ( -2.615 4.605 -3.224) 6.200 4.896 ( -1.852 -4.868 -4.518) 6.895 4.896 ( -1.852 4.868 -4.518) 6.895 5.049 ( -5.455 -5.206 -3.280) 8.223 5.049 ( -5.455 5.206 -3.280) 8.223 5.103 ( 4.092 -4.915 3.872) 7.476 5.103 ( 4.092 4.915 3.872) 7.476 5.295 ( 1.627 -3.056 -0.390) 3.484 5.295 ( 1.627 3.056 -0.390) 3.484 5.382 ( 0.423 -3.725 -1.836) 4.174 5.382 ( 0.423 3.725 -1.836) 4.174 5.526 ( 0.602 -8.364 1.207) 8.472 5.526 ( 0.602 8.364 1.207) 8.472 5.749 ( 1.528 -1.828 -4.041) 4.692 5.749 ( 1.528 1.828 -4.041) 4.692 5.821 ( -1.639 -7.657 -4.828) 9.200 5.821 ( -1.639 7.657 -4.828) 9.200 5.983 ( -6.351 -5.285 0.011) 8.262 5.983 ( -6.351 5.285 0.011) 8.262 6.097 ( 2.009 -1.615 -1.686) 3.080 6.097 ( 2.009 1.615 -1.686) 3.080 6.289 ( -4.647 -6.525 -2.556) 8.408 6.289 ( -4.647 6.525 -2.556) 8.408 6.406 ( -4.323 -2.806 1.128) 5.276 6.406 ( -4.323 2.806 1.128) 5.276 6.556 ( 7.675 -2.222 -1.075) 8.062 6.556 ( 7.675 2.222 -1.075) 8.062 6.793 ( -0.347 -1.064 1.425) 1.812 6.793 ( -0.347 1.064 1.425) 1.812 6.823 ( -2.440 -2.251 3.992) 5.192 6.823 ( -2.440 2.251 3.992) 5.192 7.022 ( 0.750 -2.464 2.304) 3.456 7.022 ( 0.750 2.464 2.304) 3.456 7.254 ( 0.560 -2.256 -1.218) 2.624 7.254 ( 0.560 2.256 -1.218) 2.624 7.312 ( -4.947 -3.307 -0.109) 5.951 7.312 ( -4.947 3.307 -0.109) 5.951 7.481 ( -5.708 -0.509 -0.162) 5.733 7.481 ( -5.708 0.509 -0.162) 5.733 8.070 ( -14.399 -6.444 -2.523) 15.975 8.070 ( -14.399 6.444 -2.523) 15.975 8.240 ( -11.854 -6.418 -0.221) 13.482 8.240 ( -11.854 6.418 -0.221) 13.482 9.034 ( 1.255 -0.456 -0.279) 1.364 9.034 ( 1.255 0.456 -0.279) 1.364 9.136 ( 0.387 -4.528 -0.747) 4.605 9.136 ( 0.387 4.528 -0.747) 4.605 9.338 ( 4.711 -1.314 -0.620) 4.930 9.338 ( 4.711 1.314 -0.620) 4.930 9.414 ( 1.764 -1.409 -1.698) 2.825 9.414 ( 1.764 1.409 -1.698) 2.825 9.531 ( 5.055 -1.441 1.746) 5.539 9.531 ( 5.055 1.441 1.746) 5.539 9.662 ( 0.457 -2.316 -0.890) 2.523 9.662 ( 0.457 2.316 -0.890) 2.523 9.887 ( -8.607 -0.754 0.062) 8.640 9.887 ( -8.607 0.754 0.062) 8.640 10.062 ( -9.427 -2.590 1.300) 9.862 10.062 ( -9.427 2.590 1.300) 9.862 10.231 ( -2.774 -4.655 3.239) 6.313 10.231 ( -2.774 4.655 3.239) 6.313 10.423 ( -6.391 -2.135 -1.594) 6.924 10.423 ( -6.391 2.135 -1.594) 6.924 10.704 ( -2.679 -7.727 -0.866) 8.224 10.704 ( -2.679 7.727 -0.866) 8.224 10.851 ( -4.120 -4.825 -0.729) 6.387 10.851 ( -4.120 4.825 -0.729) 6.387 11.705 ( 7.793 -1.799 -1.102) 8.073 11.705 ( 7.793 1.799 -1.102) 8.073 11.739 ( 6.510 -1.778 1.286) 6.870 11.739 ( 6.510 1.778 1.286) 6.870 12.153 ( -0.317 -0.931 1.608) 1.884 12.153 ( -0.317 0.931 1.608) 1.884 12.284 ( 1.773 -1.861 -0.518) 2.622 12.284 ( 1.773 1.861 -0.518) 2.622 12.312 ( -2.769 -2.891 0.074) 4.004 12.312 ( -2.769 2.891 0.074) 4.004 12.407 ( -0.151 -3.309 -0.492) 3.349 12.407 ( -0.151 3.309 -0.492) 3.349 12.818 ( 0.436 -5.204 0.253) 5.228 12.818 ( 0.436 5.204 0.253) 5.228 12.869 ( -1.311 -3.528 0.110) 3.765 12.869 ( -1.311 3.528 0.110) 3.765 13.585 ( 5.511 -8.426 -0.029) 10.069 13.585 ( 5.511 8.426 -0.029) 10.069 13.627 ( 4.533 -9.119 0.044) 10.184 13.627 ( 4.533 9.119 0.044) 10.184 14.198 ( 3.035 -3.491 -0.286) 4.634 14.198 ( 3.035 3.491 -0.286) 4.634 14.256 ( 2.947 -3.278 0.134) 4.410 14.256 ( 2.947 3.278 0.134) 4.410 14.620 ( -2.297 -7.648 1.746) 8.174 14.620 ( -2.297 7.648 1.746) 8.174 14.747 ( -3.752 -3.145 -1.073) 5.012 14.747 ( -3.752 3.145 -1.073) 5.012 15.174 ( 0.757 -8.019 0.858) 8.101 15.174 ( 0.757 8.019 0.858) 8.101 15.320 ( -0.597 -5.818 -0.292) 5.856 15.320 ( -0.597 5.818 -0.292) 5.856 15.520 ( 2.486 -1.433 2.314) 3.686 15.520 ( 2.486 1.433 2.314) 3.686 15.586 ( 4.422 -1.903 -1.557) 5.060 15.586 ( 4.422 1.903 -1.557) 5.060 16.007 ( 7.263 -1.581 1.707) 7.627 16.007 ( 7.263 1.581 1.707) 7.627 16.082 ( 2.459 -2.431 -4.176) 5.422 16.082 ( 2.459 2.431 -4.176) 5.422 16.625 ( -1.461 -1.924 -1.637) 2.919 16.625 ( -1.461 1.924 -1.637) 2.919 16.699 ( 1.515 -0.972 1.111) 2.115 16.699 ( 1.515 0.972 1.111) 2.115 17.338 ( 0.808 -0.805 0.653) 1.314 17.338 ( 0.808 0.805 0.653) 1.314 17.413 ( 0.582 -1.853 -0.594) 2.031 17.413 ( 0.582 1.853 -0.594) 2.031 19.936 ( 6.050 -3.019 -0.811) 6.810 19.936 ( 6.050 3.019 -0.811) 6.810 20.132 ( 5.839 -0.209 -1.500) 6.032 20.132 ( 5.839 0.209 -1.500) 6.032 20.376 ( -6.823 -2.904 0.640) 7.443 20.376 ( -6.823 2.904 0.640) 7.443 20.771 ( -2.904 -1.705 -1.012) 3.516 20.771 ( -2.904 1.705 -1.012) 3.516 22.239 ( 7.082 -2.192 -1.245) 7.518 22.239 ( 7.082 2.192 -1.245) 7.518 22.271 ( 8.658 -2.572 1.434) 9.145 22.271 ( 8.658 2.572 1.434) 9.145 22.862 ( -8.322 -3.603 -1.410) 9.177 22.862 ( -8.322 3.603 -1.410) 9.177 22.955 ( -9.947 -2.953 1.609) 10.500 22.955 ( -9.947 2.953 1.609) 10.500 27.228 ( 23.359 -5.539 2.870) 24.177 27.228 ( 23.359 5.539 2.870) 24.177 27.436 ( 21.069 -10.906 -5.607) 24.378 27.436 ( 21.069 10.906 -5.607) 24.378 28.565 ( -20.646 -8.737 1.079) 22.444 28.565 ( -20.646 8.737 1.079) 22.444 28.662 ( -21.035 -8.660 -1.944) 22.830 28.662 ( -21.035 8.660 -1.944) 22.830 30.531 ( 7.374 -3.313 2.307) 8.407 30.531 ( 7.374 3.313 2.307) 8.407 30.693 ( 3.549 -3.180 -0.889) 4.847 30.693 ( 3.549 3.180 -0.889) 4.847 31.065 ( 7.304 -3.343 -1.313) 8.139 31.065 ( 7.304 3.343 -1.313) 8.139 31.206 ( 4.713 -6.731 -0.108) 8.217 31.206 ( 4.713 6.731 -0.108) 8.217 31.646 ( -7.463 -5.386 2.175) 9.457 31.646 ( -7.463 5.386 2.175) 9.457 31.812 ( -8.574 -6.174 -3.548) 11.145 31.812 ( -8.574 6.174 -3.548) 11.145 32.130 ( 4.802 -6.727 -2.188) 8.550 32.130 ( 4.802 6.727 -2.188) 8.550 32.386 ( 0.297 -11.465 -14.710) 18.653 32.386 ( 0.297 11.465 -14.710) 18.653 32.960 ( 9.078 -1.407 2.892) 9.631 32.960 ( 9.078 1.407 2.892) 9.631 33.264 ( 10.996 -0.605 -2.411) 11.273 33.264 ( 10.996 0.605 -2.411) 11.273 33.597 ( -3.668 -0.435 1.809) 4.113 33.597 ( -3.668 0.435 1.809) 4.113 33.834 ( -8.792 -0.956 -4.966) 10.143 33.834 ( -8.792 0.956 -4.966) 10.143 34.932 ( -1.156 -2.282 -0.348) 2.582 34.932 ( -1.156 2.282 -0.348) 2.582 35.183 ( 1.627 -0.714 3.268) 3.720 35.183 ( 1.627 0.714 3.268) 3.720 35.744 ( 1.785 -4.550 -3.698) 6.129 35.744 ( 1.785 4.550 -3.698) 6.129 35.814 ( 3.277 -3.426 -1.974) 5.136 35.814 ( 3.277 3.426 -1.974) 5.136 36.154 ( 4.816 -1.576 10.261) 11.444 36.154 ( 4.816 1.576 10.261) 11.444 36.423 ( -2.446 -3.316 1.293) 4.319 36.423 ( -2.446 3.316 1.293) 4.319 37.392 ( 1.001 -9.625 13.968) 16.992 37.392 ( 1.001 9.625 13.968) 16.992 38.058 ( -14.967 -11.203 -6.833) 19.905 38.058 ( -14.967 11.203 -6.833) 19.905 ======================= Grid point 26 (15/69) ======================= q-point: ( 0.44 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( -5.107 -4.689 -3.590) 7.807 1.973 ( -5.107 4.689 -3.590) 7.807 2.157 ( 0.609 -2.928 1.914) 3.550 2.157 ( 0.609 2.928 1.914) 3.550 2.415 ( 12.053 -10.459 -0.499) 15.966 2.415 ( 12.053 10.459 -0.499) 15.966 2.582 ( -1.533 -2.339 6.003) 6.623 2.582 ( -1.533 2.339 6.003) 6.623 2.722 ( 2.655 -3.414 3.582) 5.616 2.722 ( 2.655 3.414 3.582) 5.616 2.852 ( 3.135 -5.549 0.286) 6.380 2.852 ( 3.135 5.549 0.286) 6.380 3.079 ( 3.129 -6.007 -3.310) 7.539 3.079 ( 3.129 6.007 -3.310) 7.539 3.141 ( -3.508 -2.551 -0.076) 4.338 3.141 ( -3.508 2.551 -0.076) 4.338 3.240 ( -0.512 -1.019 0.831) 1.411 3.240 ( -0.512 1.019 0.831) 1.411 3.432 ( 3.682 -7.128 3.200) 8.637 3.432 ( 3.682 7.128 3.200) 8.637 3.659 ( 0.296 -2.234 3.618) 4.263 3.659 ( 0.296 2.234 3.619) 4.263 3.753 ( -0.239 -2.369 -2.389) 3.373 3.753 ( -0.239 2.369 -2.389) 3.373 3.918 ( 10.030 -5.748 4.103) 12.267 3.918 ( 10.030 5.748 4.103) 12.267 4.106 ( 0.926 -5.420 -1.408) 5.676 4.106 ( 0.926 5.420 -1.408) 5.676 4.261 ( 0.950 -4.352 5.107) 6.777 4.261 ( 0.950 4.352 5.107) 6.777 4.348 ( -2.082 -1.287 -1.085) 2.678 4.348 ( -2.082 1.287 -1.085) 2.678 4.445 ( -2.797 -0.716 -3.516) 4.549 4.445 ( -2.797 0.716 -3.516) 4.549 4.490 ( 1.015 -10.145 -3.975) 10.943 4.490 ( 1.015 10.145 -3.975) 10.943 4.675 ( 1.616 -6.546 3.006) 7.382 4.675 ( 1.616 6.546 3.006) 7.382 4.843 ( 0.250 -0.530 -3.416) 3.466 4.843 ( 0.250 0.530 -3.416) 3.466 4.939 ( -1.466 -5.023 -2.334) 5.729 4.939 ( -1.466 5.023 -2.334) 5.729 5.156 ( -1.287 -4.701 1.721) 5.169 5.156 ( -1.287 4.701 1.721) 5.169 5.338 ( 1.634 -3.937 2.841) 5.123 5.338 ( 1.634 3.937 2.841) 5.123 5.402 ( 3.464 -7.285 -1.871) 8.281 5.402 ( 3.464 7.285 -1.871) 8.281 5.574 ( -0.503 -4.470 5.737) 7.290 5.574 ( -0.503 4.470 5.737) 7.290 5.679 ( -2.855 -5.125 -7.230) 9.311 5.679 ( -2.855 5.125 -7.230) 9.311 5.818 ( 4.639 -1.402 -0.787) 4.910 5.818 ( 4.639 1.402 -0.787) 4.910 5.893 ( -2.883 -4.942 -0.450) 5.739 5.893 ( -2.883 4.942 -0.450) 5.739 6.088 ( 0.173 -2.095 -1.475) 2.568 6.088 ( 0.173 2.095 -1.475) 2.568 6.233 ( -1.785 -4.750 0.034) 5.074 6.233 ( -1.785 4.750 0.034) 5.074 6.342 ( -3.680 -0.575 0.379) 3.744 6.342 ( -3.680 0.575 0.379) 3.744 6.601 ( 0.511 -1.784 -1.798) 2.584 6.601 ( 0.511 1.784 -1.798) 2.584 6.785 ( 0.164 -1.545 2.724) 3.136 6.785 ( 0.164 1.545 2.724) 3.136 6.905 ( 2.725 -3.522 1.334) 4.649 6.905 ( 2.725 3.522 1.334) 4.649 7.092 ( 4.884 -2.310 1.221) 5.539 7.092 ( 4.884 2.310 1.221) 5.539 7.190 ( -4.259 -0.752 -1.127) 4.470 7.190 ( -4.259 0.752 -1.127) 4.470 7.254 ( -3.126 -0.485 -1.091) 3.347 7.254 ( -3.126 0.485 -1.091) 3.347 7.421 ( -1.304 -0.905 0.591) 1.694 7.421 ( -1.304 0.905 0.591) 1.694 7.870 ( -6.400 -7.686 -2.033) 10.206 7.870 ( -6.400 7.686 -2.033) 10.206 8.096 ( -5.235 -7.654 -0.480) 9.286 8.096 ( -5.235 7.654 -0.480) 9.286 9.052 ( 0.812 -0.384 0.087) 0.903 9.052 ( 0.812 0.384 0.087) 0.903 9.135 ( 0.149 -4.746 -0.239) 4.754 9.135 ( 0.149 4.746 -0.239) 4.754 9.399 ( 1.268 -0.103 -0.039) 1.273 9.399 ( 1.268 0.103 -0.039) 1.273 9.411 ( 2.116 -1.428 -1.030) 2.753 9.411 ( 2.116 1.428 -1.030) 2.753 9.599 ( 1.552 -1.294 0.576) 2.102 9.599 ( 1.552 1.294 0.576) 2.102 9.688 ( 1.325 -1.029 0.589) 1.778 9.688 ( 1.325 1.029 0.589) 1.778 9.748 ( -5.243 -0.397 -0.406) 5.274 9.748 ( -5.243 0.397 -0.406) 5.274 9.959 ( -4.557 -1.798 0.354) 4.911 9.959 ( -4.557 1.798 0.354) 4.911 10.234 ( -1.127 -0.817 0.380) 1.443 10.234 ( -1.127 0.817 0.380) 1.443 10.355 ( -1.213 -4.359 0.608) 4.565 10.355 ( -1.213 4.359 0.608) 4.565 10.675 ( -0.432 -7.867 -0.322) 7.886 10.675 ( -0.432 7.867 -0.322) 7.886 10.792 ( -1.978 -4.376 -0.652) 4.847 10.792 ( -1.978 4.376 -0.652) 4.847 11.776 ( 2.619 -2.602 -0.435) 3.718 11.776 ( 2.619 2.602 -0.435) 3.718 11.815 ( 1.944 -1.070 0.514) 2.277 11.815 ( 1.944 1.070 0.514) 2.277 12.155 ( -0.533 -4.203 0.520) 4.269 12.155 ( -0.533 4.203 0.520) 4.269 12.277 ( -0.913 -1.271 -0.181) 1.576 12.277 ( -0.913 1.271 -0.181) 1.576 12.318 ( 1.152 -5.070 0.471) 5.221 12.318 ( 1.152 5.070 0.471) 5.221 12.420 ( 1.459 -4.149 -0.163) 4.401 12.420 ( 1.459 4.149 -0.163) 4.401 12.794 ( -1.764 -2.414 -0.683) 3.067 12.794 ( -1.764 2.414 -0.683) 3.067 12.867 ( -0.017 -1.964 0.569) 2.045 12.867 ( -0.017 1.964 0.569) 2.045 13.649 ( 2.337 -4.638 0.109) 5.195 13.649 ( 2.337 4.638 0.109) 5.195 13.671 ( 1.215 -5.091 0.004) 5.234 13.671 ( 1.215 5.091 0.004) 5.234 14.252 ( 3.179 -3.898 -0.307) 5.039 14.252 ( 3.179 3.898 -0.307) 5.039 14.324 ( 3.878 -1.534 0.127) 4.172 14.324 ( 3.878 1.534 0.127) 4.172 14.573 ( -3.876 -4.476 0.716) 5.964 14.573 ( -3.876 4.476 0.716) 5.964 14.667 ( -3.606 -2.934 -0.558) 4.683 14.667 ( -3.606 2.934 -0.558) 4.683 15.188 ( 0.123 -2.856 0.623) 2.925 15.188 ( 0.123 2.856 0.623) 2.925 15.285 ( -1.803 -2.619 -0.149) 3.183 15.285 ( -1.803 2.619 -0.149) 3.183 15.577 ( 1.739 -0.970 0.347) 2.021 15.577 ( 1.739 0.970 0.347) 2.021 15.651 ( 3.088 -1.550 0.120) 3.457 15.651 ( 3.088 1.550 0.120) 3.457 16.076 ( 2.009 -2.640 -1.494) 3.639 16.076 ( 2.009 2.640 -1.494) 3.639 16.112 ( 2.361 -1.581 0.736) 2.935 16.112 ( 2.361 1.581 0.736) 2.935 16.591 ( -0.869 -0.361 -0.507) 1.069 16.591 ( -0.869 0.361 -0.507) 1.069 16.715 ( -0.195 -1.508 0.423) 1.579 16.715 ( -0.195 1.508 0.423) 1.579 17.368 ( 1.480 -0.997 1.055) 2.072 17.368 ( 1.480 0.997 1.055) 2.072 17.402 ( -0.731 -1.509 -1.011) 1.958 17.402 ( -0.731 1.509 -1.011) 1.958 20.022 ( 4.895 -0.638 -0.672) 4.982 20.022 ( 4.895 0.638 -0.672) 4.982 20.187 ( 1.334 -1.865 0.173) 2.300 20.187 ( 1.334 1.865 0.173) 2.300 20.293 ( -3.288 -2.735 0.281) 4.286 20.293 ( -3.288 2.735 0.281) 4.286 20.719 ( -1.837 -1.601 -0.674) 2.528 20.719 ( -1.837 1.601 -0.674) 2.528 22.340 ( 6.053 -2.607 -0.293) 6.597 22.340 ( 6.053 2.607 -0.293) 6.597 22.384 ( 3.292 -2.625 0.084) 4.211 22.384 ( 3.292 2.625 0.084) 4.211 22.734 ( -5.353 -3.119 -0.229) 6.200 22.734 ( -5.353 3.119 -0.229) 6.200 22.846 ( -4.756 -2.195 0.368) 5.251 22.846 ( -4.756 2.195 0.368) 5.251 27.588 ( 15.362 -7.237 -0.280) 16.983 27.588 ( 15.362 7.237 -0.280) 16.983 27.672 ( 13.752 -8.196 0.660) 16.023 27.672 ( 13.752 8.196 0.660) 16.023 28.281 ( -15.104 -8.908 -1.631) 17.611 28.281 ( -15.104 8.908 -1.631) 17.611 28.349 ( -13.094 -8.047 -0.123) 15.369 28.349 ( -13.094 8.047 -0.123) 15.369 30.626 ( 2.445 -3.024 0.879) 3.987 30.626 ( 2.445 3.024 0.879) 3.987 30.735 ( 1.958 -1.644 -0.242) 2.568 30.735 ( 1.958 1.644 -0.242) 2.568 31.139 ( 2.963 -2.747 -0.860) 4.132 31.139 ( 2.963 2.747 -0.860) 4.132 31.293 ( 5.099 -4.758 1.645) 7.165 31.293 ( 5.099 4.758 1.645) 7.165 31.534 ( -7.140 -2.022 -0.882) 7.473 31.534 ( -7.140 2.022 -0.882) 7.473 31.676 ( -3.142 -4.728 -1.798) 5.955 31.676 ( -3.142 4.728 -1.798) 5.955 32.193 ( 2.629 -4.852 1.769) 5.795 32.193 ( 2.629 4.852 1.769) 5.795 32.278 ( 0.418 -6.103 -6.744) 9.105 32.278 ( 0.418 6.103 -6.744) 9.105 33.104 ( 4.409 -2.444 2.135) 5.474 33.104 ( 4.409 2.444 2.135) 5.474 33.389 ( 6.834 -0.492 -1.677) 7.054 33.389 ( 6.834 0.492 -1.677) 7.054 33.571 ( -2.001 -0.955 1.492) 2.672 33.571 ( -2.001 0.955 1.492) 2.672 33.668 ( -6.094 -0.195 -2.014) 6.421 33.668 ( -6.094 0.195 -2.014) 6.421 34.912 ( -0.609 -2.311 -0.339) 2.413 34.912 ( -0.609 2.311 -0.339) 2.413 35.231 ( 0.774 -1.072 1.459) 1.969 35.231 ( 0.774 1.072 1.459) 1.969 35.725 ( 0.305 -5.869 -1.793) 6.144 35.725 ( 0.305 5.869 -1.793) 6.144 35.836 ( 1.111 -2.907 -0.451) 3.145 35.836 ( 1.111 2.907 -0.451) 3.145 36.320 ( 3.322 -2.134 5.204) 6.532 36.320 ( 3.322 2.134 5.204) 6.532 36.405 ( -0.880 -3.438 0.257) 3.558 36.405 ( -0.880 3.438 0.257) 3.558 37.489 ( -0.400 -4.152 3.012) 5.146 37.489 ( -0.400 4.152 3.012) 5.146 37.823 ( -6.435 -8.008 -2.454) 10.562 37.823 ( -6.435 8.008 -2.454) 10.562 ======================= Grid point 45 (16/69) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.415 ( 6.676 0.000 21.432) 22.448 0.539 ( -3.357 0.000 27.940) 28.141 1.193 ( 1.257 0.000 56.320) 56.334 1.737 ( -2.798 0.000 -10.002) 10.386 2.025 ( 3.712 0.000 0.991) 3.842 2.178 ( 2.700 0.000 16.193) 16.417 2.427 ( -1.312 0.000 3.427) 3.670 2.444 ( -10.768 0.000 -0.768) 10.795 2.506 ( 0.172 0.000 12.119) 12.120 2.674 ( -5.359 0.000 9.265) 10.704 2.775 ( -1.936 0.000 4.920) 5.287 2.792 ( 2.268 0.000 7.798) 8.121 2.885 ( 6.238 0.000 -1.709) 6.468 2.948 ( 2.459 0.000 -2.115) 3.244 3.046 ( 10.659 0.000 -3.269) 11.149 3.098 ( -8.445 0.000 -6.422) 10.609 3.122 ( 6.761 0.000 -2.740) 7.295 3.198 ( -3.499 0.000 2.850) 4.512 3.264 ( -3.702 0.000 2.561) 4.502 3.344 ( -1.015 0.000 -2.664) 2.851 3.495 ( 2.815 0.000 -8.283) 8.749 3.525 ( 4.579 0.000 3.456) 5.737 3.585 ( 1.862 0.000 -3.825) 4.254 3.676 ( -1.646 0.000 1.375) 2.145 3.687 ( 2.182 0.000 -0.907) 2.363 3.707 ( -1.249 0.000 -1.955) 2.320 3.821 ( -0.938 0.000 -1.861) 2.084 3.841 ( -11.363 0.000 -0.027) 11.363 3.915 ( 6.705 0.000 3.283) 7.466 4.004 ( 0.180 0.000 0.434) 0.470 4.129 ( 3.861 0.000 9.697) 10.438 4.186 ( -3.857 0.000 -2.200) 4.440 4.246 ( 8.573 0.000 -0.699) 8.601 4.380 ( -8.478 0.000 4.249) 9.483 4.435 ( 0.837 0.000 -2.482) 2.619 4.494 ( -2.170 0.000 3.565) 4.174 4.676 ( -2.077 0.000 0.245) 2.091 4.708 ( 0.112 0.000 -1.675) 1.679 4.855 ( -0.660 0.000 -3.412) 3.475 5.000 ( 4.576 0.000 -8.542) 9.690 5.011 ( 0.691 0.000 -4.534) 4.587 5.090 ( 0.432 0.000 -2.090) 2.134 5.199 ( -2.689 0.000 -1.564) 3.111 5.212 ( -4.285 0.000 -1.646) 4.590 5.258 ( -0.128 0.000 -2.982) 2.985 5.334 ( 8.547 0.000 -7.670) 11.484 5.400 ( -0.238 0.000 -2.443) 2.455 5.430 ( -0.912 0.000 -0.561) 1.071 5.535 ( -0.564 0.000 1.423) 1.530 5.553 ( -1.284 0.000 -3.742) 3.956 5.629 ( 2.041 0.000 -8.227) 8.477 5.847 ( -1.457 0.000 3.564) 3.850 5.873 ( -6.023 0.000 -3.188) 6.815 5.893 ( 6.734 0.000 -5.749) 8.854 5.944 ( 0.305 0.000 -2.807) 2.823 6.018 ( -0.009 0.000 -5.246) 5.246 6.131 ( -2.116 0.000 -1.678) 2.700 6.138 ( -3.040 0.000 0.385) 3.064 6.210 ( -0.169 0.000 -5.746) 5.748 6.395 ( -0.345 0.000 -5.230) 5.242 6.478 ( 6.063 0.000 5.323) 8.068 6.498 ( -2.687 0.000 3.909) 4.743 6.639 ( -1.263 0.000 3.207) 3.447 6.684 ( -3.827 0.000 -0.773) 3.904 6.699 ( -3.044 0.000 -2.174) 3.741 6.872 ( 1.727 0.000 -0.136) 1.733 6.938 ( -3.172 0.000 7.147) 7.820 6.969 ( -0.111 0.000 4.800) 4.801 7.053 ( 8.958 0.000 0.788) 8.992 7.179 ( -2.242 0.000 6.530) 6.904 7.232 ( 3.803 0.000 -1.012) 3.935 7.372 ( 0.749 0.000 5.647) 5.696 7.422 ( 0.181 0.000 3.073) 3.079 7.543 ( -0.084 0.000 -0.706) 0.711 7.629 ( -0.277 0.000 5.221) 5.228 8.243 ( 9.632 0.000 -7.008) 11.912 8.575 ( -0.687 0.000 3.309) 3.379 8.778 ( 2.029 0.000 0.025) 2.029 8.800 ( -5.354 0.000 -1.874) 5.673 8.842 ( 6.395 0.000 -3.014) 7.069 9.002 ( 3.398 0.000 0.111) 3.399 9.008 ( -2.246 0.000 0.770) 2.374 9.092 ( -10.048 0.000 2.120) 10.269 9.206 ( -4.416 0.000 -2.012) 4.853 9.227 ( 2.641 0.000 -0.783) 2.754 9.233 ( 2.941 0.000 -0.691) 3.022 9.287 ( 0.408 0.000 -2.779) 2.809 9.373 ( -0.128 0.000 -2.461) 2.464 9.426 ( 0.172 0.000 -1.171) 1.183 9.444 ( -1.822 0.000 3.139) 3.630 9.529 ( -2.189 0.000 -2.859) 3.601 9.683 ( 2.198 0.000 -1.960) 2.945 9.840 ( -3.260 0.000 4.808) 5.810 10.182 ( 2.033 0.000 -0.319) 2.058 10.202 ( -2.769 0.000 2.223) 3.551 10.337 ( 0.329 0.000 -2.252) 2.276 10.450 ( 2.599 0.000 2.174) 3.388 10.631 ( -0.088 0.000 -3.638) 3.639 10.771 ( -1.657 0.000 -0.042) 1.657 10.799 ( -0.817 0.000 -1.411) 1.630 10.823 ( -1.607 0.000 0.153) 1.614 10.907 ( -2.258 0.000 -4.768) 5.275 11.044 ( 3.121 0.000 1.075) 3.301 11.138 ( -2.020 0.000 -1.489) 2.510 11.208 ( -0.144 0.000 0.465) 0.487 11.231 ( 3.502 0.000 -0.033) 3.502 11.633 ( 0.808 0.000 0.271) 0.852 11.645 ( -0.889 0.000 0.022) 0.889 11.903 ( -3.031 0.000 2.008) 3.636 12.111 ( 2.492 0.000 -3.455) 4.260 12.256 ( -2.955 0.000 2.357) 3.779 12.330 ( -0.872 0.000 0.911) 1.261 12.365 ( 0.594 0.000 -0.244) 0.642 12.404 ( 1.294 0.000 -0.572) 1.414 12.414 ( 0.761 0.000 0.368) 0.846 12.433 ( 2.104 0.000 0.035) 2.105 12.519 ( -2.878 0.000 -1.690) 3.337 12.570 ( 0.762 0.000 -0.884) 1.167 12.962 ( 1.056 0.000 0.930) 1.407 12.997 ( -0.578 0.000 0.219) 0.618 13.227 ( -0.617 0.000 0.589) 0.853 13.311 ( 0.835 0.000 -1.584) 1.790 13.369 ( 0.596 0.000 1.455) 1.573 13.436 ( -1.023 0.000 -0.190) 1.040 14.018 ( 0.625 0.000 1.040) 1.213 14.103 ( -0.195 0.000 -0.897) 0.918 14.220 ( 2.439 0.000 0.213) 2.448 14.240 ( -1.531 0.000 -0.326) 1.565 14.467 ( -2.806 0.000 0.736) 2.901 14.468 ( -1.586 0.000 1.019) 1.885 14.606 ( 1.598 0.000 -0.742) 1.762 14.621 ( 15.002 0.000 -1.020) 15.037 14.864 ( -3.531 0.000 1.215) 3.734 14.906 ( -0.287 0.000 0.314) 0.426 14.996 ( 0.577 0.000 -0.610) 0.840 15.061 ( 1.897 0.000 -2.508) 3.145 15.071 ( 5.546 0.000 2.383) 6.036 15.197 ( -4.534 0.000 -0.326) 4.546 15.764 ( 1.316 0.000 0.639) 1.463 15.771 ( -1.948 0.000 -0.011) 1.948 15.847 ( -2.393 0.000 0.888) 2.552 15.872 ( -0.874 0.000 0.023) 0.874 15.998 ( 1.029 0.000 2.968) 3.141 16.314 ( 0.753 0.000 -3.270) 3.356 16.501 ( 0.335 0.000 0.321) 0.465 16.539 ( 1.101 0.000 2.274) 2.526 16.582 ( -5.499 0.000 -2.228) 5.933 16.657 ( 0.301 0.000 0.371) 0.478 17.301 ( -0.079 0.000 1.602) 1.604 17.343 ( 0.527 0.000 -0.059) 0.530 17.343 ( -0.728 0.000 0.498) 0.882 17.401 ( 0.783 0.000 -0.163) 0.800 19.723 ( -3.165 0.000 0.536) 3.210 19.874 ( 0.919 0.000 -3.631) 3.746 20.068 ( -0.413 0.000 1.195) 1.264 20.081 ( 0.327 0.000 0.673) 0.748 20.530 ( -2.117 0.000 1.632) 2.673 20.583 ( 0.264 0.000 1.095) 1.126 20.813 ( 1.208 0.000 -1.263) 1.748 20.859 ( 1.318 0.000 -1.516) 2.009 21.881 ( 0.854 0.000 2.463) 2.607 22.038 ( 0.682 0.000 -1.609) 1.748 22.128 ( 1.088 0.000 0.581) 1.234 22.150 ( -0.517 0.000 -0.237) 0.568 23.138 ( -5.778 0.000 -2.336) 6.232 23.166 ( 2.592 0.000 -4.211) 4.945 23.372 ( -1.951 0.000 2.871) 3.472 23.375 ( -0.343 0.000 1.798) 1.830 26.543 ( 0.517 0.000 -0.120) 0.531 26.547 ( -0.061 0.000 -0.364) 0.369 26.568 ( 0.279 0.000 0.534) 0.603 26.581 ( 1.571 0.000 0.104) 1.574 29.144 ( -0.152 0.000 1.762) 1.768 29.239 ( -2.090 0.000 2.471) 3.237 29.322 ( 4.901 0.000 -1.177) 5.040 29.587 ( 0.087 0.000 -4.091) 4.092 29.657 ( -2.192 0.000 1.620) 2.726 29.834 ( -0.038 0.000 -2.962) 2.962 30.363 ( -0.485 0.000 8.662) 8.676 30.714 ( 0.321 0.000 0.484) 0.581 30.745 ( -0.082 0.000 1.523) 1.525 30.858 ( 0.655 0.000 -2.323) 2.413 31.044 ( -3.968 0.000 0.994) 4.090 31.045 ( -0.307 0.000 0.587) 0.663 31.493 ( -1.052 0.000 -0.064) 1.053 31.500 ( 0.644 0.000 -0.386) 0.751 31.858 ( 1.758 0.000 4.241) 4.591 32.129 ( 2.041 0.000 0.737) 2.170 32.188 ( -1.993 0.000 -0.445) 2.042 32.322 ( 5.330 0.000 -0.577) 5.361 32.331 ( -0.749 0.000 1.183) 1.400 32.532 ( -1.473 0.000 -1.538) 2.130 32.532 ( -6.033 0.000 0.234) 6.037 32.553 ( 1.099 0.000 0.353) 1.155 32.751 ( 3.171 0.000 -1.917) 3.706 33.455 ( -1.448 0.000 -9.717) 9.824 33.643 ( 0.034 0.000 4.072) 4.072 34.052 ( -1.274 0.000 -35.690) 35.713 34.118 ( 0.118 0.000 -7.750) 7.751 34.209 ( -0.039 0.000 -6.014) 6.014 34.951 ( -2.361 0.000 2.346) 3.329 34.979 ( 4.227 0.000 3.979) 5.806 35.036 ( -1.645 0.000 4.741) 5.019 35.041 ( 5.984 0.000 0.952) 6.059 35.553 ( 1.785 0.000 -2.366) 2.964 35.598 ( 1.620 0.000 -1.938) 2.526 35.685 ( 1.080 0.000 0.310) 1.123 35.715 ( 0.916 0.000 -1.034) 1.382 35.886 ( 0.239 0.000 7.876) 7.880 35.987 ( -0.166 0.000 6.920) 6.922 36.457 ( 0.672 0.000 4.213) 4.266 36.556 ( -0.203 0.000 -4.907) 4.911 36.671 ( -0.718 0.000 27.839) 27.848 38.186 ( -0.104 0.000 -10.165) 10.166 38.699 ( -4.878 0.000 2.540) 5.500 38.940 ( 0.485 0.000 -2.838) 2.880 ======================= Grid point 46 (17/69) ======================= q-point: ( 0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.952 ( 14.043 0.000 23.479) 27.358 1.070 ( 33.568 0.000 18.601) 38.377 1.725 ( 18.919 0.000 -13.287) 23.119 1.903 ( 11.155 0.000 29.739) 31.762 1.989 ( 3.844 0.000 6.364) 7.435 2.202 ( -9.380 0.000 -6.884) 11.635 2.428 ( -3.209 0.000 0.216) 3.216 2.469 ( 3.642 0.000 18.420) 18.776 2.647 ( 2.568 0.000 3.102) 4.027 2.753 ( -3.857 0.000 5.135) 6.422 2.781 ( 1.108 0.000 12.893) 12.941 2.850 ( -9.575 0.000 -7.083) 11.910 2.887 ( 0.216 0.000 8.203) 8.206 2.944 ( -0.165 0.000 4.458) 4.461 2.948 ( 0.094 0.000 9.296) 9.296 3.160 ( 8.902 0.000 -0.916) 8.949 3.175 ( -6.672 0.000 -3.429) 7.502 3.231 ( -2.325 0.000 8.889) 9.188 3.362 ( 11.427 0.000 -2.727) 11.748 3.367 ( 8.715 0.000 0.682) 8.741 3.455 ( 2.093 0.000 -7.329) 7.622 3.530 ( -2.384 0.000 -1.915) 3.058 3.620 ( -1.075 0.000 2.394) 2.624 3.651 ( 1.545 0.000 0.263) 1.567 3.662 ( -3.859 0.000 -0.027) 3.859 3.669 ( -0.660 0.000 -6.181) 6.216 3.780 ( -3.786 0.000 -7.344) 8.263 3.866 ( 14.114 0.000 2.835) 14.396 3.975 ( 3.917 0.000 -6.999) 8.021 4.057 ( -4.931 0.000 9.385) 10.602 4.089 ( 5.719 0.000 -7.250) 9.234 4.263 ( -5.932 0.000 0.908) 6.001 4.309 ( 7.555 0.000 0.226) 7.558 4.386 ( 1.844 0.000 -8.103) 8.310 4.414 ( 8.510 0.000 1.926) 8.725 4.524 ( 0.938 0.000 4.379) 4.479 4.658 ( -1.252 0.000 3.043) 3.290 4.682 ( -1.043 0.000 -3.145) 3.313 4.775 ( 0.141 0.000 -0.552) 0.570 4.981 ( 4.574 0.000 -6.269) 7.760 5.019 ( -3.255 0.000 6.310) 7.100 5.080 ( -2.576 0.000 -9.519) 9.862 5.096 ( 4.912 0.000 -3.825) 6.225 5.159 ( -5.825 0.000 -5.137) 7.766 5.178 ( 6.507 0.000 -10.287) 12.172 5.303 ( -4.619 0.000 -3.965) 6.087 5.331 ( -0.882 0.000 -3.016) 3.143 5.432 ( 1.504 0.000 2.133) 2.610 5.525 ( -3.343 0.000 1.324) 3.595 5.612 ( 3.639 0.000 -5.945) 6.970 5.633 ( 6.503 0.000 3.423) 7.349 5.793 ( 1.668 0.000 -4.761) 5.044 5.889 ( 2.316 0.000 -6.600) 6.995 5.912 ( 1.457 0.000 2.480) 2.877 5.955 ( 4.733 0.000 -0.789) 4.798 6.003 ( 0.793 0.000 -1.265) 1.493 6.069 ( 2.255 0.000 -4.734) 5.243 6.083 ( -2.512 0.000 -1.445) 2.898 6.137 ( -1.882 0.000 -3.596) 4.059 6.365 ( 2.199 0.000 -2.168) 3.088 6.537 ( 0.877 0.000 5.397) 5.468 6.572 ( -4.738 0.000 -3.130) 5.679 6.621 ( 0.263 0.000 5.092) 5.099 6.627 ( 0.590 0.000 2.163) 2.242 6.669 ( -2.227 0.000 1.927) 2.945 6.856 ( -1.360 0.000 -2.796) 3.109 6.942 ( -5.002 0.000 4.981) 7.059 7.025 ( -0.268 0.000 3.524) 3.534 7.150 ( 2.621 0.000 1.138) 2.858 7.215 ( -5.497 0.000 6.573) 8.569 7.241 ( -1.217 0.000 -1.026) 1.591 7.402 ( -4.769 0.000 3.729) 6.054 7.441 ( -1.771 0.000 1.841) 2.555 7.467 ( -5.822 0.000 -1.885) 6.119 7.685 ( -2.896 0.000 5.376) 6.106 7.878 ( -31.378 0.000 6.633) 32.072 8.459 ( -9.852 0.000 0.754) 9.880 8.546 ( -20.016 0.000 -4.234) 20.458 8.765 ( -11.810 0.000 -0.257) 11.812 8.800 ( -6.412 0.000 -2.013) 6.720 8.973 ( -4.387 0.000 4.034) 5.960 8.976 ( -4.219 0.000 2.761) 5.042 9.065 ( 6.113 0.000 -1.765) 6.362 9.076 ( -4.860 0.000 -5.139) 7.073 9.285 ( 1.001 0.000 1.777) 2.039 9.301 ( 4.401 0.000 -1.530) 4.659 9.327 ( 6.076 0.000 -1.201) 6.194 9.357 ( 3.584 0.000 -1.963) 4.087 9.449 ( 3.367 0.000 -1.240) 3.588 9.457 ( -1.761 0.000 4.005) 4.375 9.522 ( 6.912 0.000 -1.217) 7.018 9.726 ( 5.536 0.000 -2.051) 5.904 9.885 ( 0.611 0.000 5.870) 5.901 10.150 ( -6.642 0.000 1.821) 6.887 10.187 ( -0.862 0.000 -1.507) 1.736 10.299 ( -4.439 0.000 -0.424) 4.459 10.436 ( -6.634 0.000 1.381) 6.777 10.508 ( -7.835 0.000 -5.164) 9.384 10.671 ( -9.076 0.000 -0.871) 9.118 10.692 ( -8.921 0.000 0.263) 8.925 10.769 ( -8.605 0.000 -2.998) 9.113 10.812 ( -2.364 0.000 0.902) 2.530 11.069 ( -1.680 0.000 1.755) 2.429 11.070 ( -3.194 0.000 -2.255) 3.910 11.339 ( 13.052 0.000 0.009) 13.052 11.382 ( 13.271 0.000 -1.559) 13.363 11.633 ( 0.491 0.000 -0.443) 0.661 11.645 ( 0.294 0.000 0.757) 0.812 11.936 ( 3.743 0.000 2.143) 4.314 12.113 ( 1.739 0.000 -2.768) 3.269 12.265 ( 0.659 0.000 1.790) 1.908 12.275 ( -5.778 0.000 1.116) 5.885 12.348 ( -1.643 0.000 0.177) 1.652 12.399 ( -0.786 0.000 -0.537) 0.952 12.428 ( 0.783 0.000 0.475) 0.916 12.498 ( 2.123 0.000 -3.025) 3.696 12.509 ( 5.179 0.000 1.373) 5.358 12.609 ( 4.806 0.000 -1.026) 4.914 12.982 ( 0.671 0.000 0.852) 1.084 12.984 ( -0.593 0.000 -0.232) 0.637 13.229 ( 0.206 0.000 0.429) 0.476 13.302 ( 0.203 0.000 -1.046) 1.065 13.544 ( 14.686 0.000 0.991) 14.720 13.674 ( 22.605 0.000 -7.644) 23.862 13.991 ( -7.528 0.000 0.888) 7.580 14.018 ( -8.949 0.000 -0.764) 8.981 14.220 ( 3.737 0.000 -0.477) 3.767 14.257 ( 3.129 0.000 0.093) 3.130 14.403 ( -6.387 0.000 1.261) 6.511 14.465 ( -3.318 0.000 -0.259) 3.328 14.654 ( 7.348 0.000 -0.500) 7.365 14.766 ( 1.963 0.000 -0.667) 2.074 14.925 ( 2.183 0.000 0.041) 2.184 14.941 ( 15.273 0.000 -3.258) 15.617 15.112 ( 11.782 0.000 0.156) 11.783 15.172 ( 10.548 0.000 -0.840) 10.581 15.202 ( 10.390 0.000 -2.845) 10.773 15.328 ( 20.421 0.000 -4.007) 20.810 15.713 ( -4.222 0.000 0.141) 4.224 15.763 ( -7.617 0.000 0.830) 7.662 15.803 ( 2.632 0.000 0.598) 2.699 15.887 ( 2.413 0.000 -1.990) 3.128 16.039 ( -1.661 0.000 4.506) 4.802 16.242 ( -3.884 0.000 -4.982) 6.318 16.551 ( 3.628 0.000 1.486) 3.921 16.565 ( 4.560 0.000 -2.577) 5.238 16.600 ( 2.691 0.000 2.973) 4.010 16.670 ( 2.303 0.000 -2.827) 3.646 17.313 ( -0.560 0.000 1.093) 1.228 17.339 ( -0.382 0.000 0.648) 0.753 17.348 ( 0.085 0.000 -0.059) 0.104 17.416 ( 1.379 0.000 -0.308) 1.413 19.721 ( 1.020 0.000 2.063) 2.301 19.875 ( 4.401 0.000 -3.897) 5.878 20.066 ( -1.085 0.000 0.973) 1.457 20.082 ( -0.501 0.000 0.485) 0.697 20.490 ( -5.045 0.000 1.586) 5.289 20.586 ( -2.078 0.000 1.688) 2.677 20.791 ( -1.002 0.000 -2.016) 2.252 20.856 ( 0.340 0.000 -1.427) 1.467 21.959 ( 4.883 0.000 2.681) 5.571 22.042 ( 2.381 0.000 -2.026) 3.126 22.139 ( 1.473 0.000 1.772) 2.305 22.155 ( 1.834 0.000 -0.474) 1.894 23.031 ( -6.417 0.000 -0.856) 6.474 23.126 ( -2.375 0.000 -2.709) 3.603 23.307 ( -9.544 0.000 2.467) 9.858 23.341 ( -5.911 0.000 1.541) 6.108 26.615 ( 9.040 0.000 0.320) 9.046 26.641 ( 12.210 0.000 -0.571) 12.224 26.696 ( 14.669 0.000 1.634) 14.760 26.949 ( 37.468 0.000 -17.185) 41.221 28.997 ( -18.245 0.000 1.605) 18.315 29.075 ( -18.182 0.000 -1.126) 18.216 29.254 ( -10.058 0.000 3.781) 10.746 29.434 ( -11.317 0.000 -4.533) 12.191 29.846 ( 17.488 0.000 1.334) 17.539 29.947 ( 14.657 0.000 -2.116) 14.809 30.502 ( 4.198 0.000 7.561) 8.648 30.724 ( 1.237 0.000 -1.862) 2.236 30.782 ( 2.775 0.000 1.960) 3.398 30.854 ( 1.785 0.000 -2.149) 2.794 31.094 ( 5.286 0.000 0.711) 5.334 31.121 ( 9.703 0.000 -3.370) 10.272 31.498 ( 1.535 0.000 -0.464) 1.603 31.543 ( 4.572 0.000 1.031) 4.686 31.956 ( -0.315 0.000 5.824) 5.832 32.065 ( -9.649 0.000 -2.102) 9.875 32.070 ( -6.535 0.000 3.126) 7.244 32.250 ( -8.487 0.000 1.426) 8.606 32.305 ( -6.216 0.000 -1.914) 6.504 32.553 ( 10.006 0.000 3.184) 10.500 32.623 ( 9.435 0.000 -4.778) 10.576 32.668 ( 11.932 0.000 -1.302) 12.003 32.863 ( 11.479 0.000 -1.623) 11.593 33.193 ( -2.282 0.000 -26.325) 26.423 33.679 ( -2.186 0.000 4.962) 5.422 33.755 ( -3.093 0.000 -8.670) 9.205 34.009 ( -3.225 0.000 -6.212) 7.000 34.103 ( -4.054 0.000 -7.001) 8.090 34.932 ( -2.654 0.000 1.271) 2.943 35.048 ( -2.184 0.000 2.220) 3.115 35.072 ( 3.500 0.000 2.228) 4.149 35.127 ( 2.753 0.000 3.101) 4.147 35.553 ( 2.920 0.000 -4.477) 5.345 35.625 ( 4.021 0.000 -1.370) 4.248 35.727 ( 4.424 0.000 -0.641) 4.470 35.740 ( 4.560 0.000 -2.917) 5.413 36.007 ( 1.858 0.000 10.657) 10.818 36.089 ( 0.498 0.000 10.416) 10.427 36.413 ( -0.219 0.000 -6.778) 6.781 36.480 ( 0.267 0.000 -7.613) 7.617 37.046 ( 0.211 0.000 31.733) 31.734 37.997 ( -5.445 0.000 -15.099) 16.051 38.439 ( -29.857 0.000 17.229) 34.472 38.827 ( -10.054 0.000 -4.377) 10.965 ======================= Grid point 47 (18/69) ======================= q-point: ( 0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( 12.261 0.000 16.880) 20.863 1.720 ( 18.800 0.000 17.640) 25.780 1.931 ( 14.577 0.000 -11.270) 18.426 1.998 ( 30.867 0.000 -9.972) 32.438 2.108 ( 4.418 0.000 2.541) 5.097 2.336 ( 0.761 0.000 -8.175) 8.210 2.549 ( 10.606 0.000 21.810) 24.253 2.563 ( -7.299 0.000 -11.687) 13.779 2.710 ( -7.697 0.000 -1.047) 7.768 2.720 ( 3.991 0.000 14.719) 15.250 2.741 ( 2.452 0.000 2.106) 3.232 2.814 ( 0.522 0.000 -1.229) 1.335 2.992 ( -9.813 0.000 6.897) 11.994 3.021 ( 5.414 0.000 8.983) 10.488 3.145 ( -0.937 0.000 2.729) 2.886 3.153 ( -3.031 0.000 14.629) 14.940 3.269 ( 6.407 0.000 -3.531) 7.316 3.329 ( 5.066 0.000 -15.583) 16.386 3.347 ( 2.391 0.000 7.997) 8.347 3.353 ( -2.443 0.000 -9.528) 9.836 3.436 ( 5.387 0.000 1.021) 5.483 3.466 ( -7.648 0.000 -11.296) 13.641 3.574 ( 2.859 0.000 15.170) 15.437 3.631 ( -0.955 0.000 5.258) 5.344 3.637 ( 2.626 0.000 -0.268) 2.639 3.708 ( 6.360 0.000 1.263) 6.484 3.784 ( 9.077 0.000 -2.165) 9.331 3.970 ( -0.631 0.000 -8.751) 8.773 4.000 ( 8.889 0.000 -5.413) 10.407 4.054 ( 1.585 0.000 -2.059) 2.598 4.213 ( 3.220 0.000 12.387) 12.799 4.262 ( 1.443 0.000 2.328) 2.739 4.360 ( 4.018 0.000 -7.959) 8.916 4.374 ( 7.882 0.000 -3.636) 8.681 4.564 ( 5.574 0.000 2.968) 6.315 4.593 ( 4.343 0.000 -9.465) 10.414 4.650 ( 0.350 0.000 7.180) 7.189 4.717 ( 4.360 0.000 3.941) 5.877 4.841 ( 2.844 0.000 4.778) 5.560 4.902 ( -2.488 0.000 -7.007) 7.435 4.988 ( -3.507 0.000 -6.541) 7.422 5.015 ( -3.370 0.000 2.814) 4.390 5.087 ( 7.932 0.000 -2.978) 8.473 5.107 ( 0.518 0.000 -4.490) 4.520 5.175 ( 3.564 0.000 -3.438) 4.952 5.196 ( -5.346 0.000 2.195) 5.779 5.306 ( -2.420 0.000 -0.826) 2.556 5.494 ( 2.970 0.000 -2.302) 3.757 5.499 ( -0.876 0.000 5.654) 5.722 5.555 ( -2.862 0.000 -4.322) 5.184 5.752 ( 4.103 0.000 2.221) 4.665 5.760 ( 3.175 0.000 -7.693) 8.322 5.869 ( 1.226 0.000 -1.065) 1.624 5.937 ( -6.088 0.000 0.194) 6.091 5.954 ( 0.401 0.000 3.399) 3.422 5.970 ( 2.033 0.000 -3.326) 3.898 6.072 ( -0.610 0.000 -1.826) 1.925 6.129 ( 5.477 0.000 -0.898) 5.550 6.147 ( 7.730 0.000 -0.567) 7.751 6.396 ( 2.445 0.000 -5.312) 5.848 6.489 ( -0.689 0.000 2.070) 2.182 6.609 ( 0.690 0.000 4.483) 4.536 6.653 ( -1.782 0.000 1.338) 2.228 6.661 ( 1.565 0.000 3.573) 3.901 6.700 ( -0.988 0.000 4.271) 4.384 6.784 ( -1.917 0.000 -4.411) 4.809 6.906 ( -3.749 0.000 1.902) 4.204 6.960 ( -9.946 0.000 -2.893) 10.358 7.094 ( -15.604 0.000 5.090) 16.413 7.183 ( 0.975 0.000 0.314) 1.024 7.224 ( -1.879 0.000 3.971) 4.393 7.303 ( -8.192 0.000 -1.358) 8.304 7.348 ( -4.956 0.000 -3.566) 6.106 7.400 ( -3.649 0.000 -1.251) 3.858 7.631 ( -7.561 0.000 -0.102) 7.562 7.634 ( -11.023 0.000 5.295) 12.228 8.164 ( -20.847 0.000 -4.524) 21.333 8.279 ( -13.353 0.000 -0.607) 13.367 8.494 ( -18.956 0.000 -0.866) 18.975 8.633 ( -12.648 0.000 -0.077) 12.648 8.948 ( 0.359 0.000 -3.119) 3.139 8.981 ( 0.103 0.000 1.484) 1.488 8.997 ( -1.186 0.000 1.927) 2.263 9.168 ( 6.716 0.000 0.684) 6.751 9.306 ( 0.272 0.000 1.472) 1.497 9.357 ( 3.227 0.000 -1.013) 3.383 9.369 ( 3.584 0.000 1.262) 3.800 9.435 ( 3.025 0.000 -2.436) 3.884 9.478 ( 4.009 0.000 -1.004) 4.133 9.513 ( 4.057 0.000 2.036) 4.539 9.619 ( 5.585 0.000 -0.019) 5.585 9.777 ( 3.042 0.000 -1.359) 3.332 9.961 ( 0.633 0.000 4.352) 4.398 10.038 ( -10.805 0.000 2.282) 11.043 10.112 ( -4.423 0.000 -4.101) 6.032 10.192 ( -9.829 0.000 1.810) 9.994 10.303 ( -11.266 0.000 1.620) 11.382 10.321 ( -7.739 0.000 -4.518) 8.961 10.501 ( -9.226 0.000 -2.880) 9.665 10.588 ( -7.262 0.000 1.644) 7.446 10.617 ( -6.623 0.000 0.502) 6.642 10.765 ( -4.065 0.000 0.173) 4.068 10.992 ( -3.838 0.000 -1.715) 4.204 11.016 ( -6.918 0.000 0.892) 6.975 11.558 ( 14.102 0.000 0.270) 14.104 11.580 ( 12.952 0.000 -0.649) 12.969 11.672 ( 4.548 0.000 0.028) 4.548 11.675 ( 2.601 0.000 0.526) 2.654 12.030 ( 4.769 0.000 1.847) 5.114 12.095 ( -0.779 0.000 -1.989) 2.136 12.215 ( -3.768 0.000 2.060) 4.294 12.254 ( -2.845 0.000 0.440) 2.878 12.378 ( -0.859 0.000 -0.509) 0.998 12.390 ( 5.322 0.000 0.740) 5.373 12.450 ( 2.040 0.000 0.256) 2.056 12.478 ( -0.538 0.000 -2.573) 2.629 12.610 ( 5.414 0.000 1.261) 5.559 12.679 ( 4.717 0.000 -0.611) 4.756 12.977 ( -0.302 0.000 0.043) 0.305 12.991 ( -0.472 0.000 -0.238) 0.529 13.248 ( 2.043 0.000 0.055) 2.043 13.306 ( 1.737 0.000 -0.324) 1.767 13.835 ( 0.512 0.000 1.787) 1.859 13.849 ( -9.311 0.000 0.203) 9.313 13.886 ( 9.588 0.000 1.902) 9.775 13.886 ( 14.494 0.000 -3.878) 15.004 14.293 ( 1.528 0.000 -0.787) 1.719 14.313 ( 4.463 0.000 -0.182) 4.467 14.333 ( -1.101 0.000 0.786) 1.353 14.389 ( -4.677 0.000 -0.086) 4.678 14.756 ( 4.165 0.000 -1.490) 4.423 14.771 ( -0.651 0.000 0.641) 0.913 14.978 ( 6.580 0.000 -0.383) 6.591 15.126 ( 11.563 0.000 -2.707) 11.876 15.299 ( 8.455 0.000 0.458) 8.467 15.311 ( 11.711 0.000 1.023) 11.756 15.443 ( 17.500 0.000 -1.135) 17.537 15.521 ( 7.633 0.000 -0.623) 7.659 15.644 ( -6.624 0.000 -0.298) 6.631 15.656 ( -3.547 0.000 0.493) 3.581 15.898 ( 7.409 0.000 1.913) 7.652 15.918 ( 8.159 0.000 -5.722) 9.965 16.043 ( -4.085 0.000 4.451) 6.041 16.102 ( -5.557 0.000 -5.372) 7.729 16.600 ( 0.125 0.000 1.798) 1.802 16.630 ( 6.153 0.000 -1.804) 6.412 16.656 ( 0.583 0.000 -3.430) 3.479 16.689 ( 3.082 0.000 3.487) 4.654 17.312 ( -0.167 0.000 0.262) 0.310 17.348 ( 0.394 0.000 -0.050) 0.397 17.349 ( 0.370 0.000 0.941) 1.011 17.430 ( 1.324 0.000 -1.164) 1.763 19.796 ( 4.967 0.000 2.837) 5.720 19.904 ( 4.709 0.000 -4.333) 6.400 20.083 ( 2.759 0.000 1.258) 3.032 20.089 ( 1.578 0.000 -0.540) 1.667 20.419 ( -6.713 0.000 2.383) 7.124 20.549 ( -5.184 0.000 1.506) 5.398 20.747 ( -1.855 0.000 -1.624) 2.465 20.833 ( -1.242 0.000 -1.543) 1.981 22.069 ( 6.386 0.000 0.498) 6.405 22.073 ( 4.589 0.000 -1.608) 4.862 22.209 ( 5.814 0.000 0.194) 5.817 22.223 ( 6.704 0.000 1.072) 6.789 22.906 ( -8.275 0.000 -0.991) 8.334 23.041 ( -6.145 0.000 -0.663) 6.181 23.156 ( -12.342 0.000 1.878) 12.484 23.230 ( -9.719 0.000 0.538) 9.733 26.827 ( 16.614 0.000 1.430) 16.675 26.871 ( 18.154 0.000 -1.965) 18.260 27.067 ( 25.805 0.000 7.940) 26.999 27.267 ( 29.348 0.000 -16.349) 33.595 28.695 ( -21.621 0.000 1.483) 21.672 28.744 ( -21.385 0.000 -1.854) 21.465 29.095 ( -16.126 0.000 4.016) 16.619 29.159 ( -17.584 0.000 -4.419) 18.131 30.141 ( 17.122 0.000 2.253) 17.270 30.164 ( 14.955 0.000 -1.747) 15.057 30.628 ( 2.816 0.000 4.975) 5.716 30.719 ( 1.781 0.000 -2.888) 3.393 30.872 ( 4.024 0.000 -2.281) 4.625 30.880 ( 6.796 0.000 2.144) 7.126 31.206 ( 7.949 0.000 0.153) 7.950 31.214 ( 7.023 0.000 -2.761) 7.547 31.505 ( -0.980 0.000 -0.436) 1.073 31.639 ( 2.305 0.000 2.806) 3.632 31.901 ( -4.950 0.000 0.771) 5.010 31.902 ( -7.819 0.000 -1.509) 7.964 32.003 ( -10.591 0.000 1.190) 10.658 32.160 ( -5.338 0.000 2.014) 5.705 32.311 ( 4.682 0.000 7.176) 8.568 32.519 ( -0.058 0.000 -22.384) 22.384 32.780 ( 11.494 0.000 4.747) 12.436 32.871 ( 11.756 0.000 3.314) 12.214 33.038 ( 12.976 0.000 -1.663) 13.082 33.055 ( 10.668 0.000 -9.034) 13.979 33.674 ( -3.657 0.000 0.383) 3.677 33.683 ( -3.422 0.000 3.322) 4.770 33.896 ( -5.712 0.000 -1.124) 5.822 33.940 ( -7.011 0.000 -5.972) 9.210 34.899 ( -2.465 0.000 0.117) 2.468 35.019 ( -2.293 0.000 -0.794) 2.427 35.142 ( 3.039 0.000 1.163) 3.254 35.198 ( 2.135 0.000 2.566) 3.338 35.545 ( 2.117 0.000 -3.538) 4.123 35.683 ( 4.842 0.000 -1.038) 4.952 35.783 ( 4.981 0.000 -2.821) 5.725 35.799 ( 5.601 0.000 -0.794) 5.657 36.174 ( 2.710 0.000 11.805) 12.112 36.228 ( 1.931 0.000 10.433) 10.610 36.327 ( 0.071 0.000 -7.765) 7.765 36.405 ( 3.305 0.000 -10.174) 10.698 37.344 ( -2.707 0.000 23.906) 24.059 37.703 ( -7.517 0.000 -17.719) 19.248 38.227 ( -23.928 0.000 17.796) 29.820 38.536 ( -17.540 0.000 -8.220) 19.370 ======================= Grid point 48 (19/69) ======================= q-point: ( 0.33 0.00 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( 10.470 0.000 5.902) 12.018 1.936 ( 15.559 0.000 -12.844) 20.176 2.176 ( 9.920 0.000 11.784) 15.403 2.190 ( 6.234 0.000 -11.303) 12.908 2.357 ( 5.008 0.000 -8.902) 10.214 2.384 ( -3.975 0.000 -2.455) 4.672 2.396 ( 11.146 0.000 12.599) 16.821 2.632 ( 5.263 0.000 -1.810) 5.565 2.707 ( -0.368 0.000 -1.101) 1.161 2.759 ( -0.136 0.000 4.369) 4.371 2.849 ( -0.236 0.000 3.867) 3.874 2.875 ( 5.106 0.000 5.557) 7.547 2.913 ( -7.596 0.000 -2.276) 7.930 3.065 ( 2.341 0.000 -1.225) 2.642 3.083 ( -8.165 0.000 1.716) 8.343 3.180 ( -2.736 0.000 -7.181) 7.685 3.205 ( 7.437 0.000 -7.487) 10.553 3.249 ( -0.254 0.000 -3.224) 3.234 3.352 ( 2.659 0.000 -0.670) 2.742 3.402 ( 8.036 0.000 3.918) 8.941 3.453 ( 10.311 0.000 -8.521) 13.377 3.562 ( -3.739 0.000 -0.238) 3.746 3.636 ( 3.271 0.000 -4.568) 5.618 3.741 ( -3.925 0.000 -2.661) 4.742 3.815 ( 13.904 0.000 0.118) 13.904 3.862 ( 7.397 0.000 -4.645) 8.734 3.882 ( 4.129 0.000 16.069) 16.591 4.001 ( 14.019 0.000 11.617) 18.207 4.040 ( 3.232 0.000 -1.562) 3.590 4.086 ( 1.708 0.000 0.257) 1.727 4.282 ( -0.837 0.000 0.134) 0.847 4.312 ( 2.406 0.000 -6.993) 7.395 4.407 ( 2.075 0.000 10.750) 10.948 4.409 ( 3.317 0.000 -6.142) 6.981 4.577 ( 1.594 0.000 0.933) 1.847 4.627 ( -0.520 0.000 2.712) 2.762 4.683 ( -3.161 0.000 1.473) 3.487 4.788 ( -3.883 0.000 -8.804) 9.622 4.862 ( 6.629 0.000 1.644) 6.829 4.908 ( 2.226 0.000 -4.558) 5.072 4.917 ( -3.988 0.000 -5.152) 6.516 4.971 ( 1.834 0.000 8.779) 8.969 5.082 ( -1.214 0.000 -4.447) 4.610 5.144 ( -2.482 0.000 1.856) 3.099 5.172 ( 5.550 0.000 2.739) 6.189 5.287 ( 8.569 0.000 4.897) 9.870 5.288 ( 1.023 0.000 2.780) 2.962 5.401 ( -9.567 0.000 1.583) 9.697 5.540 ( 0.153 0.000 3.198) 3.202 5.578 ( -0.507 0.000 3.719) 3.753 5.717 ( 2.681 0.000 -7.100) 7.589 5.806 ( 2.172 0.000 0.112) 2.174 5.861 ( -4.806 0.000 2.240) 5.303 5.915 ( 2.306 0.000 2.820) 3.643 5.974 ( -4.081 0.000 2.003) 4.546 6.021 ( 7.199 0.000 -2.255) 7.544 6.048 ( -1.154 0.000 0.975) 1.510 6.168 ( 0.891 0.000 -1.167) 1.469 6.210 ( 0.011 0.000 -0.353) 0.353 6.286 ( -3.447 0.000 -6.309) 7.190 6.566 ( -9.517 0.000 1.279) 9.602 6.592 ( 5.781 0.000 -0.203) 5.785 6.640 ( -2.597 0.000 -3.448) 4.316 6.692 ( -0.752 0.000 3.399) 3.481 6.719 ( -0.039 0.000 -3.294) 3.294 6.751 ( -5.381 0.000 -0.067) 5.381 6.760 ( 2.598 0.000 2.043) 3.305 6.910 ( 1.658 0.000 0.745) 1.818 6.988 ( -2.998 0.000 2.771) 4.082 7.150 ( -5.659 0.000 -2.153) 6.055 7.179 ( -1.882 0.000 -0.821) 2.053 7.244 ( -2.140 0.000 2.265) 3.116 7.292 ( 0.879 0.000 -1.161) 1.456 7.342 ( 1.442 0.000 -2.138) 2.579 7.473 ( -10.962 0.000 -1.508) 11.065 7.559 ( -6.177 0.000 2.940) 6.841 7.840 ( -14.489 0.000 -2.704) 14.739 8.047 ( -14.733 0.000 -0.926) 14.762 8.214 ( -14.881 0.000 -0.191) 14.882 8.442 ( -11.386 0.000 0.345) 11.391 8.944 ( 3.152 0.000 -2.988) 4.344 8.999 ( 1.427 0.000 -0.710) 1.594 9.038 ( 0.437 0.000 4.701) 4.721 9.260 ( 3.333 0.000 0.502) 3.371 9.342 ( 1.265 0.000 3.657) 3.870 9.382 ( -0.946 0.000 -2.567) 2.736 9.425 ( 4.240 0.000 -0.764) 4.308 9.428 ( 1.852 0.000 1.737) 2.539 9.548 ( 4.644 0.000 -0.636) 4.687 9.613 ( 6.577 0.000 -0.006) 6.577 9.682 ( 2.485 0.000 0.329) 2.507 9.786 ( -1.382 0.000 0.094) 1.385 9.876 ( -12.024 0.000 1.796) 12.157 9.927 ( -8.844 0.000 -0.365) 8.851 9.988 ( -4.061 0.000 -4.074) 5.752 10.079 ( -6.905 0.000 0.297) 6.912 10.189 ( -5.681 0.000 5.748) 8.081 10.197 ( -2.564 0.000 -3.377) 4.240 10.334 ( -7.581 0.000 -3.591) 8.389 10.496 ( -4.667 0.000 0.848) 4.743 10.574 ( -3.535 0.000 1.989) 4.056 10.703 ( -3.475 0.000 -0.452) 3.504 10.911 ( -6.201 0.000 0.547) 6.225 10.924 ( -2.644 0.000 -0.895) 2.792 11.721 ( 2.698 0.000 0.306) 2.716 11.743 ( 4.586 0.000 0.341) 4.599 11.749 ( 8.686 0.000 -0.292) 8.690 11.757 ( 9.755 0.000 -0.049) 9.755 12.053 ( -1.742 0.000 -0.980) 1.999 12.114 ( 3.283 0.000 1.211) 3.499 12.196 ( -2.099 0.000 1.553) 2.611 12.216 ( -2.202 0.000 -0.193) 2.210 12.373 ( 0.083 0.000 1.120) 1.124 12.438 ( -0.329 0.000 -2.135) 2.161 12.480 ( 3.699 0.000 0.899) 3.807 12.507 ( 5.718 0.000 -0.528) 5.743 12.697 ( 4.333 0.000 0.662) 4.383 12.721 ( 1.477 0.000 -0.876) 1.718 12.947 ( -4.302 0.000 -0.869) 4.389 12.967 ( -1.438 0.000 0.306) 1.471 13.305 ( 5.680 0.000 -0.179) 5.682 13.353 ( 4.432 0.000 -0.145) 4.434 13.704 ( -8.274 0.000 -0.224) 8.277 13.712 ( -8.641 0.000 0.256) 8.645 14.058 ( 10.325 0.000 -0.830) 10.358 14.190 ( 13.828 0.000 2.931) 14.135 14.297 ( 0.010 0.000 -0.016) 0.019 14.297 ( -0.003 0.000 -0.012) 0.012 14.337 ( -2.047 0.000 0.125) 2.051 14.420 ( 6.955 0.000 -1.566) 7.129 14.719 ( -5.243 0.000 -1.616) 5.486 14.766 ( -2.006 0.000 1.578) 2.552 15.125 ( 9.975 0.000 0.678) 9.998 15.222 ( 5.157 0.000 -2.466) 5.716 15.410 ( 3.033 0.000 1.328) 3.311 15.462 ( 4.665 0.000 1.275) 4.836 15.552 ( -0.390 0.000 -1.097) 1.164 15.561 ( -1.249 0.000 1.023) 1.614 15.627 ( 0.064 0.000 -0.774) 0.776 15.663 ( 7.184 0.000 -0.233) 7.188 15.992 ( 0.728 0.000 -2.094) 2.217 16.014 ( 8.659 0.000 -5.057) 10.028 16.027 ( 0.134 0.000 2.603) 2.606 16.059 ( 6.473 0.000 2.658) 6.997 16.613 ( -0.985 0.000 2.308) 2.510 16.620 ( -1.076 0.000 -1.827) 2.120 16.694 ( 4.270 0.000 -1.543) 4.540 16.736 ( -2.114 0.000 2.716) 3.442 17.319 ( 0.796 0.000 -0.075) 0.800 17.367 ( 0.269 0.000 1.174) 1.205 17.367 ( 1.820 0.000 0.452) 1.875 17.427 ( 0.574 0.000 -2.026) 2.106 19.928 ( 7.434 0.000 2.959) 8.001 19.932 ( 5.711 0.000 -4.124) 7.044 20.115 ( 2.524 0.000 -1.193) 2.791 20.178 ( 5.783 0.000 2.049) 6.135 20.342 ( -7.403 0.000 3.559) 8.214 20.464 ( -7.271 0.000 1.274) 7.382 20.703 ( -2.142 0.000 -0.585) 2.220 20.786 ( -2.502 0.000 -1.324) 2.831 22.152 ( 7.136 0.000 -0.691) 7.169 22.168 ( 7.525 0.000 -1.353) 7.646 22.332 ( 8.596 0.000 0.624) 8.618 22.352 ( 8.552 0.000 -0.178) 8.554 22.765 ( -8.107 0.000 -0.497) 8.122 22.918 ( -8.652 0.000 -0.408) 8.662 22.989 ( -11.499 0.000 1.894) 11.654 23.066 ( -11.214 0.000 -0.058) 11.214 27.139 ( 19.273 0.000 -2.567) 19.443 27.139 ( 19.809 0.000 2.472) 19.963 27.525 ( 24.302 0.000 -10.915) 26.641 27.617 ( 26.233 0.000 14.306) 29.880 28.384 ( -20.335 0.000 1.680) 20.404 28.389 ( -20.713 0.000 -2.479) 20.860 28.797 ( -21.706 0.000 -4.965) 22.266 28.869 ( -18.158 0.000 4.638) 18.741 30.351 ( 11.346 0.000 -1.559) 11.453 30.410 ( 13.616 0.000 2.673) 13.875 30.702 ( 0.646 0.000 3.380) 3.441 30.709 ( 0.544 0.000 -2.793) 2.846 30.933 ( 7.228 0.000 -2.211) 7.559 31.036 ( 9.490 0.000 2.599) 9.840 31.283 ( 2.263 0.000 1.397) 2.660 31.337 ( 8.640 0.000 0.656) 8.665 31.449 ( -3.696 0.000 -1.119) 3.861 31.579 ( -10.884 0.000 0.121) 10.885 31.791 ( -5.916 0.000 0.080) 5.917 31.830 ( -11.377 0.000 1.580) 11.486 31.942 ( 5.936 0.000 0.637) 5.970 32.128 ( 0.969 0.000 -3.144) 3.290 32.331 ( 1.524 0.000 -7.490) 7.644 32.489 ( 2.496 0.000 11.672) 11.936 32.979 ( 6.713 0.000 4.242) 7.941 33.075 ( 9.399 0.000 1.427) 9.507 33.184 ( 13.066 0.000 -2.323) 13.271 33.213 ( 12.176 0.000 -2.262) 12.385 33.610 ( -4.501 0.000 -1.721) 4.819 33.651 ( -3.179 0.000 0.832) 3.286 33.776 ( -8.270 0.000 -0.673) 8.297 33.808 ( -8.080 0.000 3.845) 8.948 34.866 ( -1.409 0.000 -0.207) 1.424 34.974 ( -0.992 0.000 -1.877) 2.123 35.185 ( 2.154 0.000 -1.126) 2.430 35.244 ( 1.829 0.000 -0.175) 1.837 35.550 ( 1.434 0.000 0.087) 1.437 35.740 ( 3.774 0.000 -1.093) 3.929 35.828 ( 3.639 0.000 -1.050) 3.788 35.873 ( 4.378 0.000 -0.200) 4.383 36.250 ( 1.895 0.000 -8.206) 8.422 36.315 ( -0.615 0.000 7.487) 7.513 36.358 ( 6.206 0.000 -11.296) 12.888 36.367 ( 2.875 0.000 6.064) 6.711 37.420 ( -3.104 0.000 -14.565) 14.892 37.493 ( -6.354 0.000 14.826) 16.130 38.071 ( -19.224 0.000 12.848) 23.122 38.158 ( -14.016 0.000 -11.070) 17.860 ======================= Grid point 49 (20/69) ======================= q-point: ( 0.44 0.00 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( 6.865 0.000 0.673) 6.898 2.024 ( 12.860 0.000 -10.270) 16.457 2.161 ( -0.714 0.000 -9.602) 9.629 2.235 ( -1.074 0.000 -0.149) 1.085 2.306 ( -9.232 0.000 1.892) 9.423 2.432 ( 9.735 0.000 3.662) 10.401 2.597 ( 7.917 0.000 0.608) 7.941 2.608 ( 5.415 0.000 -1.335) 5.577 2.734 ( -4.357 0.000 -6.361) 7.711 2.769 ( -15.344 0.000 -0.067) 15.344 2.811 ( 0.535 0.000 3.217) 3.261 2.874 ( -2.591 0.000 -6.646) 7.133 2.890 ( -2.387 0.000 6.199) 6.642 2.997 ( -1.262 0.000 0.027) 1.262 3.083 ( 4.999 0.000 -5.509) 7.439 3.132 ( 5.053 0.000 -2.336) 5.567 3.230 ( 4.625 0.000 -7.975) 9.219 3.303 ( 3.303 0.000 4.420) 5.518 3.344 ( -3.904 0.000 -11.606) 12.245 3.480 ( 4.522 0.000 1.236) 4.688 3.519 ( 5.543 0.000 1.149) 5.661 3.576 ( 13.623 0.000 -4.707) 14.413 3.636 ( 1.405 0.000 -0.479) 1.484 3.712 ( -3.226 0.000 3.431) 4.709 3.821 ( -2.487 0.000 -8.280) 8.646 3.944 ( 11.217 0.000 -7.069) 13.258 3.985 ( -8.203 0.000 2.439) 8.558 4.054 ( -3.336 0.000 -1.467) 3.645 4.167 ( 2.158 0.000 1.859) 2.848 4.242 ( -0.769 0.000 0.663) 1.016 4.258 ( 2.547 0.000 1.874) 3.163 4.316 ( 7.255 0.000 -1.073) 7.334 4.428 ( 3.254 0.000 2.114) 3.880 4.454 ( -4.569 0.000 -0.330) 4.581 4.561 ( -5.143 0.000 -4.439) 6.793 4.671 ( -0.746 0.000 6.532) 6.575 4.677 ( 0.937 0.000 5.675) 5.752 4.744 ( 7.294 0.000 4.065) 8.350 4.782 ( -2.834 0.000 -2.330) 3.669 4.903 ( -2.865 0.000 -2.096) 3.550 4.916 ( 4.410 0.000 -3.706) 5.760 4.966 ( -0.429 0.000 -6.390) 6.405 5.088 ( -4.309 0.000 3.902) 5.813 5.173 ( 3.452 0.000 6.446) 7.312 5.247 ( 1.654 0.000 -4.160) 4.477 5.288 ( -6.875 0.000 0.765) 6.917 5.408 ( 7.729 0.000 3.563) 8.511 5.469 ( 4.207 0.000 2.015) 4.665 5.565 ( -6.004 0.000 9.866) 11.549 5.584 ( -3.452 0.000 4.462) 5.642 5.684 ( -0.736 0.000 -0.078) 0.741 5.826 ( 0.017 0.000 -2.671) 2.671 5.830 ( -5.266 0.000 8.040) 9.611 5.924 ( 0.029 0.000 1.537) 1.537 5.950 ( -2.140 0.000 4.411) 4.903 6.051 ( 0.577 0.000 0.502) 0.765 6.072 ( 0.559 0.000 -0.383) 0.678 6.161 ( -0.762 0.000 -0.512) 0.918 6.203 ( -1.346 0.000 2.331) 2.691 6.245 ( 7.499 0.000 -2.622) 7.944 6.479 ( -5.038 0.000 2.393) 5.577 6.527 ( 1.470 0.000 -5.832) 6.015 6.608 ( 0.117 0.000 -2.487) 2.490 6.641 ( -6.259 0.000 0.409) 6.272 6.700 ( 4.748 0.000 -2.590) 5.409 6.801 ( 1.318 0.000 -2.248) 2.605 6.884 ( 10.250 0.000 0.403) 10.258 6.905 ( -1.418 0.000 -6.997) 7.140 7.030 ( 5.619 0.000 3.495) 6.618 7.070 ( -2.639 0.000 -0.251) 2.651 7.149 ( -2.265 0.000 1.895) 2.953 7.171 ( -13.615 0.000 -4.096) 14.218 7.285 ( 1.317 0.000 1.691) 2.143 7.353 ( -3.433 0.000 6.028) 6.937 7.371 ( 2.298 0.000 -4.644) 5.182 7.512 ( -2.857 0.000 2.639) 3.890 7.708 ( -0.823 0.000 0.728) 1.099 7.850 ( -7.747 0.000 0.950) 7.805 8.076 ( -3.896 0.000 2.755) 4.771 8.313 ( -5.176 0.000 0.458) 5.197 8.947 ( 1.189 0.000 -3.205) 3.418 8.999 ( 0.858 0.000 -2.737) 2.868 9.097 ( -0.140 0.000 4.732) 4.735 9.280 ( 0.127 0.000 -0.682) 0.694 9.369 ( 3.258 0.000 -1.157) 3.458 9.410 ( -0.260 0.000 4.331) 4.339 9.466 ( 0.044 0.000 2.274) 2.274 9.485 ( 0.827 0.000 1.970) 2.137 9.601 ( 2.976 0.000 -0.317) 2.993 9.683 ( 3.593 0.000 -1.295) 3.819 9.718 ( 1.941 0.000 -0.811) 2.104 9.720 ( -5.090 0.000 0.216) 5.094 9.758 ( -4.208 0.000 -0.225) 4.214 9.780 ( -6.429 0.000 -1.073) 6.518 9.937 ( 1.166 0.000 -1.063) 1.578 9.974 ( -4.316 0.000 -0.639) 4.363 10.151 ( 0.715 0.000 -2.565) 2.663 10.180 ( -6.509 0.000 -3.256) 7.278 10.240 ( 1.594 0.000 4.950) 5.200 10.466 ( -1.035 0.000 1.415) 1.753 10.524 ( -3.387 0.000 -1.204) 3.595 10.653 ( -1.266 0.000 -1.572) 2.018 10.860 ( -2.081 0.000 1.738) 2.711 10.897 ( -0.291 0.000 0.257) 0.388 11.748 ( 0.645 0.000 0.191) 0.673 11.784 ( 1.196 0.000 -0.210) 1.214 11.848 ( 3.793 0.000 0.168) 3.796 11.871 ( 4.184 0.000 -0.237) 4.190 12.034 ( -0.217 0.000 0.569) 0.609 12.142 ( -0.524 0.000 0.182) 0.555 12.173 ( -1.658 0.000 -0.229) 1.673 12.185 ( -1.088 0.000 -0.299) 1.128 12.376 ( -1.051 0.000 0.180) 1.066 12.460 ( 2.844 0.000 1.457) 3.196 12.511 ( 0.786 0.000 -1.406) 1.611 12.592 ( 4.446 0.000 -0.459) 4.470 12.715 ( -0.417 0.000 -0.505) 0.655 12.759 ( 3.097 0.000 -0.129) 3.100 12.864 ( -4.104 0.000 -0.128) 4.106 12.940 ( -1.849 0.000 -0.269) 1.868 13.411 ( 7.569 0.000 -0.341) 7.577 13.427 ( 4.452 0.000 -0.145) 4.454 13.583 ( -8.003 0.000 0.129) 8.004 13.592 ( -5.270 0.000 -0.480) 5.292 14.168 ( 3.621 0.000 0.564) 3.664 14.264 ( 0.488 0.000 -0.320) 0.584 14.285 ( -0.639 0.000 0.049) 0.641 14.316 ( -0.897 0.000 -0.552) 1.053 14.444 ( 11.121 0.000 1.817) 11.268 14.511 ( 7.500 0.000 -2.192) 7.814 14.591 ( -8.919 0.000 -0.794) 8.954 14.722 ( -5.905 0.000 0.670) 5.943 15.262 ( 6.718 0.000 0.255) 6.722 15.276 ( 6.408 0.000 -1.917) 6.689 15.389 ( -5.808 0.000 0.664) 5.846 15.432 ( -6.862 0.000 0.777) 6.905 15.586 ( 4.840 0.000 -1.272) 5.004 15.599 ( -0.678 0.000 -0.161) 0.697 15.611 ( 2.803 0.000 -0.186) 2.809 15.689 ( -2.177 0.000 -0.133) 2.181 16.011 ( 3.283 0.000 -0.914) 3.408 16.060 ( 1.310 0.000 0.208) 1.327 16.110 ( 5.998 0.000 -0.007) 5.998 16.159 ( 1.546 0.000 1.655) 2.265 16.597 ( 0.137 0.000 -0.068) 0.153 16.625 ( -1.052 0.000 2.216) 2.453 16.694 ( -4.693 0.000 0.748) 4.752 16.731 ( 2.611 0.000 -1.015) 2.801 17.327 ( 0.300 0.000 -0.500) 0.583 17.380 ( -0.362 0.000 1.332) 1.380 17.393 ( -0.452 0.000 -0.872) 0.982 17.418 ( 2.240 0.000 -0.704) 2.349 19.996 ( 7.383 0.000 -3.006) 7.972 20.063 ( 4.084 0.000 -0.274) 4.093 20.120 ( 0.872 0.000 0.487) 0.999 20.236 ( -2.948 0.000 1.156) 3.167 20.296 ( -3.135 0.000 4.188) 5.232 20.386 ( -4.388 0.000 2.404) 5.003 20.675 ( -0.833 0.000 0.234) 0.865 20.748 ( -0.496 0.000 -0.141) 0.516 22.252 ( 4.216 0.000 0.153) 4.219 22.265 ( 5.378 0.000 -0.940) 5.459 22.460 ( 5.838 0.000 -0.600) 5.869 22.463 ( 6.517 0.000 0.622) 6.546 22.672 ( -3.257 0.000 0.025) 3.257 22.781 ( -6.804 0.000 -2.296) 7.181 22.860 ( -6.793 0.000 2.513) 7.243 22.914 ( -6.681 0.000 0.274) 6.687 27.388 ( 14.245 0.000 -1.453) 14.319 27.435 ( 11.261 0.000 1.664) 11.383 27.766 ( 16.408 0.000 -3.852) 16.854 28.052 ( 2.909 0.000 6.296) 6.936 28.104 ( -7.520 0.000 -2.772) 8.014 28.126 ( -13.224 0.000 0.949) 13.258 28.462 ( -8.307 0.000 1.815) 8.503 28.675 ( -13.423 0.000 6.132) 14.758 30.472 ( 5.760 0.000 -0.867) 5.825 30.591 ( 4.606 0.000 -0.247) 4.612 30.677 ( 0.239 0.000 -0.109) 0.263 30.722 ( -1.992 0.000 2.020) 2.836 31.051 ( 9.992 0.000 -0.339) 9.998 31.198 ( 7.432 0.000 0.387) 7.442 31.247 ( -8.541 0.000 1.692) 8.707 31.384 ( -10.423 0.000 -2.031) 10.619 31.459 ( 4.062 0.000 1.657) 4.387 31.502 ( 9.238 0.000 3.898) 10.027 31.682 ( -10.836 0.000 2.567) 11.136 31.723 ( -3.533 0.000 1.764) 3.949 32.018 ( 1.653 0.000 0.622) 1.766 32.098 ( 2.353 0.000 -5.401) 5.891 32.423 ( 7.260 0.000 9.206) 11.724 32.613 ( -4.699 0.000 11.955) 12.845 33.056 ( 0.286 0.000 -0.039) 0.289 33.156 ( 2.477 0.000 -3.875) 4.599 33.359 ( 8.928 0.000 -2.023) 9.154 33.378 ( 9.250 0.000 1.990) 9.461 33.520 ( -0.781 0.000 -2.602) 2.717 33.619 ( -2.435 0.000 1.117) 2.679 33.683 ( -5.834 0.000 3.836) 6.982 33.723 ( -8.008 0.000 4.180) 9.033 34.859 ( 0.026 0.000 0.959) 0.959 34.957 ( 0.800 0.000 -0.754) 1.099 35.180 ( 0.812 0.000 -3.460) 3.554 35.244 ( 0.388 0.000 -3.064) 3.089 35.598 ( 1.479 0.000 4.237) 4.487 35.770 ( 1.712 0.000 -1.146) 2.060 35.874 ( 2.246 0.000 1.161) 2.528 35.925 ( 2.165 0.000 0.292) 2.184 36.204 ( 4.384 0.000 -8.739) 9.777 36.279 ( -5.962 0.000 -4.477) 7.456 36.340 ( 7.961 0.000 -11.834) 14.262 36.389 ( -3.715 0.000 -3.069) 4.819 37.351 ( 7.964 0.000 -3.211) 8.587 37.478 ( -10.507 0.000 5.875) 12.038 37.908 ( -16.012 0.000 6.443) 17.259 37.961 ( 2.646 0.000 -5.317) 5.939 ======================= Grid point 50 (21/69) ======================= q-point: (-0.44 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( -17.865 0.000 -0.621) 17.876 1.987 ( -20.777 0.000 -9.547) 22.866 2.121 ( 10.081 0.000 -5.515) 11.490 2.127 ( 12.926 0.000 -6.227) 14.348 2.380 ( 3.149 0.000 0.411) 3.176 2.383 ( -21.447 0.000 -7.147) 22.607 2.480 ( 7.224 0.000 -3.377) 7.975 2.659 ( -3.336 0.000 -7.693) 8.385 2.680 ( -5.134 0.000 0.680) 5.179 2.716 ( -3.075 0.000 -4.442) 5.402 2.813 ( 10.632 0.000 7.335) 12.917 2.904 ( -6.713 0.000 4.555) 8.113 2.956 ( 7.015 0.000 8.663) 11.147 2.964 ( 2.706 0.000 1.479) 3.084 3.038 ( 1.436 0.000 -4.579) 4.799 3.039 ( -3.437 0.000 -12.306) 12.777 3.199 ( -1.879 0.000 1.406) 2.347 3.282 ( -5.828 0.000 -8.805) 10.560 3.359 ( -3.227 0.000 -5.912) 6.735 3.431 ( 4.476 0.000 8.620) 9.712 3.540 ( -12.128 0.000 -9.419) 15.356 3.603 ( -3.196 0.000 -0.199) 3.202 3.635 ( -9.592 0.000 2.217) 9.845 3.712 ( 0.536 0.000 5.415) 5.442 3.787 ( 8.188 0.000 -7.533) 11.126 3.867 ( 1.649 0.000 0.937) 1.897 3.914 ( -6.537 0.000 -5.236) 8.375 3.983 ( -0.112 0.000 -9.167) 9.168 4.088 ( 1.300 0.000 -4.527) 4.710 4.294 ( -3.443 0.000 -0.799) 3.534 4.302 ( -9.551 0.000 0.069) 9.552 4.350 ( 3.757 0.000 0.460) 3.785 4.358 ( 1.738 0.000 3.042) 3.503 4.478 ( 1.991 0.000 -0.597) 2.078 4.528 ( 3.544 0.000 4.949) 6.087 4.670 ( -5.069 0.000 5.424) 7.424 4.748 ( -2.897 0.000 -4.891) 5.685 4.766 ( -2.088 0.000 9.501) 9.728 4.829 ( -0.167 0.000 -5.574) 5.577 4.887 ( 9.072 0.000 -11.980) 15.027 4.942 ( 1.164 0.000 2.139) 2.435 5.022 ( -4.171 0.000 0.861) 4.259 5.060 ( 10.791 0.000 11.504) 15.773 5.180 ( -0.246 0.000 -5.296) 5.302 5.208 ( -5.658 0.000 0.975) 5.742 5.291 ( 2.065 0.000 4.040) 4.538 5.405 ( -5.514 0.000 -0.799) 5.571 5.552 ( 3.313 0.000 4.529) 5.612 5.576 ( -3.477 0.000 5.468) 6.480 5.607 ( -3.308 0.000 12.221) 12.661 5.730 ( 0.495 0.000 4.912) 4.937 5.755 ( -0.308 0.000 -5.473) 5.482 5.889 ( -4.121 0.000 4.435) 6.054 5.966 ( -2.557 0.000 4.059) 4.797 5.997 ( 5.240 0.000 3.608) 6.362 6.074 ( 0.294 0.000 -1.066) 1.106 6.096 ( 4.051 0.000 0.955) 4.162 6.149 ( 1.567 0.000 -0.282) 1.593 6.221 ( 1.379 0.000 2.013) 2.440 6.406 ( 9.534 0.000 3.060) 10.012 6.427 ( -5.230 0.000 1.945) 5.580 6.513 ( 1.213 0.000 -3.912) 4.096 6.575 ( 0.598 0.000 -3.325) 3.378 6.642 ( 7.750 0.000 -1.305) 7.860 6.747 ( -4.242 0.000 -3.013) 5.203 6.766 ( 4.092 0.000 0.151) 4.095 6.784 ( -1.318 0.000 -7.762) 7.873 6.809 ( -12.400 0.000 -5.424) 13.534 6.999 ( -1.116 0.000 -1.045) 1.529 7.067 ( -10.054 0.000 0.623) 10.073 7.136 ( 5.507 0.000 2.269) 5.956 7.185 ( 8.674 0.000 2.692) 9.083 7.290 ( 0.172 0.000 -1.026) 1.040 7.351 ( 3.531 0.000 -4.176) 5.469 7.445 ( -8.522 0.000 0.943) 8.575 7.450 ( 4.849 0.000 5.054) 7.003 7.795 ( 7.997 0.000 3.808) 8.857 7.892 ( 9.222 0.000 0.381) 9.230 8.146 ( 6.107 0.000 5.242) 8.048 8.298 ( 3.376 0.000 -1.090) 3.548 8.925 ( 0.813 0.000 -2.084) 2.237 8.964 ( -0.540 0.000 -3.610) 3.650 9.128 ( -2.433 0.000 4.391) 5.020 9.263 ( -0.791 0.000 -1.266) 1.493 9.404 ( -4.963 0.000 2.976) 5.787 9.447 ( 5.230 0.000 1.723) 5.507 9.469 ( -2.994 0.000 2.112) 3.664 9.476 ( -4.131 0.000 2.394) 4.774 9.622 ( -1.656 0.000 0.571) 1.752 9.645 ( -5.237 0.000 -3.698) 6.410 9.709 ( 4.073 0.000 -1.550) 4.358 9.725 ( 0.492 0.000 0.268) 0.560 9.741 ( 3.165 0.000 0.675) 3.236 9.790 ( 8.206 0.000 -0.222) 8.209 9.967 ( 2.972 0.000 -0.308) 2.988 9.968 ( 3.658 0.000 -0.470) 3.688 10.043 ( -5.772 0.000 -3.517) 6.759 10.169 ( 4.814 0.000 -1.469) 5.033 10.347 ( 5.417 0.000 3.588) 6.497 10.454 ( -0.380 0.000 -3.858) 3.877 10.502 ( 1.624 0.000 3.206) 3.594 10.636 ( 1.907 0.000 -2.096) 2.834 10.872 ( 0.846 0.000 1.478) 1.703 10.916 ( 1.762 0.000 0.704) 1.897 11.747 ( -1.140 0.000 0.280) 1.174 11.778 ( -1.416 0.000 -0.398) 1.471 11.855 ( -3.369 0.000 0.240) 3.377 11.870 ( -4.048 0.000 -0.286) 4.058 12.057 ( 1.502 0.000 1.497) 2.120 12.128 ( -0.303 0.000 -0.944) 0.991 12.140 ( -2.152 0.000 -0.328) 2.177 12.186 ( 1.522 0.000 -0.235) 1.540 12.367 ( -0.312 0.000 0.758) 0.820 12.480 ( -1.577 0.000 -2.311) 2.798 12.506 ( 0.248 0.000 2.300) 2.313 12.587 ( -3.573 0.000 -1.155) 3.755 12.726 ( 1.333 0.000 0.379) 1.386 12.736 ( -4.227 0.000 -1.237) 4.404 12.893 ( 5.557 0.000 1.041) 5.654 12.920 ( 0.870 0.000 -1.228) 1.505 13.418 ( -5.070 0.000 -0.519) 5.097 13.420 ( -7.059 0.000 0.045) 7.059 13.570 ( 7.454 0.000 -0.281) 7.459 13.592 ( 5.975 0.000 -0.322) 5.984 14.184 ( -2.330 0.000 1.540) 2.792 14.272 ( -2.785 0.000 -0.976) 2.951 14.282 ( 0.183 0.000 -0.176) 0.254 14.285 ( 1.071 0.000 -0.913) 1.407 14.412 ( -10.850 0.000 0.290) 10.854 14.563 ( -4.691 0.000 0.171) 4.694 14.635 ( 2.436 0.000 -3.158) 3.988 14.645 ( 10.160 0.000 1.954) 10.346 15.249 ( -8.060 0.000 -0.694) 8.090 15.332 ( -5.553 0.000 -0.452) 5.571 15.376 ( 3.603 0.000 0.702) 3.671 15.382 ( 7.472 0.000 -0.260) 7.477 15.546 ( -3.477 0.000 -1.078) 3.641 15.610 ( -2.121 0.000 -0.107) 2.123 15.657 ( 1.196 0.000 -1.540) 1.950 15.662 ( 1.155 0.000 0.848) 1.432 16.032 ( -4.829 0.000 -0.821) 4.898 16.034 ( 0.290 0.000 0.399) 0.493 16.137 ( -5.283 0.000 -0.084) 5.284 16.198 ( 3.247 0.000 2.559) 4.135 16.609 ( -3.275 0.000 1.428) 3.573 16.642 ( 4.594 0.000 1.986) 5.005 16.656 ( 0.006 0.000 -0.896) 0.896 16.754 ( 1.033 0.000 -0.209) 1.054 17.316 ( -0.834 0.000 -0.372) 0.913 17.360 ( -1.131 0.000 -1.445) 1.835 17.386 ( -0.855 0.000 1.080) 1.377 17.449 ( 1.420 0.000 -0.183) 1.432 19.981 ( -7.300 0.000 -2.060) 7.585 20.062 ( 2.867 0.000 -1.559) 3.264 20.193 ( -1.506 0.000 -0.170) 1.515 20.207 ( 3.051 0.000 2.021) 3.659 20.275 ( -4.780 0.000 4.207) 6.368 20.384 ( 0.200 0.000 2.708) 2.715 20.691 ( 2.198 0.000 0.847) 2.355 20.769 ( 2.668 0.000 0.023) 2.668 22.240 ( -4.734 0.000 -0.426) 4.753 22.273 ( -3.574 0.000 -0.466) 3.604 22.474 ( -7.770 0.000 0.553) 7.790 22.495 ( -5.852 0.000 0.589) 5.882 22.664 ( 6.030 0.000 0.072) 6.030 22.731 ( 6.771 0.000 -2.909) 7.369 22.869 ( 4.243 0.000 1.765) 4.596 22.928 ( 6.891 0.000 0.672) 6.923 27.375 ( -16.201 0.000 -0.950) 16.229 27.454 ( -7.734 0.000 1.261) 7.836 27.762 ( -26.293 0.000 -4.264) 26.636 27.965 ( 10.258 0.000 4.466) 11.189 28.079 ( 9.314 0.000 -0.846) 9.352 28.196 ( 16.111 0.000 -0.473) 16.118 28.626 ( -0.036 0.000 4.919) 4.919 28.683 ( 15.463 0.000 7.182) 17.050 30.499 ( -2.294 0.000 0.463) 2.341 30.513 ( -8.261 0.000 -1.951) 8.488 30.692 ( -3.559 0.000 0.800) 3.648 30.742 ( 2.928 0.000 1.111) 3.131 31.126 ( -8.403 0.000 1.597) 8.553 31.135 ( -11.168 0.000 -1.490) 11.267 31.232 ( 11.333 0.000 2.715) 11.654 31.361 ( 8.148 0.000 -3.217) 8.760 31.537 ( 0.411 0.000 4.779) 4.797 31.538 ( -9.822 0.000 1.278) 9.904 31.709 ( 8.795 0.000 5.565) 10.408 31.739 ( 2.832 0.000 1.965) 3.447 31.998 ( -4.601 0.000 0.355) 4.615 32.100 ( 1.587 0.000 0.773) 1.765 32.590 ( -12.070 0.000 7.233) 14.071 32.711 ( 11.140 0.000 14.380) 18.190 33.017 ( -4.066 0.000 -0.916) 4.168 33.067 ( -5.921 0.000 -5.306) 7.951 33.390 ( -2.741 0.000 -1.872) 3.319 33.415 ( -2.951 0.000 -1.368) 3.252 33.561 ( -5.379 0.000 -0.245) 5.385 33.569 ( 2.436 0.000 5.410) 5.933 33.742 ( 5.398 0.000 3.930) 6.677 33.750 ( 9.226 0.000 3.793) 9.975 34.885 ( 0.397 0.000 2.729) 2.758 34.975 ( 1.204 0.000 0.612) 1.350 35.141 ( -0.170 0.000 -4.031) 4.035 35.189 ( -1.494 0.000 -4.876) 5.100 35.686 ( 1.432 0.000 7.080) 7.223 35.767 ( -0.477 0.000 -1.029) 1.134 35.922 ( 1.113 0.000 2.588) 2.817 35.944 ( 0.163 0.000 -0.100) 0.191 36.085 ( -7.545 0.000 -8.553) 11.405 36.181 ( 5.791 0.000 -9.923) 11.489 36.213 ( -7.430 0.000 -9.345) 11.938 36.327 ( 8.607 0.000 -13.868) 16.322 37.307 ( -14.628 0.000 -0.983) 14.661 37.551 ( 14.862 0.000 4.121) 15.423 37.718 ( -13.231 0.000 -0.060) 13.231 38.100 ( 15.957 0.000 0.815) 15.977 ======================= Grid point 51 (22/69) ======================= q-point: (-0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( -23.535 0.000 -1.086) 23.561 1.485 ( -27.592 0.000 -10.854) 29.650 2.028 ( -16.156 0.000 -1.131) 16.195 2.219 ( 2.959 0.000 -3.598) 4.659 2.221 ( -5.416 0.000 -2.391) 5.921 2.272 ( 3.508 0.000 -2.770) 4.470 2.398 ( -8.272 0.000 -4.220) 9.286 2.584 ( -22.209 0.000 -10.214) 24.445 2.587 ( -0.608 0.000 -3.942) 3.989 2.714 ( 8.947 0.000 0.208) 8.950 2.738 ( -2.999 0.000 -3.496) 4.606 2.839 ( -8.443 0.000 -12.372) 14.979 2.936 ( -0.722 0.000 4.786) 4.841 2.967 ( -2.821 0.000 6.086) 6.708 2.970 ( -9.855 0.000 -11.048) 14.804 3.072 ( -0.611 0.000 -3.210) 3.268 3.086 ( -6.160 0.000 3.662) 7.166 3.209 ( -7.070 0.000 6.550) 9.638 3.320 ( -0.041 0.000 -1.835) 1.836 3.349 ( 12.793 0.000 0.930) 12.827 3.475 ( -8.810 0.000 -2.544) 9.170 3.478 ( -1.114 0.000 -2.322) 2.576 3.687 ( 1.369 0.000 5.530) 5.697 3.701 ( -4.963 0.000 4.318) 6.578 3.792 ( 6.142 0.000 4.714) 7.743 3.869 ( -3.948 0.000 3.945) 5.581 3.911 ( 5.492 0.000 -1.993) 5.843 4.011 ( 5.070 0.000 4.997) 7.119 4.020 ( -4.880 0.000 -6.480) 8.112 4.110 ( -3.998 0.000 -7.199) 8.235 4.207 ( -4.881 0.000 -3.733) 6.146 4.395 ( 0.153 0.000 -0.698) 0.715 4.429 ( -1.747 0.000 4.698) 5.013 4.499 ( -4.234 0.000 3.243) 5.333 4.587 ( -5.308 0.000 -5.312) 7.509 4.607 ( -2.017 0.000 4.913) 5.311 4.657 ( -4.561 0.000 2.715) 5.307 4.727 ( -6.606 0.000 -3.013) 7.261 4.863 ( 9.446 0.000 -10.134) 13.854 4.934 ( 9.860 0.000 4.435) 10.812 4.989 ( 1.547 0.000 3.046) 3.416 5.035 ( 4.038 0.000 -2.068) 4.536 5.041 ( -8.265 0.000 -1.672) 8.433 5.137 ( -3.576 0.000 0.899) 3.688 5.336 ( 6.462 0.000 6.000) 8.818 5.345 ( 1.466 0.000 1.494) 2.093 5.382 ( 0.134 0.000 2.512) 2.516 5.602 ( -3.344 0.000 3.418) 4.782 5.640 ( 0.863 0.000 8.753) 8.795 5.665 ( -6.032 0.000 10.119) 11.781 5.750 ( 3.959 0.000 -2.087) 4.476 5.761 ( -1.208 0.000 -1.928) 2.275 5.862 ( 1.165 0.000 3.018) 3.235 5.967 ( 0.192 0.000 0.574) 0.605 6.055 ( -2.184 0.000 -1.681) 2.756 6.079 ( 0.083 0.000 3.774) 3.775 6.157 ( 1.741 0.000 1.187) 2.107 6.192 ( 3.451 0.000 0.703) 3.522 6.276 ( 0.306 0.000 2.400) 2.420 6.384 ( 1.430 0.000 -3.981) 4.230 6.467 ( -1.105 0.000 -2.646) 2.868 6.525 ( -4.110 0.000 1.522) 4.382 6.553 ( 2.158 0.000 -6.090) 6.461 6.605 ( -0.540 0.000 3.795) 3.833 6.628 ( -5.297 0.000 -4.106) 6.701 6.708 ( -0.201 0.000 -3.017) 3.024 6.793 ( 10.108 0.000 -4.026) 10.880 6.843 ( 3.553 0.000 0.181) 3.558 6.941 ( -6.639 0.000 2.488) 7.090 7.011 ( 3.791 0.000 -0.080) 3.792 7.200 ( 2.337 0.000 -1.186) 2.620 7.305 ( 4.396 0.000 -1.806) 4.753 7.312 ( 1.736 0.000 -4.539) 4.860 7.330 ( -5.378 0.000 4.339) 6.910 7.354 ( 3.130 0.000 -2.821) 4.214 7.566 ( 4.352 0.000 1.545) 4.618 8.026 ( 15.570 0.000 3.884) 16.048 8.050 ( 13.086 0.000 -3.534) 13.555 8.356 ( 12.442 0.000 5.198) 13.484 8.381 ( 10.535 0.000 -3.319) 11.045 8.913 ( -0.972 0.000 -2.815) 2.978 8.942 ( 2.611 0.000 0.284) 2.626 9.141 ( -2.269 0.000 5.274) 5.742 9.225 ( -2.398 0.000 -1.085) 2.632 9.351 ( -4.755 0.000 1.410) 4.959 9.428 ( -4.053 0.000 -0.172) 4.056 9.438 ( -3.368 0.000 1.668) 3.758 9.521 ( -5.489 0.000 -1.224) 5.623 9.523 ( 0.846 0.000 1.626) 1.833 9.570 ( -5.116 0.000 0.147) 5.118 9.732 ( -2.252 0.000 2.054) 3.049 9.749 ( 3.694 0.000 -2.590) 4.511 9.878 ( 9.645 0.000 3.094) 10.129 9.899 ( -2.658 0.000 -4.643) 5.349 9.954 ( 8.589 0.000 1.484) 8.717 10.029 ( 6.815 0.000 -1.690) 7.021 10.074 ( 10.414 0.000 -2.313) 10.667 10.258 ( 7.668 0.000 -0.367) 7.677 10.437 ( 3.775 0.000 -2.532) 4.546 10.477 ( 6.668 0.000 2.407) 7.089 10.603 ( 6.232 0.000 3.780) 7.288 10.668 ( 4.861 0.000 -1.784) 5.178 10.911 ( 2.954 0.000 -0.144) 2.958 10.964 ( 3.706 0.000 0.462) 3.735 11.719 ( -3.029 0.000 0.478) 3.067 11.733 ( -4.857 0.000 0.006) 4.857 11.754 ( -9.056 0.000 -0.285) 9.060 11.758 ( -8.771 0.000 -0.107) 8.772 12.078 ( -4.138 0.000 -0.965) 4.249 12.103 ( 1.911 0.000 1.289) 2.306 12.137 ( 1.346 0.000 0.888) 1.613 12.214 ( 2.055 0.000 -0.308) 2.078 12.388 ( 1.018 0.000 1.396) 1.728 12.424 ( -2.403 0.000 -1.653) 2.917 12.501 ( -5.034 0.000 -0.720) 5.085 12.534 ( 0.584 0.000 1.838) 1.928 12.641 ( -5.614 0.000 -1.482) 5.807 12.728 ( -1.435 0.000 -0.337) 1.474 12.938 ( 2.528 0.000 -0.841) 2.664 12.979 ( 3.245 0.000 0.363) 3.265 13.318 ( -5.553 0.000 0.501) 5.576 13.331 ( -3.950 0.000 -0.989) 4.072 13.695 ( 8.610 0.000 -0.331) 8.617 13.709 ( 8.605 0.000 0.138) 8.606 14.091 ( -16.105 0.000 -1.629) 16.187 14.155 ( -4.645 0.000 3.541) 5.841 14.284 ( 0.498 0.000 -0.015) 0.499 14.323 ( -2.094 0.000 0.505) 2.154 14.324 ( 3.332 0.000 -0.006) 3.332 14.427 ( -8.156 0.000 -1.617) 8.315 14.689 ( 4.762 0.000 -1.504) 4.994 14.793 ( 5.008 0.000 1.336) 5.183 15.105 ( -8.899 0.000 -0.197) 8.901 15.241 ( -5.316 0.000 -1.751) 5.597 15.395 ( -3.696 0.000 1.199) 3.885 15.424 ( -4.595 0.000 0.163) 4.598 15.516 ( 2.519 0.000 -0.527) 2.574 15.588 ( 0.905 0.000 0.539) 1.054 15.648 ( -2.128 0.000 -1.203) 2.444 15.652 ( -2.642 0.000 0.069) 2.643 15.921 ( -6.033 0.000 -1.520) 6.222 16.014 ( -8.645 0.000 -0.809) 8.682 16.069 ( 4.040 0.000 1.465) 4.297 16.259 ( 0.793 0.000 2.306) 2.438 16.589 ( -1.243 0.000 1.017) 1.606 16.635 ( -1.236 0.000 -1.744) 2.138 16.736 ( -0.889 0.000 1.128) 1.436 16.799 ( 7.695 0.000 4.158) 8.747 17.300 ( -0.981 0.000 0.165) 0.994 17.336 ( -0.107 0.000 -0.947) 0.953 17.374 ( -1.746 0.000 0.541) 1.828 17.454 ( -0.081 0.000 -0.545) 0.551 19.845 ( -7.314 0.000 -0.946) 7.375 20.048 ( -1.561 0.000 -0.550) 1.655 20.138 ( -5.675 0.000 -0.251) 5.681 20.223 ( -3.870 0.000 2.976) 4.882 20.321 ( 3.873 0.000 3.911) 5.504 20.447 ( 4.253 0.000 1.101) 4.393 20.751 ( 3.573 0.000 1.086) 3.734 20.811 ( 3.076 0.000 -1.060) 3.253 22.132 ( -7.127 0.000 -1.660) 7.318 22.159 ( -9.171 0.000 -1.259) 9.257 22.333 ( -8.593 0.000 0.312) 8.598 22.351 ( -10.056 0.000 0.048) 10.056 22.814 ( 9.377 0.000 1.838) 9.555 22.855 ( 11.774 0.000 -2.800) 12.103 22.995 ( 8.276 0.000 1.879) 8.486 23.076 ( 10.233 0.000 0.074) 10.233 27.075 ( -19.225 0.000 -0.567) 19.233 27.238 ( -19.279 0.000 1.287) 19.321 27.308 ( -26.147 0.000 -2.392) 26.257 28.144 ( 0.715 0.000 12.202) 12.223 28.326 ( 20.835 0.000 -0.693) 20.846 28.472 ( 18.686 0.000 0.242) 18.688 28.776 ( 13.836 0.000 0.313) 13.840 28.982 ( 16.278 0.000 2.442) 16.460 30.330 ( -13.049 0.000 -1.027) 13.090 30.411 ( -10.170 0.000 1.485) 10.278 30.634 ( -4.941 0.000 0.165) 4.944 30.770 ( 0.031 0.000 0.378) 0.379 30.946 ( -10.112 0.000 -1.821) 10.275 31.030 ( -6.599 0.000 1.936) 6.877 31.368 ( -9.069 0.000 -0.046) 9.069 31.452 ( 10.697 0.000 4.019) 11.427 31.474 ( 6.043 0.000 -2.313) 6.470 31.585 ( -1.028 0.000 6.463) 6.545 31.837 ( 6.819 0.000 1.512) 6.985 31.880 ( 6.865 0.000 0.821) 6.914 31.915 ( -5.001 0.000 0.977) 5.095 32.175 ( 1.461 0.000 8.690) 8.812 32.442 ( -12.294 0.000 2.869) 12.624 32.892 ( -8.413 0.000 -3.690) 9.187 32.905 ( -10.173 0.000 0.497) 10.185 33.001 ( 3.563 0.000 8.194) 8.935 33.262 ( -11.220 0.000 -0.106) 11.221 33.332 ( -2.428 0.000 -1.031) 2.638 33.509 ( 1.424 0.000 -2.675) 3.031 33.769 ( 12.039 0.000 12.100) 17.069 33.909 ( 9.098 0.000 3.552) 9.766 33.958 ( 11.048 0.000 3.079) 11.468 34.922 ( -0.432 0.000 3.450) 3.477 34.996 ( -0.071 0.000 1.195) 1.197 35.088 ( -0.458 0.000 -4.801) 4.822 35.096 ( -2.487 0.000 -5.713) 6.231 35.734 ( -2.287 0.000 -1.013) 2.501 35.797 ( 0.984 0.000 9.178) 9.231 35.888 ( -4.941 0.000 -7.571) 9.041 35.923 ( -3.530 0.000 -0.880) 3.638 35.965 ( -0.228 0.000 4.015) 4.022 36.019 ( -4.929 0.000 -5.358) 7.280 36.141 ( 4.284 0.000 -12.374) 13.094 36.278 ( 8.230 0.000 -18.773) 20.498 37.032 ( -16.476 0.000 -3.211) 16.786 37.499 ( -11.558 0.000 -4.189) 12.293 37.845 ( 15.450 0.000 4.444) 16.077 38.399 ( 19.373 0.000 1.234) 19.413 ======================= Grid point 52 (23/69) ======================= q-point: (-0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.939 ( -31.564 0.000 -0.476) 31.567 1.031 ( -29.986 0.000 0.921) 30.001 1.792 ( -49.648 0.000 -4.003) 49.809 1.889 ( -6.369 0.000 1.038) 6.453 2.088 ( -11.643 0.000 6.110) 13.148 2.093 ( -7.052 0.000 -5.736) 9.090 2.314 ( 1.630 0.000 2.588) 3.058 2.495 ( 5.036 0.000 -0.839) 5.106 2.516 ( -3.289 0.000 -4.689) 5.727 2.536 ( -5.416 0.000 -1.076) 5.522 2.710 ( -0.479 0.000 0.080) 0.486 2.725 ( -3.897 0.000 0.813) 3.981 2.802 ( -0.725 0.000 -7.015) 7.053 2.973 ( -6.992 0.000 0.255) 6.997 3.037 ( 5.994 0.000 5.444) 8.097 3.101 ( 8.949 0.000 -3.366) 9.561 3.122 ( 9.526 0.000 2.787) 9.926 3.158 ( -8.420 0.000 -3.566) 9.144 3.312 ( -0.419 0.000 -5.573) 5.589 3.367 ( 0.068 0.000 6.787) 6.787 3.399 ( 0.872 0.000 0.894) 1.249 3.571 ( 5.843 0.000 -1.311) 5.988 3.668 ( -3.876 0.000 -4.347) 5.824 3.706 ( 0.268 0.000 4.693) 4.701 3.805 ( -8.344 0.000 -2.324) 8.662 3.871 ( 0.826 0.000 5.535) 5.596 3.986 ( -2.711 0.000 2.054) 3.401 3.990 ( -11.752 0.000 -1.667) 11.870 4.033 ( 3.058 0.000 -2.942) 4.243 4.046 ( -12.452 0.000 -3.976) 13.072 4.048 ( 3.394 0.000 4.048) 5.282 4.329 ( -7.633 0.000 3.352) 8.337 4.390 ( -2.309 0.000 -1.557) 2.785 4.458 ( -7.732 0.000 1.546) 7.885 4.460 ( -2.624 0.000 2.626) 3.712 4.567 ( -4.074 0.000 -1.817) 4.460 4.632 ( -1.682 0.000 -0.893) 1.904 4.722 ( 6.688 0.000 6.249) 9.153 4.850 ( -2.561 0.000 -4.306) 5.010 4.949 ( 4.952 0.000 -5.938) 7.732 4.992 ( -1.115 0.000 -3.673) 3.839 5.080 ( 2.465 0.000 0.902) 2.625 5.121 ( 1.629 0.000 5.321) 5.565 5.211 ( 8.250 0.000 6.878) 10.741 5.355 ( -0.375 0.000 -2.657) 2.684 5.390 ( 2.933 0.000 -4.340) 5.238 5.447 ( 2.935 0.000 -1.963) 3.531 5.566 ( -5.635 0.000 4.106) 6.972 5.668 ( -7.408 0.000 7.437) 10.497 5.695 ( -0.535 0.000 4.105) 4.140 5.721 ( -4.869 0.000 -0.465) 4.891 5.754 ( 1.793 0.000 -0.734) 1.938 5.953 ( -0.906 0.000 -8.970) 9.016 5.965 ( 4.621 0.000 3.627) 5.875 6.029 ( 5.071 0.000 -0.494) 5.095 6.103 ( -3.025 0.000 4.713) 5.600 6.195 ( 0.828 0.000 4.386) 4.463 6.206 ( -0.004 0.000 -2.920) 2.920 6.292 ( -1.906 0.000 5.339) 5.669 6.360 ( 4.204 0.000 -9.805) 10.669 6.440 ( -5.101 0.000 6.909) 8.588 6.462 ( -2.225 0.000 -9.232) 9.496 6.541 ( 4.282 0.000 2.535) 4.976 6.546 ( -0.991 0.000 -0.506) 1.113 6.663 ( 3.142 0.000 -1.143) 3.344 6.696 ( 0.490 0.000 -0.630) 0.798 6.836 ( 1.775 0.000 -3.105) 3.576 6.893 ( 2.159 0.000 2.012) 2.951 6.911 ( -3.033 0.000 3.734) 4.810 7.098 ( 6.610 0.000 -1.522) 6.783 7.202 ( -5.984 0.000 -1.643) 6.205 7.227 ( 3.584 0.000 -1.634) 3.939 7.303 ( -0.950 0.000 -2.506) 2.680 7.377 ( 7.522 0.000 -1.935) 7.767 7.385 ( 0.315 0.000 0.763) 0.825 7.611 ( 0.805 0.000 0.215) 0.833 8.233 ( 15.972 0.000 -4.148) 16.502 8.339 ( 19.766 0.000 1.930) 19.860 8.548 ( 15.088 0.000 -3.073) 15.398 8.609 ( 13.414 0.000 2.461) 13.638 8.876 ( -0.708 0.000 -1.201) 1.394 8.996 ( 2.314 0.000 1.483) 2.749 9.173 ( -3.546 0.000 0.852) 3.647 9.180 ( 0.052 0.000 4.124) 4.125 9.296 ( -2.388 0.000 -0.584) 2.458 9.345 ( -4.543 0.000 -1.741) 4.865 9.414 ( -1.526 0.000 0.762) 1.705 9.459 ( -3.689 0.000 1.634) 4.035 9.463 ( -7.784 0.000 -0.170) 7.786 9.516 ( -2.363 0.000 -0.475) 2.411 9.679 ( -7.985 0.000 2.239) 8.293 9.755 ( 0.347 0.000 -2.510) 2.534 9.814 ( -2.071 0.000 -1.304) 2.448 10.052 ( 6.715 0.000 3.278) 7.472 10.119 ( 6.549 0.000 -1.860) 6.808 10.135 ( 11.825 0.000 0.707) 11.846 10.225 ( 11.705 0.000 -2.721) 12.017 10.401 ( 11.076 0.000 -0.006) 11.076 10.529 ( 10.243 0.000 -0.628) 10.262 10.604 ( 7.168 0.000 1.391) 7.301 10.729 ( 4.571 0.000 -1.293) 4.751 10.771 ( 9.648 0.000 3.013) 10.107 10.951 ( 3.298 0.000 -1.827) 3.770 11.044 ( 5.803 0.000 0.477) 5.822 11.557 ( -13.900 0.000 0.150) 13.901 11.596 ( -11.285 0.000 -0.423) 11.293 11.667 ( -4.011 0.000 0.401) 4.031 11.683 ( -3.221 0.000 0.354) 3.241 11.999 ( -5.224 0.000 0.345) 5.236 12.130 ( 0.435 0.000 -0.167) 0.466 12.201 ( 4.711 0.000 1.856) 5.064 12.242 ( 2.272 0.000 -0.129) 2.275 12.375 ( -2.724 0.000 -0.056) 2.725 12.410 ( -0.156 0.000 0.686) 0.704 12.433 ( -2.666 0.000 -0.590) 2.731 12.519 ( -3.608 0.000 -2.937) 4.653 12.579 ( -1.469 0.000 2.627) 3.010 12.681 ( -3.557 0.000 -0.734) 3.632 12.968 ( 1.759 0.000 0.036) 1.759 12.989 ( -1.365 0.000 -0.500) 1.454 13.263 ( -2.793 0.000 0.723) 2.885 13.291 ( 0.246 0.000 -1.011) 1.041 13.792 ( -15.782 0.000 0.404) 15.788 13.833 ( 9.570 0.000 -0.188) 9.572 13.866 ( 7.468 0.000 -0.509) 7.486 14.131 ( -4.550 0.000 5.037) 6.788 14.270 ( -3.453 0.000 -2.649) 4.352 14.300 ( -2.470 0.000 -0.084) 2.472 14.340 ( 0.731 0.000 1.272) 1.467 14.388 ( 5.207 0.000 -0.370) 5.220 14.732 ( 2.143 0.000 -0.580) 2.220 14.784 ( -6.332 0.000 -0.432) 6.347 14.993 ( -6.146 0.000 0.827) 6.201 15.102 ( -9.057 0.000 -3.421) 9.681 15.299 ( -11.442 0.000 0.185) 11.444 15.310 ( -8.389 0.000 1.022) 8.451 15.521 ( -12.466 0.000 1.347) 12.539 15.532 ( 0.557 0.000 -1.456) 1.558 15.644 ( 3.051 0.000 -0.275) 3.063 15.653 ( 4.709 0.000 0.262) 4.716 15.834 ( -3.774 0.000 -0.587) 3.820 15.925 ( 0.235 0.000 -1.163) 1.186 16.164 ( 2.843 0.000 1.555) 3.241 16.276 ( 2.415 0.000 -2.029) 3.154 16.575 ( -2.121 0.000 0.415) 2.162 16.580 ( -3.235 0.000 -1.136) 3.429 16.703 ( -3.594 0.000 0.841) 3.691 17.003 ( 10.579 0.000 3.142) 11.036 17.290 ( -0.798 0.000 0.462) 0.922 17.334 ( 0.959 0.000 -0.760) 1.224 17.353 ( -1.312 0.000 0.432) 1.382 17.442 ( -0.674 0.000 -0.289) 0.733 19.747 ( -4.883 0.000 0.771) 4.944 20.013 ( -2.474 0.000 -2.390) 3.440 20.054 ( -3.661 0.000 1.509) 3.960 20.178 ( -5.402 0.000 2.025) 5.769 20.431 ( 4.333 0.000 3.249) 5.416 20.516 ( 3.363 0.000 0.394) 3.386 20.806 ( 1.942 0.000 -0.046) 1.943 20.838 ( 2.496 0.000 -1.667) 3.001 21.997 ( -8.626 0.000 -1.318) 8.726 22.000 ( -5.699 0.000 -2.617) 6.271 22.216 ( -7.925 0.000 0.723) 7.958 22.233 ( -5.343 0.000 0.663) 5.384 22.973 ( 7.669 0.000 3.030) 8.246 23.013 ( 12.729 0.000 -3.877) 13.307 23.148 ( 7.689 0.000 3.144) 8.307 23.220 ( 8.247 0.000 -0.547) 8.265 26.800 ( -15.337 0.000 0.085) 15.338 26.921 ( -21.363 0.000 0.124) 21.363 26.935 ( -19.720 0.000 -0.461) 19.726 28.271 ( -0.598 0.000 7.543) 7.567 28.659 ( 21.733 0.000 0.080) 21.733 28.763 ( 20.024 0.000 -2.126) 20.136 29.003 ( 14.555 0.000 -0.880) 14.581 29.252 ( 16.885 0.000 0.075) 16.885 30.092 ( -16.423 0.000 -0.309) 16.426 30.231 ( -14.682 0.000 1.294) 14.738 30.528 ( -9.208 0.000 0.059) 9.208 30.765 ( -0.632 0.000 -0.074) 0.636 30.801 ( -5.889 0.000 -0.914) 5.959 30.962 ( -4.787 0.000 1.488) 5.013 31.214 ( -9.801 0.000 0.335) 9.807 31.527 ( 2.226 0.000 -1.379) 2.618 31.531 ( -1.080 0.000 -0.262) 1.111 31.770 ( 12.165 0.000 7.573) 14.330 31.865 ( 0.016 0.000 -0.634) 0.634 31.948 ( 1.784 0.000 -1.910) 2.613 31.976 ( 8.745 0.000 1.345) 8.848 32.326 ( 3.677 0.000 6.606) 7.560 32.346 ( -2.282 0.000 1.941) 2.996 32.720 ( -8.943 0.000 -1.935) 9.150 32.733 ( -12.964 0.000 2.048) 13.125 32.949 ( -12.518 0.000 0.660) 12.536 33.066 ( -12.890 0.000 -0.887) 12.920 33.377 ( 5.837 0.000 0.585) 5.866 33.534 ( 3.622 0.000 -0.687) 3.686 34.073 ( 8.287 0.000 0.620) 8.311 34.125 ( 9.996 0.000 1.319) 10.083 34.190 ( 20.505 0.000 7.010) 21.671 34.945 ( -1.372 0.000 3.169) 3.453 34.976 ( -2.759 0.000 -7.839) 8.311 35.001 ( -1.615 0.000 2.279) 2.793 35.017 ( -0.430 0.000 -8.381) 8.392 35.676 ( -2.870 0.000 -1.838) 3.408 35.757 ( -4.335 0.000 -2.687) 5.100 35.844 ( -2.981 0.000 -1.289) 3.247 35.872 ( 0.333 0.000 -6.495) 6.503 35.950 ( -2.080 0.000 0.284) 2.099 35.995 ( 1.196 0.000 -18.169) 18.208 36.022 ( -2.955 0.000 5.684) 6.406 36.206 ( 2.027 0.000 4.679) 5.099 36.776 ( -12.457 0.000 -0.603) 12.471 37.306 ( -10.685 0.000 5.783) 12.150 38.095 ( 12.034 0.000 0.969) 12.073 38.689 ( 16.612 0.000 -0.413) 16.617 ======================= Grid point 53 (24/69) ======================= q-point: (-0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.600 ( -30.895 0.000 11.713) 33.041 0.662 ( -24.477 0.000 26.904) 36.373 0.944 ( -51.954 0.000 13.839) 53.765 1.875 ( -2.871 0.000 11.171) 11.534 1.948 ( -14.926 0.000 2.637) 15.157 2.097 ( 4.878 0.000 -0.637) 4.920 2.399 ( 0.893 0.000 7.028) 7.085 2.424 ( -3.699 0.000 1.976) 4.194 2.428 ( 0.952 0.000 5.695) 5.774 2.680 ( -3.249 0.000 3.727) 4.944 2.699 ( -1.231 0.000 5.216) 5.359 2.700 ( 1.880 0.000 1.333) 2.304 2.796 ( 8.964 0.000 -3.444) 9.603 2.918 ( 1.250 0.000 -1.984) 2.345 3.006 ( -0.293 0.000 -7.006) 7.012 3.162 ( -2.694 0.000 1.188) 2.944 3.220 ( 3.909 0.000 -5.773) 6.972 3.231 ( 7.641 0.000 0.701) 7.673 3.279 ( 5.373 0.000 -0.486) 5.395 3.322 ( -7.117 0.000 -2.136) 7.430 3.468 ( 2.602 0.000 1.386) 2.948 3.577 ( -0.224 0.000 -5.876) 5.881 3.648 ( -13.291 0.000 -1.772) 13.409 3.659 ( 2.725 0.000 2.218) 3.513 3.704 ( -2.391 0.000 2.967) 3.810 3.776 ( -5.930 0.000 -5.820) 8.309 3.857 ( -0.284 0.000 -4.647) 4.656 3.899 ( -4.603 0.000 9.245) 10.328 3.915 ( -7.287 0.000 -0.858) 7.338 4.040 ( -3.136 0.000 -0.995) 3.290 4.087 ( 6.285 0.000 1.381) 6.435 4.187 ( -16.249 0.000 3.362) 16.593 4.312 ( -5.896 0.000 -2.081) 6.253 4.426 ( -5.513 0.000 7.305) 9.152 4.454 ( -0.036 0.000 -2.456) 2.456 4.501 ( -2.667 0.000 1.128) 2.896 4.664 ( 3.509 0.000 1.421) 3.786 4.766 ( -4.133 0.000 -2.053) 4.615 4.858 ( 0.397 0.000 -0.420) 0.578 4.964 ( 7.760 0.000 -6.349) 10.027 4.972 ( 8.456 0.000 -3.080) 8.999 5.115 ( -0.243 0.000 1.017) 1.046 5.219 ( 2.050 0.000 4.115) 4.597 5.285 ( -5.864 0.000 0.739) 5.911 5.301 ( 2.745 0.000 -6.149) 6.734 5.359 ( -2.767 0.000 -9.575) 9.967 5.417 ( 3.291 0.000 -0.060) 3.292 5.473 ( -5.053 0.000 -5.456) 7.436 5.585 ( -9.026 0.000 3.764) 9.780 5.663 ( -5.864 0.000 0.702) 5.906 5.721 ( -0.637 0.000 -4.579) 4.623 5.806 ( 2.475 0.000 4.855) 5.450 5.862 ( 7.226 0.000 -11.658) 13.716 5.995 ( -2.323 0.000 -4.519) 5.081 6.073 ( 3.532 0.000 -6.166) 7.106 6.076 ( -1.773 0.000 -7.767) 7.967 6.160 ( -1.704 0.000 -0.655) 1.825 6.194 ( -9.559 0.000 -2.599) 9.906 6.276 ( 1.993 0.000 -5.251) 5.616 6.344 ( 5.331 0.000 0.866) 5.400 6.454 ( -2.983 0.000 2.526) 3.909 6.506 ( -1.396 0.000 4.725) 4.927 6.596 ( 1.458 0.000 1.189) 1.881 6.661 ( 14.133 0.000 21.284) 25.549 6.720 ( 3.274 0.000 0.470) 3.308 6.737 ( 8.111 0.000 8.215) 11.544 6.838 ( 0.833 0.000 0.341) 0.900 6.907 ( -3.325 0.000 5.335) 6.287 6.934 ( -0.471 0.000 2.987) 3.024 7.151 ( -3.234 0.000 7.097) 7.799 7.168 ( 5.944 0.000 -2.117) 6.310 7.287 ( 3.554 0.000 2.330) 4.250 7.320 ( 9.032 0.000 7.482) 11.729 7.434 ( 4.786 0.000 12.477) 13.363 7.476 ( 6.450 0.000 -0.223) 6.454 7.617 ( -0.786 0.000 1.166) 1.407 8.421 ( 12.253 0.000 -2.718) 12.551 8.652 ( 18.312 0.000 -0.335) 18.315 8.745 ( 12.283 0.000 -1.972) 12.441 8.772 ( 5.428 0.000 -2.004) 5.786 8.904 ( 6.154 0.000 1.078) 6.248 9.029 ( -0.239 0.000 0.905) 0.936 9.148 ( -3.513 0.000 3.956) 5.291 9.206 ( -0.331 0.000 -0.150) 0.363 9.259 ( -2.344 0.000 -3.223) 3.985 9.287 ( 0.699 0.000 1.779) 1.911 9.334 ( -7.093 0.000 -0.694) 7.127 9.402 ( -1.420 0.000 -0.189) 1.432 9.436 ( -1.181 0.000 1.852) 2.196 9.465 ( -2.781 0.000 -0.948) 2.938 9.554 ( -9.736 0.000 2.129) 9.966 9.708 ( -1.790 0.000 -2.374) 2.973 9.804 ( -0.383 0.000 2.701) 2.728 10.142 ( 3.352 0.000 0.081) 3.353 10.186 ( 1.746 0.000 1.825) 2.525 10.320 ( 9.556 0.000 1.180) 9.629 10.343 ( 6.770 0.000 -2.540) 7.231 10.572 ( 9.952 0.000 -0.904) 9.993 10.709 ( 11.708 0.000 -0.362) 11.714 10.726 ( 6.050 0.000 0.871) 6.113 10.778 ( 3.853 0.000 -0.258) 3.862 10.924 ( 7.055 0.000 -2.522) 7.492 10.974 ( 2.635 0.000 -0.171) 2.641 11.133 ( 3.697 0.000 0.380) 3.716 11.339 ( -13.565 0.000 0.196) 13.566 11.407 ( -11.294 0.000 -2.797) 11.635 11.626 ( -0.871 0.000 0.113) 0.878 11.655 ( -1.143 0.000 0.485) 1.241 11.932 ( -4.612 0.000 1.884) 4.982 12.121 ( 0.577 0.000 -2.169) 2.245 12.273 ( -0.536 0.000 1.429) 1.526 12.300 ( 3.978 0.000 1.863) 4.393 12.348 ( 0.044 0.000 0.399) 0.401 12.399 ( -0.303 0.000 -1.314) 1.348 12.403 ( -0.254 0.000 -0.560) 0.615 12.442 ( -2.084 0.000 -1.281) 2.447 12.572 ( -2.658 0.000 0.933) 2.817 12.611 ( -3.756 0.000 -0.919) 3.866 12.957 ( -1.400 0.000 -0.170) 1.410 12.991 ( 0.742 0.000 0.413) 0.849 13.238 ( -1.576 0.000 0.729) 1.736 13.302 ( 2.156 0.000 -1.217) 2.476 13.549 ( -13.061 0.000 0.730) 13.081 13.966 ( 6.308 0.000 0.011) 6.308 14.023 ( 10.388 0.000 -0.318) 10.393 14.064 ( -10.501 0.000 -12.233) 16.122 14.207 ( 1.015 0.000 0.703) 1.234 14.231 ( -4.568 0.000 -0.812) 4.640 14.407 ( 2.898 0.000 3.248) 4.353 14.469 ( 4.599 0.000 -0.292) 4.609 14.649 ( -8.694 0.000 0.148) 8.695 14.718 ( -4.147 0.000 -4.763) 6.315 14.909 ( -7.889 0.000 -3.752) 8.735 14.925 ( -2.766 0.000 -0.016) 2.766 15.105 ( -11.613 0.000 0.016) 11.613 15.161 ( -9.681 0.000 -0.953) 9.728 15.331 ( -12.882 0.000 1.638) 12.986 15.421 ( -12.275 0.000 -16.885) 20.875 15.722 ( 3.642 0.000 0.102) 3.643 15.723 ( 5.623 0.000 0.684) 5.664 15.829 ( 1.633 0.000 1.281) 2.076 15.951 ( 2.399 0.000 0.531) 2.458 16.073 ( -9.878 0.000 -11.505) 15.164 16.315 ( 4.721 0.000 -4.212) 6.327 16.530 ( -2.376 0.000 0.704) 2.478 16.531 ( -3.065 0.000 -0.273) 3.077 16.659 ( -3.018 0.000 1.128) 3.222 16.976 ( -11.214 0.000 -26.373) 28.658 17.288 ( -0.314 0.000 0.989) 1.038 17.340 ( 0.702 0.000 -1.193) 1.384 17.346 ( -0.538 0.000 0.624) 0.824 17.409 ( -1.603 0.000 -1.689) 2.329 19.736 ( 0.510 0.000 3.295) 3.334 19.929 ( -2.930 0.000 -2.944) 4.154 20.054 ( 0.239 0.000 1.091) 1.117 20.099 ( -4.222 0.000 -1.810) 4.594 20.512 ( 1.546 0.000 2.436) 2.885 20.560 ( 1.715 0.000 0.361) 1.753 20.800 ( -0.536 0.000 -0.893) 1.042 20.852 ( 1.873 0.000 -1.704) 2.532 21.889 ( -4.291 0.000 0.558) 4.327 21.964 ( 2.732 0.000 4.657) 5.399 22.120 ( -5.509 0.000 1.104) 5.619 22.176 ( -2.770 0.000 0.230) 2.779 23.130 ( 7.028 0.000 4.350) 8.265 23.133 ( 8.408 0.000 -4.715) 9.640 23.298 ( 5.802 0.000 3.777) 6.923 23.311 ( 4.738 0.000 -0.592) 4.775 26.613 ( -8.688 0.000 0.198) 8.690 26.656 ( -12.571 0.000 -0.430) 12.578 26.665 ( -13.131 0.000 0.381) 13.137 27.869 ( -42.490 0.000 -68.263) 80.407 28.974 ( 17.195 0.000 0.763) 17.212 29.058 ( 19.364 0.000 1.118) 19.397 29.186 ( 8.945 0.000 0.400) 8.954 29.493 ( 14.010 0.000 -1.468) 14.087 29.832 ( -16.776 0.000 1.401) 16.834 30.001 ( -14.604 0.000 -0.745) 14.623 30.381 ( -9.885 0.000 3.223) 10.397 30.745 ( -1.827 0.000 0.747) 1.974 30.748 ( -1.185 0.000 -1.179) 1.672 30.908 ( -3.292 0.000 -0.540) 3.336 31.092 ( -6.168 0.000 0.466) 6.186 31.475 ( -3.364 0.000 -9.222) 9.817 31.516 ( -1.366 0.000 -0.482) 1.449 31.777 ( -27.885 0.000 -46.159) 53.928 31.839 ( -2.068 0.000 0.003) 2.068 32.010 ( 8.644 0.000 -0.452) 8.656 32.120 ( 9.494 0.000 -0.172) 9.496 32.169 ( 5.409 0.000 -7.638) 9.359 32.366 ( 0.247 0.000 -0.225) 0.334 32.587 ( -8.222 0.000 3.703) 9.018 32.596 ( -7.057 0.000 0.168) 7.059 32.725 ( -14.860 0.000 -0.574) 14.871 32.858 ( -10.799 0.000 -2.271) 11.035 33.490 ( 4.986 0.000 -0.270) 4.993 33.590 ( 2.353 0.000 1.943) 3.052 34.155 ( 4.703 0.000 -4.632) 6.601 34.220 ( 4.524 0.000 -2.931) 5.391 34.386 ( 12.247 0.000 -27.741) 30.324 34.892 ( -0.397 0.000 0.747) 0.846 34.919 ( 3.531 0.000 -0.016) 3.531 34.954 ( -1.921 0.000 2.935) 3.507 35.008 ( -1.886 0.000 4.320) 4.714 35.617 ( -6.946 0.000 -9.274) 11.587 35.619 ( -1.113 0.000 -2.226) 2.489 35.691 ( -2.352 0.000 0.110) 2.355 35.773 ( -6.022 0.000 -4.119) 7.296 35.827 ( -1.284 0.000 3.870) 4.077 35.942 ( -1.014 0.000 2.752) 2.933 36.194 ( -0.135 0.000 25.764) 25.765 36.500 ( 7.102 0.000 12.173) 14.093 36.638 ( -6.185 0.000 0.786) 6.234 37.754 ( 39.263 0.000 68.694) 79.123 38.221 ( 6.306 0.000 -4.394) 7.686 38.884 ( 9.885 0.000 -1.914) 10.068 ======================= Grid point 54 (25/69) ======================= q-point: ( 0.00 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( -3.094 29.582 9.504) 31.225 1.244 ( 1.403 31.344 25.745) 40.585 1.360 ( 1.498 32.582 33.889) 47.035 1.796 ( -2.065 2.408 -7.803) 8.423 1.983 ( -2.821 -18.167 2.273) 18.525 1.993 ( 2.092 -13.576 28.181) 31.350 2.249 ( -0.555 -0.659 -2.259) 2.417 2.443 ( -4.607 -1.262 -2.526) 5.403 2.566 ( 3.196 3.094 8.484) 9.579 2.607 ( -2.332 -0.508 -3.003) 3.836 2.729 ( -3.427 -4.158 1.705) 5.652 2.874 ( -1.383 1.067 0.001) 1.746 2.910 ( 3.629 3.101 5.885) 7.577 2.997 ( 4.901 0.998 0.757) 5.059 3.016 ( 1.784 1.274 -4.360) 4.880 3.130 ( 4.301 -0.513 0.078) 4.332 3.156 ( 4.170 2.129 1.485) 4.911 3.203 ( -0.703 -6.959 1.091) 7.079 3.260 ( -6.039 2.018 -1.453) 6.531 3.328 ( 0.987 -0.448 -4.793) 4.914 3.482 ( -1.667 -4.913 2.557) 5.784 3.522 ( 2.830 -0.967 -0.683) 3.068 3.543 ( 0.809 -1.246 -1.948) 2.450 3.675 ( -2.453 -0.628 0.315) 2.552 3.718 ( -3.945 -0.614 -1.588) 4.296 3.808 ( -0.354 0.854 -0.762) 1.198 3.844 ( 3.361 7.405 2.830) 8.610 3.895 ( 0.881 1.302 2.226) 2.725 3.948 ( -8.745 11.628 -2.987) 14.853 4.033 ( 4.281 0.758 3.128) 5.356 4.044 ( 1.282 6.974 3.776) 8.034 4.196 ( -0.126 -3.102 0.596) 3.161 4.234 ( -2.250 -5.523 3.242) 6.788 4.339 ( -8.269 -2.661 2.362) 9.002 4.408 ( 2.558 -1.972 -1.574) 3.593 4.506 ( -1.385 0.908 4.173) 4.490 4.567 ( -0.146 2.367 -3.462) 4.196 4.681 ( 1.464 -8.443 -2.468) 8.917 4.806 ( -0.769 -6.698 -2.418) 7.163 4.998 ( 4.471 -2.122 0.996) 5.048 5.022 ( 6.805 -1.152 -7.098) 9.900 5.105 ( -3.848 1.721 2.944) 5.142 5.186 ( 0.381 -1.742 -5.081) 5.385 5.213 ( 4.777 -4.462 1.138) 6.635 5.297 ( 0.520 5.014 -0.163) 5.044 5.316 ( -1.983 4.494 -5.655) 7.491 5.382 ( 0.120 -1.934 -9.824) 10.013 5.442 ( -0.428 3.145 -1.204) 3.394 5.601 ( -4.321 3.259 -8.734) 10.275 5.627 ( 0.741 5.475 -1.763) 5.799 5.705 ( -1.848 3.117 -4.450) 5.739 5.818 ( -1.094 -2.259 3.734) 4.499 5.865 ( 1.495 1.831 3.009) 3.826 5.923 ( 0.851 0.898 -1.422) 1.885 5.963 ( 1.145 1.672 -1.887) 2.769 5.994 ( 1.296 -3.157 -7.306) 8.064 6.143 ( -3.162 2.132 0.142) 3.816 6.167 ( 2.520 -2.471 -8.448) 9.155 6.247 ( -2.825 5.702 -2.630) 6.886 6.319 ( 0.527 -7.268 -5.385) 9.060 6.412 ( 0.302 -7.921 7.250) 10.743 6.472 ( -3.167 -2.106 2.372) 4.482 6.537 ( -0.568 1.887 4.035) 4.491 6.600 ( -1.829 -6.091 1.178) 6.468 6.805 ( 1.151 4.461 -3.608) 5.852 6.863 ( -0.102 1.111 2.994) 3.195 6.939 ( -0.439 -1.724 5.599) 5.875 7.016 ( -0.915 3.660 4.339) 5.750 7.093 ( 4.970 0.770 1.271) 5.188 7.144 ( 0.160 -6.479 4.858) 8.100 7.210 ( 1.744 0.579 -0.718) 1.973 7.353 ( 1.487 -3.577 1.393) 4.117 7.415 ( -0.378 0.063 2.451) 2.480 7.519 ( 0.687 -1.067 0.115) 1.274 7.566 ( -0.740 -6.937 4.131) 8.107 7.722 ( 1.224 -20.319 4.529) 20.854 8.610 ( -0.299 4.926 1.281) 5.099 8.775 ( -2.832 0.297 -0.869) 2.977 8.830 ( 5.808 -1.677 -2.399) 6.503 8.859 ( 2.053 2.416 -1.132) 3.366 8.955 ( 2.398 -0.822 0.821) 2.665 9.019 ( -4.927 -0.263 1.819) 5.259 9.090 ( -0.244 1.775 0.336) 1.823 9.105 ( -0.790 -5.895 -1.397) 6.109 9.169 ( -1.722 -4.379 -0.586) 4.742 9.247 ( 0.964 -0.398 -2.136) 2.377 9.274 ( -1.593 -1.609 -1.934) 2.978 9.320 ( 0.633 -3.686 -2.401) 4.444 9.398 ( -0.986 -0.664 0.648) 1.354 9.438 ( -0.788 -1.023 1.855) 2.260 9.533 ( -0.209 2.688 -0.972) 2.866 9.660 ( 2.589 -2.697 -2.675) 4.597 9.855 ( -1.941 2.146 4.954) 5.737 10.093 ( 0.693 -8.706 0.775) 8.767 10.352 ( -2.207 11.120 3.392) 11.833 10.404 ( 1.255 5.018 -1.934) 5.522 10.467 ( 1.915 2.066 0.321) 2.835 10.641 ( 0.283 1.469 -3.550) 3.853 10.714 ( -0.107 -4.485 -0.292) 4.496 10.762 ( -1.287 -2.528 -1.526) 3.221 10.842 ( -0.119 2.057 0.572) 2.139 10.928 ( 0.101 1.392 -3.184) 3.476 11.031 ( 0.385 -0.883 -0.071) 0.966 11.127 ( -1.318 -1.627 -1.699) 2.697 11.248 ( 0.276 3.974 0.037) 3.984 11.255 ( 0.564 2.806 -0.122) 2.865 11.518 ( 0.940 -9.321 0.491) 9.381 11.565 ( -0.728 -8.718 -1.031) 8.809 11.947 ( -1.656 4.951 2.270) 5.692 12.138 ( 2.304 0.971 -2.796) 3.750 12.215 ( -2.326 -1.638 1.699) 3.314 12.339 ( -0.237 -1.519 -0.810) 1.738 12.405 ( -0.192 2.575 0.601) 2.651 12.438 ( -2.656 3.675 -0.417) 4.553 12.460 ( 2.055 3.531 -0.022) 4.086 12.511 ( 0.702 4.950 -0.636) 5.040 12.604 ( -1.428 8.149 0.987) 8.332 12.765 ( 1.983 6.074 -3.311) 7.196 12.915 ( -1.285 -4.638 1.012) 4.918 12.948 ( 1.983 -4.763 0.327) 5.169 13.267 ( 0.549 3.889 -0.075) 3.928 13.299 ( 0.192 -0.549 -0.965) 1.127 13.359 ( -0.572 -1.004 1.393) 1.810 13.416 ( -0.453 -2.007 -0.096) 2.060 14.160 ( 1.337 11.294 0.953) 11.412 14.235 ( 0.612 2.165 0.304) 2.270 14.303 ( -2.473 5.574 -1.370) 6.250 14.345 ( 0.171 1.779 -1.614) 2.408 14.455 ( -2.991 -0.683 0.643) 3.135 14.555 ( -5.737 2.418 -0.005) 6.225 14.623 ( 7.444 2.753 -1.829) 8.145 14.681 ( 4.302 1.723 -1.147) 4.774 14.820 ( -2.090 -2.023 -0.117) 2.911 14.940 ( 7.344 1.200 -4.979) 8.954 14.973 ( -4.022 -5.657 0.083) 6.942 15.103 ( 3.953 0.729 -2.419) 4.691 15.181 ( -6.810 6.986 1.500) 9.870 15.535 ( 8.437 28.462 -20.050) 35.822 15.735 ( 1.179 -2.075 0.646) 2.472 15.784 ( -1.208 1.331 -0.315) 1.825 15.852 ( 1.100 0.700 -0.320) 1.342 15.865 ( -1.264 -0.618 -0.848) 1.643 15.951 ( -3.625 -1.284 0.329) 3.860 16.279 ( 0.450 -4.007 -5.185) 6.568 16.517 ( -0.549 1.197 0.558) 1.430 16.547 ( 0.559 1.142 1.401) 1.892 16.565 ( -4.609 -1.481 -1.497) 5.067 16.636 ( 0.513 -2.047 0.580) 2.189 17.317 ( -0.028 1.246 0.933) 1.557 17.342 ( 0.373 -0.092 0.154) 0.414 17.352 ( -0.278 0.847 0.285) 0.936 17.393 ( 0.695 -0.775 -0.108) 1.047 19.728 ( -1.128 2.136 1.276) 2.732 19.882 ( 0.987 0.088 -4.101) 4.219 20.008 ( -0.431 -4.831 1.347) 5.033 20.034 ( -0.383 -3.412 -0.434) 3.461 20.539 ( -1.909 0.947 1.619) 2.677 20.578 ( -0.261 -0.553 1.273) 1.412 20.811 ( 0.859 0.410 -0.699) 1.180 20.854 ( 1.072 -0.830 -1.675) 2.155 21.907 ( 0.930 2.167 1.473) 2.780 22.017 ( 2.413 -3.111 0.812) 4.020 22.083 ( -2.106 -0.689 1.554) 2.706 22.135 ( -0.279 -1.505 -0.238) 1.550 23.091 ( -1.290 -1.198 -1.114) 2.083 23.148 ( 2.028 -1.913 -4.157) 5.005 23.368 ( -1.573 -0.260 2.404) 2.885 23.370 ( -1.112 -0.213 1.767) 2.099 26.544 ( 0.291 0.174 -0.128) 0.362 26.551 ( -0.579 -0.011 -0.394) 0.700 26.576 ( 0.358 0.420 0.069) 0.556 26.581 ( 0.924 -0.004 0.111) 0.931 29.159 ( -0.079 1.492 1.823) 2.357 29.228 ( -1.323 -1.104 2.424) 2.974 29.328 ( 2.906 3.145 -0.772) 4.351 29.534 ( 0.474 -4.902 -3.324) 5.942 29.782 ( -1.382 11.850 3.127) 12.333 30.247 ( -2.166 -5.215 3.250) 6.515 30.573 ( -0.411 18.817 -16.212) 24.841 30.710 ( -0.343 -0.449 0.206) 0.601 30.782 ( 1.762 4.963 -2.733) 5.934 30.871 ( 0.506 1.068 -2.814) 3.052 31.022 ( -2.937 -1.925 0.882) 3.621 31.029 ( 2.018 -1.749 0.509) 2.719 31.546 ( -0.868 5.369 0.308) 5.448 31.800 ( 0.141 -4.009 1.986) 4.476 32.026 ( -1.620 36.259 -30.623) 47.488 32.160 ( 1.752 4.398 -2.052) 5.159 32.209 ( -2.186 2.278 -0.630) 3.220 32.288 ( 2.491 -2.098 -0.353) 3.276 32.328 ( 4.421 0.356 -3.010) 5.360 32.529 ( -5.206 0.255 0.318) 5.222 32.540 ( -4.948 0.135 -0.555) 4.981 32.553 ( 3.412 -0.432 -1.682) 3.829 32.850 ( 1.965 13.183 -14.422) 19.638 33.413 ( -1.007 -4.770 -14.129) 14.947 33.676 ( -0.591 3.681 -0.660) 3.786 33.976 ( -1.497 -7.254 -32.876) 33.700 34.139 ( 0.010 1.462 -9.220) 9.336 34.197 ( -0.019 -1.220 -6.365) 6.481 34.954 ( -1.569 0.344 2.692) 3.134 34.974 ( 2.628 -0.470 3.773) 4.622 35.039 ( 0.953 0.293 3.871) 3.997 35.044 ( 4.299 0.189 1.977) 4.735 35.575 ( 1.876 2.136 -1.979) 3.464 35.612 ( 1.225 1.402 -1.882) 2.648 35.671 ( 1.589 -1.486 -0.048) 2.176 35.694 ( 0.396 -2.034 -1.159) 2.374 35.893 ( 0.490 0.778 7.921) 7.975 35.959 ( 0.462 -2.320 7.384) 7.754 36.484 ( 0.527 1.918 -1.794) 2.679 36.542 ( 0.224 -1.247 -5.063) 5.219 36.766 ( -2.055 10.744 37.065) 38.645 37.778 ( -3.970 -41.445 38.974) 57.030 38.494 ( -0.804 2.044 -3.325) 3.985 38.854 ( 0.398 -8.428 -4.134) 9.396 ======================= Grid point 55 (26/69) ======================= q-point: ( 0.11 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.057 ( 19.227 14.806 15.077) 28.570 1.511 ( 9.700 27.979 11.012) 31.594 1.774 ( 13.087 3.731 -5.095) 14.531 1.938 ( -2.078 -5.701 2.313) 6.493 2.020 ( 15.145 8.216 38.113) 41.827 2.208 ( 4.058 9.807 -14.118) 17.662 2.300 ( -0.730 -11.229 0.596) 11.268 2.387 ( -0.448 -10.835 22.409) 24.895 2.556 ( -0.900 -3.291 2.852) 4.447 2.705 ( -2.913 -3.827 5.408) 7.237 2.768 ( 8.215 -0.526 6.096) 10.244 2.834 ( -1.472 1.694 -2.169) 3.121 2.946 ( -8.716 2.164 -4.693) 10.133 2.979 ( -2.157 3.241 0.842) 3.983 3.020 ( 0.522 -0.431 6.172) 6.209 3.125 ( 5.083 3.023 1.758) 6.169 3.207 ( -4.078 0.255 -3.365) 5.293 3.238 ( 0.505 -0.958 6.382) 6.474 3.319 ( 3.134 -4.499 3.077) 6.287 3.395 ( 9.925 -1.505 4.469) 10.988 3.450 ( -2.038 -3.365 -0.712) 3.998 3.548 ( 4.795 2.124 -5.166) 7.361 3.588 ( 1.138 -5.343 -1.621) 5.699 3.631 ( 0.906 -1.679 0.433) 1.956 3.696 ( -1.342 4.232 -2.194) 4.952 3.755 ( 5.740 5.826 -1.198) 8.265 3.843 ( -5.438 11.258 0.735) 12.524 3.903 ( -0.077 0.891 -7.400) 7.454 4.014 ( 2.830 -1.443 6.542) 7.273 4.064 ( 8.171 4.933 -2.266) 9.810 4.108 ( 0.230 6.507 1.984) 6.806 4.139 ( -7.597 -8.170 2.052) 11.344 4.210 ( 4.597 -2.416 -3.578) 6.307 4.338 ( 5.245 -9.278 0.259) 10.661 4.473 ( 7.270 3.691 -1.113) 8.229 4.525 ( 0.787 -0.702 2.108) 2.358 4.609 ( 1.405 -0.309 0.071) 1.440 4.684 ( 2.332 -1.648 2.634) 3.885 4.780 ( 2.181 -1.776 -4.760) 5.529 4.981 ( -0.922 0.413 -1.928) 2.177 5.027 ( 2.862 -3.731 -6.013) 7.634 5.069 ( -2.079 0.994 -2.797) 3.624 5.162 ( -6.883 3.617 -6.691) 10.258 5.195 ( 5.048 5.845 -2.825) 8.223 5.210 ( -1.657 1.600 -6.952) 7.324 5.319 ( 0.336 -0.070 -0.610) 0.700 5.346 ( 1.996 4.584 1.258) 5.155 5.441 ( -1.191 -1.729 -4.090) 4.597 5.458 ( -1.461 -1.757 0.428) 2.325 5.630 ( 3.728 1.370 -4.674) 6.133 5.673 ( -0.584 0.421 -0.092) 0.726 5.820 ( -1.837 -3.096 1.136) 3.775 5.878 ( -0.010 -1.673 -0.653) 1.796 5.917 ( 2.799 -0.438 -5.004) 5.750 5.959 ( 0.453 2.533 -5.154) 5.760 5.991 ( 6.455 2.319 -2.248) 7.218 6.061 ( -1.643 2.415 -0.465) 2.958 6.110 ( -1.903 2.242 -1.409) 3.261 6.236 ( 1.427 5.764 -5.817) 8.312 6.311 ( 4.043 -2.570 0.601) 4.828 6.444 ( -2.700 -8.452 3.743) 9.630 6.508 ( 1.511 -6.280 5.112) 8.238 6.539 ( -3.121 -3.412 -4.776) 6.648 6.582 ( -0.575 -2.897 4.423) 5.318 6.754 ( -2.328 4.147 -0.586) 4.792 6.867 ( -1.697 2.104 0.087) 2.705 6.971 ( -3.710 -1.698 4.318) 5.941 7.027 ( -2.391 3.012 3.973) 5.529 7.139 ( -7.801 -4.911 5.767) 10.874 7.171 ( -0.146 -3.494 -2.209) 4.137 7.209 ( 0.170 -2.156 0.509) 2.221 7.349 ( -3.609 -5.425 0.506) 6.536 7.429 ( -1.558 -1.098 1.303) 2.309 7.456 ( -6.325 -0.668 2.143) 6.711 7.612 ( -1.891 -7.351 3.305) 8.278 7.677 ( -7.721 -8.577 3.604) 12.090 8.507 ( -11.637 4.566 0.628) 12.516 8.565 ( -17.922 1.941 -2.353) 18.180 8.731 ( -15.010 -3.245 -0.577) 15.367 8.774 ( -10.449 -4.260 -0.666) 11.303 8.968 ( 0.092 2.818 0.167) 2.824 9.024 ( -3.204 -0.107 -0.935) 3.339 9.060 ( 3.236 -0.226 -0.846) 3.352 9.080 ( 1.004 3.817 -0.170) 3.950 9.235 ( 4.057 -4.041 0.864) 5.791 9.260 ( 2.830 -3.501 -1.925) 4.896 9.286 ( 5.528 -2.835 -1.112) 6.311 9.333 ( 4.225 -2.458 -2.092) 5.317 9.421 ( 1.973 -0.016 1.766) 2.648 9.467 ( 1.032 -1.214 2.065) 2.608 9.545 ( 4.328 2.165 -2.399) 5.401 9.688 ( 4.340 -3.842 -2.421) 6.282 9.903 ( 0.348 2.212 5.419) 5.863 10.105 ( -1.003 -6.806 0.917) 6.941 10.291 ( -7.340 10.494 1.130) 12.856 10.352 ( -6.983 4.365 -0.142) 8.236 10.421 ( -7.186 -1.289 0.250) 7.305 10.532 ( -7.571 2.286 -3.916) 8.825 10.645 ( -8.590 -3.879 0.272) 9.429 10.663 ( -6.631 -0.981 -1.651) 6.903 10.780 ( -7.366 3.021 -0.663) 7.990 10.862 ( -3.786 4.138 -1.295) 5.756 11.009 ( -3.933 -3.903 0.942) 5.620 11.077 ( -2.572 -2.008 -1.162) 3.464 11.356 ( 11.374 1.780 -0.463) 11.521 11.370 ( 11.921 0.301 -0.158) 11.926 11.559 ( 2.617 -6.205 -1.123) 6.827 11.567 ( 4.236 -7.135 0.944) 8.352 11.978 ( 2.498 4.653 2.080) 5.676 12.154 ( 2.444 3.690 -2.910) 5.297 12.223 ( 1.240 -4.177 2.625) 5.086 12.329 ( -2.644 1.082 1.015) 3.032 12.370 ( -4.248 3.161 -0.124) 5.297 12.385 ( -1.101 0.088 -0.937) 1.448 12.461 ( -1.097 1.752 -0.694) 2.181 12.502 ( -0.174 2.701 -0.758) 2.811 12.613 ( 0.963 8.842 1.505) 9.021 12.759 ( 1.692 7.191 -1.713) 7.584 12.912 ( 0.167 -5.295 0.282) 5.305 12.972 ( 0.442 -3.235 0.262) 3.276 13.273 ( 1.308 5.095 -0.046) 5.260 13.304 ( 2.393 1.921 -0.385) 3.093 13.489 ( 9.844 -4.546 0.140) 10.844 13.546 ( 14.606 -7.600 -1.187) 16.508 14.170 ( -7.404 7.307 -1.738) 10.547 14.185 ( -7.162 12.820 1.292) 14.742 14.221 ( 1.470 4.468 1.259) 4.870 14.350 ( 4.881 1.924 -0.311) 5.255 14.386 ( -5.528 -0.805 0.182) 5.589 14.501 ( -1.475 4.823 -1.874) 5.381 14.691 ( 5.837 1.935 -0.345) 6.159 14.787 ( 4.486 1.070 0.753) 4.673 14.897 ( 6.748 -1.829 0.837) 7.041 14.992 ( 13.190 4.179 -4.910) 14.681 15.103 ( 11.365 -3.876 -0.561) 12.020 15.149 ( 5.769 -2.655 -1.225) 6.468 15.231 ( 10.971 7.378 -0.587) 13.234 15.490 ( 7.837 15.375 -8.906) 19.420 15.689 ( -5.891 -3.564 0.960) 6.952 15.760 ( -6.552 -0.523 0.675) 6.607 15.822 ( 2.175 2.340 0.698) 3.270 15.884 ( 2.830 -0.122 -2.055) 3.500 15.969 ( -0.345 -5.733 3.167) 6.559 16.185 ( -3.150 -6.296 -6.385) 9.504 16.540 ( 3.488 -0.206 -0.069) 3.494 16.572 ( 3.878 -0.597 0.728) 3.991 16.603 ( 3.238 0.946 0.713) 3.448 16.660 ( 2.656 -1.050 -1.644) 3.296 17.323 ( -0.525 0.895 0.750) 1.280 17.344 ( -0.308 0.089 0.187) 0.371 17.355 ( 0.268 1.034 0.169) 1.082 17.407 ( 1.243 -0.930 -0.280) 1.578 19.742 ( 1.406 2.521 1.356) 3.189 19.873 ( 3.624 -0.672 -4.140) 5.543 20.017 ( 0.088 -3.974 1.007) 4.100 20.037 ( 1.040 -3.632 -0.116) 3.780 20.508 ( -4.400 1.695 1.599) 4.979 20.575 ( -2.458 -1.121 1.685) 3.184 20.800 ( -0.558 0.873 -1.686) 1.979 20.847 ( 0.175 -0.990 -1.474) 1.784 21.978 ( 5.004 1.870 2.124) 5.749 22.054 ( 3.364 0.813 -2.266) 4.137 22.096 ( 1.691 -2.669 2.501) 4.030 22.148 ( 2.308 -1.561 -0.213) 2.794 23.029 ( -4.813 0.249 -1.433) 5.028 23.100 ( -2.636 -2.397 -2.937) 4.618 23.301 ( -9.689 -0.437 2.351) 9.980 23.316 ( -7.554 -1.662 2.220) 8.047 26.622 ( 9.704 0.718 0.349) 9.737 26.648 ( 12.777 0.269 -0.119) 12.780 26.697 ( 14.496 0.654 0.531) 14.520 26.847 ( 28.720 -7.197 -8.209) 30.725 29.042 ( -16.207 4.201 0.801) 16.762 29.129 ( -14.205 3.701 0.331) 14.683 29.230 ( -12.297 -1.873 2.655) 12.719 29.382 ( -12.538 -5.048 -3.675) 14.006 29.962 ( 14.914 11.661 3.707) 19.291 30.254 ( 6.362 14.105 -7.034) 16.997 30.502 ( 3.588 3.107 2.795) 5.509 30.701 ( 0.407 -2.083 -1.755) 2.754 30.816 ( 4.001 3.014 -0.122) 5.011 30.870 ( 2.642 1.362 -2.413) 3.829 31.044 ( 3.859 -2.713 0.187) 4.721 31.117 ( 8.217 -2.728 -1.439) 8.777 31.558 ( 1.591 7.037 0.285) 7.220 31.754 ( 3.003 17.223 -8.923) 19.628 31.919 ( 0.139 -0.734 2.580) 2.686 32.076 ( -9.617 1.773 1.319) 9.868 32.108 ( -5.698 2.676 -1.206) 6.410 32.240 ( -7.061 -0.484 -0.319) 7.084 32.265 ( -7.021 -3.395 -2.353) 8.146 32.565 ( 7.856 -0.489 0.067) 7.872 32.594 ( 9.603 -2.334 -6.524) 11.841 32.655 ( 11.431 -1.369 -0.941) 11.551 32.884 ( 10.825 2.258 -3.350) 11.554 33.119 ( -0.142 -7.311 -25.140) 26.182 33.681 ( -2.203 0.415 3.924) 4.519 33.734 ( -2.856 -1.841 -5.062) 6.097 34.021 ( -3.390 1.202 -6.750) 7.649 34.087 ( -3.955 -1.510 -7.146) 8.306 34.946 ( -2.424 1.337 1.552) 3.174 35.018 ( -1.189 -2.041 2.299) 3.296 35.096 ( 2.277 1.433 2.189) 3.469 35.126 ( 2.653 -0.196 2.902) 3.937 35.583 ( 3.223 2.851 -4.121) 5.958 35.636 ( 4.000 1.131 -1.482) 4.413 35.706 ( 3.638 -2.044 -1.530) 4.444 35.718 ( 4.935 -2.075 -2.180) 5.781 36.017 ( 1.984 0.920 10.497) 10.722 36.071 ( 0.902 -1.590 10.347) 10.507 36.420 ( -0.116 0.777 -7.177) 7.220 36.469 ( 0.420 -1.158 -7.761) 7.858 37.160 ( -1.707 11.830 33.156) 35.244 37.903 ( -10.650 -15.572 10.426) 21.555 38.339 ( -15.835 -0.252 2.859) 16.093 38.725 ( -9.537 -9.885 -6.197) 15.069 ======================= Grid point 56 (27/69) ======================= q-point: ( 0.22 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( 18.736 11.176 16.401) 27.294 1.765 ( 14.052 4.179 6.520) 16.045 1.989 ( 8.437 0.207 -2.005) 8.674 2.046 ( 15.256 6.295 -2.995) 16.773 2.143 ( 11.382 6.477 -5.429) 14.177 2.249 ( 2.661 -4.029 -5.312) 7.179 2.492 ( -0.558 -5.177 5.832) 7.818 2.554 ( 3.141 -3.353 5.909) 7.485 2.610 ( -1.756 -6.087 -0.754) 6.380 2.730 ( -0.710 -1.555 3.146) 3.580 2.751 ( -1.427 3.489 6.098) 7.169 2.845 ( 2.443 -0.322 4.386) 5.031 2.976 ( 1.303 -7.144 4.674) 8.636 3.022 ( -1.249 4.583 3.799) 6.082 3.042 ( 2.157 0.791 4.092) 4.693 3.170 ( -0.905 2.527 -3.905) 4.739 3.215 ( 7.946 -3.008 2.973) 9.001 3.307 ( -4.050 -2.308 2.222) 5.164 3.388 ( -0.180 -3.063 -1.576) 3.450 3.429 ( 2.232 2.856 3.649) 5.143 3.431 ( -0.115 0.514 -6.023) 6.046 3.574 ( 1.996 0.387 5.234) 5.615 3.612 ( 0.698 5.347 -8.950) 10.449 3.667 ( 6.881 3.682 4.568) 9.043 3.719 ( 3.369 3.174 -2.571) 5.295 3.748 ( 1.766 9.533 8.397) 12.826 3.803 ( 4.383 0.320 -1.808) 4.752 3.916 ( 4.965 0.703 -3.053) 5.871 4.095 ( 3.895 2.206 0.667) 4.526 4.127 ( 3.326 1.026 2.942) 4.558 4.147 ( 0.330 4.387 1.821) 4.762 4.217 ( 4.689 3.177 2.922) 6.373 4.313 ( 9.395 -2.975 3.020) 10.307 4.414 ( 7.755 -3.017 -7.565) 11.246 4.568 ( 3.450 -0.564 0.270) 3.506 4.592 ( 4.502 -0.337 -2.039) 4.954 4.600 ( 3.052 -7.663 1.368) 8.361 4.731 ( 2.549 -6.622 -4.689) 8.505 4.791 ( 2.130 4.742 -0.018) 5.198 4.900 ( -3.838 5.325 -5.659) 8.667 4.965 ( -4.915 -1.717 -2.098) 5.613 5.030 ( 4.952 -2.959 -4.751) 7.474 5.077 ( 1.911 1.243 2.426) 3.329 5.145 ( -1.415 2.632 -1.042) 3.164 5.222 ( -0.754 6.047 -2.342) 6.528 5.276 ( -1.583 4.240 -1.133) 4.666 5.335 ( -3.957 0.819 -0.303) 4.052 5.414 ( 2.660 -1.995 2.430) 4.118 5.506 ( -0.310 -0.396 4.758) 4.785 5.621 ( 4.265 1.850 -6.520) 8.008 5.672 ( -0.257 -1.134 -0.332) 1.209 5.794 ( -1.303 -4.688 -0.983) 4.964 5.848 ( -2.644 -7.568 1.423) 8.142 5.887 ( -2.096 -0.458 -1.490) 2.612 5.952 ( 0.925 3.390 -2.434) 4.274 6.014 ( -0.331 3.676 -0.720) 3.761 6.070 ( 3.303 -2.518 -0.357) 4.169 6.147 ( 5.053 2.477 -1.436) 5.808 6.157 ( -0.600 3.216 -5.005) 5.979 6.391 ( 2.192 -0.528 -4.586) 5.110 6.435 ( -1.731 -4.488 1.513) 5.042 6.486 ( 2.666 -6.221 3.843) 7.783 6.578 ( -0.409 -6.561 3.465) 7.430 6.600 ( -2.034 -6.765 2.387) 7.456 6.747 ( 0.386 3.264 1.627) 3.667 6.816 ( -2.832 1.095 -1.975) 3.623 6.921 ( -6.239 -1.134 -0.621) 6.372 6.996 ( -6.375 3.965 2.657) 7.964 7.001 ( -9.353 -6.087 2.935) 11.539 7.169 ( -3.374 -2.387 3.557) 5.452 7.209 ( 0.268 -0.560 -0.218) 0.658 7.275 ( -2.592 -2.503 -1.765) 4.012 7.358 ( -6.115 1.102 -1.557) 6.406 7.411 ( -3.653 0.502 -0.094) 3.689 7.569 ( -5.229 -4.107 -0.833) 6.701 7.606 ( -6.162 -2.724 2.090) 7.054 8.214 ( -20.022 4.417 -3.122) 20.740 8.322 ( -13.989 4.326 -0.111) 14.643 8.445 ( -19.068 -4.638 -0.977) 19.649 8.572 ( -13.990 -5.999 -0.304) 15.225 8.959 ( 1.993 1.933 -2.543) 3.765 8.998 ( 0.146 2.025 0.061) 2.031 9.049 ( -1.332 3.896 1.528) 4.392 9.166 ( 5.073 -0.775 0.597) 5.166 9.283 ( 1.995 -1.932 1.364) 3.094 9.308 ( 3.627 -3.737 0.021) 5.207 9.346 ( 4.964 -1.450 -1.323) 5.338 9.401 ( 4.139 -2.619 -0.825) 4.967 9.475 ( 2.636 0.031 -0.231) 2.646 9.518 ( 3.385 -0.378 3.009) 4.545 9.596 ( 4.495 -1.214 -1.767) 4.981 9.723 ( 2.730 -5.126 -1.411) 5.977 9.958 ( -1.176 1.013 3.432) 3.766 10.049 ( -8.071 -2.315 0.388) 8.405 10.186 ( -6.117 3.957 -0.719) 7.320 10.199 ( -10.417 5.100 -0.793) 11.626 10.287 ( -10.737 -1.384 2.093) 11.026 10.361 ( -9.001 2.651 -1.881) 9.570 10.513 ( -8.017 0.214 -2.489) 8.397 10.544 ( -5.757 -4.229 1.475) 7.295 10.647 ( -8.054 5.203 0.235) 9.592 10.792 ( -3.780 2.742 -0.820) 4.741 10.941 ( -5.636 -4.363 1.141) 7.218 11.001 ( -5.748 -2.743 -1.209) 6.483 11.541 ( 12.058 -0.589 -0.200) 12.074 11.562 ( 11.832 -1.541 -0.332) 11.936 11.631 ( 7.345 -1.527 -0.392) 7.512 11.669 ( 6.950 -2.786 1.104) 7.569 12.056 ( 4.029 3.710 2.025) 5.839 12.135 ( -1.172 4.015 -1.781) 4.546 12.263 ( -1.423 0.676 0.680) 1.716 12.284 ( -3.873 4.815 2.053) 6.511 12.334 ( -0.098 -3.830 -0.425) 3.855 12.372 ( 1.425 -2.112 0.010) 2.548 12.427 ( -1.302 -1.034 -1.246) 2.077 12.485 ( -0.765 -0.878 -0.822) 1.426 12.672 ( 3.643 6.424 1.577) 7.551 12.772 ( 1.978 5.436 -1.332) 5.936 12.925 ( 0.471 -4.685 0.415) 4.727 12.967 ( -1.175 -3.170 -0.313) 3.396 13.313 ( 4.062 7.294 -0.264) 8.353 13.359 ( 4.746 6.154 0.038) 7.772 13.653 ( 7.685 -8.653 0.740) 11.597 13.711 ( 7.010 -8.418 -0.656) 10.974 14.065 ( -1.920 8.978 -1.208) 9.260 14.110 ( -1.449 10.796 1.102) 10.948 14.257 ( 1.307 -1.982 0.575) 2.443 14.312 ( -2.924 -1.512 -0.467) 3.325 14.438 ( 0.329 8.096 3.033) 8.652 14.490 ( 4.224 11.433 -2.172) 12.380 14.760 ( 2.904 0.507 -1.086) 3.141 14.820 ( -0.933 0.881 0.025) 1.283 14.989 ( 6.015 3.546 0.550) 7.004 15.145 ( 10.226 2.453 -2.861) 10.898 15.262 ( 8.453 -3.241 -0.030) 9.053 15.292 ( 11.581 -2.060 0.676) 11.782 15.435 ( 14.346 0.232 -0.071) 14.348 15.534 ( 3.716 1.319 -1.481) 4.212 15.605 ( -5.515 -3.867 0.464) 6.752 15.649 ( -6.764 -1.359 -0.197) 6.902 15.910 ( 6.827 0.690 2.066) 7.166 15.928 ( 8.288 1.448 -5.448) 10.023 15.992 ( -1.314 -4.289 4.092) 6.072 16.064 ( -3.008 -3.788 -5.142) 7.059 16.592 ( 2.087 -0.168 0.043) 2.094 16.632 ( 2.177 -1.523 -1.693) 3.150 16.656 ( 3.544 1.522 -0.178) 3.861 16.694 ( 2.191 0.055 2.511) 3.333 17.321 ( -0.106 0.774 0.167) 0.799 17.343 ( 0.146 -0.245 0.223) 0.362 17.364 ( 0.670 1.218 0.180) 1.402 17.420 ( 1.227 -1.025 -1.009) 1.890 19.807 ( 4.666 1.234 1.833) 5.163 19.888 ( 4.079 -1.736 -4.037) 5.996 20.054 ( 3.762 -1.911 0.302) 4.231 20.068 ( 3.312 -2.040 0.417) 3.912 20.444 ( -6.471 2.254 2.156) 7.184 20.534 ( -5.427 -1.588 1.616) 5.881 20.762 ( -1.748 1.416 -1.548) 2.731 20.822 ( -1.304 -1.137 -1.525) 2.306 22.085 ( 6.650 1.494 -0.100) 6.816 22.091 ( 5.041 1.774 -1.738) 5.619 22.184 ( 6.552 -1.799 1.239) 6.906 22.214 ( 6.007 -1.499 0.767) 6.239 22.916 ( -7.464 1.138 -1.367) 7.674 23.013 ( -5.481 -2.796 -1.223) 6.274 23.146 ( -12.783 -0.501 1.866) 12.928 23.196 ( -10.345 -2.779 1.382) 10.801 26.849 ( 17.726 2.321 1.565) 17.946 26.901 ( 19.576 2.733 -1.829) 19.850 27.027 ( 23.938 -3.199 5.352) 24.737 27.174 ( 27.270 -7.799 -10.800) 30.350 28.747 ( -21.208 5.905 0.575) 22.022 28.831 ( -21.440 6.930 -1.063) 22.557 29.036 ( -17.310 -5.774 2.982) 18.490 29.102 ( -18.321 -5.497 -3.254) 19.403 30.238 ( 14.315 10.279 2.806) 17.846 30.337 ( 10.631 12.305 -2.260) 16.418 30.614 ( 3.763 -1.593 3.977) 5.702 30.696 ( 2.309 -2.485 -2.417) 4.165 30.889 ( 5.201 1.975 -1.567) 5.780 30.921 ( 7.000 3.415 0.686) 7.819 31.119 ( 5.403 -4.381 -0.430) 6.969 31.227 ( 8.066 -3.590 -1.782) 9.007 31.573 ( -1.379 8.428 0.484) 8.554 31.738 ( -0.828 9.393 -1.393) 9.531 31.879 ( -7.159 -2.297 2.257) 7.850 31.957 ( -4.053 4.345 0.255) 5.947 31.996 ( -9.806 -0.789 -1.994) 10.038 32.146 ( -4.428 -0.765 0.747) 4.555 32.241 ( 4.376 -6.301 4.361) 8.825 32.432 ( 0.631 -8.823 -20.412) 22.247 32.793 ( 11.655 1.333 3.926) 12.371 32.857 ( 11.685 -1.380 3.279) 12.214 33.043 ( 12.801 0.407 -2.192) 12.993 33.054 ( 11.416 -0.093 -6.946) 13.363 33.674 ( -3.561 0.018 1.238) 3.770 33.681 ( -3.548 -0.195 2.941) 4.613 33.897 ( -5.821 0.201 -2.067) 6.180 33.928 ( -6.768 -1.037 -5.486) 8.774 34.917 ( -2.401 1.679 0.084) 2.931 34.999 ( -2.153 -1.855 -0.442) 2.876 35.155 ( 2.613 1.114 1.161) 3.068 35.193 ( 2.105 -0.562 2.286) 3.158 35.583 ( 2.502 3.700 -3.382) 5.603 35.693 ( 4.867 1.023 -1.078) 5.089 35.748 ( 4.309 -2.966 -2.235) 5.689 35.782 ( 5.520 -2.125 -1.368) 6.071 36.182 ( 2.866 0.637 11.263) 11.639 36.211 ( 2.078 -1.206 9.690) 9.984 36.339 ( 0.889 1.096 -7.610) 7.740 36.395 ( 3.071 -1.104 -9.680) 10.215 37.431 ( -4.671 8.765 23.556) 25.564 37.750 ( -8.933 2.217 -8.994) 12.869 38.145 ( -19.339 -5.098 12.537) 23.605 38.431 ( -16.068 -10.087 -9.512) 21.222 ======================= Grid point 57 (28/69) ======================= q-point: ( 0.33 0.25 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 4.971 10.621 -2.183) 11.929 2.038 ( 4.451 7.301 -10.596) 13.616 2.078 ( 7.238 -5.507 2.823) 9.523 2.157 ( 11.271 -2.588 1.559) 11.669 2.252 ( 6.457 -5.550 4.322) 9.549 2.374 ( 6.714 -0.627 -1.197) 6.849 2.497 ( 7.062 3.256 3.405) 8.490 2.622 ( 4.069 -2.463 -0.990) 4.858 2.680 ( 3.057 -4.975 2.667) 6.419 2.729 ( 5.171 3.541 3.670) 7.262 2.774 ( -2.807 -2.860 -3.074) 5.051 2.920 ( -3.294 0.127 5.950) 6.802 2.980 ( -0.799 -4.645 -6.758) 8.240 3.006 ( 1.354 4.859 1.275) 5.203 3.108 ( 1.828 4.036 -1.753) 4.765 3.169 ( 2.962 -0.666 -3.535) 4.660 3.232 ( -3.834 0.862 0.269) 3.939 3.278 ( 1.063 0.939 -7.987) 8.112 3.323 ( -0.504 -3.172 1.430) 3.516 3.394 ( 8.224 -0.122 -0.680) 8.253 3.524 ( 5.283 2.080 -6.281) 8.467 3.586 ( 1.358 3.774 -6.830) 7.921 3.709 ( 2.610 6.951 -2.304) 7.774 3.781 ( 2.226 4.182 4.923) 6.832 3.805 ( 4.716 -0.878 2.715) 5.512 3.849 ( 5.949 -2.074 6.125) 8.787 3.978 ( 8.176 7.775 5.792) 12.682 3.982 ( 3.944 3.306 3.713) 6.346 4.110 ( 8.848 2.222 -3.036) 9.614 4.187 ( 4.470 5.183 -1.329) 6.972 4.251 ( 1.280 7.516 3.389) 8.344 4.323 ( 3.020 -0.767 0.565) 3.167 4.406 ( 0.338 -2.586 3.611) 4.454 4.423 ( 3.098 1.338 -2.320) 4.095 4.516 ( -2.529 -3.486 -2.575) 5.018 4.639 ( 1.615 -9.769 -3.584) 10.531 4.695 ( -1.007 3.124 0.640) 3.344 4.725 ( 3.642 -9.278 -4.466) 10.923 4.770 ( 1.046 5.417 0.803) 5.575 4.870 ( -3.044 -1.763 -1.727) 3.918 4.907 ( 0.292 -4.416 7.291) 8.529 5.003 ( -0.774 -5.358 -9.543) 10.972 5.090 ( 0.387 8.471 0.642) 8.504 5.190 ( 3.685 1.016 2.236) 4.429 5.206 ( -1.952 6.935 3.688) 8.093 5.304 ( 3.563 0.919 2.656) 4.539 5.360 ( 5.674 6.492 5.151) 10.044 5.460 ( -3.073 0.646 3.403) 4.630 5.526 ( -1.797 -1.461 2.827) 3.655 5.613 ( -2.484 3.987 1.070) 4.817 5.692 ( 7.963 -2.474 -4.477) 9.464 5.762 ( -2.384 -5.368 -0.403) 5.887 5.798 ( -5.244 -0.852 -1.057) 5.417 5.857 ( -0.518 -7.525 3.831) 8.460 5.927 ( -1.846 -2.635 1.745) 3.660 6.033 ( 1.803 0.637 -0.896) 2.112 6.072 ( -2.160 -2.191 -1.402) 3.381 6.117 ( 0.160 -2.061 0.295) 2.088 6.175 ( -1.548 0.250 -1.127) 1.931 6.308 ( -0.776 -0.410 -4.868) 4.946 6.476 ( -6.473 -5.259 2.093) 8.599 6.513 ( 5.529 -5.390 -1.398) 7.847 6.588 ( -4.234 -6.330 3.039) 8.199 6.599 ( 0.467 -4.656 -1.572) 4.936 6.749 ( -2.316 1.616 -2.249) 3.610 6.791 ( 3.831 3.598 0.318) 5.265 6.822 ( -1.972 1.865 -0.088) 2.716 6.941 ( -1.872 -0.251 -1.225) 2.251 6.991 ( 0.882 3.541 5.151) 6.313 7.122 ( -3.168 -0.876 0.194) 3.293 7.214 ( -1.185 0.245 0.310) 1.249 7.242 ( -4.573 0.725 -0.254) 4.637 7.277 ( 2.315 -1.413 -0.837) 2.839 7.336 ( -3.324 -1.550 -2.892) 4.671 7.449 ( -6.397 -0.324 -1.366) 6.550 7.536 ( -5.980 -2.261 2.151) 6.745 7.902 ( -15.193 5.536 -1.972) 16.290 8.098 ( -13.465 5.178 -0.992) 14.460 8.161 ( -14.969 -5.344 -0.349) 15.898 8.364 ( -11.599 -6.920 -0.297) 13.509 8.979 ( 3.447 2.991 -2.429) 5.170 9.012 ( 1.502 1.456 -0.490) 2.148 9.067 ( -0.411 2.618 3.695) 4.547 9.222 ( 1.565 -3.978 0.257) 4.282 9.341 ( 1.985 -0.848 1.319) 2.530 9.361 ( 3.282 -0.986 0.501) 3.463 9.402 ( 3.919 -1.413 -0.544) 4.201 9.425 ( 0.315 -1.141 0.552) 1.306 9.526 ( 4.955 -0.397 -0.276) 4.978 9.619 ( 4.822 0.486 -0.207) 4.851 9.634 ( 2.415 -3.878 0.796) 4.638 9.746 ( 1.027 -4.480 0.743) 4.656 9.884 ( -12.040 -0.219 0.181) 12.043 9.903 ( -8.092 -0.467 0.117) 8.106 10.019 ( -9.019 1.885 -1.258) 9.300 10.091 ( -6.944 0.315 -1.597) 7.132 10.181 ( -2.603 2.681 -2.035) 4.255 10.254 ( -4.480 2.559 2.777) 5.859 10.361 ( -6.902 1.966 -2.783) 7.697 10.500 ( -3.869 -4.904 1.570) 6.441 10.565 ( -3.749 6.091 2.112) 7.458 10.733 ( -2.262 2.413 -0.919) 3.433 10.867 ( -5.788 -4.431 1.032) 7.362 10.902 ( -3.608 -2.509 -1.057) 4.520 11.681 ( 6.449 -1.813 -0.426) 6.713 11.729 ( 9.296 -0.746 0.222) 9.329 11.738 ( 5.837 -0.710 0.026) 5.880 11.783 ( 5.551 0.179 0.421) 5.570 12.085 ( -1.707 3.819 -0.775) 4.255 12.145 ( 3.228 3.090 1.667) 4.770 12.223 ( -2.212 3.119 -0.511) 3.858 12.259 ( -1.955 3.293 0.179) 3.834 12.325 ( -0.431 -4.265 0.478) 4.313 12.394 ( -0.141 -2.245 -0.149) 2.255 12.437 ( 2.775 -5.364 0.875) 6.103 12.479 ( 2.243 -3.318 -1.126) 4.160 12.732 ( 1.950 3.743 0.101) 4.222 12.783 ( 1.238 4.059 -0.603) 4.287 12.908 ( -3.018 -3.595 -0.729) 4.750 12.941 ( -1.698 -2.595 0.445) 3.133 13.393 ( 6.515 8.977 -0.269) 11.095 13.443 ( 5.721 8.461 -0.005) 10.214 13.700 ( -1.625 -2.138 0.562) 2.744 13.729 ( -2.652 -0.882 -0.283) 2.809 14.098 ( 5.628 4.702 -0.418) 7.345 14.182 ( 6.945 0.470 0.862) 7.014 14.282 ( 2.319 -1.721 0.034) 2.888 14.306 ( 2.272 -1.292 -0.504) 2.662 14.444 ( -0.521 10.337 0.894) 10.388 14.520 ( 0.637 10.140 -0.645) 10.180 14.721 ( -5.475 0.125 -1.371) 5.646 14.792 ( -3.483 0.667 1.058) 3.701 15.110 ( 7.462 0.062 0.643) 7.490 15.226 ( 4.041 0.766 -1.768) 4.477 15.354 ( 0.804 -5.363 1.419) 5.605 15.426 ( 2.642 -4.570 -0.057) 5.279 15.543 ( -2.018 -1.148 -0.144) 2.326 15.551 ( 2.617 -0.371 -0.657) 2.724 15.594 ( 0.757 -2.501 0.061) 2.614 15.626 ( 7.737 -3.030 0.381) 8.318 15.983 ( 3.182 -0.666 -2.156) 3.901 15.996 ( 5.646 -1.093 -4.235) 7.142 16.051 ( 4.018 1.611 1.962) 4.753 16.070 ( 5.811 0.745 2.999) 6.581 16.602 ( -0.638 -0.445 0.368) 0.861 16.618 ( -0.710 -0.621 -0.639) 1.139 16.707 ( 2.480 1.109 -0.276) 2.730 16.735 ( -1.545 -0.142 2.423) 2.877 17.330 ( 1.106 1.013 -0.028) 1.500 17.361 ( 1.514 -0.391 0.668) 1.700 17.376 ( 0.503 0.694 0.305) 0.910 17.418 ( 0.425 -0.910 -1.738) 2.007 19.919 ( 6.421 -0.769 -1.682) 6.682 19.923 ( 6.481 -0.766 0.082) 6.527 20.113 ( 3.842 0.192 -0.347) 3.862 20.163 ( 5.794 -1.481 1.897) 6.274 20.364 ( -7.400 2.072 3.090) 8.283 20.449 ( -7.326 -1.502 1.626) 7.653 20.716 ( -2.298 1.272 -0.812) 2.750 20.774 ( -2.502 -1.152 -1.287) 3.040 22.175 ( 7.461 2.098 -0.743) 7.786 22.187 ( 7.999 1.730 -1.422) 8.306 22.315 ( 8.092 -1.520 0.942) 8.287 22.333 ( 7.932 -1.865 0.029) 8.149 22.780 ( -7.863 1.637 -0.895) 8.081 22.902 ( -7.402 -2.584 -0.852) 7.886 22.969 ( -11.854 -0.587 1.727) 11.993 23.038 ( -10.955 -2.534 0.529) 11.257 27.167 ( 20.265 3.754 -0.918) 20.630 27.202 ( 21.001 5.327 0.941) 21.686 27.445 ( 23.616 -6.912 -6.729) 25.510 27.533 ( 25.680 -7.798 9.020) 28.314 28.423 ( -21.062 5.776 0.261) 21.841 28.483 ( -21.107 7.068 -0.704) 22.270 28.732 ( -21.995 -6.433 -3.655) 23.206 28.796 ( -19.023 -6.941 3.320) 20.520 30.425 ( 9.625 7.076 -1.586) 12.051 30.517 ( 9.847 8.305 3.402) 13.323 30.675 ( 2.126 -2.093 -1.462) 3.322 30.724 ( 1.593 0.098 1.262) 2.035 30.962 ( 7.024 3.147 -1.623) 7.866 31.079 ( 9.688 4.084 2.717) 10.859 31.194 ( 3.731 -6.100 0.858) 7.202 31.324 ( 6.613 -3.994 -1.193) 7.817 31.517 ( -5.186 6.819 -0.092) 8.568 31.625 ( -10.740 4.121 -0.198) 11.505 31.788 ( -7.648 -0.862 2.626) 8.133 31.816 ( -9.020 -2.111 -1.795) 9.436 32.006 ( 5.662 7.006 1.909) 9.208 32.123 ( 1.651 0.461 -2.150) 2.749 32.281 ( 1.975 -4.762 -4.946) 7.144 32.407 ( 3.041 -8.290 9.501) 12.971 32.993 ( 7.476 1.402 3.871) 8.535 33.061 ( 9.058 -1.365 2.517) 9.500 33.191 ( 12.682 0.729 -2.924) 13.035 33.214 ( 12.146 -0.065 -2.272) 12.357 33.613 ( -4.374 0.406 -1.494) 4.640 33.644 ( -3.481 -0.760 0.303) 3.576 33.777 ( -8.014 0.181 0.149) 8.018 33.800 ( -7.913 -0.721 3.276) 8.594 34.883 ( -1.378 1.586 -0.415) 2.141 34.958 ( -1.092 -1.566 -1.569) 2.471 35.194 ( 2.005 0.886 -1.022) 2.419 35.236 ( 1.767 -0.843 -0.320) 1.984 35.593 ( 1.683 4.197 -0.131) 4.524 35.751 ( 3.794 1.151 -0.835) 4.051 35.787 ( 3.086 -3.644 -0.849) 4.850 35.849 ( 4.087 -2.579 -0.208) 4.837 36.255 ( 2.899 0.879 -7.674) 8.251 36.329 ( 1.244 0.708 5.201) 5.394 36.333 ( 4.448 -1.346 -5.923) 7.529 36.374 ( 2.841 -0.125 1.673) 3.300 37.500 ( -4.270 7.388 -12.302) 14.972 37.546 ( -7.552 5.019 13.475) 16.242 38.007 ( -17.142 -5.733 11.672) 21.516 38.074 ( -12.637 -7.912 -10.425) 18.192 ======================= Grid point 58 (29/69) ======================= q-point: ( 0.44 0.25 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 5.786 -0.106 -1.797) 6.059 2.027 ( 6.099 -0.754 -2.512) 6.639 2.108 ( 2.616 -3.437 -2.136) 4.818 2.239 ( -7.052 3.143 -2.551) 8.131 2.369 ( 2.753 2.972 4.141) 5.793 2.462 ( 1.550 -1.183 -2.186) 2.929 2.592 ( -1.060 -2.409 -3.191) 4.137 2.664 ( 0.832 8.849 -3.065) 9.401 2.687 ( 4.153 2.645 -1.191) 5.066 2.742 ( 0.259 -5.048 -2.624) 5.695 2.776 ( -3.807 -5.138 -1.786) 6.640 2.889 ( 1.332 -3.884 -0.335) 4.120 2.944 ( 3.175 6.205 0.304) 6.977 3.015 ( 1.058 2.147 -3.870) 4.551 3.122 ( -1.668 3.971 1.520) 4.567 3.182 ( 0.277 3.014 -1.635) 3.440 3.196 ( 5.007 -1.475 -5.368) 7.488 3.262 ( 2.979 -2.215 -1.115) 3.876 3.364 ( -1.977 -5.308 0.760) 5.716 3.442 ( 0.282 2.749 -7.866) 8.338 3.550 ( 11.249 0.933 -3.367) 11.779 3.561 ( 5.238 -0.244 -1.020) 5.342 3.713 ( -1.828 8.160 -0.549) 8.380 3.775 ( -1.541 5.333 -1.962) 5.888 3.832 ( 1.636 2.558 -7.208) 7.821 3.962 ( 1.112 3.230 -2.077) 3.998 3.982 ( 3.204 -2.015 0.128) 3.787 4.167 ( -0.607 -0.408 -6.842) 6.881 4.218 ( -2.556 5.259 3.636) 6.886 4.242 ( 0.259 1.649 2.237) 2.792 4.258 ( 1.888 3.229 1.858) 4.176 4.313 ( 3.986 1.625 -2.033) 4.760 4.404 ( 1.414 2.034 1.089) 2.706 4.463 ( -0.121 1.258 5.464) 5.608 4.580 ( 0.065 -4.262 6.440) 7.723 4.596 ( 2.072 -7.745 -2.125) 8.294 4.663 ( -1.902 -2.660 -1.910) 3.787 4.732 ( 0.917 3.083 0.342) 3.235 4.794 ( 1.886 -0.146 4.219) 4.624 4.873 ( 2.765 -0.198 1.123) 2.991 4.901 ( 0.182 -2.517 -6.396) 6.876 4.957 ( -2.554 -2.154 2.920) 4.437 5.084 ( -4.540 4.053 0.051) 6.087 5.195 ( -0.924 2.561 -0.723) 2.817 5.274 ( 4.507 1.924 1.708) 5.190 5.380 ( -1.007 3.141 -0.201) 3.305 5.403 ( -0.200 1.066 -0.334) 1.135 5.511 ( -0.704 -0.708 4.029) 4.151 5.533 ( -0.600 1.347 1.176) 1.887 5.607 ( -4.828 -0.614 6.423) 8.059 5.695 ( 1.726 1.313 0.406) 2.206 5.725 ( -3.744 -4.168 6.657) 8.701 5.844 ( 4.807 -3.064 4.335) 7.162 5.889 ( -1.194 -2.743 0.485) 3.031 5.939 ( -0.355 -3.098 2.994) 4.323 6.003 ( -0.444 -4.291 -0.442) 4.336 6.080 ( 0.691 0.124 2.422) 2.522 6.116 ( -2.351 1.197 -0.848) 2.771 6.135 ( 1.266 -1.256 2.419) 3.005 6.285 ( 1.368 -1.277 -1.071) 2.156 6.418 ( -2.019 -4.020 0.698) 4.552 6.477 ( -7.898 -9.052 1.035) 12.058 6.538 ( 2.414 -1.810 -4.297) 5.251 6.632 ( 4.800 -3.327 -1.532) 6.038 6.709 ( -0.025 4.556 -3.554) 5.778 6.799 ( -0.702 -0.158 -1.889) 2.022 6.871 ( 0.268 -1.072 -2.198) 2.460 6.900 ( 5.052 -1.635 -5.687) 7.781 7.084 ( 4.447 4.387 3.295) 7.062 7.095 ( 0.078 2.154 0.947) 2.355 7.162 ( -5.192 0.285 -1.670) 5.461 7.188 ( -7.394 2.246 -0.230) 7.731 7.271 ( 1.879 -1.857 3.066) 4.047 7.300 ( -0.756 -4.258 0.325) 4.337 7.391 ( -1.716 1.964 -0.404) 2.639 7.487 ( -3.121 -2.026 2.272) 4.360 7.751 ( -3.039 4.369 1.810) 5.621 7.926 ( -5.475 6.510 -0.384) 8.515 8.022 ( -3.933 -5.233 2.700) 7.082 8.229 ( -4.705 -7.253 -0.177) 8.647 8.989 ( 1.357 3.720 -2.561) 4.716 9.021 ( 0.982 1.927 -1.656) 2.723 9.107 ( -0.409 0.941 3.843) 3.978 9.232 ( -0.147 -4.388 -0.014) 4.390 9.370 ( 3.473 0.688 -0.511) 3.577 9.421 ( 0.511 0.047 2.451) 2.504 9.435 ( -0.449 -2.591 1.347) 2.955 9.463 ( 1.956 -2.109 1.582) 3.283 9.597 ( 3.139 0.289 0.572) 3.204 9.653 ( 1.293 -2.151 0.103) 2.512 9.696 ( 2.493 -0.900 -0.164) 2.655 9.715 ( -3.609 -0.648 0.297) 3.679 9.753 ( -5.257 -1.002 -0.764) 5.406 9.771 ( -6.648 -1.527 -0.128) 6.823 9.930 ( 0.373 -0.241 -1.219) 1.298 9.973 ( -5.008 -0.679 -1.302) 5.219 10.146 ( 1.715 1.666 -2.690) 3.599 10.204 ( -3.542 1.455 -3.048) 4.894 10.295 ( -0.946 3.978 2.967) 5.052 10.447 ( -2.691 -3.905 -1.266) 4.909 10.553 ( -2.032 6.315 2.370) 7.044 10.701 ( -0.350 3.378 -1.380) 3.666 10.815 ( -1.943 -4.279 1.757) 5.017 10.871 ( -0.663 -3.161 0.556) 3.277 11.743 ( 2.032 0.245 0.076) 2.048 11.795 ( 1.718 0.630 -0.107) 1.833 11.835 ( 2.043 -1.976 -0.147) 2.847 11.841 ( 3.410 -1.585 0.177) 3.764 12.068 ( -0.103 3.450 0.249) 3.460 12.170 ( -1.368 2.041 0.441) 2.496 12.200 ( 0.240 3.629 -1.645) 3.992 12.224 ( -1.211 2.487 -0.874) 2.901 12.330 ( -0.285 -2.808 1.058) 3.014 12.419 ( 1.555 -3.151 1.422) 3.791 12.452 ( 0.173 -5.426 -1.323) 5.588 12.528 ( 3.026 -6.025 -0.453) 6.757 12.737 ( 0.339 2.509 -0.077) 2.533 12.807 ( 2.222 2.225 -0.043) 3.145 12.847 ( -3.291 -1.133 -0.416) 3.505 12.914 ( -1.951 -2.215 -0.212) 2.959 13.495 ( 6.075 8.347 -0.211) 10.326 13.521 ( 3.717 7.948 -0.142) 8.775 13.648 ( -4.616 4.664 0.202) 6.565 13.675 ( -2.711 4.893 -0.445) 5.612 14.174 ( 3.072 2.067 0.505) 3.737 14.271 ( 3.990 -0.551 0.051) 4.028 14.313 ( -0.704 2.213 -0.332) 2.346 14.344 ( 1.758 0.814 -0.208) 1.948 14.471 ( 3.521 4.617 1.391) 5.971 14.545 ( 5.930 3.675 -2.007) 7.260 14.601 ( -7.218 0.731 -0.677) 7.286 14.719 ( -7.057 -0.644 0.535) 7.106 15.204 ( 5.000 -3.660 -0.613) 6.227 15.271 ( 4.035 -1.705 -0.617) 4.424 15.318 ( -5.045 -5.973 0.691) 7.849 15.374 ( -5.615 -5.591 -0.227) 7.927 15.565 ( 3.540 -0.721 -0.886) 3.719 15.592 ( 0.387 -1.319 -0.954) 1.673 15.629 ( 3.818 1.550 0.348) 4.135 15.680 ( -0.691 -0.899 0.033) 1.134 16.021 ( 3.548 0.980 -0.881) 3.785 16.059 ( 3.938 -0.364 -0.527) 3.990 16.118 ( 2.899 0.866 0.510) 3.069 16.156 ( 0.817 -0.448 1.710) 1.948 16.594 ( 0.075 -0.137 0.373) 0.404 16.616 ( -0.978 -0.901 1.826) 2.259 16.701 ( -3.323 0.780 0.370) 3.434 16.731 ( 0.992 -0.207 -0.535) 1.146 17.341 ( 0.351 1.359 -0.759) 1.596 17.382 ( 0.022 0.162 0.927) 0.941 17.391 ( -0.647 -0.209 -0.889) 1.120 17.408 ( 2.250 -0.939 -0.252) 2.451 19.991 ( 6.686 -0.125 -2.270) 7.062 20.039 ( 5.074 -2.059 -0.019) 5.476 20.143 ( 0.250 2.100 0.025) 2.115 20.228 ( -1.008 -1.227 0.327) 1.622 20.306 ( -4.406 1.330 4.467) 6.414 20.374 ( -4.549 -1.266 2.778) 5.478 20.685 ( -0.728 1.006 0.106) 1.246 20.736 ( -0.503 -1.105 -0.143) 1.223 22.280 ( 4.564 2.743 0.200) 5.329 22.292 ( 5.746 2.676 -0.777) 6.386 22.425 ( 4.809 -2.889 -0.042) 5.610 22.443 ( 5.796 -2.639 0.107) 6.370 22.679 ( -3.565 1.054 -0.364) 3.736 22.771 ( -6.452 -1.632 -1.937) 6.932 22.847 ( -5.689 -0.411 2.077) 6.071 22.897 ( -6.420 -1.605 0.463) 6.634 27.432 ( 14.883 4.706 -1.339) 15.667 27.514 ( 12.099 7.617 1.697) 14.397 27.704 ( 16.751 -5.946 -3.276) 18.074 27.940 ( 7.103 -10.129 4.228) 13.073 28.139 ( -11.627 4.256 0.040) 12.381 28.206 ( -12.741 6.817 0.312) 14.453 28.394 ( -10.302 -6.292 0.663) 12.090 28.580 ( -13.805 -9.004 4.812) 17.170 30.524 ( 4.804 4.752 -0.962) 6.826 30.651 ( -0.297 3.143 -2.324) 3.920 30.677 ( 4.258 1.252 2.005) 4.871 30.745 ( -0.890 1.457 1.121) 2.042 31.073 ( 8.355 2.436 0.177) 8.705 31.209 ( -0.990 -1.769 0.809) 2.183 31.245 ( 3.799 2.337 1.025) 4.577 31.363 ( -4.873 -2.025 -1.204) 5.412 31.458 ( 1.846 0.805 -0.356) 2.045 31.514 ( -0.632 0.346 1.949) 2.078 31.696 ( -7.459 1.058 3.025) 8.118 31.729 ( -2.326 -0.430 2.379) 3.355 32.085 ( 0.476 6.861 1.833) 7.118 32.130 ( 2.495 4.207 -1.194) 5.035 32.372 ( 6.023 -4.948 8.474) 11.514 32.533 ( -3.012 -8.037 11.514) 14.361 33.077 ( 0.311 1.894 -0.273) 1.939 33.147 ( 1.716 -1.006 -2.883) 3.502 33.355 ( 9.032 -0.154 -1.562) 9.167 33.372 ( 9.064 -0.620 0.523) 9.100 33.535 ( -0.732 1.377 -1.789) 2.373 33.602 ( -2.187 -1.539 0.708) 2.766 33.690 ( -5.950 0.633 3.847) 7.114 33.717 ( -7.607 -0.595 4.100) 8.662 34.873 ( 0.096 1.403 0.691) 1.567 34.942 ( 0.626 -1.480 -0.523) 1.690 35.189 ( 0.748 0.882 -3.380) 3.573 35.234 ( 0.426 -0.974 -3.098) 3.275 35.639 ( 1.527 3.992 3.665) 5.631 35.785 ( 1.685 1.635 -0.711) 2.453 35.828 ( 1.875 -4.033 1.195) 4.605 35.900 ( 1.964 -2.890 1.021) 3.640 36.216 ( 4.871 1.720 -9.979) 11.237 36.304 ( -5.001 2.079 -4.162) 6.830 36.319 ( 7.525 -2.049 -11.631) 14.003 36.378 ( -3.806 -1.156 -3.496) 5.296 37.424 ( 6.602 6.838 -2.795) 9.908 37.517 ( -10.166 3.470 5.822) 12.218 37.862 ( -14.535 -4.264 5.829) 16.230 37.894 ( 2.345 -6.169 -4.650) 8.073 ======================= Grid point 59 (30/69) ======================= q-point: (-0.44 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -11.331 5.108 -3.108) 12.812 2.045 ( -6.666 6.697 -4.729) 10.566 2.094 ( 3.507 -0.751 -1.976) 4.095 2.215 ( 9.144 3.277 -0.330) 9.719 2.231 ( -14.904 -2.062 -3.495) 15.447 2.416 ( 4.330 -6.523 -2.460) 8.207 2.465 ( -4.039 2.163 -8.202) 9.395 2.626 ( -9.726 -3.487 -4.682) 11.343 2.674 ( 2.091 -2.660 -3.136) 4.613 2.708 ( 0.182 -0.241 -1.570) 1.598 2.745 ( -5.653 -3.054 6.082) 8.848 2.913 ( -2.282 0.659 -1.066) 2.603 2.984 ( 3.310 2.431 -0.957) 4.217 3.041 ( -8.162 1.115 -5.167) 9.724 3.081 ( 7.852 7.729 1.440) 11.112 3.156 ( 2.618 2.774 -4.674) 6.032 3.168 ( 2.211 -0.897 -4.044) 4.695 3.241 ( -4.420 -1.750 1.386) 4.952 3.340 ( -1.910 -4.806 -0.752) 5.226 3.422 ( -1.282 3.328 0.785) 3.652 3.533 ( -6.136 0.429 -6.610) 9.029 3.574 ( -3.805 -1.582 -1.742) 4.474 3.667 ( -2.381 -0.860 -4.040) 4.768 3.720 ( 1.264 4.119 -0.177) 4.312 3.805 ( 2.921 -0.058 -6.004) 6.677 3.902 ( -4.013 5.042 3.887) 7.525 3.963 ( -3.628 2.408 -8.467) 9.521 4.053 ( -2.992 2.918 -2.539) 4.891 4.154 ( -3.555 6.427 -0.497) 7.361 4.214 ( -1.443 1.360 -5.010) 5.388 4.346 ( -4.510 4.025 0.692) 6.084 4.368 ( 0.588 2.611 8.900) 9.294 4.404 ( 2.670 3.399 -0.292) 4.332 4.518 ( -0.511 1.972 2.071) 2.905 4.574 ( 0.590 -3.902 3.698) 5.409 4.643 ( 2.555 -4.038 3.826) 6.121 4.689 ( -3.547 -2.350 -2.239) 4.808 4.747 ( 4.887 -2.442 -1.277) 5.610 4.811 ( -1.405 -2.406 1.820) 3.328 4.883 ( 2.207 -0.849 -7.359) 7.730 4.941 ( 0.821 2.859 0.222) 2.983 4.980 ( 2.331 -1.350 -0.100) 2.695 5.052 ( 4.625 0.231 4.779) 6.654 5.167 ( 0.387 2.536 -0.064) 2.567 5.281 ( -3.985 5.878 0.710) 7.137 5.326 ( -5.054 0.214 -2.155) 5.498 5.445 ( 0.631 -7.256 2.746) 7.784 5.479 ( -3.436 2.906 3.918) 5.967 5.573 ( 2.344 -1.548 3.024) 4.128 5.618 ( -0.725 -1.818 8.867) 9.081 5.738 ( -0.892 2.531 2.553) 3.704 5.763 ( -1.230 1.140 1.352) 2.154 5.868 ( -1.883 -0.643 5.181) 5.550 5.925 ( -1.836 -4.561 1.426) 5.119 5.995 ( -3.247 -4.988 2.740) 6.552 6.010 ( 6.007 -2.396 2.697) 7.007 6.110 ( 2.837 2.387 0.292) 3.719 6.139 ( 1.037 -0.576 3.378) 3.580 6.211 ( 2.495 -0.751 3.131) 4.073 6.305 ( 0.299 -4.689 0.868) 4.778 6.393 ( 0.702 -6.696 -2.017) 7.028 6.431 ( 2.230 -4.672 1.256) 5.328 6.577 ( 3.348 0.789 -2.960) 4.538 6.637 ( 1.540 -0.066 -2.439) 2.885 6.721 ( 2.696 -3.177 -1.727) 4.510 6.745 ( 0.445 -1.586 -3.828) 4.167 6.784 ( -0.902 0.459 -6.036) 6.120 6.837 ( -4.973 -0.005 -7.248) 8.790 7.039 ( -5.540 4.269 2.353) 7.379 7.081 ( -9.397 1.518 0.455) 9.530 7.169 ( 5.331 2.718 1.729) 6.229 7.209 ( 5.054 2.062 2.248) 5.903 7.267 ( 1.766 -2.276 -1.497) 3.246 7.368 ( 3.854 0.133 -1.640) 4.191 7.406 ( 0.118 -2.574 3.058) 3.999 7.443 ( -1.840 -0.672 1.788) 2.652 7.831 ( 7.725 3.375 3.877) 9.279 7.949 ( 7.478 5.841 -0.411) 9.498 8.087 ( 6.019 -5.827 4.423) 9.474 8.224 ( 4.439 -6.333 -1.051) 7.805 8.977 ( 0.742 4.482 -1.622) 4.823 9.002 ( -0.403 3.269 -2.325) 4.031 9.129 ( -1.943 0.157 3.442) 3.956 9.224 ( -0.575 -3.612 -0.316) 3.671 9.406 ( -3.942 0.362 1.679) 4.300 9.431 ( -1.437 -2.349 1.549) 3.159 9.449 ( 2.073 -0.882 1.003) 2.466 9.470 ( -2.419 -0.838 2.843) 3.826 9.613 ( -4.001 -1.024 0.509) 4.161 9.617 ( -3.388 -2.330 -1.760) 4.473 9.662 ( -0.504 -0.904 -0.611) 1.202 9.715 ( 0.570 -2.081 -0.782) 2.295 9.761 ( 4.811 0.568 1.154) 4.980 9.788 ( 8.403 -0.742 0.893) 8.483 9.923 ( 2.283 -1.410 -1.220) 2.948 9.972 ( 4.548 -1.522 -1.522) 5.031 10.100 ( -3.653 4.990 -3.907) 7.315 10.184 ( 5.028 1.469 -1.752) 5.523 10.349 ( 3.493 -0.590 1.657) 3.911 10.404 ( 0.991 -3.332 -2.015) 4.018 10.561 ( -0.118 6.246 2.838) 6.862 10.699 ( 2.194 5.043 -1.169) 5.623 10.828 ( 0.215 -4.465 1.628) 4.758 10.891 ( 2.243 -2.940 0.900) 3.806 11.753 ( -1.129 0.899 0.531) 1.538 11.782 ( -2.619 0.554 -0.612) 2.746 11.835 ( -2.875 -1.760 -0.030) 3.371 11.844 ( -3.028 -2.518 0.092) 3.939 12.082 ( 0.984 2.604 0.892) 2.923 12.146 ( -1.562 0.586 -1.119) 2.009 12.178 ( 0.075 4.585 -1.118) 4.720 12.220 ( 1.249 3.012 -0.540) 3.305 12.340 ( 0.209 -1.790 1.096) 2.109 12.413 ( -2.067 -5.452 -1.325) 5.980 12.451 ( -0.085 -4.371 1.096) 4.507 12.528 ( -1.650 -5.545 -0.793) 5.839 12.755 ( -0.486 2.980 0.492) 3.059 12.794 ( -1.305 3.036 -0.779) 3.395 12.870 ( 4.728 -1.952 0.886) 5.191 12.889 ( 0.342 -2.458 -1.281) 2.792 13.506 ( -5.401 7.909 0.183) 9.579 13.512 ( -4.214 8.332 -0.493) 9.350 13.640 ( 3.825 5.183 0.005) 6.442 13.671 ( 3.241 4.614 -0.486) 5.659 14.191 ( -2.196 1.537 1.402) 3.025 14.260 ( -4.922 0.158 -1.012) 5.028 14.317 ( 1.303 2.261 0.159) 2.615 14.338 ( -1.151 1.798 -0.522) 2.198 14.441 ( -6.669 4.315 0.124) 7.944 14.585 ( -4.576 1.236 -0.076) 4.741 14.634 ( 8.005 1.180 -1.321) 8.198 14.659 ( 6.809 1.237 0.165) 6.923 15.208 ( -6.857 -3.673 -0.604) 7.802 15.278 ( 5.013 -6.639 -0.060) 8.319 15.295 ( -3.503 -2.916 -0.297) 4.567 15.369 ( 6.303 -4.009 -0.118) 7.471 15.546 ( -3.924 0.191 -1.127) 4.087 15.595 ( 0.358 -2.708 -1.049) 2.926 15.628 ( -4.320 0.942 0.262) 4.429 15.675 ( 0.670 -0.549 -0.015) 0.867 16.039 ( -2.394 1.392 -0.081) 2.770 16.058 ( -1.264 1.584 -0.745) 2.159 16.132 ( -4.827 -0.416 0.215) 4.849 16.178 ( 2.386 -2.026 2.432) 3.964 16.610 ( -1.818 0.144 1.638) 2.451 16.633 ( 3.076 -0.742 1.901) 3.692 16.669 ( -0.049 1.336 -0.803) 1.559 16.738 ( 0.472 -1.511 -0.428) 1.640 17.327 ( -0.831 0.972 -0.572) 1.401 17.357 ( -1.124 -0.353 -1.297) 1.752 17.395 ( -0.336 0.886 0.826) 1.257 17.439 ( 1.263 -0.935 -0.046) 1.572 19.990 ( -6.071 1.007 -1.529) 6.341 20.052 ( 0.365 -1.187 -1.142) 1.688 20.179 ( 1.257 -0.475 0.796) 1.561 20.205 ( 0.529 -0.735 0.047) 0.907 20.296 ( -3.290 1.841 4.368) 5.770 20.370 ( -0.343 -1.366 3.058) 3.366 20.703 ( 2.368 1.150 0.653) 2.712 20.758 ( 2.659 -1.120 0.091) 2.887 22.270 ( -4.814 3.049 -0.301) 5.706 22.302 ( -3.696 2.919 -0.318) 4.720 22.433 ( -6.625 -3.786 0.370) 7.639 22.460 ( -5.334 -3.430 0.320) 6.350 22.686 ( 6.271 1.944 0.012) 6.565 22.735 ( 6.999 0.237 -2.540) 7.450 22.854 ( 3.504 -1.107 1.771) 4.079 22.899 ( 5.292 -2.600 0.494) 5.917 27.429 ( -17.526 5.294 -1.138) 18.343 27.522 ( -7.266 6.834 1.556) 10.096 27.700 ( -24.292 -5.896 -3.454) 25.235 27.894 ( 4.155 -7.848 3.518) 9.552 28.140 ( 10.207 6.312 0.159) 12.002 28.229 ( 15.997 4.322 -0.073) 16.570 28.519 ( 2.085 -9.456 2.751) 10.066 28.581 ( 16.424 -9.393 5.850) 19.804 30.541 ( -3.427 3.825 -0.153) 5.138 30.566 ( -4.833 3.798 -1.634) 6.360 30.714 ( -3.322 1.690 0.519) 3.763 30.750 ( 1.315 0.357 0.626) 1.499 31.137 ( -7.465 1.169 1.329) 7.672 31.171 ( -9.348 3.523 -1.084) 10.049 31.213 ( 6.075 -1.825 2.513) 6.822 31.337 ( 3.738 -2.818 -2.355) 5.240 31.494 ( -0.143 0.088 0.422) 0.454 31.589 ( 6.356 -2.636 -0.668) 6.913 31.671 ( -1.266 3.457 6.568) 7.529 31.789 ( 5.465 0.083 2.376) 5.959 32.079 ( -4.540 8.036 3.290) 9.799 32.176 ( 1.394 7.899 4.892) 9.395 32.522 ( -8.496 -6.219 8.727) 13.675 32.652 ( 8.204 -6.429 13.786) 17.283 33.024 ( -4.364 0.767 -1.947) 4.840 33.061 ( -5.914 -0.640 -4.698) 7.580 33.389 ( -2.730 0.016 -1.707) 3.219 33.408 ( -3.017 -0.656 -1.466) 3.418 33.562 ( -3.293 0.123 0.909) 3.418 33.569 ( 0.543 -0.050 3.712) 3.752 33.741 ( 6.044 -0.109 3.838) 7.161 33.747 ( 8.351 -0.320 3.829) 9.192 34.898 ( 0.480 1.194 2.362) 2.690 34.960 ( 1.033 -1.452 0.872) 1.984 35.149 ( -0.265 0.712 -4.171) 4.240 35.182 ( -1.215 -0.694 -4.731) 4.933 35.716 ( 1.146 2.904 5.655) 6.459 35.790 ( -0.329 2.427 0.154) 2.454 35.863 ( 0.383 -3.971 1.330) 4.205 35.939 ( 0.173 -2.710 3.147) 4.156 36.101 ( -5.562 2.056 -10.113) 11.724 36.183 ( -2.851 -0.456 -10.253) 10.651 36.218 ( 0.727 1.017 -9.962) 10.040 36.307 ( 8.260 -2.008 -13.601) 16.039 37.352 ( -14.688 4.547 -0.387) 15.380 37.559 ( 0.585 -1.696 2.837) 3.356 37.730 ( 0.514 3.677 0.860) 3.811 38.032 ( 15.656 -6.642 1.142) 17.045 ======================= Grid point 60 (31/69) ======================= q-point: (-0.33 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( -23.673 8.843 -6.766) 26.160 1.794 ( -18.312 22.995 -4.611) 29.755 1.944 ( -14.062 -8.357 -0.984) 16.387 2.162 ( 1.947 0.133 -3.320) 3.851 2.255 ( -8.459 -0.440 -3.757) 9.266 2.344 ( -13.604 -0.469 -6.608) 15.132 2.346 ( 3.506 0.870 0.820) 3.705 2.478 ( -6.356 -7.639 -7.045) 12.181 2.572 ( -6.046 0.021 -0.796) 6.098 2.720 ( -5.155 -4.793 -1.698) 7.240 2.761 ( -1.180 1.458 -1.136) 2.193 2.811 ( -1.126 0.409 8.390) 8.475 2.874 ( 0.104 -0.380 -6.969) 6.980 2.972 ( -3.669 -4.974 -4.924) 7.902 3.060 ( -1.323 8.793 -0.532) 8.908 3.097 ( -8.067 4.197 -3.005) 9.577 3.158 ( 1.146 -5.148 -1.280) 5.427 3.225 ( -1.969 4.373 -10.133) 11.211 3.297 ( -3.876 -2.114 2.353) 5.003 3.423 ( 0.945 8.327 7.563) 11.288 3.436 ( 9.270 4.411 4.047) 11.035 3.577 ( -9.204 2.029 -4.517) 10.451 3.617 ( -0.349 -1.931 0.921) 2.168 3.700 ( -5.796 -5.096 -1.285) 7.824 3.763 ( 8.565 -6.297 0.146) 10.632 3.834 ( 1.606 0.317 1.913) 2.518 3.921 ( -5.718 -0.915 0.029) 5.791 4.006 ( -2.534 -0.459 -3.905) 4.678 4.038 ( -10.507 2.975 0.532) 10.933 4.139 ( 0.242 8.645 0.091) 8.649 4.244 ( -5.228 4.391 -0.715) 6.865 4.428 ( -4.442 1.173 3.677) 5.884 4.455 ( -0.679 2.109 3.377) 4.039 4.529 ( -6.463 1.938 2.820) 7.312 4.562 ( -5.187 -7.847 -0.201) 9.409 4.618 ( 1.588 1.826 -0.430) 2.458 4.675 ( -6.484 -3.938 0.374) 7.595 4.745 ( 0.181 9.576 -1.032) 9.634 4.863 ( 7.552 -2.216 -6.443) 10.171 4.877 ( 1.523 -4.534 -0.906) 4.868 4.931 ( 0.698 -1.353 -5.967) 6.158 5.007 ( 8.161 1.334 2.144) 8.543 5.105 ( -2.696 2.329 -2.337) 4.260 5.219 ( 0.011 1.366 -0.622) 1.501 5.228 ( -0.493 -1.801 4.792) 5.143 5.320 ( 4.606 0.190 4.103) 6.172 5.460 ( -3.845 -2.805 3.847) 6.120 5.515 ( 1.089 -2.130 5.813) 6.286 5.614 ( -1.590 -2.878 4.931) 5.927 5.694 ( -5.305 -3.914 -1.221) 6.705 5.742 ( 4.561 3.705 1.853) 6.162 5.821 ( -0.145 4.538 7.196) 8.509 5.901 ( 2.989 3.491 1.665) 4.888 5.921 ( -1.173 -3.600 3.505) 5.160 5.963 ( -0.191 -4.616 0.164) 4.623 6.112 ( 1.930 -2.733 2.125) 3.963 6.162 ( -0.139 1.906 2.531) 3.172 6.173 ( -0.891 -5.598 -0.198) 5.671 6.275 ( 1.899 2.900 4.347) 5.559 6.317 ( 4.712 -2.700 -3.540) 6.483 6.409 ( 1.552 -2.203 -2.953) 3.998 6.479 ( -0.938 -3.862 1.464) 4.236 6.539 ( -3.831 -2.015 -5.353) 6.884 6.591 ( -0.550 -2.927 0.753) 3.072 6.673 ( -0.908 3.195 -2.365) 4.077 6.710 ( 1.024 0.149 -3.457) 3.608 6.792 ( 8.114 -0.243 -4.364) 9.216 6.821 ( 4.285 -1.995 -0.173) 4.730 6.968 ( -5.040 2.769 1.762) 6.014 7.026 ( -0.344 1.086 3.005) 3.214 7.209 ( 1.186 1.387 -1.886) 2.624 7.259 ( 2.922 -0.994 -1.233) 3.324 7.325 ( -3.821 -0.251 -1.174) 4.005 7.338 ( 3.508 -1.589 -0.137) 3.853 7.416 ( 3.246 4.883 -1.411) 6.031 7.534 ( 4.520 -2.658 1.355) 5.416 8.042 ( 14.152 1.841 1.689) 14.371 8.095 ( 12.906 4.432 -1.499) 13.728 8.279 ( 12.349 -6.919 2.895) 14.448 8.328 ( 11.328 -4.814 -2.127) 12.491 8.964 ( -1.012 4.603 -2.207) 5.204 8.986 ( 1.671 3.735 -0.052) 4.093 9.138 ( -1.815 -0.081 3.976) 4.371 9.205 ( -1.613 -1.850 -0.143) 2.459 9.352 ( -4.679 0.098 1.703) 4.980 9.399 ( -3.598 -2.239 0.943) 4.342 9.430 ( -2.875 -0.570 0.052) 2.931 9.498 ( -5.029 -1.988 1.080) 5.514 9.514 ( -0.682 -1.402 -0.200) 1.572 9.547 ( -5.927 -1.695 0.544) 6.189 9.676 ( 1.175 -2.082 -0.381) 2.421 9.739 ( 0.481 -3.196 0.643) 3.295 9.878 ( 4.887 0.777 1.490) 5.168 9.935 ( 4.798 -1.692 2.128) 5.515 9.966 ( 7.746 3.630 -3.624) 9.291 10.020 ( 6.981 0.026 -3.907) 8.000 10.085 ( 9.184 1.964 -1.481) 9.508 10.258 ( 7.410 -1.752 -1.448) 7.750 10.405 ( 4.928 -0.537 -0.180) 4.961 10.486 ( 7.520 -0.920 1.267) 7.681 10.619 ( 3.479 4.431 2.563) 6.189 10.743 ( 4.593 5.362 -0.434) 7.074 10.853 ( 1.890 -4.730 0.328) 5.104 10.950 ( 4.202 -2.914 0.262) 5.120 11.698 ( -6.941 -0.941 -0.676) 7.037 11.721 ( -5.712 -0.220 1.125) 5.826 11.744 ( -6.932 -1.457 -0.572) 7.106 11.758 ( -7.813 -0.626 0.164) 7.840 12.082 ( -3.161 1.293 -0.692) 3.484 12.127 ( 1.533 1.624 0.689) 2.337 12.192 ( 2.471 5.033 0.291) 5.614 12.239 ( 1.666 2.706 -0.585) 3.231 12.359 ( -1.715 -3.360 0.163) 3.775 12.373 ( 1.214 -2.877 0.083) 3.124 12.452 ( -1.243 -4.093 0.262) 4.285 12.499 ( -0.293 -3.817 0.083) 3.829 12.698 ( -4.309 4.983 -0.730) 6.628 12.794 ( -0.121 4.342 -0.309) 4.354 12.895 ( 1.724 -3.828 -0.940) 4.303 12.947 ( 3.221 -3.213 0.483) 4.575 13.411 ( -6.226 8.704 0.468) 10.712 13.420 ( -5.687 9.093 -0.797) 10.754 13.693 ( 1.670 -1.609 0.299) 2.339 13.728 ( 3.360 -0.885 -0.183) 3.479 14.137 ( -7.748 4.696 -0.926) 9.107 14.158 ( -4.339 1.015 1.800) 4.806 14.280 ( -3.903 -2.761 -0.183) 4.784 14.313 ( -1.116 -1.366 -0.244) 1.781 14.387 ( -1.857 9.043 -0.525) 9.247 14.542 ( 1.043 9.486 0.043) 9.543 14.723 ( 5.481 2.479 -1.664) 6.241 14.788 ( 5.389 -1.031 1.194) 5.615 15.093 ( -7.313 -0.105 -0.055) 7.314 15.244 ( -2.709 1.040 -1.214) 3.145 15.334 ( -0.015 -6.432 1.038) 6.515 15.408 ( -4.867 -2.245 -0.281) 5.367 15.495 ( 0.359 -1.647 -0.663) 1.812 15.547 ( -0.564 -5.452 -1.291) 5.631 15.597 ( -0.170 -0.718 0.424) 0.851 15.654 ( -3.697 -1.615 0.357) 4.051 15.935 ( -7.163 1.607 -1.498) 7.493 16.002 ( -7.834 -1.104 -1.085) 7.985 16.093 ( 1.711 2.398 1.827) 3.466 16.230 ( 0.460 -2.933 2.547) 3.911 16.609 ( -0.386 1.982 1.132) 2.315 16.642 ( -1.164 0.711 -1.704) 2.183 16.719 ( -1.249 -1.636 1.004) 2.290 16.757 ( 5.173 -3.588 3.347) 7.130 17.310 ( -0.731 0.896 0.009) 1.157 17.335 ( -0.166 -0.199 -0.745) 0.789 17.387 ( -1.299 1.270 0.241) 1.833 17.443 ( -0.248 -1.063 -0.517) 1.208 19.869 ( -6.675 2.450 -0.877) 7.164 20.012 ( -2.729 -3.410 -0.625) 4.412 20.149 ( -5.142 1.163 0.526) 5.298 20.207 ( -3.782 -1.396 2.885) 4.957 20.346 ( 3.907 2.251 3.306) 5.591 20.433 ( 4.291 -1.451 1.567) 4.793 20.759 ( 3.396 0.750 0.525) 3.517 20.801 ( 3.087 -0.962 -0.906) 3.358 22.161 ( -7.655 2.975 -1.485) 8.346 22.190 ( -8.863 2.762 -1.101) 9.349 22.308 ( -7.844 -2.266 0.509) 8.181 22.330 ( -9.310 -2.356 0.240) 9.606 22.828 ( 9.786 1.419 0.571) 9.905 22.865 ( 11.291 0.942 -2.107) 11.525 22.969 ( 7.691 -2.348 2.035) 8.295 23.019 ( 8.832 -4.655 -0.142) 9.984 27.106 ( -20.272 3.168 -0.744) 20.532 27.268 ( -25.288 -3.273 -1.365) 25.535 27.316 ( -19.670 7.518 1.167) 21.090 27.900 ( -11.943 -19.641 8.199) 24.405 28.409 ( 21.434 6.423 0.421) 22.380 28.526 ( 20.269 5.755 -0.014) 21.070 28.693 ( 16.798 -6.754 -1.010) 18.133 28.890 ( 17.478 -8.796 1.988) 19.667 30.390 ( -11.970 5.684 -0.943) 13.284 30.503 ( -5.447 4.926 1.210) 7.443 30.647 ( -5.409 1.686 -0.139) 5.668 30.752 ( -1.328 -1.797 0.119) 2.238 31.006 ( -8.155 5.321 -1.067) 9.796 31.054 ( -6.665 2.609 1.993) 7.429 31.273 ( -4.422 -6.683 3.067) 8.581 31.339 ( -1.395 -7.136 -1.144) 7.361 31.518 ( 5.377 4.041 -0.358) 6.736 31.694 ( 8.370 -0.550 -0.087) 8.388 31.767 ( 5.457 1.694 2.065) 6.076 31.888 ( 4.235 -1.029 -0.820) 4.435 32.046 ( -2.899 9.432 3.546) 10.485 32.294 ( -0.069 5.731 10.297) 11.784 32.450 ( -6.224 6.340 7.701) 11.758 32.870 ( -6.378 -3.064 1.229) 7.181 32.906 ( -8.766 0.255 -0.867) 8.813 32.967 ( 2.925 -3.094 6.524) 7.790 33.267 ( -9.959 0.636 -0.214) 9.982 33.319 ( -3.326 -1.300 -0.668) 3.634 33.537 ( 1.861 2.906 -1.060) 3.610 33.721 ( 9.826 -4.622 9.846) 14.658 33.915 ( 9.582 0.587 3.626) 10.262 33.949 ( 10.841 -0.866 3.177) 11.330 34.931 ( -0.433 0.846 3.052) 3.197 34.981 ( -0.256 -1.349 1.457) 2.002 35.091 ( -0.643 0.269 -5.089) 5.136 35.098 ( -1.879 0.101 -5.435) 5.752 35.747 ( -2.030 1.533 0.219) 2.553 35.827 ( 0.021 2.731 6.775) 7.305 35.864 ( -1.337 -3.751 0.421) 4.005 35.897 ( -6.334 0.195 -5.156) 8.169 35.984 ( -3.671 0.241 -2.908) 4.689 36.007 ( -1.733 -1.328 0.481) 2.236 36.150 ( 4.954 1.550 -15.034) 15.905 36.256 ( 7.751 -2.204 -18.225) 19.927 37.079 ( -17.077 4.863 -2.732) 17.965 37.390 ( -14.096 -9.042 -2.979) 17.010 37.957 ( 16.352 9.563 3.466) 19.257 38.330 ( 19.014 -6.800 1.646) 20.261 ======================= Grid point 61 (32/69) ======================= q-point: (-0.22 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.054 ( -25.905 14.399 0.749) 29.648 1.388 ( -27.010 24.279 -2.886) 36.433 1.782 ( -9.259 -13.234 1.025) 16.184 1.956 ( -31.332 13.949 0.520) 34.301 1.986 ( -10.815 -5.056 -1.686) 12.057 2.135 ( -13.195 3.705 1.175) 13.755 2.259 ( -4.001 -4.743 2.217) 6.589 2.433 ( -4.518 1.717 -0.138) 4.836 2.516 ( 7.011 0.186 4.291) 8.222 2.602 ( -1.671 -1.334 -1.281) 2.493 2.703 ( -1.574 5.767 -8.783) 10.624 2.821 ( 1.818 7.564 -0.498) 7.795 2.877 ( 1.369 -0.184 -6.163) 6.316 2.925 ( -5.353 -0.122 -0.937) 5.435 3.026 ( 6.856 1.418 7.929) 10.577 3.104 ( 5.805 -0.859 -2.217) 6.273 3.163 ( -0.035 -6.087 -0.946) 6.160 3.249 ( 5.794 4.639 -3.020) 8.013 3.294 ( -8.541 5.832 0.370) 10.348 3.341 ( 1.222 -3.810 -3.541) 5.343 3.457 ( -4.797 6.548 6.755) 10.560 3.597 ( 3.831 -0.452 -0.340) 3.872 3.640 ( 2.367 -1.889 0.258) 3.039 3.676 ( 2.556 -9.373 -0.609) 9.734 3.734 ( -11.636 -3.661 1.648) 12.309 3.822 ( -5.358 -1.784 -0.166) 5.650 3.901 ( -2.130 -4.794 -2.793) 5.943 3.916 ( -2.073 0.132 0.487) 2.134 3.995 ( 2.735 -2.475 2.914) 4.701 4.117 ( -7.851 5.222 -0.028) 9.429 4.152 ( -6.312 4.169 3.577) 8.368 4.350 ( -9.395 4.041 -4.082) 11.012 4.388 ( -6.233 1.241 3.432) 7.223 4.453 ( -7.193 -3.268 4.521) 9.103 4.484 ( -3.926 -2.591 1.765) 5.025 4.555 ( -8.439 0.378 1.634) 8.604 4.680 ( 3.553 1.337 1.542) 4.098 4.721 ( -1.681 8.895 -0.052) 9.053 4.820 ( 0.028 -4.295 -5.360) 6.868 4.880 ( 2.465 -4.569 -3.473) 6.246 4.926 ( 3.339 -5.614 -6.250) 9.040 5.067 ( 3.096 -6.314 -0.443) 7.046 5.150 ( -0.864 5.331 0.397) 5.415 5.252 ( 7.458 2.036 4.573) 8.982 5.283 ( 1.545 1.285 0.104) 2.012 5.410 ( 1.812 -3.396 -1.602) 4.169 5.461 ( 0.280 -0.722 0.416) 0.879 5.570 ( -2.894 0.359 4.237) 5.144 5.628 ( 1.116 -2.074 -2.532) 3.459 5.655 ( -0.689 -1.892 5.532) 5.887 5.770 ( -1.477 5.064 -0.571) 5.306 5.825 ( -3.120 2.440 3.033) 4.989 5.909 ( -1.798 -1.824 -0.719) 2.660 5.976 ( 0.423 1.414 4.672) 4.900 6.014 ( 2.339 -2.243 -4.354) 5.428 6.107 ( -4.363 -5.849 0.777) 7.338 6.156 ( -0.095 -1.524 -0.268) 1.550 6.217 ( 4.196 -1.908 4.933) 6.751 6.288 ( 1.082 -2.278 -5.053) 5.648 6.325 ( 0.016 5.072 -4.192) 6.580 6.385 ( -1.037 -1.731 0.491) 2.077 6.429 ( -2.486 -1.385 5.196) 5.925 6.501 ( 0.114 -2.366 0.233) 2.380 6.561 ( -1.675 -2.302 -2.016) 3.488 6.697 ( 1.904 2.151 0.168) 2.877 6.787 ( 10.528 3.476 -6.660) 12.933 6.845 ( 5.014 0.984 1.309) 5.274 6.877 ( 2.478 -0.550 1.733) 3.074 6.960 ( -0.705 4.180 3.283) 5.361 7.089 ( 3.178 -0.122 1.174) 3.390 7.209 ( 1.330 -0.448 -2.411) 2.789 7.234 ( -4.714 1.039 0.261) 4.834 7.307 ( 6.431 -0.982 -2.432) 6.946 7.358 ( 1.879 -0.607 -1.979) 2.796 7.448 ( 2.383 4.774 -0.799) 5.396 7.584 ( 1.491 -2.293 -0.228) 2.745 8.261 ( 15.736 3.344 -2.915) 16.349 8.348 ( 18.167 1.193 1.314) 18.253 8.500 ( 15.557 -5.458 -1.732) 16.577 8.530 ( 14.399 -5.900 0.642) 15.574 8.927 ( -0.729 5.361 -1.709) 5.674 9.017 ( 1.596 1.723 0.388) 2.381 9.161 ( -1.191 -1.285 3.158) 3.612 9.172 ( -2.935 -0.018 1.082) 3.128 9.305 ( -3.840 0.044 1.664) 4.185 9.334 ( -3.464 -0.598 -2.380) 4.245 9.391 ( -1.889 -1.956 0.267) 2.732 9.427 ( -6.429 -2.320 0.926) 6.898 9.464 ( -3.678 -0.769 0.580) 3.803 9.496 ( -3.265 -1.903 0.871) 3.878 9.660 ( -4.411 -1.085 0.406) 4.560 9.713 ( -1.460 -2.514 -1.981) 3.518 9.858 ( -2.753 2.066 0.029) 3.442 10.023 ( 3.459 -6.202 -0.390) 7.112 10.102 ( 11.930 4.272 0.083) 12.672 10.180 ( 12.198 1.653 0.017) 12.309 10.244 ( 11.745 2.432 -1.425) 12.078 10.404 ( 12.069 -1.381 -0.030) 12.148 10.512 ( 8.339 0.569 0.350) 8.366 10.618 ( 7.278 -0.912 0.840) 7.382 10.711 ( 5.325 2.800 0.458) 6.033 10.831 ( 7.414 3.837 -0.157) 8.350 10.903 ( 3.971 -3.856 0.221) 5.539 11.025 ( 5.610 -3.048 -0.237) 6.389 11.551 ( -11.077 -1.081 0.193) 11.132 11.566 ( -12.580 -0.468 -0.618) 12.604 11.627 ( -7.241 -3.116 -0.312) 7.890 11.665 ( -6.091 -2.417 1.020) 6.632 12.020 ( -4.099 2.846 0.427) 5.008 12.155 ( 0.676 1.298 0.099) 1.466 12.247 ( 0.506 0.863 -0.465) 1.103 12.261 ( 4.676 5.074 1.116) 6.990 12.336 ( -0.422 -1.727 0.390) 1.820 12.397 ( 0.136 -1.745 0.207) 1.763 12.442 ( 0.796 -0.582 -0.499) 1.105 12.505 ( 0.732 -1.492 -0.924) 1.901 12.640 ( -2.938 6.282 1.075) 7.018 12.773 ( -1.417 5.720 -0.909) 5.963 12.914 ( 1.177 -4.951 0.084) 5.090 12.969 ( -0.307 -2.998 -0.323) 3.031 13.333 ( -4.638 7.227 0.589) 8.608 13.336 ( -3.559 6.130 -0.864) 7.141 13.653 ( -8.344 -7.262 0.679) 11.082 13.736 ( -3.406 -10.333 -0.115) 10.880 14.066 ( 1.966 13.401 -0.810) 13.569 14.136 ( -0.012 1.803 1.251) 2.194 14.236 ( -1.152 -1.287 0.155) 1.734 14.322 ( 2.846 -0.961 -0.219) 3.012 14.349 ( -1.796 5.921 -0.455) 6.204 14.578 ( 0.979 9.137 1.536) 9.317 14.760 ( 0.797 2.012 -0.640) 2.257 14.805 ( -3.754 -0.258 -0.710) 3.829 14.979 ( -8.172 1.679 0.298) 8.348 15.155 ( -6.703 3.881 -1.622) 7.913 15.278 ( -10.387 -1.925 0.051) 10.564 15.288 ( -6.701 -3.333 0.610) 7.509 15.458 ( -3.194 -1.545 -0.500) 3.583 15.569 ( -2.639 -2.676 -0.357) 3.775 15.609 ( 3.453 -0.331 0.523) 3.508 15.648 ( 5.467 -0.678 -0.303) 5.517 15.831 ( -3.967 -0.175 -0.735) 4.039 15.881 ( -3.500 -2.862 -1.125) 4.659 16.165 ( 2.886 0.307 1.497) 3.266 16.248 ( 1.377 -2.786 -0.841) 3.219 16.588 ( -3.053 0.882 -0.849) 3.289 16.607 ( -1.628 2.965 -0.156) 3.386 16.681 ( -4.046 -1.707 1.266) 4.570 16.888 ( 3.885 -9.056 3.346) 10.407 17.304 ( -0.272 1.040 0.260) 1.106 17.332 ( 0.622 -0.251 -0.625) 0.917 17.368 ( -1.054 1.297 0.062) 1.672 17.424 ( -1.225 -1.425 -0.616) 1.978 19.777 ( -4.404 3.266 0.002) 5.483 19.973 ( -0.917 -4.508 -1.468) 4.829 20.066 ( -6.050 1.771 0.993) 6.382 20.158 ( -5.603 -1.930 1.745) 6.177 20.452 ( 4.365 1.791 2.869) 5.522 20.511 ( 3.488 -0.699 0.894) 3.668 20.804 ( 1.908 0.068 -0.409) 1.952 20.830 ( 2.555 -0.762 -1.477) 3.048 22.020 ( -6.779 2.345 -1.421) 7.312 22.040 ( -7.476 2.821 -2.099) 8.262 22.203 ( -7.219 -1.016 1.176) 7.384 22.221 ( -5.298 -1.403 0.613) 5.515 22.982 ( 8.348 0.833 1.293) 8.489 23.013 ( 11.232 -0.058 -3.445) 11.749 23.120 ( 8.182 -2.694 2.843) 9.071 23.150 ( 7.994 -4.480 0.208) 9.167 26.816 ( -16.136 1.635 0.045) 16.219 26.902 ( -20.348 -1.894 -0.029) 20.436 26.995 ( -21.654 6.470 -0.127) 22.600 27.686 ( -26.040 -35.110 2.518) 43.785 28.760 ( 21.495 5.462 1.054) 22.203 28.831 ( 19.746 6.138 -1.587) 20.738 28.954 ( 16.694 -3.861 -0.462) 17.141 29.173 ( 17.710 -7.751 -0.058) 19.332 30.169 ( -15.525 7.407 -0.003) 17.201 30.430 ( -6.686 1.610 2.166) 7.210 30.555 ( -4.248 7.607 -0.664) 8.738 30.728 ( -1.430 -2.154 0.213) 2.594 30.892 ( -4.787 7.552 -1.077) 9.006 30.987 ( -4.987 2.416 1.765) 5.816 31.172 ( -9.085 -3.920 0.823) 9.929 31.286 ( -4.678 -11.736 -0.897) 12.666 31.589 ( 1.447 3.198 0.559) 3.554 31.798 ( 2.570 -5.998 -0.940) 6.592 31.891 ( 9.690 3.238 -0.216) 10.219 31.936 ( 7.895 2.099 -1.036) 8.235 32.079 ( 3.022 5.701 0.965) 6.524 32.302 ( -1.604 -4.176 2.088) 4.937 32.600 ( 1.664 12.592 3.812) 13.261 32.718 ( -8.702 -0.399 -2.035) 8.946 32.798 ( -5.281 7.892 5.687) 11.069 32.938 ( -11.822 -1.074 1.033) 11.916 33.150 ( -1.234 9.598 1.354) 9.771 33.364 ( 6.260 -1.363 0.507) 6.427 33.606 ( 7.466 8.819 1.912) 11.712 34.060 ( 12.724 -3.192 3.000) 13.457 34.111 ( 12.248 -1.452 2.493) 12.583 34.140 ( 14.457 -3.363 3.858) 15.336 34.949 ( -1.486 0.348 2.698) 3.100 34.970 ( -2.444 -0.548 -3.373) 4.202 35.004 ( -1.361 0.331 -2.322) 2.712 35.016 ( -0.662 -0.126 -8.002) 8.030 35.696 ( -3.221 2.032 -1.542) 4.109 35.759 ( -4.627 0.142 -2.904) 5.465 35.824 ( -2.489 -1.367 -1.082) 3.039 35.863 ( -0.419 -3.428 -2.742) 4.409 35.911 ( -2.667 0.667 -3.747) 4.648 35.984 ( -1.526 -1.540 -18.647) 18.773 36.075 ( 0.074 3.605 7.161) 8.018 36.188 ( 2.069 -1.874 4.791) 5.545 36.811 ( -14.361 3.882 0.441) 14.883 37.141 ( -16.976 -12.519 4.941) 21.664 38.228 ( 14.756 10.808 0.753) 18.306 38.619 ( 16.344 -6.930 -0.226) 17.754 ======================= Grid point 62 (33/69) ======================= q-point: (-0.11 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( -17.412 17.691 21.305) 32.712 0.997 ( -23.602 24.022 14.037) 36.485 1.456 ( -27.114 47.394 2.779) 54.673 1.722 ( -5.047 -16.720 13.697) 22.196 1.952 ( -1.199 -16.291 1.356) 16.391 1.985 ( -9.509 2.542 4.574) 10.854 2.267 ( -1.337 -7.196 3.577) 8.147 2.445 ( 2.098 3.172 4.385) 5.804 2.546 ( -6.241 9.144 -3.082) 11.492 2.597 ( 3.253 -3.501 0.670) 4.826 2.718 ( 3.297 2.279 6.078) 7.280 2.845 ( 0.161 5.616 2.945) 6.343 2.864 ( 4.866 7.773 -5.420) 10.652 2.885 ( 0.952 -2.829 0.186) 2.991 3.042 ( -1.938 6.738 -7.384) 10.183 3.147 ( 0.857 -5.763 -2.459) 6.323 3.198 ( 0.287 -2.230 -0.401) 2.284 3.221 ( 8.060 -1.420 -1.129) 8.262 3.263 ( -6.090 -8.517 -5.701) 11.922 3.325 ( 3.784 1.234 0.905) 4.081 3.481 ( 0.303 -4.672 4.551) 6.529 3.562 ( -6.139 -2.789 -2.913) 7.345 3.615 ( -5.725 -5.474 -2.876) 8.427 3.685 ( 0.327 1.528 2.063) 2.588 3.735 ( 2.001 4.713 6.193) 8.036 3.774 ( -3.938 5.192 2.098) 6.846 3.838 ( -2.169 -2.341 -6.027) 6.820 3.872 ( -0.141 0.782 6.977) 7.022 3.999 ( -3.011 -1.418 4.051) 5.243 4.023 ( -4.242 8.406 -1.275) 9.502 4.101 ( -2.247 4.066 -0.283) 4.654 4.195 ( -9.552 3.441 0.851) 10.189 4.303 ( -7.399 -4.442 0.483) 8.643 4.395 ( -6.449 -3.170 6.156) 9.462 4.441 ( -4.996 1.160 0.143) 5.131 4.495 ( -1.367 1.083 2.705) 3.218 4.663 ( -2.617 -1.338 -5.518) 6.252 4.695 ( 0.601 -3.540 -3.538) 5.041 4.808 ( 0.848 -4.992 3.216) 5.999 4.900 ( 3.296 -11.403 -2.380) 12.106 4.957 ( 7.524 0.548 -2.250) 7.872 5.111 ( 3.816 -1.681 1.017) 4.292 5.141 ( -0.806 0.638 -0.683) 1.235 5.268 ( -1.209 -0.189 -3.335) 3.553 5.329 ( -4.561 1.364 -1.775) 5.081 5.382 ( 2.370 0.650 0.292) 2.475 5.459 ( 1.649 0.310 -4.723) 5.013 5.485 ( -4.192 3.221 -4.936) 7.232 5.643 ( 1.623 0.042 -3.409) 3.776 5.730 ( -2.228 3.061 5.529) 6.701 5.748 ( 0.930 5.514 0.268) 5.599 5.785 ( -2.661 3.482 -0.799) 4.455 5.874 ( -0.271 -0.162 -4.054) 4.066 5.912 ( -4.683 -1.181 0.667) 4.875 5.995 ( -0.105 -2.759 -4.180) 5.009 6.074 ( 0.483 -4.224 -5.211) 6.725 6.145 ( -2.236 0.986 5.113) 5.667 6.201 ( 0.752 -7.318 -7.700) 10.649 6.306 ( 1.164 -6.443 1.185) 6.654 6.336 ( 1.237 -2.607 2.879) 4.077 6.425 ( -0.440 0.920 -8.554) 8.615 6.464 ( -0.941 3.940 3.372) 5.271 6.531 ( 2.877 -3.219 10.292) 11.161 6.536 ( -2.761 0.163 3.080) 4.139 6.752 ( 4.674 1.433 1.647) 5.159 6.813 ( 4.090 -0.298 -2.679) 4.898 6.913 ( -0.768 1.036 1.736) 2.162 6.949 ( 4.642 0.604 -1.562) 4.935 7.023 ( 2.857 3.806 4.468) 6.527 7.097 ( -0.756 -0.598 1.058) 1.431 7.195 ( 0.332 1.272 -0.681) 1.480 7.271 ( 5.983 -1.766 1.203) 6.353 7.387 ( 4.663 2.469 -1.380) 5.454 7.433 ( 5.129 -1.849 5.185) 7.524 7.495 ( 6.231 2.208 2.015) 6.911 7.597 ( 1.185 -1.949 0.466) 2.328 8.467 ( 13.651 5.689 -0.999) 14.823 8.635 ( 16.312 -0.839 0.415) 16.339 8.713 ( 13.051 -2.635 -2.004) 13.465 8.748 ( 12.656 -4.583 -0.208) 13.462 8.912 ( 1.189 4.767 -0.819) 4.981 9.037 ( 0.752 1.188 -0.123) 1.412 9.129 ( -4.891 -0.763 2.404) 5.503 9.151 ( -3.818 -3.417 -0.012) 5.124 9.255 ( -3.501 -2.450 -0.251) 4.280 9.272 ( -1.812 -1.155 -2.387) 3.212 9.333 ( -5.185 -0.109 0.786) 5.245 9.361 ( -2.173 -2.631 -0.600) 3.465 9.432 ( -1.014 -1.258 -2.053) 2.613 9.453 ( -4.718 -1.918 3.417) 6.134 9.572 ( -4.796 1.955 -0.155) 5.181 9.673 ( -0.644 -2.678 -2.270) 3.569 9.839 ( -1.633 2.699 2.713) 4.161 10.064 ( 2.205 -8.239 0.303) 8.534 10.270 ( 7.082 7.402 2.199) 10.478 10.356 ( 9.536 2.351 0.901) 9.863 10.375 ( 6.615 4.674 -1.749) 8.286 10.583 ( 9.617 0.608 -0.657) 9.659 10.655 ( 8.476 -3.758 -0.280) 9.276 10.719 ( 6.044 -1.518 -0.868) 6.292 10.788 ( 4.584 3.298 0.392) 5.660 10.926 ( 5.131 -0.971 -3.771) 6.442 10.979 ( 4.961 1.350 1.406) 5.330 11.113 ( 4.532 -2.302 0.120) 5.084 11.359 ( -11.914 1.879 -0.628) 12.078 11.371 ( -11.731 0.164 -0.010) 11.732 11.534 ( -3.587 -7.255 -0.228) 8.096 11.595 ( -3.205 -6.749 0.173) 7.473 11.969 ( -3.894 4.330 1.774) 6.087 12.149 ( 0.028 1.134 -1.513) 1.891 12.234 ( -1.925 -1.373 0.873) 2.521 12.347 ( 2.102 2.039 1.758) 3.415 12.364 ( 2.484 1.900 0.122) 3.130 12.399 ( 3.315 0.235 -0.538) 3.367 12.453 ( 0.807 2.745 -0.539) 2.911 12.501 ( 0.849 3.961 -1.158) 4.213 12.623 ( -1.986 5.767 1.489) 6.278 12.747 ( 0.838 6.631 -1.577) 6.867 12.926 ( -0.893 -4.349 0.811) 4.513 12.947 ( -0.764 -3.586 -0.702) 3.733 13.281 ( -2.626 4.847 0.248) 5.518 13.299 ( -0.283 1.295 -0.631) 1.468 13.502 ( -9.694 -4.092 0.547) 10.536 13.579 ( -16.313 -14.172 -1.225) 21.644 14.132 ( 4.471 12.509 -0.777) 13.306 14.193 ( 4.071 5.080 0.149) 6.512 14.240 ( 2.844 3.198 0.939) 4.382 14.347 ( 1.334 -1.661 0.373) 2.163 14.404 ( 7.824 -0.587 0.314) 7.853 14.579 ( -3.349 6.414 0.564) 7.258 14.688 ( -7.421 -0.946 -1.924) 7.725 14.736 ( -3.744 0.458 0.277) 3.782 14.857 ( -4.976 0.443 -0.585) 5.030 15.006 ( -9.327 1.680 -2.197) 9.729 15.122 ( -7.897 -2.032 -0.718) 8.186 15.161 ( -8.943 -1.658 -0.810) 9.131 15.330 ( -12.295 3.834 1.179) 12.933 15.571 ( 8.848 8.122 -9.567) 15.355 15.685 ( 3.637 -2.829 0.344) 4.621 15.736 ( 6.231 0.980 0.196) 6.311 15.817 ( 1.716 -0.942 0.545) 2.032 15.870 ( 1.299 -4.503 -0.466) 4.710 16.132 ( -3.793 3.831 -7.772) 9.458 16.283 ( 4.733 -3.026 -3.502) 6.620 16.542 ( -2.272 1.080 0.596) 2.585 16.555 ( -3.414 2.290 -1.082) 4.251 16.639 ( -3.347 -1.455 2.087) 4.204 16.825 ( -12.562 -9.925 -7.654) 17.746 17.308 ( 0.221 1.202 0.346) 1.270 17.335 ( 0.577 -0.304 -0.480) 0.810 17.357 ( -0.736 0.811 0.145) 1.105 17.396 ( -0.853 -0.961 -0.659) 1.444 19.736 ( -1.939 2.439 1.274) 3.366 19.932 ( -1.223 -1.527 -3.432) 3.950 20.011 ( -2.353 -2.329 1.358) 3.579 20.079 ( -4.110 -2.086 -1.465) 4.836 20.527 ( 1.223 1.056 2.128) 2.672 20.558 ( 1.445 -0.290 0.795) 1.674 20.807 ( 0.199 0.728 -0.849) 1.136 20.848 ( 2.041 -0.722 -1.636) 2.713 21.927 ( -3.591 2.256 -1.380) 4.460 21.968 ( -0.660 0.129 2.716) 2.798 22.121 ( -4.817 0.238 1.006) 4.927 22.162 ( -2.992 -1.397 0.200) 3.308 23.086 ( 3.022 -1.802 0.362) 3.537 23.120 ( 7.889 -1.341 -4.313) 9.091 23.276 ( 8.271 -0.920 2.035) 8.567 23.289 ( 6.605 -0.905 3.461) 7.511 26.619 ( -9.201 0.616 0.181) 9.224 26.651 ( -11.846 -0.653 0.313) 11.868 26.689 ( -15.210 2.738 -0.553) 15.465 27.073 ( -44.732 -28.421 -9.602) 53.861 29.044 ( 12.743 2.721 0.138) 13.031 29.103 ( 15.415 3.453 0.807) 15.818 29.175 ( 12.275 0.386 -0.197) 12.282 29.426 ( 14.753 -6.480 -1.264) 16.163 29.926 ( -15.923 9.217 1.388) 18.450 30.316 ( -10.683 -6.676 3.262) 13.013 30.572 ( 8.734 14.980 -3.668) 17.724 30.719 ( -0.584 -1.210 0.597) 1.471 30.828 ( -0.947 7.254 -3.223) 7.994 30.932 ( -3.692 2.369 -0.275) 4.395 31.057 ( -5.630 -3.302 0.180) 6.529 31.157 ( -9.227 -10.896 -2.969) 14.583 31.575 ( -2.864 3.984 0.545) 4.937 31.788 ( -1.132 -4.552 0.402) 4.707 32.030 ( 9.911 2.171 -0.392) 10.154 32.125 ( 13.465 -1.018 -0.237) 13.505 32.159 ( 5.971 3.420 0.198) 6.884 32.324 ( 1.329 -3.704 -0.571) 3.977 32.473 ( -3.464 10.840 -17.501) 20.875 32.584 ( -5.907 -0.311 -0.241) 5.920 32.691 ( -10.459 4.755 -4.791) 12.448 32.725 ( -14.232 0.027 -0.765) 14.252 33.155 ( 9.450 26.189 -33.345) 43.440 33.460 ( 4.265 -2.382 -1.024) 4.991 33.758 ( 13.091 19.350 -21.201) 31.548 34.158 ( 5.070 0.198 -5.556) 7.524 34.212 ( 4.776 -0.613 -3.332) 5.856 34.345 ( 14.188 -4.592 -29.400) 32.966 34.893 ( -0.195 0.104 0.852) 0.880 34.908 ( 1.787 -0.742 0.456) 1.988 34.968 ( -0.813 1.097 2.739) 3.060 35.003 ( -1.544 -0.546 3.965) 4.290 35.622 ( -3.803 1.120 -4.933) 6.329 35.648 ( -4.223 2.428 -4.986) 6.970 35.683 ( -2.638 -0.977 -1.015) 2.991 35.755 ( -5.937 -1.886 -3.988) 7.397 35.830 ( -1.148 0.359 3.750) 3.938 35.894 ( -0.430 -3.457 3.921) 5.245 36.269 ( 1.189 6.309 25.666) 26.457 36.474 ( 7.455 -2.749 14.963) 16.942 36.659 ( -8.775 2.799 4.188) 10.118 37.175 ( -7.656 -31.128 52.267) 61.314 38.423 ( 11.974 10.793 -2.926) 16.384 38.810 ( 9.713 -7.309 -2.358) 12.383 ======================= Grid point 63 (34/69) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( -2.203 -29.780 4.247) 30.162 1.364 ( -2.203 29.780 4.247) 30.162 1.609 ( -0.491 -17.873 35.995) 40.191 1.609 ( -0.491 17.873 35.995) 40.191 2.056 ( 1.390 -9.325 -3.816) 10.171 2.056 ( 1.390 9.325 -3.816) 10.171 2.302 ( -1.578 -33.882 0.678) 33.925 2.302 ( -1.578 33.882 0.678) 33.925 2.618 ( -1.688 -2.842 0.655) 3.369 2.618 ( -1.688 2.842 0.655) 3.369 2.686 ( -0.584 -11.933 -0.263) 11.950 2.686 ( -0.584 11.933 -0.263) 11.950 2.949 ( 3.113 -3.592 -2.699) 5.466 2.949 ( 3.113 3.592 -2.699) 5.466 3.039 ( 2.370 -3.023 5.470) 6.684 3.039 ( 2.370 3.023 5.470) 6.684 3.225 ( -0.438 -5.111 -2.181) 5.574 3.225 ( -0.438 5.111 -2.181) 5.574 3.281 ( 4.037 -5.962 -1.133) 7.289 3.281 ( 4.037 5.962 -1.133) 7.289 3.497 ( -4.599 -4.519 3.028) 7.124 3.497 ( -4.599 4.519 3.028) 7.124 3.544 ( 1.032 -4.885 -1.350) 5.172 3.544 ( 1.032 4.885 -1.350) 5.172 3.792 ( 0.885 -5.573 -1.314) 5.794 3.792 ( 0.885 5.573 -1.314) 5.794 3.910 ( -3.782 -0.810 5.333) 6.588 3.910 ( -3.782 0.810 5.333) 6.588 4.039 ( -3.203 -3.330 5.436) 7.135 4.039 ( -3.203 3.330 5.436) 7.135 4.236 ( -4.562 -3.431 -4.409) 7.212 4.236 ( -4.562 3.431 -4.409) 7.212 4.301 ( -0.851 -3.743 1.593) 4.156 4.301 ( -0.851 3.743 1.593) 4.156 4.379 ( 3.393 -16.650 -2.067) 17.117 4.379 ( 3.393 16.650 -2.067) 17.117 4.561 ( -1.195 -4.169 1.975) 4.766 4.561 ( -1.195 4.169 1.975) 4.766 4.824 ( 5.223 -8.810 1.136) 10.305 4.824 ( 5.223 8.810 1.136) 10.305 5.080 ( 0.249 -3.294 -1.510) 3.632 5.080 ( 0.249 3.294 -1.510) 3.632 5.183 ( 1.930 -0.744 -1.816) 2.752 5.183 ( 1.930 0.744 -1.816) 2.752 5.342 ( 2.550 -0.911 -6.102) 6.676 5.342 ( 2.550 0.911 -6.102) 6.676 5.460 ( -0.409 -6.985 -3.338) 7.753 5.460 ( -0.409 6.985 -3.338) 7.753 5.626 ( -4.865 -4.192 -3.218) 7.183 5.626 ( -4.865 4.192 -3.218) 7.183 5.747 ( -1.510 -2.464 -3.685) 4.683 5.747 ( -1.510 2.464 -3.685) 4.683 5.940 ( 0.951 -1.782 -0.129) 2.024 5.940 ( 0.951 1.782 -0.129) 2.024 5.999 ( 1.314 -2.251 -3.776) 4.588 5.999 ( 1.314 2.251 -3.776) 4.588 6.105 ( 3.419 -4.997 3.063) 6.785 6.105 ( 3.419 4.997 3.063) 6.785 6.249 ( -2.894 -5.859 1.853) 6.792 6.249 ( -2.894 5.859 1.853) 6.792 6.430 ( -2.290 -5.659 -4.024) 7.312 6.430 ( -2.290 5.659 -4.024) 7.312 6.548 ( -1.505 -0.689 1.659) 2.343 6.548 ( -1.505 0.689 1.659) 2.343 6.873 ( 1.592 -3.940 2.287) 4.826 6.873 ( 1.592 3.940 2.287) 4.826 6.966 ( 2.519 -7.358 0.720) 7.810 6.966 ( 2.519 7.358 0.720) 7.810 7.084 ( -0.102 -1.772 2.222) 2.844 7.084 ( -0.102 1.772 2.222) 2.844 7.238 ( 0.153 -4.382 0.192) 4.389 7.238 ( 0.153 4.382 0.192) 4.389 7.441 ( -2.119 -3.472 2.305) 4.676 7.441 ( -2.119 3.472 2.305) 4.676 7.571 ( 2.169 -4.333 -0.937) 4.936 7.571 ( 2.169 4.333 -0.937) 4.936 8.721 ( -0.420 -5.688 0.551) 5.730 8.721 ( -0.420 5.688 0.551) 5.730 8.835 ( 1.916 -2.555 -2.208) 3.882 8.835 ( 1.916 2.555 -2.208) 3.882 9.023 ( -0.169 -2.274 -0.352) 2.307 9.023 ( -0.169 2.274 -0.352) 2.307 9.048 ( -0.669 -5.941 -0.059) 5.978 9.048 ( -0.669 5.941 -0.059) 5.978 9.183 ( 0.143 -5.106 0.056) 5.108 9.183 ( 0.143 5.106 0.056) 5.108 9.268 ( -1.211 -1.102 -3.016) 3.432 9.268 ( -1.211 1.102 -3.016) 3.432 9.408 ( -0.557 -1.512 1.593) 2.266 9.408 ( -0.557 1.512 1.593) 2.266 9.597 ( 1.160 -3.526 -2.020) 4.226 9.597 ( 1.160 3.526 -2.020) 4.226 9.936 ( -0.270 -6.528 3.122) 7.242 9.936 ( -0.270 6.528 3.122) 7.242 10.464 ( 0.200 -0.775 -0.109) 0.808 10.464 ( 0.200 0.775 -0.109) 0.808 10.582 ( -0.193 -9.163 0.352) 9.172 10.582 ( -0.193 9.163 0.352) 9.172 10.701 ( 0.305 -4.031 -2.300) 4.651 10.701 ( 0.305 4.031 -2.300) 4.651 10.901 ( 0.475 -3.514 0.363) 3.565 10.901 ( 0.475 3.514 0.363) 3.565 11.069 ( -1.342 -3.937 -2.153) 4.684 11.069 ( -1.342 3.937 -2.153) 4.684 11.333 ( 0.392 -3.028 -0.927) 3.191 11.333 ( 0.392 3.028 -0.927) 3.191 11.391 ( 0.210 -5.026 0.301) 5.040 11.391 ( 0.210 5.026 0.301) 5.040 12.065 ( -0.745 -6.414 1.304) 6.587 12.065 ( -0.745 6.414 1.304) 6.587 12.270 ( -0.159 -4.790 -1.730) 5.096 12.270 ( -0.159 4.790 -1.730) 5.096 12.455 ( -0.598 -1.949 1.128) 2.330 12.455 ( -0.598 1.949 1.128) 2.330 12.535 ( 0.293 -2.692 -1.004) 2.888 12.535 ( 0.293 2.692 -1.004) 2.888 12.777 ( 0.220 -8.959 1.264) 9.050 12.777 ( 0.220 8.959 1.264) 9.050 12.854 ( 0.704 -4.423 -0.376) 4.495 12.854 ( 0.704 4.423 -0.376) 4.495 13.314 ( 0.720 -1.150 -0.032) 1.357 13.314 ( 0.720 1.150 -0.032) 1.357 13.362 ( -0.643 -3.036 0.538) 3.150 13.362 ( -0.643 3.036 0.538) 3.150 14.287 ( -0.811 -3.074 0.126) 3.181 14.287 ( -0.811 3.074 0.126) 3.181 14.332 ( 2.266 -5.611 -1.309) 6.191 14.332 ( 2.266 5.611 -1.309) 6.191 14.548 ( -4.559 -5.963 1.997) 7.767 14.548 ( -4.559 5.963 1.997) 7.767 14.662 ( 3.303 -2.105 0.476) 3.945 14.662 ( 3.303 2.105 0.476) 3.945 14.821 ( 0.543 -4.203 0.567) 4.276 14.821 ( 0.543 4.203 0.567) 4.276 15.027 ( 0.941 -5.080 -4.158) 6.632 15.027 ( 0.941 5.080 -4.158) 6.632 15.449 ( -1.569 -16.402 3.343) 16.812 15.449 ( -1.569 16.402 3.343) 16.812 15.802 ( -1.900 -1.089 -1.001) 2.408 15.802 ( -1.900 1.089 -1.001) 2.408 15.859 ( 5.892 -0.747 -0.539) 5.964 15.859 ( 5.892 0.747 -0.539) 5.964 16.132 ( -2.305 -12.048 -11.596) 16.880 16.132 ( -2.305 12.048 -11.596) 16.880 16.537 ( -2.641 -1.171 0.179) 2.895 16.537 ( -2.641 1.171 0.179) 2.895 16.588 ( 0.631 -2.700 0.665) 2.851 16.588 ( 0.631 2.700 0.665) 2.851 17.336 ( 0.168 -0.621 0.518) 0.826 17.336 ( 0.168 0.621 0.518) 0.826 17.373 ( 0.344 -1.205 0.030) 1.253 17.373 ( 0.344 1.205 0.030) 1.253 19.817 ( 0.553 -6.112 -1.363) 6.286 19.817 ( 0.553 6.112 -1.363) 6.286 19.978 ( -0.672 -1.924 -1.000) 2.269 19.978 ( -0.672 1.924 -1.000) 2.269 20.561 ( -1.180 -1.142 1.529) 2.244 20.561 ( -1.180 1.142 1.529) 2.244 20.831 ( 0.865 -1.388 -1.204) 2.031 20.831 ( 0.865 1.388 -1.204) 2.031 21.954 ( 1.248 -2.855 1.752) 3.575 21.954 ( 1.248 2.855 1.752) 3.575 22.102 ( -0.959 -1.738 -0.106) 1.988 22.102 ( -0.959 1.738 -0.106) 1.988 23.106 ( 1.012 -2.043 -3.253) 3.972 23.106 ( 1.012 2.043 -3.253) 3.972 23.367 ( -1.327 -0.115 1.915) 2.332 23.367 ( -1.327 0.115 1.915) 2.332 26.548 ( -0.024 -0.208 -0.191) 0.284 26.548 ( -0.024 0.208 -0.191) 0.284 26.580 ( 0.320 -0.118 0.094) 0.354 26.580 ( 0.320 0.118 0.094) 0.354 29.195 ( -0.246 -2.081 2.183) 3.026 29.195 ( -0.246 2.081 2.183) 3.026 29.422 ( 1.135 -6.042 -2.253) 6.548 29.422 ( 1.135 6.042 -2.253) 6.548 30.046 ( -1.366 -13.717 5.629) 14.890 30.046 ( -1.366 13.717 5.629) 14.890 30.694 ( -1.136 -1.473 -1.450) 2.358 30.694 ( -1.136 1.473 -1.450) 2.358 30.872 ( 0.286 -2.091 -4.940) 5.372 30.872 ( 0.286 2.091 -4.940) 5.372 30.999 ( 0.806 -0.439 0.765) 1.195 30.999 ( 0.806 0.439 0.765) 1.195 31.677 ( 0.210 -7.503 1.627) 7.680 31.677 ( 0.210 7.503 1.627) 7.680 32.203 ( -0.434 -3.006 0.386) 3.062 32.203 ( -0.434 3.006 0.386) 3.062 32.258 ( 1.012 -2.499 -0.675) 2.779 32.258 ( 1.012 2.499 -0.675) 2.779 32.501 ( 4.133 -6.099 -11.408) 13.581 32.501 ( 4.133 6.099 -11.408) 13.581 32.539 ( -5.032 -0.320 1.018) 5.144 32.539 ( -5.032 0.320 1.018) 5.144 33.223 ( -0.429 -17.034 -32.338) 36.552 33.223 ( -0.429 17.034 -32.338) 36.552 33.802 ( -1.646 -9.324 -19.775) 21.925 33.802 ( -1.646 9.324 -19.775) 21.925 34.168 ( 0.008 -1.609 -7.600) 7.768 34.168 ( 0.008 1.609 -7.600) 7.768 34.963 ( 0.224 -0.575 3.306) 3.363 34.963 ( 0.224 0.575 3.306) 3.363 35.044 ( 2.985 -0.183 2.994) 4.232 35.044 ( 2.985 0.183 2.994) 4.232 35.625 ( 1.917 -2.541 -1.205) 3.403 35.625 ( 1.917 2.541 -1.205) 3.403 35.651 ( 0.517 -1.976 -1.368) 2.459 35.651 ( 0.517 1.976 -1.368) 2.459 35.917 ( 0.786 -1.798 7.858) 8.100 35.917 ( 0.786 1.798 7.858) 8.100 36.515 ( 0.460 -1.457 -4.943) 5.173 36.515 ( 0.460 1.457 -4.943) 5.173 37.109 ( -3.820 -25.773 48.238) 54.825 37.109 ( -3.820 25.773 48.238) 54.825 38.654 ( 0.182 -11.169 -6.531) 12.940 38.654 ( 0.182 11.169 -6.531) 12.940 ======================= Grid point 65 (35/69) ======================= q-point: ( 0.11 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.424 ( 6.776 -20.727 5.889) 22.588 1.424 ( 6.776 20.727 5.889) 22.588 1.994 ( 5.428 -12.021 5.839) 14.424 1.994 ( 5.428 12.021 5.839) 14.424 2.094 ( 5.435 -15.338 11.901) 20.161 2.094 ( 5.435 15.338 11.901) 20.161 2.374 ( 4.160 -6.822 4.031) 8.949 2.374 ( 4.160 6.822 4.031) 8.949 2.580 ( -1.991 -4.430 5.413) 7.272 2.580 ( -1.991 4.430 5.413) 7.272 2.773 ( 4.540 -6.158 2.377) 8.011 2.773 ( 4.540 6.158 2.377) 8.011 2.946 ( 2.312 -2.213 0.142) 3.203 2.946 ( 2.312 2.213 0.142) 3.203 3.102 ( -4.429 -3.023 -1.694) 5.623 3.102 ( -4.429 3.023 -1.694) 5.623 3.200 ( 0.985 -6.320 4.458) 7.797 3.200 ( 0.985 6.320 4.458) 7.797 3.316 ( 2.696 -5.532 0.814) 6.207 3.316 ( 2.696 5.532 0.814) 6.207 3.470 ( -1.196 -5.238 2.053) 5.752 3.470 ( -1.196 5.238 2.053) 5.752 3.592 ( 5.125 -3.020 -1.983) 6.270 3.592 ( 5.125 3.020 -1.983) 6.270 3.810 ( 5.276 -5.933 -2.625) 8.362 3.810 ( 5.276 5.933 -2.625) 8.362 3.932 ( 1.250 -4.200 -2.459) 5.025 3.932 ( 1.250 4.200 -2.459) 5.025 4.019 ( -7.124 -3.926 7.495) 11.061 4.019 ( -7.124 3.926 7.495) 11.061 4.143 ( -1.077 -8.050 -1.139) 8.202 4.143 ( -1.077 8.050 -1.139) 8.202 4.322 ( 5.050 -10.357 0.945) 11.562 4.322 ( 5.050 10.357 0.945) 11.562 4.413 ( 4.405 -12.490 -2.594) 13.496 4.413 ( 4.405 12.490 -2.594) 13.496 4.651 ( 4.136 -4.186 0.885) 5.951 4.651 ( 4.136 4.186 0.885) 5.951 4.850 ( 3.715 -8.188 -4.256) 9.948 4.850 ( 3.715 8.188 -4.256) 9.948 5.065 ( -3.499 -2.605 2.331) 4.946 5.065 ( -3.499 2.605 2.331) 4.946 5.181 ( 2.402 -1.622 -4.454) 5.315 5.181 ( 2.402 1.622 -4.454) 5.315 5.307 ( -1.925 -3.812 -5.564) 7.014 5.307 ( -1.925 3.812 -5.564) 7.014 5.427 ( -1.534 -1.924 0.807) 2.590 5.427 ( -1.534 1.924 0.807) 2.590 5.529 ( 2.373 -10.781 -4.376) 11.874 5.529 ( 2.373 10.781 -4.376) 11.874 5.700 ( -2.435 -4.545 -1.352) 5.330 5.700 ( -2.435 4.545 -1.352) 5.330 5.910 ( -0.481 -2.633 -4.547) 5.276 5.910 ( -0.481 2.633 -4.547) 5.276 6.000 ( 2.611 -1.110 -1.872) 3.399 6.000 ( 2.611 1.110 -1.872) 3.399 6.131 ( -3.267 -1.381 1.155) 3.730 6.131 ( -3.267 1.381 1.155) 3.730 6.289 ( 6.081 -2.504 1.874) 6.838 6.289 ( 6.081 2.504 1.874) 6.838 6.395 ( -0.929 -3.451 0.135) 3.576 6.395 ( -0.929 3.451 0.135) 3.576 6.516 ( -2.655 -1.864 -1.346) 3.512 6.516 ( -2.655 1.864 -1.346) 3.512 6.860 ( -3.448 -6.873 -1.531) 7.841 6.860 ( -3.448 6.873 -1.531) 7.841 6.963 ( -3.722 -6.353 2.009) 7.632 6.963 ( -3.722 6.353 2.009) 7.632 7.104 ( -2.449 -3.405 3.782) 5.647 7.104 ( -2.449 3.405 3.782) 5.647 7.239 ( 0.340 -4.637 -0.783) 4.715 7.239 ( 0.340 4.637 -0.783) 4.715 7.428 ( -3.222 -1.319 3.313) 4.806 7.428 ( -3.222 1.319 3.313) 4.806 7.585 ( -0.143 -3.183 -0.206) 3.193 7.585 ( -0.143 3.183 -0.206) 3.193 8.594 ( -14.637 -2.257 -0.092) 14.810 8.594 ( -14.637 2.257 -0.092) 14.810 8.683 ( -14.016 -2.169 -0.868) 14.209 8.683 ( -14.016 2.169 -0.868) 14.209 9.014 ( -0.027 -1.498 -1.295) 1.980 9.014 ( -0.027 1.498 -1.295) 1.980 9.107 ( 3.280 -4.650 -0.233) 5.695 9.107 ( 3.280 4.650 -0.233) 5.695 9.202 ( 3.478 -2.331 -0.528) 4.220 9.202 ( 3.478 2.331 -0.528) 4.220 9.271 ( 4.569 -2.625 -1.701) 5.538 9.271 ( 4.569 2.625 -1.701) 5.538 9.437 ( 1.437 -1.459 2.126) 2.952 9.437 ( 1.437 1.459 2.126) 2.952 9.605 ( 2.959 -4.080 -2.620) 5.680 9.605 ( 2.959 4.080 -2.620) 5.680 9.977 ( 0.321 -5.573 3.446) 6.560 9.977 ( 0.321 5.573 3.446) 6.560 10.389 ( -8.363 -1.961 -0.221) 8.592 10.389 ( -8.363 1.961 -0.221) 8.592 10.499 ( -9.678 -7.224 0.364) 12.082 10.499 ( -9.678 7.224 0.364) 12.082 10.630 ( -5.377 -2.535 -2.443) 6.428 10.630 ( -5.377 2.535 -2.443) 6.428 10.870 ( -5.199 -5.057 0.515) 7.271 10.870 ( -5.199 5.057 0.515) 7.271 11.001 ( -4.228 -4.726 -1.104) 6.436 11.001 ( -4.228 4.726 -1.104) 6.436 11.400 ( 8.725 -0.818 -0.919) 8.812 11.400 ( 8.725 0.818 -0.919) 8.812 11.460 ( 7.823 -0.626 0.449) 7.861 11.460 ( 7.823 0.626 0.449) 7.861 12.099 ( 2.709 -6.990 1.787) 7.707 12.099 ( 2.709 6.990 1.787) 7.707 12.257 ( 0.557 -5.336 -1.479) 5.565 12.257 ( 0.557 5.336 -1.479) 5.565 12.425 ( -3.999 -1.093 0.947) 4.253 12.425 ( -3.999 1.093 0.947) 4.253 12.496 ( -3.243 -2.785 -1.053) 4.403 12.496 ( -3.243 2.785 -1.053) 4.403 12.782 ( 0.025 -8.065 0.461) 8.078 12.782 ( 0.025 8.065 0.461) 8.078 12.874 ( 1.103 -5.956 -0.172) 6.060 12.874 ( 1.103 5.956 -0.172) 6.060 13.379 ( 6.511 -2.708 -0.548) 7.073 13.379 ( 6.511 2.708 -0.548) 7.073 13.413 ( 6.131 -4.281 0.654) 7.506 13.413 ( 6.131 4.281 0.654) 7.506 14.239 ( -3.972 -0.459 0.050) 3.998 14.239 ( -3.972 0.459 0.050) 3.998 14.338 ( -4.515 -2.630 -0.544) 5.253 14.338 ( -4.515 2.630 -0.544) 5.253 14.504 ( 3.538 -8.317 1.184) 9.116 14.504 ( 3.538 8.317 1.184) 9.116 14.731 ( 3.270 -4.366 0.725) 5.503 14.731 ( 3.270 4.366 0.725) 5.503 14.962 ( 11.936 -7.017 0.699) 13.864 14.962 ( 11.936 7.017 0.699) 13.864 15.084 ( 11.440 -3.607 -3.466) 12.486 15.084 ( 11.440 3.607 -3.466) 12.486 15.476 ( -0.322 -14.789 2.479) 14.999 15.476 ( -0.322 14.789 2.479) 14.999 15.727 ( -6.179 -4.133 -1.809) 7.651 15.727 ( -6.179 4.133 -1.809) 7.651 15.878 ( -3.028 -1.636 1.963) 3.962 15.878 ( -3.028 1.636 1.963) 3.962 16.000 ( 3.661 -11.481 -9.287) 15.214 16.000 ( 3.661 11.481 -9.287) 15.214 16.550 ( 3.341 -1.147 0.316) 3.546 16.550 ( 3.341 1.147 0.316) 3.546 16.632 ( 3.300 -1.724 -0.109) 3.725 16.632 ( 3.300 1.724 -0.109) 3.725 17.339 ( -0.441 -0.577 0.345) 0.804 17.339 ( -0.441 0.577 0.345) 0.804 17.382 ( 0.843 -1.563 -0.162) 1.784 17.382 ( 0.843 1.563 -0.162) 1.784 19.818 ( 1.711 -4.731 -1.442) 5.234 19.818 ( 1.711 4.731 -1.442) 5.234 19.983 ( 2.332 -1.204 -0.495) 2.670 19.983 ( 2.332 1.204 -0.495) 2.670 20.545 ( -3.348 -1.923 1.668) 4.206 20.545 ( -3.348 1.923 1.668) 4.206 20.822 ( -0.073 -1.374 -1.481) 2.021 20.822 ( -0.073 1.374 -1.481) 2.021 22.024 ( 5.080 -2.736 1.114) 5.876 22.024 ( 5.080 2.736 1.114) 5.876 22.105 ( 1.788 -2.395 -0.039) 2.989 22.105 ( 1.788 2.395 -0.039) 2.989 23.052 ( -3.372 -2.151 -2.634) 4.789 23.052 ( -3.372 2.151 -2.634) 4.789 23.298 ( -9.382 -0.261 2.309) 9.666 23.298 ( -9.382 0.261 2.309) 9.666 26.639 ( 11.453 -0.916 0.469) 11.500 26.639 ( 11.453 0.916 0.469) 11.500 26.740 ( 18.658 -3.826 -2.228) 19.176 26.740 ( 18.658 3.826 -2.228) 19.176 29.127 ( -11.722 -3.879 2.075) 12.520 29.127 ( -11.722 3.879 2.075) 12.520 29.268 ( -15.192 -5.856 -1.757) 16.376 29.268 ( -15.192 5.856 -1.757) 16.376 30.207 ( 10.382 -11.391 6.180) 16.605 30.207 ( 10.382 11.391 6.180) 16.605 30.636 ( -0.458 -5.461 -4.131) 6.863 30.636 ( -0.458 5.461 -4.131) 6.863 30.873 ( 4.382 -1.952 -2.612) 5.462 30.873 ( 4.382 1.952 -2.612) 5.462 31.043 ( 4.315 -3.229 -0.174) 5.393 31.043 ( 4.315 3.229 -0.174) 5.393 31.724 ( 1.848 -9.052 3.395) 9.842 31.724 ( 1.848 9.052 3.395) 9.842 32.109 ( -8.111 -0.450 -0.994) 8.184 32.109 ( -8.111 0.450 -0.994) 8.184 32.170 ( -7.233 -6.017 -4.364) 10.371 32.170 ( -7.233 6.017 -4.364) 10.371 32.383 ( 1.910 -15.583 -18.881) 24.555 32.383 ( 1.910 15.583 -18.881) 24.555 32.618 ( 10.772 -2.225 0.749) 11.025 32.618 ( 10.772 2.225 0.749) 11.025 32.965 ( 6.900 -6.763 -12.772) 16.015 32.965 ( 6.900 6.763 -12.772) 16.015 33.699 ( -2.433 -1.508 0.652) 2.936 33.699 ( -2.433 1.508 0.652) 2.936 34.052 ( -3.701 -1.895 -7.241) 8.349 34.052 ( -3.701 1.895 -7.241) 8.349 34.979 ( -1.824 -1.952 2.062) 3.375 34.979 ( -1.824 1.952 2.062) 3.375 35.117 ( 2.435 -0.740 2.468) 3.545 35.117 ( 2.435 0.740 2.468) 3.545 35.646 ( 3.713 -2.780 -3.118) 5.589 35.646 ( 3.713 2.780 -3.118) 5.589 35.675 ( 4.141 -1.541 -1.552) 4.684 35.675 ( 4.141 1.541 -1.552) 4.684 36.040 ( 1.647 -1.464 10.379) 10.610 36.040 ( 1.647 1.464 10.379) 10.610 36.442 ( 0.295 -1.423 -7.677) 7.813 36.442 ( 0.295 1.423 -7.677) 7.813 37.489 ( -6.911 -21.798 32.564) 39.791 37.489 ( -6.911 21.798 32.564) 39.791 38.495 ( -9.102 -12.495 -8.635) 17.707 38.495 ( -9.102 12.495 -8.635) 17.707 ======================= Grid point 67 (36/69) ======================= q-point: ( 0.22 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( 18.919 -7.340 9.594) 22.447 1.725 ( 18.919 7.340 9.594) 22.447 2.053 ( 7.946 -7.488 -7.676) 13.346 2.053 ( 7.946 7.488 -7.676) 13.346 2.292 ( 3.005 -6.754 2.261) 7.730 2.292 ( 3.005 6.754 2.261) 7.730 2.427 ( -1.332 -2.490 3.063) 4.166 2.427 ( -1.332 2.490 3.063) 4.166 2.604 ( 0.348 -5.520 2.254) 5.973 2.604 ( 0.348 5.520 2.254) 5.973 2.857 ( 2.448 -3.094 5.607) 6.856 2.857 ( 2.448 3.094 5.607) 6.856 2.969 ( -2.592 -7.530 -2.796) 8.440 2.969 ( -2.592 7.530 -2.796) 8.440 3.109 ( 4.517 -4.483 6.054) 8.783 3.109 ( 4.517 4.483 6.054) 8.783 3.244 ( 0.880 -3.799 2.382) 4.570 3.244 ( 0.880 3.799 2.382) 4.570 3.399 ( -2.248 -3.892 -7.245) 8.526 3.399 ( -2.248 3.892 -7.245) 8.526 3.493 ( 8.314 -4.927 10.863) 14.540 3.493 ( 8.314 4.927 10.863) 14.540 3.688 ( 4.503 -2.975 -5.781) 7.909 3.688 ( 4.503 2.975 -5.781) 7.909 3.778 ( 0.002 -4.106 0.706) 4.167 3.778 ( 0.002 4.106 0.706) 4.167 3.936 ( 6.631 -6.050 1.959) 9.187 3.936 ( 6.631 6.050 1.959) 9.187 4.103 ( 3.421 -5.210 3.137) 6.977 4.103 ( 3.421 5.210 3.137) 6.977 4.224 ( 6.495 -4.443 5.406) 9.547 4.224 ( 6.495 4.443 5.406) 9.547 4.389 ( 3.984 -8.096 -2.103) 9.265 4.389 ( 3.984 8.096 -2.103) 9.265 4.486 ( 4.999 -8.399 -2.337) 10.050 4.486 ( 4.999 8.399 -2.337) 10.050 4.619 ( 1.102 -2.545 -4.854) 5.591 4.619 ( 1.102 2.545 -4.854) 5.591 4.893 ( 0.078 -4.461 -0.294) 4.472 4.893 ( 0.078 4.461 -0.294) 4.472 5.017 ( -0.874 -1.320 -7.373) 7.541 5.017 ( -0.874 1.320 -7.373) 7.541 5.127 ( -1.545 -4.987 0.192) 5.225 5.127 ( -1.545 4.987 0.192) 5.225 5.260 ( 2.792 -5.320 1.478) 6.187 5.260 ( 2.792 5.320 1.478) 6.187 5.421 ( -3.379 -4.164 1.033) 5.461 5.421 ( -3.379 4.164 1.033) 5.461 5.554 ( 0.042 -10.859 2.926) 11.246 5.554 ( 0.042 10.859 2.926) 11.246 5.660 ( 2.510 -3.083 -3.250) 5.135 5.660 ( 2.510 3.083 -3.250) 5.135 5.840 ( -3.207 -4.869 -2.490) 6.340 5.840 ( -3.207 4.869 -2.490) 6.340 6.023 ( 1.320 -2.874 -1.539) 3.517 6.023 ( 1.320 2.874 -1.539) 3.517 6.100 ( -2.593 -4.396 0.649) 5.145 6.100 ( -2.593 4.396 0.649) 5.145 6.307 ( -2.407 -8.100 -6.763) 10.824 6.307 ( -2.407 8.100 -6.763) 10.824 6.421 ( 5.492 -3.746 1.612) 6.841 6.421 ( 5.492 3.746 1.612) 6.841 6.491 ( -2.185 -3.735 3.574) 5.612 6.491 ( -2.185 3.735 3.574) 5.612 6.801 ( -1.774 -2.326 0.142) 2.929 6.801 ( -1.774 2.326 0.142) 2.929 6.912 ( -4.599 -1.564 1.268) 5.021 6.912 ( -4.599 1.564 1.268) 5.021 7.094 ( -3.906 -4.715 3.568) 7.086 7.094 ( -3.906 4.715 3.568) 7.086 7.228 ( 0.374 -2.142 -1.509) 2.646 7.228 ( 0.374 2.142 -1.509) 2.646 7.389 ( -4.926 -2.237 0.022) 5.410 7.389 ( -4.926 2.237 0.022) 5.410 7.552 ( -3.257 -2.226 -0.814) 4.028 7.552 ( -3.257 2.226 -0.814) 4.028 8.318 ( -18.837 -6.096 -0.976) 19.823 8.318 ( -18.837 6.096 -0.976) 19.823 8.445 ( -14.878 -6.328 -0.756) 16.185 8.445 ( -14.878 6.328 -0.756) 16.185 9.005 ( 1.189 -1.882 -1.135) 2.498 9.005 ( 1.189 1.882 -1.135) 2.498 9.127 ( 0.397 -3.525 0.055) 3.547 9.127 ( 0.397 3.525 0.055) 3.547 9.265 ( 4.542 -0.568 -0.168) 4.581 9.265 ( 4.542 0.568 -0.168) 4.581 9.349 ( 5.443 -2.082 -0.094) 5.828 9.349 ( 5.443 2.082 -0.094) 5.828 9.489 ( 2.374 -1.704 1.891) 3.481 9.489 ( 2.374 1.704 1.891) 3.481 9.624 ( 2.681 -4.066 -1.893) 5.225 9.624 ( 2.681 4.066 -1.893) 5.225 9.995 ( -3.279 -2.629 1.825) 4.582 9.995 ( -3.279 2.629 1.825) 4.582 10.227 ( -10.680 -2.486 -1.051) 11.016 10.227 ( -10.680 2.486 -1.051) 11.016 10.350 ( -9.718 -4.665 2.062) 10.975 10.350 ( -9.718 4.665 2.062) 10.975 10.505 ( -6.554 -0.974 -2.147) 6.965 10.505 ( -6.554 0.974 -2.147) 6.965 10.778 ( -6.438 -6.793 0.789) 9.392 10.778 ( -6.438 6.793 0.789) 9.392 10.918 ( -5.217 -4.512 -0.612) 6.924 10.918 ( -5.217 4.512 -0.612) 6.924 11.546 ( 10.631 -0.798 -1.026) 10.711 11.546 ( 10.631 0.798 -1.026) 10.711 11.618 ( 10.217 -1.086 1.011) 10.324 11.618 ( 10.217 1.086 1.011) 10.324 12.167 ( 1.920 -6.552 2.601) 7.306 12.167 ( 1.920 6.552 2.601) 7.306 12.244 ( 0.673 -5.532 -2.152) 5.974 12.244 ( 0.673 5.532 -2.152) 5.974 12.371 ( -3.931 -0.219 0.886) 4.035 12.371 ( -3.931 0.219 0.886) 4.035 12.428 ( -3.260 -3.526 -1.023) 4.910 12.428 ( -3.260 3.526 -1.023) 4.910 12.803 ( 1.708 -6.420 0.234) 6.647 12.803 ( 1.708 6.420 0.234) 6.647 12.880 ( -0.055 -4.971 -0.103) 4.972 12.880 ( -0.055 4.971 -0.103) 4.972 13.484 ( 7.237 -8.232 -0.121) 10.962 13.484 ( 7.237 8.232 -0.121) 10.962 13.531 ( 7.456 -9.370 0.025) 11.975 13.531 ( 7.456 9.370 0.025) 11.975 14.193 ( -2.062 -4.588 0.552) 5.060 14.193 ( -2.062 4.588 0.552) 5.060 14.250 ( -2.938 -4.919 -0.849) 5.792 14.250 ( -2.938 4.919 -0.849) 5.792 14.623 ( 5.489 -3.483 2.198) 6.862 14.623 ( 5.489 3.483 2.198) 6.862 14.754 ( 0.135 -1.977 -1.629) 2.565 14.754 ( 0.135 1.977 -1.629) 2.565 15.133 ( 7.354 -7.772 1.239) 10.772 15.133 ( 7.354 7.772 1.239) 10.772 15.241 ( 9.866 -3.512 -1.520) 10.582 15.241 ( 9.866 3.512 -1.520) 10.582 15.492 ( 1.705 -5.858 0.569) 6.128 15.492 ( 1.705 5.858 0.569) 6.128 15.593 ( -6.472 -3.862 -1.069) 7.612 15.593 ( -6.472 3.862 -1.069) 7.612 15.927 ( 4.510 -1.854 2.374) 5.423 15.927 ( 4.510 1.854 2.374) 5.423 15.982 ( 4.316 -3.992 -4.650) 7.495 15.982 ( 4.316 3.992 -4.650) 7.495 16.603 ( 2.516 -1.249 -1.113) 3.022 16.603 ( 2.516 1.249 -1.113) 3.022 16.684 ( 2.453 -1.113 1.768) 3.223 16.684 ( 2.453 1.113 1.768) 3.223 17.335 ( -0.029 -0.601 0.116) 0.613 17.335 ( -0.029 0.601 0.116) 0.613 17.393 ( 0.993 -1.651 -0.549) 2.003 17.393 ( 0.993 1.651 -0.549) 2.003 19.844 ( 3.902 -2.448 -1.355) 4.802 19.844 ( 3.902 2.448 -1.355) 4.802 20.038 ( 4.886 -0.559 0.204) 4.922 20.038 ( 4.886 0.559 0.204) 4.922 20.492 ( -5.949 -2.556 1.857) 6.736 20.492 ( -5.949 2.556 1.857) 6.736 20.794 ( -1.494 -1.677 -1.496) 2.699 20.794 ( -1.494 1.677 -1.496) 2.699 22.113 ( 6.644 -0.705 -1.859) 6.935 22.113 ( 6.644 0.705 -1.859) 6.935 22.174 ( 5.865 -1.724 1.954) 6.417 22.174 ( 5.865 1.724 1.954) 6.417 22.953 ( -5.979 -2.788 -1.766) 6.830 22.953 ( -5.979 2.788 -1.766) 6.830 23.153 ( -11.975 -1.391 1.989) 12.218 23.153 ( -11.975 1.391 1.989) 12.218 26.908 ( 20.603 -3.058 1.972) 20.922 26.908 ( 20.603 3.058 1.972) 20.922 27.035 ( 22.930 -5.431 -3.743) 23.860 27.035 ( 22.930 5.431 -3.743) 23.860 28.894 ( -19.629 -8.360 1.133) 21.366 28.894 ( -19.629 8.360 1.133) 21.366 28.972 ( -20.041 -7.423 -1.353) 21.415 28.972 ( -20.041 7.423 -1.353) 21.415 30.429 ( 9.257 -5.999 3.933) 11.711 30.429 ( 9.257 5.999 3.933) 11.711 30.623 ( 3.603 -4.389 -2.068) 6.043 30.623 ( 3.603 4.389 -2.068) 6.043 30.940 ( 6.949 -2.459 -0.968) 7.434 30.940 ( 6.949 2.459 -0.968) 7.434 31.119 ( 5.687 -5.303 -0.554) 7.796 31.119 ( 5.687 5.303 -0.554) 7.796 31.768 ( -3.819 -9.334 3.732) 10.754 31.768 ( -3.819 9.334 3.732) 10.754 31.926 ( -9.789 -7.311 -5.200) 13.278 31.926 ( -9.789 7.311 -5.200) 13.278 32.078 ( 0.571 -7.394 0.520) 7.434 32.078 ( 0.571 7.394 0.520) 7.434 32.233 ( 1.886 -8.637 -10.287) 13.563 32.233 ( 1.886 8.637 -10.287) 13.563 32.825 ( 11.668 -1.803 3.361) 12.275 32.825 ( 11.668 1.803 3.361) 12.275 33.050 ( 12.348 -0.298 -3.908) 12.955 33.050 ( 12.348 0.298 -3.908) 12.955 33.676 ( -3.568 -0.231 2.335) 4.270 33.676 ( -3.568 0.231 2.335) 4.270 33.908 ( -6.231 -0.927 -4.019) 7.472 33.908 ( -6.231 0.927 -4.019) 7.472 34.957 ( -2.228 -2.332 -0.063) 3.226 34.957 ( -2.228 2.332 -0.063) 3.226 35.177 ( 2.189 -1.066 1.626) 2.928 35.177 ( 2.189 1.066 1.626) 2.928 35.668 ( 3.465 -4.484 -2.838) 6.338 35.668 ( 3.465 4.484 -2.838) 6.338 35.732 ( 4.937 -2.357 -1.167) 5.594 35.732 ( 4.937 2.357 -1.167) 5.594 36.194 ( 2.695 -0.637 10.164) 10.535 36.194 ( 2.695 0.637 10.164) 10.535 36.366 ( 2.211 -1.665 -8.591) 9.026 36.366 ( 2.211 1.665 -8.591) 9.026 37.645 ( -9.184 -11.703 17.966) 23.325 37.645 ( -9.184 11.703 17.966) 23.325 38.208 ( -14.046 -10.805 -8.351) 19.590 38.208 ( -14.046 10.805 -8.351) 19.590 ======================= Grid point 69 (37/69) ======================= q-point: ( 0.33 -0.50 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.970 ( -1.338 -4.265 -8.361) 9.481 1.970 ( -1.338 4.265 -8.361) 9.481 2.164 ( 18.440 -4.093 5.089) 19.562 2.164 ( 18.440 4.093 5.089) 19.562 2.244 ( -3.551 -11.062 1.384) 11.700 2.244 ( -3.551 11.062 1.384) 11.700 2.551 ( 9.933 -4.361 2.526) 11.139 2.551 ( 9.933 4.361 2.526) 11.139 2.700 ( 5.621 -5.083 2.291) 7.917 2.700 ( 5.621 5.083 2.291) 7.917 2.845 ( -5.505 -6.340 -0.074) 8.397 2.845 ( -5.505 6.340 -0.074) 8.397 2.998 ( 6.381 -6.362 -2.721) 9.412 2.998 ( 6.381 6.362 -2.721) 9.412 3.142 ( -2.682 -3.734 -2.046) 5.032 3.142 ( -2.682 3.734 -2.046) 5.032 3.266 ( -2.051 -2.111 -0.594) 3.003 3.266 ( -2.051 2.111 -0.594) 3.003 3.341 ( 6.920 -5.263 -2.097) 8.944 3.341 ( 6.920 5.263 -2.097) 8.944 3.594 ( 3.051 -4.075 -10.686) 11.836 3.594 ( 3.051 4.075 -10.686) 11.836 3.771 ( 6.528 -3.089 9.794) 12.169 3.771 ( 6.528 3.089 9.794) 12.169 3.862 ( 1.254 -1.499 3.825) 4.295 3.862 ( 1.254 1.499 3.825) 4.295 4.050 ( 2.157 -1.139 1.399) 2.812 4.050 ( 2.157 1.139 1.399) 2.812 4.203 ( 9.447 -6.407 -0.891) 11.450 4.203 ( 9.447 6.407 -0.891) 11.450 4.344 ( 2.900 -4.769 -3.864) 6.788 4.344 ( 2.900 4.769 -3.864) 6.788 4.424 ( 1.245 -6.737 0.886) 6.908 4.424 ( 1.245 6.737 0.886) 6.908 4.451 ( 1.007 -6.849 -0.319) 6.930 4.451 ( 1.007 6.849 -0.319) 6.930 4.682 ( 1.700 -5.707 3.322) 6.819 4.682 ( 1.700 5.707 3.322) 6.819 4.849 ( -3.239 -0.668 -4.036) 5.218 4.849 ( -3.239 0.668 -4.036) 5.218 4.889 ( 0.549 -4.668 -2.304) 5.235 4.889 ( 0.549 4.668 -2.304) 5.235 5.199 ( 3.060 -0.403 0.292) 3.101 5.199 ( 3.060 0.403 0.292) 3.101 5.354 ( 3.445 -5.403 5.590) 8.503 5.354 ( 3.445 5.403 5.590) 8.503 5.377 ( -3.849 -5.535 2.562) 7.212 5.377 ( -3.849 5.535 2.562) 7.212 5.575 ( 1.811 -7.654 0.660) 7.893 5.575 ( 1.811 7.654 0.660) 7.893 5.716 ( 0.737 -2.987 3.401) 4.586 5.716 ( 0.737 2.987 3.401) 4.586 5.757 ( -2.127 -5.657 -1.855) 6.322 5.757 ( -2.127 5.657 -1.855) 6.322 5.953 ( -5.674 -5.020 -1.946) 7.822 5.953 ( -5.674 5.020 -1.946) 7.822 6.078 ( 0.518 -2.499 -0.297) 2.569 6.078 ( 0.518 2.499 -0.297) 2.569 6.250 ( -0.637 -4.846 -0.755) 4.946 6.250 ( -0.637 4.846 -0.755) 4.946 6.440 ( -3.994 -2.069 0.389) 4.515 6.440 ( -3.994 2.069 0.389) 4.515 6.523 ( 2.846 -1.464 -0.436) 3.230 6.523 ( 2.846 1.464 -0.436) 3.230 6.787 ( 0.443 -1.980 -0.674) 2.138 6.787 ( 0.443 1.980 -0.674) 2.138 6.890 ( -0.657 -3.778 -0.015) 3.834 6.890 ( -0.657 3.778 -0.015) 3.834 7.090 ( -0.612 -4.273 4.224) 6.039 7.090 ( -0.612 4.273 4.224) 6.039 7.217 ( -0.620 -2.559 -1.934) 3.267 7.217 ( -0.620 2.559 -1.934) 3.267 7.291 ( -4.285 -2.340 -1.922) 5.247 7.291 ( -4.285 2.340 -1.922) 5.247 7.483 ( -4.202 -2.875 0.274) 5.099 7.483 ( -4.202 2.875 0.274) 5.099 8.030 ( -15.629 -7.444 -0.792) 17.329 8.030 ( -15.629 7.444 -0.792) 17.329 8.223 ( -11.808 -7.245 -1.129) 13.899 8.223 ( -11.808 7.245 -1.129) 13.899 9.024 ( 2.051 -1.029 -0.538) 2.357 9.024 ( 2.051 1.029 -0.538) 2.357 9.136 ( 0.154 -4.407 0.757) 4.474 9.136 ( 0.154 4.407 0.757) 4.474 9.336 ( 4.493 -0.979 0.408) 4.616 9.336 ( 4.493 0.979 0.408) 4.616 9.399 ( 1.026 -0.894 0.141) 1.368 9.399 ( 1.026 0.894 0.141) 1.368 9.560 ( 4.089 -3.366 0.765) 5.351 9.560 ( 4.089 3.366 0.765) 5.351 9.653 ( 2.984 -3.734 0.323) 4.791 9.653 ( 2.984 3.734 0.323) 4.791 9.891 ( -10.704 -0.888 0.184) 10.742 9.891 ( -10.704 0.888 0.184) 10.742 10.063 ( -8.382 -2.459 -1.011) 8.794 10.063 ( -8.382 2.459 -1.011) 8.794 10.255 ( -3.792 -2.841 -1.839) 5.083 10.255 ( -3.792 2.841 -1.839) 5.083 10.411 ( -4.453 -3.721 1.470) 5.986 10.411 ( -4.453 3.721 1.470) 5.986 10.710 ( -3.512 -7.225 1.187) 8.121 10.710 ( -3.512 7.225 1.187) 8.121 10.833 ( -4.274 -3.572 -0.704) 5.614 10.833 ( -4.274 3.572 -0.704) 5.614 11.685 ( 8.074 -1.962 -0.730) 8.341 11.685 ( 8.074 1.962 -0.730) 8.341 11.762 ( 6.247 -1.766 0.871) 6.550 11.762 ( 6.247 1.766 0.871) 6.550 12.179 ( -2.038 -3.985 0.322) 4.488 12.179 ( -2.038 3.985 0.322) 4.488 12.256 ( 2.374 -2.074 -1.195) 3.371 12.256 ( 2.374 2.074 -1.195) 3.371 12.337 ( -1.722 -1.481 1.847) 2.927 12.337 ( -1.722 1.481 1.847) 2.927 12.393 ( 0.327 -3.672 -0.884) 3.791 12.393 ( 0.327 3.672 -0.884) 3.791 12.811 ( -0.787 -3.784 -0.715) 3.931 12.811 ( -0.787 3.784 -0.715) 3.931 12.876 ( -0.338 -3.310 0.338) 3.344 12.876 ( -0.338 3.310 0.338) 3.344 13.587 ( 5.599 -9.032 0.154) 10.628 13.587 ( 5.599 9.032 0.154) 10.628 13.626 ( 4.627 -8.896 -0.110) 10.028 13.626 ( 4.627 8.896 -0.110) 10.028 14.195 ( 2.287 -3.015 0.078) 3.785 14.195 ( 2.287 3.015 0.078) 3.785 14.254 ( 3.690 -2.226 -0.316) 4.321 14.254 ( 3.690 2.226 -0.316) 4.321 14.662 ( -3.964 -6.408 2.051) 7.809 14.662 ( -3.964 6.408 2.051) 7.809 14.710 ( -2.243 -5.827 -2.345) 6.669 14.710 ( -2.243 5.827 -2.345) 6.669 15.199 ( 0.029 -7.816 1.425) 7.945 15.199 ( 0.029 7.816 1.425) 7.945 15.303 ( 0.590 -5.733 -1.379) 5.926 15.303 ( 0.590 5.733 -1.379) 5.926 15.538 ( 2.091 -0.900 -1.535) 2.746 15.538 ( 2.091 0.900 -1.535) 2.746 15.580 ( 5.430 -1.386 1.773) 5.878 15.580 ( 5.430 1.386 1.773) 5.878 15.980 ( 5.658 -0.452 -3.374) 6.603 15.980 ( 5.658 0.452 -3.374) 6.603 16.074 ( 4.926 -0.534 2.858) 5.720 16.074 ( 4.926 0.534 2.858) 5.720 16.603 ( -0.473 -0.560 -0.392) 0.831 16.603 ( -0.473 0.560 -0.392) 0.831 16.727 ( 0.012 -0.802 1.439) 1.647 16.727 ( 0.012 0.802 1.439) 1.647 17.350 ( 1.572 -0.833 0.324) 1.808 17.350 ( 1.572 0.833 0.324) 1.808 17.396 ( 0.240 -1.266 -0.884) 1.562 17.396 ( 0.240 1.266 -0.884) 1.562 19.911 ( 6.378 -0.195 -1.066) 6.469 19.911 ( 6.378 0.195 -1.066) 6.469 20.131 ( 5.425 -1.556 1.137) 5.757 20.131 ( 5.425 1.556 1.137) 5.757 20.410 ( -7.382 -2.445 2.323) 8.116 20.410 ( -7.382 2.445 2.323) 8.116 20.746 ( -2.471 -1.660 -1.134) 3.186 20.746 ( -2.471 1.660 -1.134) 3.186 22.209 ( 8.571 -0.493 -1.373) 8.694 22.209 ( 8.571 0.493 -1.373) 8.694 22.298 ( 7.009 -0.738 0.974) 7.115 22.298 ( 7.009 0.738 0.974) 7.115 22.831 ( -7.371 -3.679 -1.227) 8.329 22.831 ( -7.371 3.679 -1.227) 8.329 22.989 ( -11.005 -2.179 1.279) 11.291 22.989 ( -11.005 2.179 1.279) 11.291 27.264 ( 22.676 -4.350 -1.587) 23.144 27.264 ( 22.676 4.350 -1.587) 23.144 27.377 ( 22.948 -5.792 2.389) 23.788 27.377 ( 22.948 5.792 2.389) 23.788 28.575 ( -21.771 -8.973 -0.738) 23.559 28.575 ( -21.771 8.973 -0.738) 23.559 28.638 ( -20.802 -8.627 0.437) 22.524 28.638 ( -20.802 8.627 0.437) 22.524 30.562 ( 5.957 -5.413 -0.431) 8.060 30.562 ( 5.957 5.413 -0.431) 8.060 30.687 ( 4.141 -3.949 1.095) 5.826 30.687 ( 4.141 3.949 1.095) 5.826 31.053 ( 7.001 -5.946 0.425) 9.195 31.053 ( 7.001 5.946 0.425) 9.195 31.210 ( 6.565 -6.750 0.385) 9.423 31.210 ( 6.565 6.750 0.385) 9.423 31.652 ( -9.777 -4.543 -2.994) 11.189 31.652 ( -9.777 4.543 -2.994) 11.189 31.767 ( -7.335 -0.891 1.560) 7.551 31.767 ( -7.335 0.891 1.560) 7.551 32.169 ( 3.538 -3.384 3.026) 5.756 32.169 ( 3.538 3.384 3.026) 5.756 32.208 ( 3.545 -8.819 0.872) 9.544 32.208 ( 3.545 8.819 0.872) 9.544 33.028 ( 8.446 -1.963 3.418) 9.320 33.028 ( 8.446 1.963 3.418) 9.320 33.207 ( 12.207 -0.711 -2.783) 12.540 33.207 ( 12.207 0.711 -2.783) 12.540 33.626 ( -4.016 -0.910 -0.735) 4.183 33.626 ( -4.016 0.910 -0.735) 4.183 33.785 ( -7.753 -0.662 1.836) 7.995 33.785 ( -7.753 0.662 1.836) 7.995 34.921 ( -1.265 -2.159 -0.947) 2.676 34.921 ( -1.265 2.159 -0.947) 2.676 35.215 ( 1.783 -1.214 -0.693) 2.266 35.215 ( 1.783 1.214 -0.693) 2.266 35.693 ( 2.319 -5.543 -0.489) 6.029 35.693 ( 2.319 5.543 -0.489) 6.029 35.792 ( 3.737 -2.744 -0.456) 4.658 35.792 ( 3.737 2.744 -0.456) 4.658 36.288 ( 4.596 -2.333 -6.908) 8.619 36.288 ( 4.596 2.333 -6.908) 8.619 36.359 ( 1.623 -1.364 3.229) 3.863 36.359 ( 1.623 1.364 3.229) 3.863 37.616 ( -7.776 -1.150 1.789) 8.061 37.616 ( -7.776 1.150 1.789) 8.061 37.940 ( -12.480 -2.308 -0.396) 12.698 37.940 ( -12.480 2.308 -0.396) 12.698 ======================= Grid point 71 (38/69) ======================= q-point: ( 0.44 -0.50 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.909 ( 4.057 -6.234 -1.216) 7.537 1.909 ( 4.057 6.234 -1.216) 7.537 2.206 ( -3.327 -7.840 2.003) 8.749 2.206 ( -3.327 7.840 2.003) 8.749 2.419 ( 6.944 -3.717 -0.567) 7.896 2.419 ( 6.944 3.717 -0.567) 7.896 2.631 ( -8.409 -4.679 -3.965) 10.408 2.631 ( -8.409 4.679 -3.965) 10.408 2.700 ( 1.952 -2.618 -3.200) 4.572 2.700 ( 1.952 2.618 -3.200) 4.572 2.832 ( 5.244 -3.818 -1.151) 6.588 2.832 ( 5.244 3.818 -1.151) 6.588 3.013 ( 2.490 -4.451 -4.048) 6.511 3.013 ( 2.490 4.451 -4.048) 6.511 3.130 ( 3.132 -4.723 0.332) 5.677 3.130 ( 3.132 4.723 0.332) 5.677 3.246 ( -1.288 -4.632 0.314) 4.818 3.246 ( -1.288 4.632 0.314) 4.818 3.410 ( 1.076 -8.539 -4.304) 9.622 3.410 ( 1.076 8.539 -4.304) 9.622 3.563 ( 6.515 -2.465 -6.262) 9.366 3.563 ( 6.515 2.465 -6.262) 9.366 3.812 ( -1.711 -4.266 1.104) 4.727 3.812 ( -1.711 4.266 1.104) 4.727 3.924 ( 2.472 -3.298 -5.591) 6.946 3.924 ( 2.472 3.298 -5.591) 6.946 4.090 ( 1.355 -9.189 -1.207) 9.366 4.090 ( 1.355 9.189 -1.207) 9.366 4.257 ( -2.675 -6.022 0.209) 6.593 4.257 ( -2.675 6.022 0.209) 6.593 4.331 ( 2.940 -1.321 2.361) 3.996 4.331 ( 2.940 1.321 2.361) 3.996 4.430 ( 0.852 -1.917 0.678) 2.205 4.430 ( 0.852 1.917 0.678) 2.205 4.532 ( 1.359 -5.804 2.997) 6.672 4.532 ( 1.359 5.804 2.997) 6.672 4.695 ( -1.994 -8.352 2.364) 8.906 4.695 ( -1.994 8.352 2.364) 8.906 4.833 ( 4.448 -5.044 -0.445) 6.740 4.833 ( 4.448 5.044 -0.445) 6.740 4.906 ( -0.419 -2.167 0.589) 2.285 4.906 ( -0.419 2.167 0.589) 2.285 5.198 ( -0.502 -6.094 -1.576) 6.314 5.198 ( -0.502 6.094 -1.576) 6.314 5.327 ( -2.558 -9.161 -0.670) 9.535 5.327 ( -2.558 9.161 -0.670) 9.535 5.446 ( 0.102 -8.018 2.744) 8.475 5.446 ( 0.102 8.018 2.744) 8.475 5.577 ( -4.623 -2.700 -0.981) 5.443 5.577 ( -4.623 2.700 -0.981) 5.443 5.715 ( 1.447 -1.009 7.630) 7.831 5.715 ( 1.447 1.009 7.630) 7.831 5.839 ( 4.152 -2.293 3.899) 6.140 5.839 ( 4.152 2.293 3.899) 6.140 5.893 ( -1.976 -3.081 0.217) 3.667 5.893 ( -1.976 3.081 0.217) 3.667 6.102 ( 1.130 -1.546 2.366) 3.044 6.102 ( 1.130 1.546 2.366) 3.044 6.229 ( -1.011 -5.432 -0.568) 5.555 6.229 ( -1.011 5.432 -0.568) 5.555 6.362 ( -6.043 -1.121 1.607) 6.353 6.362 ( -6.043 1.121 1.607) 6.353 6.549 ( 4.798 -2.997 -3.035) 6.420 6.549 ( 4.798 2.997 -3.035) 6.420 6.791 ( -2.197 -1.935 -2.690) 3.976 6.791 ( -2.197 1.935 -2.690) 3.976 6.860 ( 2.650 -1.250 -4.031) 4.983 6.860 ( 2.650 1.250 -4.031) 4.983 7.131 ( -0.019 -1.437 0.694) 1.596 7.131 ( -0.019 1.437 0.694) 1.596 7.197 ( -0.559 -3.867 3.026) 4.942 7.197 ( -0.559 3.867 3.026) 4.942 7.237 ( -1.103 -2.020 -0.921) 2.479 7.237 ( -1.103 2.021 -0.921) 2.479 7.441 ( -2.927 -2.755 0.991) 4.140 7.441 ( -2.927 2.755 0.991) 4.140 7.873 ( -4.289 -7.848 2.402) 9.261 7.873 ( -4.289 7.848 2.402) 9.261 8.082 ( -3.980 -7.818 -0.806) 8.810 8.082 ( -3.980 7.818 -0.806) 8.810 9.043 ( 1.138 -0.716 -0.828) 1.579 9.043 ( 1.138 0.716 -0.828) 1.579 9.145 ( -0.302 -3.703 1.091) 3.872 9.145 ( -0.302 3.703 1.091) 3.872 9.396 ( 1.716 -1.324 0.301) 2.188 9.396 ( 1.716 1.324 0.301) 2.188 9.421 ( 1.864 -1.332 1.238) 2.605 9.421 ( 1.864 1.332 1.238) 2.605 9.616 ( 1.909 -1.567 1.115) 2.709 9.616 ( 1.909 1.567 1.115) 2.709 9.704 ( -1.006 -1.092 0.876) 1.724 9.704 ( -1.006 1.092 0.876) 1.724 9.737 ( -4.686 -0.912 -0.649) 4.818 9.737 ( -4.686 0.912 -0.649) 4.818 9.945 ( -4.301 -1.693 -1.594) 4.889 9.945 ( -4.301 1.693 -1.594) 4.889 10.200 ( 0.889 -2.328 -2.994) 3.895 10.200 ( 0.889 2.328 -2.994) 3.895 10.370 ( -3.183 -3.908 0.328) 5.051 10.370 ( -3.183 3.908 0.328) 5.051 10.695 ( -1.206 -7.016 2.057) 7.410 10.695 ( -1.206 7.016 2.057) 7.410 10.786 ( -0.952 -4.605 0.101) 4.703 10.786 ( -0.952 4.605 0.101) 4.703 11.770 ( 3.428 -2.416 -0.100) 4.195 11.770 ( 3.428 2.416 -0.100) 4.195 11.823 ( 0.975 -0.880 0.184) 1.326 11.823 ( 0.975 0.880 0.184) 1.326 12.150 ( -0.748 -4.389 -0.912) 4.545 12.150 ( -0.748 4.389 -0.912) 4.545 12.258 ( 0.362 -0.791 -1.112) 1.411 12.258 ( 0.362 0.791 -1.112) 1.411 12.343 ( -1.137 -3.361 1.334) 3.791 12.343 ( -1.137 3.361 1.334) 3.791 12.413 ( 2.175 -3.957 -0.377) 4.531 12.413 ( 2.175 3.957 -0.377) 4.531 12.787 ( -0.505 -2.491 0.029) 2.542 12.787 ( -0.505 2.491 0.029) 2.542 12.870 ( -0.795 -2.233 -0.307) 2.391 12.870 ( -0.795 2.233 -0.307) 2.391 13.650 ( 2.131 -5.302 -0.023) 5.715 13.650 ( 2.131 5.302 -0.023) 5.715 13.669 ( 1.299 -5.513 -0.160) 5.666 13.669 ( 1.299 5.513 -0.160) 5.666 14.253 ( 3.404 -3.930 0.445) 5.218 14.253 ( 3.404 3.930 0.445) 5.218 14.321 ( 3.914 -2.098 -0.411) 4.460 14.321 ( 3.914 2.098 -0.411) 4.460 14.585 ( -5.366 -3.484 0.214) 6.402 14.585 ( -5.366 3.484 0.214) 6.402 14.653 ( -1.914 -6.593 -0.642) 6.895 14.653 ( -1.914 6.593 -0.642) 6.895 15.194 ( -1.187 -3.878 -0.071) 4.056 15.194 ( -1.187 3.878 -0.071) 4.056 15.278 ( -0.972 -2.644 -0.504) 2.861 15.278 ( -0.972 2.644 -0.504) 2.861 15.568 ( 2.375 -0.912 -0.934) 2.711 15.568 ( 2.375 0.912 -0.934) 2.711 15.657 ( 2.104 -1.378 0.268) 2.530 15.657 ( 2.104 1.378 0.268) 2.530 16.043 ( 4.873 -1.175 -1.065) 5.125 16.043 ( 4.873 1.175 -1.065) 5.125 16.140 ( 0.286 -1.175 1.399) 1.849 16.140 ( 0.286 1.175 1.399) 1.849 16.598 ( -0.411 -0.658 1.109) 1.354 16.598 ( -0.411 0.658 1.109) 1.354 16.719 ( -1.316 -0.945 -0.013) 1.620 16.719 ( -1.316 0.945 -0.013) 1.620 17.371 ( 0.103 -1.482 -1.285) 1.964 17.371 ( 0.103 1.482 -1.285) 1.964 17.393 ( 1.008 -0.476 0.682) 1.307 17.393 ( 1.008 0.476 0.682) 1.307 20.002 ( 5.870 -1.402 -0.867) 6.097 20.002 ( 5.870 1.402 -0.867) 6.097 20.189 ( 0.022 -2.485 0.032) 2.485 20.189 ( 0.022 2.485 0.032) 2.485 20.341 ( -4.774 -1.983 3.665) 6.337 20.341 ( -4.774 1.983 3.665) 6.337 20.710 ( -0.569 -1.495 -0.081) 1.601 20.710 ( -0.569 1.495 -0.081) 1.601 22.337 ( 7.446 -1.246 0.044) 7.550 22.337 ( 7.446 1.246 0.044) 7.550 22.382 ( 2.386 -1.610 -0.215) 2.887 22.382 ( 2.386 1.610 -0.215) 2.887 22.719 ( -4.389 -2.960 -0.877) 5.366 22.719 ( -4.389 2.960 -0.877) 5.366 22.862 ( -5.870 -1.671 0.901) 6.169 22.862 ( -5.870 1.671 0.901) 6.169 27.555 ( 17.080 -7.335 -1.841) 18.679 27.555 ( 17.080 7.335 -1.841) 18.679 27.718 ( 10.426 -11.567 2.551) 15.780 27.718 ( 10.426 11.567 2.551) 15.780 28.253 ( -12.850 -7.044 -0.368) 14.659 28.253 ( -12.850 7.044 -0.368) 14.659 28.381 ( -13.508 -10.405 2.513) 17.235 28.381 ( -13.508 10.405 2.513) 17.235 30.618 ( 2.327 -4.118 -1.243) 4.890 30.618 ( 2.327 4.118 -1.243) 4.890 30.743 ( 1.410 -2.187 0.580) 2.666 30.743 ( 1.410 2.187 0.580) 2.666 31.142 ( 3.373 -4.217 1.002) 5.492 31.142 ( 3.373 4.217 1.002) 5.492 31.311 ( 2.975 -3.377 -0.161) 4.504 31.311 ( 2.975 3.377 -0.161) 4.504 31.495 ( -3.973 -2.276 -1.443) 4.801 31.495 ( -3.973 2.276 -1.443) 4.801 31.710 ( -3.420 -0.771 3.392) 4.878 31.710 ( -3.420 0.771 3.392) 4.878 32.211 ( 1.037 -4.429 2.472) 5.177 32.211 ( 1.037 4.429 2.472) 5.177 32.341 ( 1.576 -9.108 10.194) 13.760 32.341 ( 1.576 9.108 10.194) 13.760 33.117 ( 0.688 -2.036 -1.206) 2.465 33.117 ( 0.688 2.036 -1.206) 2.465 33.359 ( 9.051 -0.578 -0.993) 9.123 33.359 ( 9.051 0.578 -0.993) 9.123 33.567 ( -1.313 -1.884 -0.384) 2.328 33.567 ( -1.313 1.884 -0.384) 2.328 33.704 ( -6.683 -0.736 3.945) 7.795 33.704 ( -6.683 0.736 3.945) 7.795 34.907 ( 0.314 -1.954 0.066) 1.980 34.907 ( 0.314 1.954 0.066) 1.980 35.211 ( 0.572 -1.286 -3.224) 3.518 35.211 ( 0.572 1.286 -3.224) 3.518 35.734 ( 1.614 -5.420 2.358) 6.127 35.734 ( 1.614 5.420 2.358) 6.127 35.833 ( 1.713 -3.321 0.359) 3.754 35.833 ( 1.713 3.321 0.359) 3.754 36.267 ( 6.320 -3.130 -11.014) 13.079 36.267 ( 6.320 3.130 -11.014) 13.079 36.346 ( -4.151 -2.085 -3.999) 6.129 36.346 ( -4.151 2.085 -3.999) 6.129 37.547 ( -1.777 -3.055 1.432) 3.813 37.547 ( -1.777 3.055 1.432) 3.813 37.800 ( -6.019 -0.528 0.874) 6.105 37.800 ( -6.019 0.528 0.874) 6.105 ======================= Grid point 73 (39/69) ======================= q-point: (-0.44 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( -3.812 -6.850 -2.994) 8.392 1.964 ( -3.812 6.850 -2.994) 8.392 2.207 ( 1.486 -5.595 4.969) 7.629 2.207 ( 1.486 5.595 4.969) 7.629 2.378 ( 0.320 -9.396 -8.777) 12.862 2.378 ( 0.320 9.396 -8.777) 12.862 2.457 ( -6.831 -13.089 -1.206) 14.814 2.457 ( -6.831 13.089 -1.206) 14.814 2.629 ( -6.078 -2.300 -3.347) 7.310 2.629 ( -6.078 2.300 -3.347) 7.310 2.844 ( -2.976 -7.159 -0.596) 7.776 2.844 ( -2.976 7.159 -0.596) 7.776 3.051 ( -3.309 -3.319 -3.860) 6.071 3.051 ( -3.309 3.319 -3.860) 6.071 3.140 ( 3.323 -4.786 -2.113) 6.198 3.140 ( 3.323 4.786 -2.113) 6.198 3.225 ( 0.788 -4.086 0.558) 4.199 3.225 ( 0.788 4.086 0.558) 4.199 3.348 ( 2.506 -9.280 -2.378) 9.902 3.348 ( 2.506 9.280 -2.378) 9.902 3.559 ( -2.497 -2.395 -3.012) 4.587 3.559 ( -2.497 2.395 -3.012) 4.587 3.706 ( -7.067 -7.081 -12.181) 15.763 3.706 ( -7.067 7.081 -12.181) 15.763 3.882 ( -0.544 -7.697 3.749) 8.579 3.882 ( -0.544 7.697 3.749) 8.579 4.067 ( -2.657 -6.349 -2.704) 7.395 4.067 ( -2.657 6.349 -2.704) 7.395 4.269 ( -3.831 -11.691 4.028) 12.945 4.269 ( -3.831 11.691 4.028) 12.945 4.393 ( 3.314 -5.854 0.801) 6.774 4.393 ( 3.314 5.854 0.801) 6.774 4.463 ( -2.293 -3.840 -0.045) 4.472 4.463 ( -2.293 3.840 -0.045) 4.472 4.544 ( 1.132 -4.071 1.929) 4.645 4.544 ( 1.132 4.071 1.929) 4.645 4.677 ( -2.200 -8.853 3.378) 9.728 4.677 ( -2.200 8.853 3.378) 9.728 4.854 ( 3.816 -4.344 -3.033) 6.529 4.854 ( 3.816 4.344 -3.033) 6.529 4.963 ( 4.674 -0.755 -0.856) 4.812 4.963 ( 4.674 0.755 -0.856) 4.812 5.163 ( -1.950 -9.055 -2.465) 9.585 5.163 ( -1.950 9.055 -2.465) 9.585 5.312 ( -0.845 -7.161 1.929) 7.464 5.312 ( -0.845 7.161 1.929) 7.464 5.415 ( -1.678 -4.818 -0.298) 5.111 5.415 ( -1.678 4.818 -0.298) 5.111 5.581 ( -1.780 -0.764 7.752) 7.990 5.581 ( -1.780 0.764 7.752) 7.990 5.788 ( -1.445 -1.025 1.022) 2.045 5.788 ( -1.445 1.025 1.022) 2.045 5.862 ( -0.682 -2.015 3.612) 4.192 5.862 ( -0.682 2.015 3.612) 4.192 5.937 ( 1.312 -3.196 5.070) 6.135 5.937 ( 1.312 3.196 5.070) 6.135 6.142 ( -0.079 -0.553 2.330) 2.396 6.142 ( -0.079 0.553 2.330) 2.396 6.243 ( 2.905 -3.397 1.418) 4.689 6.243 ( 2.905 3.397 1.418) 4.689 6.341 ( 1.988 -2.636 0.236) 3.310 6.341 ( 1.988 2.636 0.236) 3.310 6.603 ( 2.680 -2.476 -2.113) 4.217 6.603 ( 2.680 2.476 -2.113) 4.217 6.706 ( 0.308 -1.791 -4.058) 4.447 6.706 ( 0.308 1.791 -4.058) 4.447 6.811 ( -1.421 -1.897 -5.952) 6.406 6.811 ( -1.421 1.897 -5.952) 6.406 7.102 ( -7.885 -0.929 1.213) 8.032 7.102 ( -7.885 0.929 1.213) 8.032 7.208 ( 5.346 -2.659 0.566) 5.997 7.208 ( 5.346 2.659 0.566) 5.997 7.291 ( 1.036 -5.351 2.176) 5.868 7.291 ( 1.036 5.351 2.176) 5.868 7.420 ( 1.273 -1.678 0.339) 2.134 7.420 ( 1.273 1.678 0.339) 2.134 7.935 ( 6.275 -7.319 3.682) 10.319 7.935 ( 6.275 7.319 3.682) 10.319 8.094 ( 6.074 -7.057 -0.841) 9.349 8.094 ( 6.074 7.057 -0.841) 9.349 9.041 ( 0.011 -0.739 -0.790) 1.082 9.041 ( 0.011 0.739 -0.790) 1.082 9.151 ( -0.435 -2.994 1.117) 3.225 9.151 ( -0.435 2.994 1.117) 3.225 9.405 ( -1.943 -0.163 0.649) 2.055 9.405 ( -1.943 0.163 0.649) 2.055 9.448 ( -0.518 -0.905 1.777) 2.060 9.448 ( -0.518 0.905 1.777) 2.060 9.595 ( -4.154 -0.482 0.413) 4.203 9.595 ( -4.154 0.482 0.413) 4.203 9.674 ( -2.199 -1.737 -0.734) 2.897 9.674 ( -2.199 1.737 -0.734) 2.897 9.767 ( 7.093 -0.777 1.652) 7.324 9.767 ( 7.093 0.777 1.652) 7.324 9.933 ( 4.674 -1.939 -2.061) 5.463 9.933 ( 4.674 1.939 -2.061) 5.463 10.184 ( 0.137 -2.674 -3.668) 4.542 10.184 ( 0.137 2.674 -3.668) 4.542 10.352 ( 2.655 -1.977 0.041) 3.311 10.352 ( 2.655 1.977 0.041) 3.311 10.706 ( -0.501 -7.705 2.341) 8.068 10.706 ( -0.501 7.705 2.341) 8.068 10.805 ( 2.445 -5.508 0.345) 6.036 10.805 ( 2.445 5.508 0.345) 6.036 11.787 ( -1.573 -2.586 0.572) 3.081 11.787 ( -1.573 2.586 0.572) 3.081 11.804 ( -3.241 -1.620 -0.509) 3.659 11.804 ( -3.241 1.620 -0.509) 3.659 12.137 ( 0.175 -2.197 -1.013) 2.426 12.137 ( 0.175 2.197 -1.013) 2.426 12.257 ( 1.565 -1.739 -1.375) 2.713 12.257 ( 1.565 1.739 -1.375) 2.713 12.331 ( -1.704 -1.178 1.072) 2.332 12.331 ( -1.704 1.178 1.072) 2.332 12.419 ( -0.730 -3.554 -0.156) 3.632 12.419 ( -0.730 3.554 -0.156) 3.632 12.811 ( 1.728 -2.291 0.731) 2.962 12.811 ( 1.728 2.291 0.731) 2.962 12.849 ( -0.101 -1.358 -0.954) 1.662 12.849 ( -0.101 1.358 -0.954) 1.662 13.646 ( -2.209 -3.252 -0.113) 3.933 13.646 ( -2.209 3.252 -0.113) 3.933 13.669 ( -1.207 -3.712 -0.129) 3.906 13.669 ( -1.207 3.712 -0.129) 3.906 14.264 ( -3.216 -3.681 0.823) 4.957 14.264 ( -3.216 3.681 0.823) 4.957 14.316 ( -3.732 -1.538 -0.678) 4.093 14.316 ( -3.732 1.538 -0.678) 4.093 14.561 ( 2.476 -5.057 -0.322) 5.640 14.561 ( 2.476 5.057 -0.322) 5.640 14.671 ( 4.795 -1.139 -0.234) 4.934 14.671 ( 4.795 1.139 -0.234) 4.934 15.175 ( -0.502 -2.212 -0.401) 2.303 15.175 ( -0.502 2.212 -0.401) 2.303 15.282 ( 2.221 -2.738 -0.486) 3.559 15.282 ( 2.221 2.738 -0.486) 3.559 15.558 ( -2.817 -1.153 -1.138) 3.249 15.558 ( -2.817 1.153 -1.138) 3.249 15.653 ( -2.258 -1.413 0.201) 2.671 15.653 ( -2.258 1.413 0.201) 2.671 16.071 ( -1.498 -1.000 -1.027) 2.074 16.071 ( -1.498 1.000 -1.027) 2.074 16.136 ( -1.288 -1.509 1.813) 2.687 16.136 ( -1.288 1.509 1.813) 2.687 16.618 ( 0.748 -0.719 1.912) 2.176 16.618 ( 0.748 0.719 1.912) 2.176 16.703 ( -0.209 -1.987 -0.747) 2.133 16.703 ( -0.209 1.987 -0.747) 2.133 17.346 ( -0.989 -0.860 -0.978) 1.636 17.346 ( -0.989 0.860 -0.978) 1.636 17.417 ( 0.647 -1.280 0.347) 1.476 17.417 ( 0.647 1.280 0.347) 1.476 20.019 ( -3.375 -1.922 -0.817) 3.969 20.019 ( -3.375 1.922 -0.817) 3.969 20.186 ( 1.202 -0.952 0.047) 1.534 20.186 ( 1.202 0.952 0.047) 1.534 20.335 ( -1.643 -2.107 3.789) 4.636 20.335 ( -1.643 2.107 3.789) 4.636 20.731 ( 2.589 -1.576 0.313) 3.047 20.731 ( 2.589 1.576 0.313) 3.047 22.346 ( -5.158 -4.132 0.234) 6.613 22.346 ( -5.158 4.132 0.234) 6.613 22.380 ( -4.442 -4.033 -0.269) 6.006 22.380 ( -4.442 4.033 -0.269) 6.006 22.724 ( 7.163 -1.605 -0.947) 7.401 22.724 ( 7.163 1.605 -0.947) 7.401 22.853 ( 3.047 -1.477 0.868) 3.496 22.853 ( 3.047 1.477 0.868) 3.496 27.560 ( -20.930 -7.669 -1.884) 22.370 27.560 ( -20.930 7.669 -1.884) 22.370 27.701 ( -3.711 -10.733 2.298) 11.586 27.701 ( -3.711 10.733 2.298) 11.586 28.294 ( 9.961 -7.069 0.085) 12.215 28.294 ( 9.961 7.069 0.085) 12.215 28.395 ( 14.194 -6.478 3.180) 15.923 28.395 ( 14.194 6.478 3.180) 15.923 30.600 ( -3.080 -1.078 -1.013) 3.417 30.600 ( -3.080 1.078 -1.013) 3.417 30.742 ( -1.818 -1.152 0.115) 2.155 30.742 ( -1.818 1.152 0.115) 2.155 31.170 ( -3.235 -2.225 1.783) 4.312 31.170 ( -3.235 2.225 1.783) 4.312 31.258 ( -3.180 -4.902 -1.344) 5.995 31.258 ( -3.180 4.902 -1.344) 5.995 31.526 ( 5.376 -2.776 -0.811) 6.104 31.526 ( 5.376 2.776 -0.811) 6.104 31.748 ( 3.293 -3.540 2.998) 5.689 31.748 ( 3.293 3.540 2.998) 5.689 32.249 ( -4.219 -6.389 6.913) 10.315 32.249 ( -4.219 6.389 6.913) 10.315 32.489 ( 2.936 -7.657 12.135) 14.646 32.489 ( 2.936 7.657 12.135) 14.646 33.043 ( -5.352 -1.069 -3.488) 6.477 33.043 ( -5.352 1.069 -3.488) 6.477 33.395 ( -2.891 -0.591 -1.595) 3.354 33.395 ( -2.891 0.591 -1.595) 3.354 33.566 ( -1.272 -0.256 2.075) 2.447 33.566 ( -1.272 0.256 2.075) 2.447 33.741 ( 7.075 -0.186 3.804) 8.035 33.741 ( 7.075 0.186 3.804) 8.035 34.927 ( 0.718 -1.770 1.562) 2.468 34.927 ( 0.718 1.770 1.562) 2.468 35.165 ( -0.654 -0.962 -4.451) 4.600 35.165 ( -0.654 0.962 -4.451) 4.600 35.784 ( 0.456 -3.947 2.686) 4.796 35.784 ( 0.456 3.947 2.686) 4.796 35.860 ( 0.081 -4.457 2.604) 5.163 35.860 ( 0.081 4.457 2.604) 5.163 36.151 ( -5.982 -2.550 -10.047) 11.967 36.151 ( -5.982 2.550 -10.047) 11.967 36.258 ( 6.550 -2.711 -12.302) 14.198 36.258 ( 6.550 2.711 -12.302) 14.198 37.465 ( -13.046 -6.536 0.813) 14.615 37.465 ( -13.046 6.536 0.813) 14.615 37.871 ( 13.655 -9.233 1.687) 16.570 37.871 ( 13.655 9.233 1.687) 16.570 ======================= Grid point 75 (40/69) ======================= q-point: (-0.33 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -16.389 -13.194 -4.533) 21.523 1.721 ( -16.389 13.194 -4.533) 21.523 2.181 ( -17.163 -6.312 -5.472) 19.088 2.181 ( -17.163 6.312 -5.472) 19.088 2.259 ( -6.806 -6.554 -3.757) 10.168 2.259 ( -6.806 6.554 -3.757) 10.168 2.360 ( 1.628 -3.836 -1.158) 4.325 2.360 ( 1.628 3.836 -1.158) 4.325 2.614 ( 2.730 -5.031 5.493) 7.933 2.614 ( 2.730 5.031 5.493) 7.933 2.796 ( -2.583 -2.099 -0.932) 3.456 2.796 ( -2.583 2.099 -0.932) 3.456 2.877 ( -2.844 -4.989 -3.428) 6.689 2.877 ( -2.844 4.989 -3.428) 6.689 3.105 ( -3.919 -0.088 -4.394) 5.888 3.105 ( -3.919 0.088 -4.394) 5.888 3.269 ( -1.859 -3.880 -1.731) 4.638 3.269 ( -1.859 3.880 -1.731) 4.638 3.332 ( -3.223 -7.672 -1.177) 8.404 3.332 ( -3.223 7.672 -1.177) 8.404 3.539 ( 4.670 -3.281 2.298) 6.153 3.539 ( 4.670 3.281 2.298) 6.153 3.625 ( 6.409 -4.738 -0.529) 7.988 3.625 ( 6.409 4.738 -0.529) 7.988 3.812 ( -9.843 -7.597 -1.471) 12.520 3.812 ( -9.843 7.597 -1.471) 12.520 3.930 ( -6.834 -5.873 -4.015) 9.865 3.930 ( -6.834 5.873 -4.015) 9.865 4.197 ( -10.553 -10.662 -0.381) 15.006 4.197 ( -10.553 10.662 -0.381) 15.006 4.337 ( -4.586 -10.213 4.519) 12.073 4.337 ( -4.586 10.213 4.519) 12.073 4.464 ( -2.444 -4.781 2.204) 5.805 4.464 ( -2.444 4.781 2.204) 5.805 4.613 ( -2.406 -5.612 2.609) 6.640 4.613 ( -2.406 5.612 2.609) 6.640 4.723 ( 5.221 -7.813 2.412) 9.702 4.723 ( 5.221 7.813 2.412) 9.702 4.880 ( 2.874 -3.241 -7.402) 8.577 4.880 ( 2.874 3.241 -7.402) 8.577 4.936 ( -2.517 -2.859 -6.261) 7.329 4.936 ( -2.517 2.859 -6.261) 7.329 5.160 ( 5.720 -4.245 2.451) 7.533 5.160 ( 5.720 4.245 2.451) 7.533 5.315 ( -2.085 -1.518 1.534) 3.001 5.315 ( -2.085 1.518 1.534) 3.001 5.442 ( 1.999 -3.964 3.668) 5.759 5.442 ( 1.999 3.964 3.668) 5.759 5.592 ( -3.979 -2.573 4.737) 6.700 5.592 ( -3.979 2.573 4.737) 6.700 5.851 ( 4.132 -4.215 0.121) 5.904 5.851 ( 4.132 4.215 0.121) 5.904 5.881 ( -1.303 -2.792 5.530) 6.330 5.881 ( -1.303 2.792 5.530) 6.330 6.003 ( 1.999 -6.967 1.727) 7.451 6.003 ( 1.999 6.967 1.727) 7.451 6.139 ( -3.643 -1.888 2.461) 4.785 6.139 ( -3.643 1.888 2.461) 4.785 6.325 ( 3.551 -1.790 1.243) 4.167 6.325 ( 3.551 1.790 1.243) 4.167 6.409 ( 5.618 -2.501 0.256) 6.155 6.409 ( 5.618 2.501 0.256) 6.155 6.526 ( -4.723 -2.376 -4.142) 6.716 6.526 ( -4.723 2.376 -4.142) 6.716 6.711 ( 3.006 -0.543 -2.508) 3.953 6.711 ( 3.006 0.543 -2.508) 3.953 6.788 ( 4.899 -0.574 -1.962) 5.309 6.788 ( 4.899 0.574 -1.962) 5.309 7.021 ( -3.989 -1.919 2.581) 5.124 7.021 ( -3.989 1.919 2.581) 5.124 7.255 ( 0.103 -1.954 -1.063) 2.227 7.255 ( 0.103 1.954 -1.063) 2.227 7.304 ( 1.665 -0.675 -0.816) 1.973 7.304 ( 1.665 0.675 -0.816) 1.973 7.486 ( 4.356 -2.556 0.109) 5.052 7.486 ( 4.356 2.556 0.109) 5.052 8.115 ( 12.611 -5.444 1.574) 13.826 8.115 ( 12.611 5.444 1.574) 13.826 8.225 ( 12.230 -5.041 -1.647) 13.331 8.225 ( 12.230 5.041 -1.647) 13.331 9.030 ( -0.281 -0.869 -0.569) 1.076 9.030 ( -0.281 0.869 -0.569) 1.076 9.159 ( -0.322 -2.586 1.266) 2.897 9.159 ( -0.322 2.586 1.266) 2.897 9.361 ( -4.210 -1.344 1.374) 4.628 9.361 ( -4.210 1.344 1.374) 4.628 9.444 ( -2.155 -2.520 -0.004) 3.315 9.444 ( -2.155 2.520 -0.004) 3.315 9.513 ( -5.699 -1.627 0.902) 5.995 9.513 ( -5.699 1.627 0.902) 5.995 9.677 ( 0.905 -2.203 0.410) 2.416 9.677 ( 0.905 2.203 0.410) 2.416 9.899 ( 4.315 -1.345 1.422) 4.738 9.899 ( 4.315 1.345 1.422) 4.738 10.009 ( 9.581 -1.253 -3.406) 10.245 10.009 ( 9.581 1.253 -3.406) 10.245 10.172 ( 6.047 -5.808 -1.962) 8.610 10.172 ( 6.047 5.808 -1.962) 8.610 10.445 ( 7.453 -3.035 0.628) 8.072 10.445 ( 7.453 3.035 0.628) 8.072 10.740 ( 1.800 -6.727 2.041) 7.257 10.740 ( 1.800 6.727 2.041) 7.257 10.855 ( 4.041 -6.028 -0.376) 7.267 10.855 ( 4.041 6.028 -0.376) 7.267 11.707 ( -7.747 -1.675 -1.182) 8.013 11.707 ( -7.747 1.675 -1.182) 8.013 11.735 ( -6.685 -1.370 1.243) 6.936 11.735 ( -6.685 1.370 1.243) 6.936 12.126 ( -0.325 -2.196 -0.815) 2.365 12.126 ( -0.325 2.196 -0.815) 2.365 12.278 ( 2.321 -2.724 -0.391) 3.599 12.278 ( 2.321 2.724 -0.391) 3.599 12.326 ( -0.201 -3.554 0.810) 3.651 12.326 ( -0.201 3.554 0.810) 3.651 12.413 ( 0.700 -2.728 0.072) 2.818 12.413 ( 0.700 2.728 0.072) 2.818 12.803 ( -1.078 -5.488 -0.936) 5.670 12.803 ( -1.078 5.488 -0.936) 5.670 12.873 ( 1.650 -4.053 0.307) 4.387 12.873 ( 1.650 4.053 0.307) 4.387 13.589 ( -5.230 -6.931 0.278) 8.687 13.589 ( -5.230 6.931 0.278) 8.687 13.624 ( -4.455 -8.032 -0.216) 9.187 13.624 ( -4.455 8.032 -0.216) 9.187 14.205 ( -3.946 -3.584 0.391) 5.345 14.205 ( -3.946 3.584 0.391) 5.345 14.249 ( -2.218 -4.749 -0.519) 5.267 14.249 ( -2.218 4.749 -0.519) 5.267 14.598 ( 1.014 -8.421 -0.303) 8.488 14.598 ( 1.014 8.421 -0.303) 8.488 14.751 ( 4.636 -2.772 -0.532) 5.428 14.751 ( 4.636 2.772 -0.532) 5.428 15.170 ( -1.010 -8.310 0.534) 8.388 15.170 ( -1.010 8.310 0.534) 8.388 15.315 ( 0.995 -6.108 -0.742) 6.233 15.315 ( 0.995 6.108 -0.742) 6.233 15.480 ( -2.860 -0.906 -1.284) 3.264 15.480 ( -2.860 0.906 -1.284) 3.264 15.612 ( -2.957 -1.983 0.836) 3.657 15.612 ( -2.957 1.983 0.836) 3.657 15.973 ( -7.788 -1.931 -1.476) 8.158 15.973 ( -7.788 1.931 -1.476) 8.158 16.158 ( 0.261 -4.061 2.531) 4.792 16.158 ( 0.261 4.061 2.531) 4.792 16.650 ( 0.394 -1.127 -0.216) 1.213 16.650 ( 0.394 1.127 -0.216) 1.213 16.699 ( -0.016 -1.111 1.774) 2.094 16.699 ( -0.016 1.111 1.774) 2.094 17.327 ( -0.408 -0.680 -0.375) 0.878 17.327 ( -0.408 0.680 -0.375) 0.878 17.416 ( -0.656 -1.586 -0.262) 1.737 17.416 ( -0.656 1.586 -0.262) 1.737 19.935 ( -4.915 -4.137 -0.730) 6.466 19.935 ( -4.915 4.137 -0.730) 6.466 20.177 ( -4.304 -1.602 1.935) 4.984 20.177 ( -4.304 1.602 1.935) 4.984 20.394 ( 4.205 -2.491 2.436) 5.461 20.394 ( 4.205 2.491 2.436) 5.461 20.778 ( 3.167 -1.222 -0.380) 3.415 20.778 ( 3.167 1.222 -0.380) 3.415 22.225 ( -9.215 -1.852 -1.796) 9.570 22.225 ( -9.215 1.852 -1.796) 9.570 22.276 ( -7.034 -1.559 1.213) 7.306 22.276 ( -7.034 1.559 1.213) 7.306 22.864 ( 10.658 -1.837 -1.301) 10.893 22.864 ( 10.658 1.837 -1.301) 10.893 22.949 ( 7.270 -1.746 1.202) 7.573 22.949 ( 7.270 1.746 1.202) 7.573 27.185 ( -22.784 -4.688 -1.213) 23.293 27.185 ( -22.784 4.688 -1.213) 23.293 27.542 ( -19.642 -15.843 3.821) 25.523 27.542 ( -19.642 15.843 3.821) 25.523 28.546 ( 20.864 -7.409 -0.640) 22.149 28.546 ( 20.864 7.409 -0.640) 22.149 28.694 ( 19.082 -10.248 0.881) 21.678 28.694 ( 19.082 10.248 0.881) 21.678 30.500 ( -8.511 -4.379 -0.578) 9.589 30.500 ( -8.511 4.379 -0.578) 9.589 30.703 ( -2.794 -3.250 0.179) 4.289 30.703 ( -2.794 3.250 0.179) 4.289 31.093 ( -6.374 -2.052 1.133) 6.791 31.093 ( -6.374 2.052 1.133) 6.791 31.215 ( -4.316 -3.743 0.727) 5.759 31.215 ( -4.316 3.743 0.727) 5.759 31.608 ( 6.915 -5.156 -1.490) 8.753 31.608 ( 6.915 5.156 -1.490) 8.753 31.842 ( 5.915 -3.490 -0.162) 6.869 31.842 ( 5.915 3.490 -0.162) 6.869 32.223 ( -6.565 -8.210 4.699) 11.514 32.223 ( -6.565 8.210 4.699) 11.514 32.718 ( 4.233 -13.441 12.819) 19.050 32.718 ( 4.233 13.441 12.819) 19.050 32.920 ( -5.159 -1.379 -0.065) 5.341 32.920 ( -5.159 1.379 -0.065) 5.341 33.289 ( -6.571 -1.551 -0.293) 6.758 33.289 ( -6.571 1.551 -0.293) 6.758 33.618 ( 4.875 -5.328 3.986) 8.248 33.618 ( 4.875 5.328 3.986) 8.248 33.930 ( 10.303 -0.989 3.445) 10.908 33.930 ( 10.303 0.989 3.445) 10.908 34.953 ( -0.406 -1.422 2.197) 2.648 34.953 ( -0.406 1.422 2.197) 2.648 35.097 ( -1.082 -0.222 -5.276) 5.391 35.097 ( -1.082 0.222 -5.276) 5.391 35.794 ( -1.832 -3.241 1.174) 3.903 35.794 ( -1.832 3.241 1.174) 3.903 35.882 ( -3.146 -2.278 0.819) 3.969 35.882 ( -3.146 2.278 0.819) 3.969 35.983 ( -2.671 -0.484 -2.192) 3.489 35.983 ( -2.671 0.484 -2.192) 3.489 36.201 ( 6.447 -3.203 -16.818) 18.294 36.201 ( 6.447 3.203 -16.818) 18.294 37.212 ( -17.071 -8.678 -2.306) 19.288 37.212 ( -17.071 8.678 -2.306) 19.288 38.158 ( 18.001 -10.488 2.551) 20.989 38.158 ( 18.001 10.488 2.551) 20.989 ======================= Grid point 77 (41/69) ======================= q-point: (-0.22 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( -17.594 -21.051 -1.799) 27.494 1.415 ( -17.594 21.051 -1.799) 27.494 1.764 ( -24.038 -14.631 -0.025) 28.141 1.764 ( -24.038 14.631 -0.025) 28.141 2.155 ( -7.547 -3.905 3.343) 9.132 2.155 ( -7.547 3.905 3.343) 9.132 2.399 ( 3.805 -10.971 -0.935) 11.649 2.399 ( 3.805 10.971 -0.935) 11.649 2.646 ( -8.194 -15.448 4.689) 18.105 2.646 ( -8.194 15.448 4.689) 18.105 2.745 ( 2.616 -5.891 -3.856) 7.511 2.745 ( 2.616 5.891 -3.856) 7.511 2.869 ( 0.099 -5.607 -2.338) 6.076 2.869 ( 0.099 5.607 -2.338) 6.076 3.054 ( 5.787 -2.241 -3.139) 6.954 3.054 ( 5.787 2.241 -3.139) 6.954 3.174 ( -2.071 -8.632 -1.522) 9.007 3.174 ( -2.071 8.632 -1.522) 9.007 3.338 ( -4.461 -3.635 0.442) 5.772 3.338 ( -4.461 3.635 0.442) 5.772 3.564 ( 1.381 -0.467 -0.941) 1.735 3.564 ( 1.381 0.467 -0.941) 1.735 3.645 ( -10.121 -8.520 3.258) 13.625 3.645 ( -10.121 8.520 3.258) 13.625 3.723 ( 4.712 -6.684 0.500) 8.194 3.723 ( 4.712 6.684 0.500) 8.194 3.892 ( -1.976 -2.628 1.091) 3.464 3.892 ( -1.976 2.628 1.091) 3.464 4.020 ( -6.008 -6.730 -0.462) 9.034 4.020 ( -6.008 6.730 -0.462) 9.034 4.313 ( -5.737 -4.710 4.205) 8.531 4.313 ( -5.737 4.710 4.205) 8.531 4.446 ( -4.558 -3.017 4.493) 7.076 4.446 ( -4.558 3.017 4.493) 7.076 4.540 ( -5.482 -2.702 -0.820) 6.166 4.540 ( -5.482 2.702 -0.820) 6.166 4.689 ( -8.512 -4.569 -3.858) 10.402 4.689 ( -8.512 4.569 -3.858) 10.402 4.838 ( -0.018 -1.381 -5.561) 5.730 4.838 ( -0.018 1.381 -5.561) 5.730 4.918 ( 6.537 -6.867 0.037) 9.481 4.918 ( 6.537 6.867 0.037) 9.481 5.272 ( -0.246 -3.634 -0.691) 3.707 5.272 ( -0.246 3.634 -0.691) 3.707 5.306 ( 4.767 -5.240 0.484) 7.101 5.306 ( 4.767 5.240 0.484) 7.101 5.529 ( 2.667 -6.592 1.775) 7.329 5.529 ( 2.667 6.592 1.775) 7.329 5.605 ( -1.576 -3.019 5.425) 6.406 5.605 ( -1.576 3.019 5.425) 6.406 5.844 ( 0.379 -0.905 -0.239) 1.010 5.844 ( 0.379 0.905 -0.239) 1.010 5.911 ( -0.128 -3.650 -3.045) 4.755 5.911 ( -0.128 3.650 -3.045) 4.755 6.057 ( -0.121 -4.952 0.838) 5.024 6.057 ( -0.121 4.952 0.838) 5.024 6.105 ( -1.861 -1.821 1.195) 2.865 6.105 ( -1.861 1.821 1.195) 2.865 6.358 ( -4.677 -2.477 -1.844) 5.604 6.358 ( -4.677 2.477 -1.844) 5.604 6.409 ( 1.313 -4.891 4.633) 6.864 6.409 ( 1.313 4.891 4.633) 6.864 6.491 ( 2.499 -5.145 -1.558) 5.929 6.491 ( 2.499 5.145 -1.558) 5.929 6.769 ( 5.075 -4.086 -3.769) 7.527 6.769 ( 5.075 4.086 -3.769) 7.527 6.857 ( 5.776 -0.785 0.135) 5.830 6.857 ( 5.776 0.785 0.135) 5.830 7.047 ( 0.967 -4.231 4.395) 6.176 7.047 ( 0.967 4.231 4.395) 6.176 7.229 ( -1.243 -1.408 -1.542) 2.430 7.229 ( -1.243 1.408 -1.542) 2.430 7.316 ( 3.378 -2.489 -1.498) 4.456 7.316 ( 3.378 2.489 -1.498) 4.456 7.533 ( 2.770 -3.439 -1.144) 4.562 7.533 ( 2.770 3.439 -1.144) 4.562 8.353 ( 16.458 -4.548 0.049) 17.075 8.353 ( 16.458 4.548 0.049) 17.075 8.428 ( 15.901 -3.233 -1.313) 16.279 8.428 ( 15.901 3.233 -1.313) 16.279 9.022 ( 0.234 -2.713 -0.769) 2.829 9.022 ( 0.234 2.713 -0.769) 2.829 9.163 ( -1.260 -1.338 1.123) 2.153 9.163 ( -1.260 1.338 1.123) 2.153 9.307 ( -5.073 -1.889 0.906) 5.489 9.307 ( -5.073 1.889 0.906) 5.489 9.388 ( -3.282 -2.051 -0.642) 3.924 9.388 ( -3.282 2.051 -0.642) 3.924 9.456 ( -4.152 -1.354 1.602) 4.652 9.456 ( -4.152 1.354 1.602) 4.652 9.667 ( -1.906 -1.840 -0.973) 2.822 9.667 ( -1.906 1.840 -0.973) 2.822 9.913 ( -0.439 -4.302 0.071) 4.325 9.913 ( -0.439 4.302 0.071) 4.325 10.174 ( 13.088 -2.129 -0.843) 13.286 10.174 ( 13.088 2.129 -0.843) 13.286 10.327 ( 12.789 -5.345 0.124) 13.861 10.327 ( 12.789 5.345 0.124) 13.861 10.570 ( 7.514 -3.620 0.305) 8.347 10.570 ( 7.514 3.620 0.305) 8.347 10.805 ( 4.291 -5.363 0.483) 6.885 10.805 ( 4.291 5.363 0.483) 6.885 10.931 ( 6.471 -5.699 0.022) 8.622 10.931 ( 6.471 5.699 0.022) 8.622 11.552 ( -9.753 -1.484 -1.185) 9.936 11.552 ( -9.753 1.484 -1.185) 9.936 11.611 ( -10.675 -2.215 1.177) 10.966 11.611 ( -10.675 2.215 1.177) 10.966 12.107 ( -1.719 -5.224 0.200) 5.504 12.107 ( -1.719 5.224 0.200) 5.504 12.305 ( -0.398 -3.307 1.201) 3.541 12.305 ( -0.398 3.307 1.201) 3.541 12.345 ( 3.300 -2.127 -0.935) 4.036 12.345 ( 3.300 2.127 -0.935) 4.036 12.451 ( 3.907 -3.056 -0.219) 4.965 12.451 ( 3.907 3.056 -0.219) 4.965 12.780 ( -0.955 -7.373 -0.082) 7.435 12.780 ( -0.955 7.373 -0.082) 7.435 12.884 ( -0.267 -4.978 -0.106) 4.986 12.884 ( -0.267 4.978 -0.106) 4.986 13.493 ( -7.223 -5.764 0.110) 9.242 13.493 ( -7.223 5.764 0.110) 9.242 13.527 ( -7.620 -8.125 -0.118) 11.140 13.527 ( -7.620 8.125 -0.118) 11.140 14.185 ( 1.332 -3.396 0.300) 3.660 14.185 ( 1.332 3.396 0.300) 3.660 14.256 ( 3.809 -5.768 -0.640) 6.942 14.256 ( 3.809 5.768 -0.640) 6.942 14.568 ( -4.499 -11.181 0.531) 12.064 14.568 ( -4.499 11.181 0.531) 12.064 14.774 ( -1.508 -0.707 -0.656) 1.790 14.774 ( -1.508 0.707 -0.656) 1.790 15.112 ( -8.049 -9.455 0.527) 12.429 15.112 ( -8.049 9.455 0.527) 12.429 15.241 ( -7.569 -1.706 -1.006) 7.824 15.241 ( -7.569 1.706 -1.006) 7.824 15.491 ( 2.059 -3.589 0.146) 4.140 15.491 ( 2.059 3.589 0.146) 4.140 15.626 ( 5.075 -1.499 -0.178) 5.294 15.626 ( 5.075 1.499 -0.178) 5.294 15.842 ( -5.509 -1.409 -0.908) 5.759 15.842 ( -5.509 1.409 -0.908) 5.759 16.190 ( 1.255 -2.518 0.852) 2.939 16.190 ( 1.255 2.518 0.852) 2.939 16.615 ( -2.724 -1.803 -0.970) 3.407 16.615 ( -2.724 1.803 -0.970) 3.407 16.730 ( -1.472 -6.728 2.822) 7.443 16.730 ( -1.472 6.728 2.822) 7.443 17.323 ( 0.173 -0.782 -0.202) 0.826 17.323 ( 0.173 0.782 -0.202) 0.826 17.396 ( -1.193 -1.502 -0.521) 1.988 17.396 ( -1.193 1.502 -0.521) 1.988 19.867 ( -2.670 -5.741 -0.772) 6.378 19.867 ( -2.670 5.741 -0.772) 6.378 20.111 ( -6.038 -2.665 1.183) 6.705 20.111 ( -6.038 2.665 1.183) 6.705 20.487 ( 3.896 -1.677 1.943) 4.666 20.487 ( 3.896 1.677 1.943) 4.666 20.813 ( 2.294 -0.830 -1.027) 2.647 20.813 ( 2.294 0.830 -1.027) 2.647 22.063 ( -8.035 -1.050 -1.809) 8.303 22.063 ( -8.035 1.050 -1.809) 8.303 22.194 ( -5.516 -0.576 1.260) 5.687 22.194 ( -5.516 0.576 1.260) 5.687 23.001 ( 9.382 -1.107 -2.349) 9.735 23.001 ( 9.382 1.107 -2.349) 9.735 23.097 ( 9.066 -1.219 2.479) 9.477 23.097 ( 9.066 1.219 2.479) 9.477 26.857 ( -18.151 -2.448 -0.013) 18.315 26.857 ( -18.151 2.448 -0.013) 18.315 27.204 ( -26.706 -16.396 0.495) 31.342 27.204 ( -26.706 16.396 0.495) 31.342 28.861 ( 18.717 -5.010 -0.010) 19.376 28.861 ( 18.717 5.010 -0.010) 19.376 28.994 ( 19.516 -9.686 -0.429) 21.791 28.994 ( 19.516 9.686 -0.429) 21.791 30.331 ( -12.711 -8.221 0.359) 15.142 30.331 ( -12.711 8.221 0.359) 15.142 30.677 ( -0.771 -3.795 0.486) 3.903 30.677 ( -0.771 3.795 0.486) 3.903 31.025 ( -4.351 -2.011 1.562) 5.041 31.025 ( -4.351 2.011 1.562) 5.041 31.120 ( -7.361 -2.871 -1.089) 7.976 31.120 ( -7.361 2.871 -1.089) 7.976 31.679 ( 2.629 -5.867 -0.690) 6.466 31.679 ( 2.629 5.867 -0.690) 6.466 31.937 ( 8.374 -1.559 -1.234) 8.607 31.937 ( 8.374 1.559 -1.234) 8.607 32.198 ( -0.375 -6.236 1.710) 6.477 32.198 ( -0.375 6.236 1.710) 6.477 32.697 ( -8.653 -1.942 -0.579) 8.888 32.697 ( -8.653 1.942 -0.579) 8.888 32.905 ( -8.811 -2.685 2.354) 9.507 32.905 ( -8.811 2.685 2.354) 9.507 33.312 ( 8.006 -4.864 1.329) 9.462 33.312 ( 8.006 4.864 1.329) 9.462 33.868 ( 19.904 -14.914 7.553) 25.993 33.868 ( 19.904 14.914 7.553) 25.993 34.108 ( 9.067 -0.867 0.854) 9.149 34.108 ( 9.067 0.867 0.854) 9.149 34.958 ( -1.868 -0.608 0.921) 2.170 34.958 ( -1.868 0.608 0.921) 2.170 35.011 ( -0.997 -0.372 -6.531) 6.618 35.011 ( -0.997 0.372 -6.531) 6.618 35.744 ( -4.483 -2.321 -1.841) 5.374 35.744 ( -4.483 2.321 -1.841) 5.374 35.810 ( -1.716 -0.697 -0.960) 2.086 35.810 ( -1.716 0.697 -0.960) 2.086 35.946 ( -2.351 -2.184 -11.535) 11.973 35.946 ( -2.351 2.184 -11.535) 11.973 36.139 ( 1.630 -3.041 5.532) 6.520 36.139 ( 1.630 3.041 5.532) 6.520 36.931 ( -17.754 -8.717 2.764) 19.970 36.931 ( -17.754 8.717 2.764) 19.970 38.443 ( 15.826 -10.833 0.226) 19.180 38.443 ( 15.826 10.833 0.226) 19.180 ======================= Grid point 79 (42/69) ======================= q-point: (-0.11 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( -8.132 -21.057 14.653) 26.912 1.250 ( -8.132 21.057 14.653) 26.912 1.519 ( -14.832 -22.143 9.304) 28.228 1.519 ( -14.832 22.143 9.304) 28.228 2.097 ( -4.495 -8.068 1.871) 9.423 2.097 ( -4.495 8.068 1.871) 9.423 2.385 ( -6.102 -33.046 -0.787) 33.614 2.385 ( -6.102 33.046 -0.787) 33.614 2.579 ( -0.551 -13.048 2.267) 13.255 2.579 ( -0.551 13.048 2.267) 13.255 2.747 ( -1.037 -7.969 -0.688) 8.065 2.747 ( -1.037 7.969 -0.688) 8.065 2.882 ( 3.348 -1.272 0.498) 3.616 2.882 ( 3.348 1.272 0.498) 3.616 3.073 ( -2.124 -7.822 -6.064) 10.123 3.073 ( -2.124 7.822 -6.064) 10.123 3.160 ( 5.485 -3.024 -1.029) 6.348 3.160 ( 5.485 3.024 -1.029) 6.348 3.269 ( 1.446 -5.023 -2.288) 5.706 3.269 ( 1.446 5.023 -2.288) 5.706 3.554 ( -2.403 -3.192 -0.795) 4.074 3.554 ( -2.403 3.192 -0.795) 4.074 3.595 ( -8.531 -9.256 3.755) 13.136 3.595 ( -8.531 9.256 3.755) 13.136 3.746 ( 1.419 -3.093 3.586) 4.943 3.746 ( 1.419 3.093 3.586) 4.943 3.892 ( -0.759 -1.364 5.576) 5.791 3.892 ( -0.759 1.364 5.576) 5.791 4.025 ( 0.380 -3.962 1.664) 4.314 4.025 ( 0.380 3.962 1.664) 4.314 4.270 ( -3.409 -0.521 4.038) 5.310 4.270 ( -3.409 0.521 4.038) 5.310 4.391 ( -5.395 -10.653 0.737) 11.963 4.391 ( -5.395 10.653 0.737) 11.963 4.415 ( -7.832 -10.335 -6.219) 14.381 4.415 ( -7.832 10.335 -6.219) 14.381 4.599 ( -1.059 -8.047 1.914) 8.339 4.599 ( -1.059 8.047 1.914) 8.339 4.762 ( -1.233 -2.084 -2.079) 3.192 4.762 ( -1.233 2.084 -2.079) 3.192 5.022 ( 4.635 -4.514 2.464) 6.923 5.022 ( 4.635 4.514 2.464) 6.923 5.226 ( -0.511 -3.875 -4.838) 6.219 5.226 ( -0.511 3.875 -4.838) 6.219 5.358 ( 2.563 -1.884 -2.766) 4.216 5.358 ( 2.563 1.884 -2.766) 4.216 5.522 ( -0.639 -5.728 -4.252) 7.163 5.522 ( -0.639 5.728 -4.252) 7.163 5.651 ( -0.211 -5.693 3.289) 6.578 5.651 ( -0.211 5.693 3.289) 6.578 5.843 ( -3.151 -2.336 -3.115) 5.008 5.843 ( -3.151 2.336 -3.115) 5.008 5.898 ( 3.315 -3.913 1.803) 5.436 5.898 ( 3.315 3.913 1.803) 5.436 6.004 ( -0.310 -9.093 -3.683) 9.816 6.004 ( -0.310 9.093 -3.683) 9.816 6.093 ( -0.953 -4.587 -1.515) 4.923 6.093 ( -0.953 4.587 -1.515) 4.923 6.276 ( -4.490 -2.185 2.255) 5.479 6.276 ( -4.490 2.185 2.255) 5.479 6.490 ( 1.023 -2.612 -1.332) 3.106 6.490 ( 1.023 2.612 -1.332) 3.106 6.525 ( 1.317 -1.144 3.524) 3.932 6.525 ( 1.317 1.144 3.524) 3.932 6.801 ( 3.886 -1.999 -0.367) 4.385 6.801 ( 3.886 1.999 -0.367) 4.385 6.914 ( 2.875 -1.478 -0.802) 3.331 6.914 ( 2.875 1.478 -0.802) 3.331 7.076 ( -1.059 -2.479 1.142) 2.928 7.076 ( -1.059 2.479 1.142) 2.928 7.222 ( 1.098 -2.022 0.413) 2.337 7.222 ( 1.098 2.022 0.413) 2.337 7.397 ( 5.011 -1.201 1.545) 5.379 7.397 ( 5.011 1.201 1.545) 5.379 7.554 ( 2.145 -2.859 -1.701) 3.959 7.554 ( 2.145 2.859 -1.701) 3.959 8.598 ( 13.685 -5.787 0.154) 14.859 8.598 ( 13.685 5.787 0.154) 14.859 8.673 ( 16.423 -0.731 -1.008) 16.470 8.673 ( 16.423 0.731 -1.008) 16.470 9.019 ( 0.592 -4.354 -0.957) 4.497 9.019 ( 0.592 4.354 -0.957) 4.497 9.134 ( -4.380 -0.277 0.420) 4.409 9.134 ( -4.380 0.277 0.420) 4.409 9.219 ( -5.292 -1.913 -0.420) 5.643 9.219 ( -5.292 1.913 -0.420) 5.643 9.337 ( -3.168 -0.307 -0.958) 3.324 9.337 ( -3.168 0.307 -0.958) 3.324 9.416 ( -2.632 -0.840 1.239) 3.028 9.416 ( -2.632 0.840 1.239) 3.028 9.620 ( -1.519 -2.790 -1.531) 3.526 9.620 ( -1.519 2.790 -1.531) 3.526 9.917 ( -0.622 -5.972 1.844) 6.281 9.917 ( -0.622 5.972 1.844) 6.281 10.364 ( 10.971 -2.024 0.284) 11.160 10.364 ( 10.971 2.024 0.284) 11.160 10.509 ( 8.772 -7.360 0.350) 11.456 10.509 ( 8.772 7.360 0.350) 11.456 10.670 ( 5.666 -3.457 -1.233) 6.751 10.670 ( 5.666 3.457 -1.233) 6.751 10.867 ( 3.576 -4.278 -0.530) 5.601 10.867 ( 3.576 4.278 -0.530) 5.601 11.044 ( 6.372 -4.419 -0.084) 7.755 11.044 ( 6.372 4.419 -0.084) 7.755 11.402 ( -7.197 -3.149 -0.998) 7.919 11.402 ( -7.197 3.149 -0.998) 7.919 11.458 ( -9.007 -5.180 0.586) 10.407 11.458 ( -9.007 5.180 0.586) 10.407 12.080 ( -2.575 -6.259 1.220) 6.877 12.080 ( -2.575 6.259 1.220) 6.877 12.294 ( -0.783 -5.168 -0.845) 5.294 12.294 ( -0.783 5.168 -0.845) 5.294 12.407 ( 4.191 -1.710 0.893) 4.614 12.407 ( 4.191 1.710 0.893) 4.614 12.509 ( 3.728 -2.999 -0.798) 4.851 12.509 ( 3.728 2.999 -0.798) 4.851 12.769 ( -0.827 -7.715 0.474) 7.774 12.769 ( -0.827 7.715 0.474) 7.774 12.870 ( -1.078 -3.965 -0.437) 4.132 12.870 ( -1.078 3.965 -0.437) 4.132 13.375 ( -6.930 -2.662 -0.665) 7.453 13.375 ( -6.930 2.662 -0.665) 7.453 13.413 ( -6.353 -1.737 0.672) 6.621 13.413 ( -6.353 1.737 0.672) 6.621 14.242 ( 4.588 -3.116 0.256) 5.553 14.242 ( 4.588 3.116 0.256) 5.553 14.323 ( 3.795 -3.063 -1.018) 4.982 14.323 ( 3.795 3.063 -1.018) 4.982 14.519 ( -0.870 -12.614 1.677) 12.755 14.519 ( -0.870 12.614 1.677) 12.755 14.697 ( -6.146 -3.850 -0.201) 7.255 14.697 ( -6.146 3.850 -0.201) 7.255 14.947 ( -12.344 -6.786 0.015) 14.086 14.947 ( -12.344 6.786 0.015) 14.086 15.114 ( -6.016 -2.863 -2.039) 6.968 15.114 ( -6.016 2.863 -2.039) 6.968 15.473 ( -4.717 -10.069 1.766) 11.259 15.473 ( -4.717 10.069 1.766) 11.259 15.735 ( 9.296 -2.215 -1.611) 9.691 15.735 ( 9.296 2.215 -1.611) 9.691 15.818 ( 1.746 -1.533 -0.718) 2.432 15.818 ( 1.746 1.533 -0.718) 2.432 16.210 ( 3.072 -4.271 -4.194) 6.728 16.210 ( 3.072 4.271 -4.194) 6.728 16.568 ( -1.944 -1.387 -0.227) 2.399 16.568 ( -1.944 1.387 -0.227) 2.399 16.672 ( -8.291 -5.715 0.352) 10.075 16.672 ( -8.291 5.715 0.352) 10.075 17.326 ( 0.441 -0.691 0.108) 0.827 17.326 ( 0.441 0.691 0.108) 0.827 17.376 ( -0.621 -1.089 -0.268) 1.282 17.376 ( -0.621 1.089 -0.268) 1.282 19.832 ( -0.699 -6.604 -1.102) 6.731 19.832 ( -0.699 6.604 -1.102) 6.731 20.029 ( -4.297 -2.668 -0.836) 5.126 20.029 ( -4.297 2.668 -0.836) 5.126 20.546 ( 1.069 -0.910 1.570) 2.106 20.546 ( 1.069 0.910 1.570) 2.106 20.827 ( 1.286 -1.285 -1.208) 2.183 20.827 ( 1.286 1.285 -1.208) 2.183 21.960 ( -3.620 -1.095 0.127) 3.785 21.960 ( -3.620 1.095 0.127) 3.785 22.134 ( -3.478 -1.200 0.577) 3.724 22.134 ( -3.478 1.200 0.577) 3.724 23.089 ( 5.744 -1.492 -3.108) 6.699 23.089 ( 5.744 1.492 -3.108) 6.699 23.275 ( 8.542 -0.486 3.016) 9.072 23.275 ( 8.542 0.486 3.016) 9.072 26.635 ( -10.447 -0.931 0.258) 10.491 26.635 ( -10.447 0.931 0.258) 10.491 26.780 ( -23.314 -7.603 -1.677) 24.580 26.780 ( -23.314 7.603 -1.677) 24.580 29.096 ( 10.426 -2.568 0.971) 10.781 29.096 ( 10.426 2.568 0.971) 10.781 29.277 ( 16.929 -8.118 -1.039) 18.804 29.277 ( 16.929 8.118 -1.039) 18.804 30.136 ( -13.347 -11.305 2.496) 17.669 30.136 ( -13.347 11.305 2.496) 17.669 30.689 ( 1.237 -2.255 0.460) 2.613 30.689 ( 1.237 2.255 0.460) 2.613 30.972 ( -4.566 -5.563 -3.745) 8.112 30.972 ( -4.566 5.563 -3.745) 8.112 31.002 ( -3.556 -5.011 1.186) 6.258 31.002 ( -3.556 5.011 1.186) 6.258 31.678 ( -1.319 -6.254 0.376) 6.403 31.678 ( -1.319 6.254 0.376) 6.403 32.083 ( 10.765 -2.848 -0.280) 11.139 32.083 ( 10.765 2.848 -0.280) 11.139 32.240 ( 3.324 -4.623 -0.179) 5.697 32.240 ( 3.324 4.623 -0.179) 5.697 32.561 ( -5.760 -2.231 -1.898) 6.462 32.561 ( -5.760 2.231 -1.898) 6.462 32.723 ( -12.818 -0.335 -1.428) 12.901 32.723 ( -12.818 0.335 -1.428) 12.901 33.397 ( 5.485 -4.920 -7.501) 10.515 33.397 ( 5.485 4.920 -7.501) 10.515 34.117 ( 14.910 -9.851 -27.801) 33.049 34.117 ( 14.910 9.851 -27.801) 33.049 34.222 ( 10.029 -4.243 -14.321) 17.991 34.222 ( 10.029 4.243 -14.321) 17.991 34.897 ( 0.448 -0.405 0.795) 0.999 34.897 ( 0.448 0.405 0.795) 0.999 34.988 ( -0.881 -0.945 3.220) 3.470 34.988 ( -0.881 0.945 3.220) 3.470 35.654 ( -3.190 -1.854 -3.001) 4.756 35.654 ( -3.190 1.854 -3.001) 4.756 35.704 ( -5.128 -3.108 -4.179) 7.309 35.704 ( -5.128 3.108 -4.179) 7.309 35.845 ( -0.557 -1.509 3.890) 4.210 35.845 ( -0.557 1.509 3.890) 4.210 36.392 ( 5.534 -5.745 22.900) 24.250 36.392 ( 5.534 5.745 22.900) 24.250 36.784 ( -14.590 -11.600 20.573) 27.761 36.784 ( -14.590 11.600 20.573) 27.761 38.630 ( 9.783 -10.721 -3.227) 14.868 38.630 ( 9.783 10.721 -3.227) 14.868 ======================= Grid point 90 (43/69) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.887 ( 4.783 0.000 24.065) 24.535 1.128 ( -4.485 0.000 26.759) 27.133 1.398 ( -1.995 0.000 -19.649) 19.750 1.711 ( 3.455 0.000 -23.869) 24.118 2.243 ( 5.958 0.000 39.935) 40.377 2.385 ( -4.190 0.000 5.582) 6.979 2.434 ( 2.282 0.000 -2.697) 3.533 2.676 ( -8.572 0.000 17.620) 19.595 2.737 ( -5.808 0.000 7.563) 9.536 2.808 ( 1.259 0.000 -9.432) 9.516 2.842 ( 8.519 0.000 -3.131) 9.076 2.907 ( -5.375 0.000 -2.157) 5.792 2.928 ( -8.567 0.000 5.321) 10.085 2.980 ( 3.343 0.000 -2.220) 4.013 2.993 ( 3.359 0.000 3.316) 4.720 3.075 ( -1.790 0.000 -3.181) 3.650 3.120 ( 1.639 0.000 19.780) 19.848 3.250 ( 5.487 0.000 -9.454) 10.931 3.265 ( 2.114 0.000 1.309) 2.487 3.385 ( 1.824 0.000 14.449) 14.564 3.387 ( 0.483 0.000 4.857) 4.881 3.499 ( -0.921 0.000 -1.589) 1.837 3.597 ( -0.015 0.000 -11.077) 11.077 3.603 ( 0.899 0.000 -1.245) 1.536 3.671 ( -5.710 0.000 -4.452) 7.240 3.701 ( 7.332 0.000 5.691) 9.282 3.736 ( -2.440 0.000 -17.372) 17.543 3.803 ( 1.394 0.000 -5.532) 5.704 3.874 ( -8.740 0.000 3.150) 9.290 3.983 ( 3.704 0.000 -5.184) 6.372 4.119 ( 4.895 0.000 7.462) 8.924 4.231 ( 1.704 0.000 0.134) 1.709 4.317 ( 5.365 0.000 1.928) 5.701 4.353 ( -4.809 0.000 -4.552) 6.622 4.477 ( -13.985 0.000 5.511) 15.031 4.547 ( -3.446 0.000 0.567) 3.493 4.639 ( 2.214 0.000 -5.360) 5.800 4.685 ( 4.546 0.000 -6.270) 7.744 4.785 ( 0.736 0.000 2.447) 2.555 4.831 ( 0.386 0.000 -1.869) 1.909 4.982 ( 6.148 0.000 0.612) 6.179 5.046 ( -0.690 0.000 -4.314) 4.369 5.048 ( -2.278 0.000 -9.824) 10.084 5.140 ( 0.458 0.000 -7.241) 7.256 5.164 ( -6.993 0.000 6.492) 9.542 5.328 ( 4.807 0.000 -7.064) 8.544 5.356 ( -1.094 0.000 3.099) 3.287 5.363 ( -0.511 0.000 1.712) 1.787 5.498 ( 5.892 0.000 -1.650) 6.119 5.540 ( 3.101 0.000 0.314) 3.117 5.625 ( -4.468 0.000 2.722) 5.232 5.735 ( -3.676 0.000 -7.634) 8.473 5.808 ( 2.483 0.000 -0.251) 2.495 5.886 ( 0.894 0.000 -4.326) 4.418 5.926 ( 0.950 0.000 3.150) 3.290 6.004 ( -1.456 0.000 -1.220) 1.900 6.029 ( -1.085 0.000 -2.650) 2.863 6.068 ( 0.838 0.000 -2.732) 2.858 6.199 ( -4.793 0.000 2.407) 5.363 6.290 ( 3.343 0.000 -5.003) 6.017 6.569 ( 1.358 0.000 2.698) 3.020 6.616 ( -3.910 0.000 -2.557) 4.672 6.636 ( 1.508 0.000 5.218) 5.431 6.683 ( 0.497 0.000 -1.148) 1.251 6.699 ( -2.397 0.000 5.457) 5.960 6.837 ( -0.074 0.000 -4.346) 4.346 7.052 ( -0.388 0.000 2.604) 2.632 7.066 ( 5.543 0.000 2.015) 5.898 7.090 ( -6.083 0.000 4.619) 7.638 7.186 ( 4.796 0.000 -3.645) 6.023 7.325 ( 0.192 0.000 6.849) 6.852 7.424 ( 0.910 0.000 -1.579) 1.822 7.483 ( -0.601 0.000 2.290) 2.368 7.512 ( 0.571 0.000 -1.207) 1.335 7.822 ( -1.915 0.000 11.616) 11.772 8.057 ( 3.709 0.000 -10.636) 11.264 8.651 ( -0.065 0.000 3.903) 3.904 8.733 ( -1.725 0.000 -3.960) 4.319 8.785 ( 3.930 0.000 0.604) 3.976 8.802 ( -1.473 0.000 -1.158) 1.874 8.999 ( 0.786 0.000 -0.119) 0.795 9.008 ( 2.009 0.000 -0.725) 2.136 9.148 ( -9.001 0.000 2.862) 9.445 9.184 ( 2.439 0.000 0.003) 2.439 9.205 ( -4.915 0.000 -0.958) 5.008 9.221 ( 7.185 0.000 -0.888) 7.240 9.258 ( -0.575 0.000 0.534) 0.784 9.308 ( -0.461 0.000 -3.418) 3.449 9.403 ( -0.053 0.000 -0.586) 0.588 9.425 ( 1.093 0.000 -2.864) 3.066 9.547 ( -4.142 0.000 3.584) 5.477 9.624 ( 3.223 0.000 -3.548) 4.794 9.977 ( -2.793 0.000 8.010) 8.483 10.130 ( 3.047 0.000 -5.502) 6.289 10.252 ( -3.112 0.000 2.350) 3.900 10.295 ( 1.825 0.000 -1.915) 2.645 10.484 ( 2.056 0.000 1.370) 2.471 10.532 ( -1.115 0.000 -4.157) 4.304 10.770 ( -1.521 0.000 -0.079) 1.523 10.774 ( 0.231 0.000 -0.661) 0.700 10.830 ( 2.030 0.000 0.584) 2.112 10.849 ( -2.886 0.000 -1.381) 3.200 11.067 ( 3.893 0.000 1.366) 4.125 11.101 ( -3.385 0.000 -1.852) 3.858 11.219 ( -0.855 0.000 0.524) 1.003 11.227 ( 1.874 0.000 -0.303) 1.898 11.639 ( 1.328 0.000 0.219) 1.346 11.643 ( -1.377 0.000 -0.212) 1.394 11.959 ( -2.909 0.000 3.330) 4.421 12.034 ( 2.883 0.000 -3.814) 4.781 12.309 ( -3.969 0.000 2.494) 4.688 12.340 ( 1.647 0.000 -0.293) 1.672 12.367 ( 2.134 0.000 0.499) 2.192 12.389 ( 0.310 0.000 -1.149) 1.190 12.415 ( 0.623 0.000 -0.171) 0.646 12.419 ( -0.263 0.000 -0.941) 0.977 12.510 ( -2.356 0.000 1.125) 2.611 12.543 ( 1.300 0.000 -1.652) 2.102 12.983 ( 1.407 0.000 0.950) 1.698 12.997 ( -1.122 0.000 -0.326) 1.168 13.246 ( -1.019 0.000 1.195) 1.571 13.276 ( 1.092 0.000 -1.672) 1.997 13.401 ( 0.743 0.000 1.453) 1.632 13.425 ( -1.058 0.000 -0.857) 1.361 14.046 ( 0.835 0.000 1.567) 1.776 14.078 ( -0.582 0.000 -1.464) 1.575 14.225 ( 3.263 0.000 0.306) 3.277 14.232 ( -2.707 0.000 -0.377) 2.733 14.484 ( -0.233 0.000 0.694) 0.732 14.487 ( -1.828 0.000 0.537) 1.905 14.593 ( 0.316 0.000 -0.237) 0.395 14.600 ( 5.232 0.000 -0.848) 5.300 14.890 ( -4.111 0.000 1.121) 4.261 14.906 ( 1.668 0.000 -0.401) 1.715 14.993 ( 1.517 0.000 0.389) 1.566 15.014 ( 0.018 0.000 -1.710) 1.710 15.124 ( 5.622 0.000 2.680) 6.228 15.174 ( -5.533 0.000 -1.909) 5.853 15.770 ( 2.614 0.000 0.050) 2.614 15.770 ( -2.864 0.000 -0.016) 2.864 15.866 ( -3.298 0.000 0.632) 3.358 15.872 ( 2.448 0.000 -0.053) 2.449 16.092 ( 0.678 0.000 5.846) 5.885 16.218 ( 0.115 0.000 -5.805) 5.806 16.515 ( 1.716 0.000 0.988) 1.980 16.542 ( -3.612 0.000 -1.608) 3.954 16.595 ( 1.361 0.000 2.841) 3.150 16.643 ( -0.765 0.000 -1.660) 1.828 17.330 ( -0.370 0.000 0.857) 0.934 17.340 ( 0.750 0.000 -0.256) 0.792 17.364 ( -1.239 0.000 1.442) 1.901 17.390 ( 1.183 0.000 -0.927) 1.503 19.745 ( -1.680 0.000 1.716) 2.402 19.797 ( 1.242 0.000 -3.385) 3.606 20.089 ( -0.465 0.000 0.710) 0.849 20.093 ( 0.484 0.000 0.310) 0.575 20.571 ( -2.979 0.000 2.093) 3.641 20.598 ( 1.862 0.000 -0.136) 1.867 20.795 ( -1.093 0.000 -0.002) 1.093 20.819 ( 2.113 0.000 -2.010) 2.916 21.941 ( 0.795 0.000 3.043) 3.145 21.997 ( 0.021 0.000 -2.369) 2.369 22.138 ( 0.409 0.000 0.359) 0.544 22.144 ( -0.633 0.000 -0.317) 0.708 23.097 ( -3.047 0.000 -1.189) 3.271 23.102 ( 2.696 0.000 -1.748) 3.213 23.407 ( 0.365 0.000 1.008) 1.072 23.410 ( -1.271 0.000 0.796) 1.500 26.541 ( 0.470 0.000 -0.034) 0.471 26.542 ( -0.205 0.000 -0.158) 0.259 26.578 ( 0.309 0.000 0.361) 0.475 26.582 ( 0.015 0.000 -0.074) 0.076 29.192 ( -0.149 0.000 2.772) 2.776 29.248 ( -1.398 0.000 -2.234) 2.636 29.355 ( 4.009 0.000 4.976) 6.390 29.477 ( -1.253 0.000 -6.172) 6.298 29.703 ( -2.588 0.000 2.768) 3.790 29.767 ( 1.468 0.000 -3.342) 3.650 30.562 ( -0.546 0.000 9.111) 9.128 30.695 ( -0.263 0.000 -3.397) 3.408 30.780 ( -0.206 0.000 1.621) 1.634 30.810 ( 0.918 0.000 -1.732) 1.961 31.061 ( -0.022 0.000 0.665) 0.666 31.062 ( -1.351 0.000 0.571) 1.466 31.492 ( -1.777 0.000 -0.014) 1.778 31.494 ( 1.569 0.000 -0.180) 1.579 32.035 ( 0.985 0.000 13.338) 13.374 32.151 ( 1.780 0.000 1.558) 2.366 32.171 ( -4.069 0.000 -1.250) 4.257 32.282 ( 5.993 0.000 -4.973) 7.787 32.366 ( -0.867 0.000 2.357) 2.511 32.455 ( 4.451 0.000 -5.586) 7.142 32.558 ( -7.387 0.000 2.621) 7.838 32.582 ( -4.094 0.000 1.425) 4.335 32.710 ( 4.617 0.000 -0.762) 4.680 32.936 ( -0.408 0.000 -27.559) 27.562 33.734 ( 0.246 0.000 3.044) 3.054 33.744 ( -0.670 0.000 -0.833) 1.069 33.991 ( 0.019 0.000 -2.181) 2.182 34.065 ( 0.067 0.000 -7.196) 7.196 35.005 ( -4.147 0.000 2.307) 4.746 35.025 ( 4.356 0.000 0.557) 4.391 35.091 ( 4.675 0.000 2.612) 5.355 35.108 ( -3.173 0.000 1.440) 3.484 35.528 ( -2.031 0.000 -0.031) 2.031 35.553 ( 2.758 0.000 -2.141) 3.491 35.679 ( 0.975 0.000 -0.250) 1.007 35.690 ( -0.431 0.000 -1.185) 1.260 36.093 ( 0.278 0.000 11.402) 11.406 36.185 ( 0.389 0.000 11.173) 11.180 36.322 ( -0.093 0.000 -10.143) 10.144 36.405 ( -0.418 0.000 -9.450) 9.459 37.353 ( -0.311 0.000 30.298) 30.300 37.874 ( -0.044 0.000 -20.214) 20.214 38.771 ( -2.140 0.000 4.231) 4.741 38.863 ( 1.107 0.000 -4.412) 4.548 ======================= Grid point 91 (44/69) ======================= q-point: ( 0.11 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( 30.662 0.000 -15.865) 34.523 1.471 ( 30.833 0.000 19.914) 36.705 1.481 ( 3.142 0.000 20.631) 20.869 1.529 ( 10.939 0.000 -25.693) 27.925 2.253 ( -12.770 0.000 7.258) 14.688 2.316 ( -8.895 0.000 -11.126) 14.244 2.526 ( -4.561 0.000 -18.534) 19.087 2.656 ( 1.135 0.000 13.807) 13.853 2.714 ( -1.440 0.000 3.197) 3.506 2.798 ( -2.840 0.000 5.117) 5.852 2.828 ( -2.842 0.000 -5.343) 6.051 2.918 ( 0.586 0.000 22.034) 22.042 2.956 ( 9.316 0.000 0.122) 9.316 3.026 ( 5.384 0.000 -3.062) 6.194 3.104 ( 4.504 0.000 -1.363) 4.706 3.157 ( 0.408 0.000 -5.314) 5.330 3.220 ( 6.098 0.000 -6.684) 9.047 3.239 ( 3.021 0.000 0.947) 3.166 3.337 ( -10.526 0.000 -13.566) 17.171 3.352 ( -2.197 0.000 -20.577) 20.694 3.407 ( -6.500 0.000 -0.686) 6.536 3.481 ( 3.724 0.000 20.432) 20.769 3.549 ( 8.666 0.000 -1.171) 8.745 3.553 ( 1.042 0.000 8.587) 8.650 3.638 ( 1.938 0.000 -3.966) 4.414 3.705 ( 4.480 0.000 7.491) 8.729 3.792 ( 7.708 0.000 -7.034) 10.435 3.825 ( -5.362 0.000 13.120) 14.174 3.894 ( 7.379 0.000 -1.053) 7.454 3.992 ( 3.466 0.000 -3.470) 4.905 4.144 ( 0.508 0.000 -11.684) 11.695 4.239 ( 2.859 0.000 2.046) 3.515 4.305 ( 0.673 0.000 -3.183) 3.253 4.390 ( -0.279 0.000 12.205) 12.208 4.477 ( 2.255 0.000 6.425) 6.809 4.521 ( -0.980 0.000 1.896) 2.134 4.657 ( 4.950 0.000 -2.432) 5.515 4.725 ( 1.986 0.000 0.962) 2.207 4.819 ( 7.256 0.000 -5.863) 9.329 4.873 ( 3.123 0.000 5.415) 6.251 4.910 ( -4.684 0.000 -4.256) 6.329 4.989 ( -0.828 0.000 -2.558) 2.689 5.063 ( -1.165 0.000 -2.605) 2.853 5.074 ( 0.823 0.000 3.395) 3.493 5.212 ( -1.293 0.000 8.941) 9.034 5.292 ( -4.472 0.000 -0.483) 4.498 5.348 ( -2.927 0.000 0.520) 2.973 5.376 ( 7.996 0.000 -5.494) 9.702 5.452 ( -1.120 0.000 -3.693) 3.859 5.550 ( 1.045 0.000 -2.154) 2.394 5.726 ( 2.718 0.000 1.291) 3.008 5.743 ( 4.338 0.000 6.971) 8.211 5.846 ( 5.771 0.000 -7.624) 9.562 5.852 ( 0.593 0.000 1.432) 1.550 5.937 ( -0.566 0.000 -2.371) 2.437 5.996 ( 1.627 0.000 4.682) 4.957 6.044 ( -0.503 0.000 -1.920) 1.985 6.055 ( 2.914 0.000 1.517) 3.285 6.173 ( -4.235 0.000 5.464) 6.913 6.297 ( 4.013 0.000 -3.874) 5.578 6.541 ( -3.751 0.000 -0.800) 3.835 6.636 ( 2.067 0.000 3.932) 4.442 6.658 ( 0.392 0.000 2.060) 2.098 6.663 ( -0.479 0.000 -2.483) 2.529 6.765 ( -0.688 0.000 -5.016) 5.063 6.773 ( -1.342 0.000 6.315) 6.456 7.023 ( -3.692 0.000 -3.967) 5.419 7.029 ( -7.233 0.000 3.183) 7.903 7.118 ( 1.695 0.000 -2.470) 2.995 7.210 ( 3.645 0.000 -2.326) 4.324 7.349 ( -3.419 0.000 -5.372) 6.367 7.350 ( -6.500 0.000 4.268) 7.776 7.454 ( -4.358 0.000 -0.009) 4.358 7.464 ( -6.678 0.000 -1.184) 6.783 7.805 ( -13.558 0.000 4.878) 14.409 7.849 ( -11.785 0.000 -6.364) 13.394 8.459 ( -21.143 0.000 -4.009) 21.520 8.517 ( -16.091 0.000 4.131) 16.613 8.752 ( -12.450 0.000 -0.997) 12.490 8.756 ( -4.258 0.000 -1.594) 4.547 8.981 ( -5.487 0.000 -3.712) 6.625 9.012 ( -1.052 0.000 -0.399) 1.125 9.059 ( -5.302 0.000 4.531) 6.974 9.085 ( 3.177 0.000 4.160) 5.234 9.278 ( 2.627 0.000 0.583) 2.691 9.287 ( 4.183 0.000 -2.272) 4.760 9.332 ( 6.963 0.000 -0.603) 6.989 9.352 ( 4.091 0.000 3.022) 5.086 9.432 ( 2.129 0.000 -0.065) 2.130 9.454 ( 4.654 0.000 -1.913) 5.032 9.571 ( 1.573 0.000 4.181) 4.467 9.671 ( 7.055 0.000 -3.023) 7.675 10.021 ( -2.113 0.000 6.582) 6.913 10.076 ( 0.094 0.000 -7.836) 7.837 10.209 ( -6.687 0.000 2.853) 7.270 10.284 ( -1.744 0.000 -1.174) 2.103 10.417 ( -8.202 0.000 -2.927) 8.708 10.463 ( -6.496 0.000 1.877) 6.762 10.662 ( -11.659 0.000 0.076) 11.660 10.714 ( -5.932 0.000 1.604) 6.145 10.744 ( -8.591 0.000 -0.107) 8.592 10.827 ( -3.169 0.000 0.681) 3.242 11.025 ( -2.995 0.000 -2.008) 3.606 11.101 ( -1.843 0.000 1.453) 2.347 11.340 ( 13.192 0.000 0.237) 13.194 11.359 ( 13.350 0.000 -0.808) 13.374 11.628 ( 0.640 0.000 -0.102) 0.648 11.657 ( 0.757 0.000 0.395) 0.854 11.993 ( 2.298 0.000 3.196) 3.936 12.047 ( 3.265 0.000 -3.404) 4.717 12.300 ( -4.978 0.000 0.952) 5.068 12.310 ( -0.660 0.000 2.370) 2.460 12.350 ( -1.578 0.000 -0.090) 1.581 12.386 ( -0.092 0.000 -0.740) 0.746 12.428 ( 3.225 0.000 -2.981) 4.392 12.434 ( 0.617 0.000 -0.089) 0.623 12.547 ( 3.727 0.000 1.991) 4.225 12.587 ( 5.713 0.000 -0.765) 5.764 12.974 ( -0.145 0.000 -0.681) 0.696 12.996 ( -0.302 0.000 0.474) 0.562 13.245 ( -0.772 0.000 1.072) 1.321 13.278 ( 1.277 0.000 -1.165) 1.729 13.586 ( 19.911 0.000 3.557) 20.226 13.587 ( 17.163 0.000 -1.965) 17.275 13.998 ( -7.861 0.000 -1.115) 7.940 14.007 ( -8.841 0.000 0.614) 8.863 14.214 ( 4.343 0.000 -0.084) 4.344 14.251 ( 1.838 0.000 -0.643) 1.948 14.429 ( -6.730 0.000 1.325) 6.860 14.459 ( -3.598 0.000 -0.402) 3.620 14.639 ( 6.946 0.000 -0.730) 6.984 14.725 ( 8.887 0.000 -2.872) 9.340 14.907 ( 7.281 0.000 0.026) 7.281 14.918 ( 0.916 0.000 -0.779) 1.203 15.124 ( 12.076 0.000 0.810) 12.103 15.146 ( 14.885 0.000 -1.200) 14.933 15.169 ( 9.189 0.000 -0.584) 9.207 15.318 ( 14.205 0.000 1.152) 14.251 15.718 ( -3.692 0.000 0.310) 3.705 15.759 ( -7.037 0.000 -0.798) 7.082 15.836 ( 2.868 0.000 2.215) 3.624 15.867 ( -2.304 0.000 -0.581) 2.376 16.124 ( -3.263 0.000 -6.244) 7.045 16.145 ( -2.544 0.000 5.335) 5.911 16.535 ( 3.653 0.000 -0.674) 3.715 16.594 ( 3.990 0.000 2.808) 4.879 16.616 ( 0.638 0.000 -2.718) 2.792 16.657 ( 3.493 0.000 2.246) 4.152 17.323 ( -0.976 0.000 0.162) 0.989 17.341 ( 0.172 0.000 -0.651) 0.673 17.364 ( -0.684 0.000 1.364) 1.525 17.397 ( 1.298 0.000 -1.438) 1.938 19.772 ( 1.860 0.000 3.134) 3.644 19.806 ( 3.644 0.000 -2.626) 4.491 20.078 ( -0.844 0.000 0.186) 0.864 20.088 ( -0.887 0.000 -0.128) 0.896 20.532 ( -4.872 0.000 2.103) 5.307 20.606 ( -0.792 0.000 -0.450) 0.911 20.769 ( -2.256 0.000 0.446) 2.299 20.821 ( 0.654 0.000 -1.739) 1.858 21.988 ( 2.957 0.000 -3.040) 4.241 22.003 ( 3.185 0.000 1.478) 3.511 22.149 ( 2.028 0.000 -0.156) 2.034 22.164 ( 2.656 0.000 0.805) 2.776 23.018 ( -6.533 0.000 0.187) 6.535 23.100 ( -1.733 0.000 0.261) 1.752 23.336 ( -8.627 0.000 0.387) 8.635 23.366 ( -6.384 0.000 0.531) 6.406 26.625 ( 10.148 0.000 0.617) 10.167 26.629 ( 10.833 0.000 -0.557) 10.847 26.752 ( 20.629 0.000 -4.953) 21.215 26.756 ( 21.146 0.000 4.916) 21.710 29.033 ( -19.479 0.000 1.808) 19.563 29.042 ( -18.256 0.000 -1.948) 18.359 29.324 ( -9.013 0.000 -5.610) 10.616 29.346 ( -10.510 0.000 4.840) 11.571 29.891 ( 16.998 0.000 2.898) 17.243 29.904 ( 15.613 0.000 -1.987) 15.739 30.651 ( 1.710 0.000 -5.651) 5.904 30.655 ( 0.814 0.000 6.249) 6.302 30.813 ( 1.706 0.000 -1.858) 2.522 30.816 ( 3.416 0.000 1.367) 3.679 31.103 ( 5.195 0.000 0.202) 5.199 31.113 ( 5.089 0.000 1.119) 5.210 31.495 ( 1.368 0.000 0.181) 1.380 31.560 ( 6.679 0.000 0.425) 6.692 32.021 ( -9.163 0.000 -2.244) 9.434 32.058 ( -10.853 0.000 2.920) 11.239 32.167 ( -6.901 0.000 2.398) 7.306 32.222 ( -1.442 0.000 -12.587) 12.669 32.350 ( -3.633 0.000 -6.995) 7.882 32.358 ( 0.998 0.000 10.075) 10.124 32.681 ( 9.466 0.000 9.091) 13.125 32.714 ( 11.824 0.000 3.476) 12.324 32.802 ( 9.605 0.000 -9.097) 13.229 32.847 ( 9.865 0.000 3.322) 10.410 33.725 ( -2.321 0.000 0.123) 2.325 33.738 ( -1.567 0.000 0.083) 1.569 33.973 ( -3.383 0.000 -3.557) 4.909 33.981 ( -3.230 0.000 4.407) 5.464 34.955 ( -4.146 0.000 0.522) 4.179 35.049 ( -3.496 0.000 -2.137) 4.097 35.088 ( 4.016 0.000 -1.114) 4.168 35.167 ( 3.302 0.000 -0.061) 3.303 35.514 ( -0.100 0.000 0.635) 0.643 35.593 ( 4.750 0.000 -1.463) 4.970 35.698 ( 3.001 0.000 -1.024) 3.171 35.720 ( 4.037 0.000 0.342) 4.052 36.213 ( 1.859 0.000 -11.318) 11.470 36.241 ( 2.104 0.000 11.090) 11.288 36.282 ( -0.215 0.000 -10.955) 10.957 36.315 ( 0.175 0.000 10.502) 10.503 37.589 ( -3.272 0.000 -24.477) 24.695 37.633 ( -3.756 0.000 24.112) 24.402 38.677 ( -16.064 0.000 8.188) 18.031 38.710 ( -13.543 0.000 -7.069) 15.277 ======================= Grid point 92 (45/69) ======================= q-point: ( 0.22 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( 19.297 0.000 -19.664) 27.551 1.586 ( 10.382 0.000 -9.669) 14.187 1.869 ( 27.269 0.000 7.065) 28.170 2.118 ( 5.977 0.000 -11.537) 12.993 2.143 ( 22.150 0.000 16.758) 27.775 2.256 ( 6.655 0.000 7.656) 10.144 2.337 ( 2.368 0.000 -11.246) 11.493 2.600 ( -6.615 0.000 -8.511) 10.779 2.737 ( -6.843 0.000 -4.457) 8.166 2.755 ( 3.202 0.000 -1.257) 3.440 2.827 ( 5.489 0.000 0.111) 5.490 2.926 ( -5.179 0.000 -15.328) 16.180 2.952 ( -9.805 0.000 -1.296) 9.890 3.027 ( 5.289 0.000 -11.613) 12.761 3.077 ( 0.041 0.000 0.338) 0.341 3.117 ( -1.925 0.000 -0.962) 2.152 3.159 ( 8.352 0.000 -3.933) 9.232 3.213 ( 4.114 0.000 -8.214) 9.187 3.277 ( -6.341 0.000 -2.023) 6.656 3.277 ( -1.257 0.000 -0.943) 1.572 3.342 ( 6.339 0.000 6.683) 9.212 3.599 ( -1.322 0.000 2.656) 2.967 3.651 ( 7.002 0.000 -4.818) 8.500 3.669 ( -6.942 0.000 2.243) 7.295 3.686 ( 6.503 0.000 -0.618) 6.533 3.822 ( -1.246 0.000 4.778) 4.938 3.905 ( 7.322 0.000 8.493) 11.214 3.930 ( 11.692 0.000 0.324) 11.696 3.976 ( 3.420 0.000 9.997) 10.566 4.033 ( 4.717 0.000 1.302) 4.893 4.147 ( 7.683 0.000 -8.847) 11.717 4.290 ( 4.953 0.000 -1.492) 5.173 4.313 ( 1.988 0.000 3.317) 3.867 4.542 ( -3.782 0.000 14.613) 15.094 4.564 ( 6.767 0.000 -3.952) 7.837 4.570 ( 1.170 0.000 5.597) 5.718 4.728 ( -1.195 0.000 -0.819) 1.449 4.759 ( 9.127 0.000 1.784) 9.300 4.795 ( -5.524 0.000 -2.695) 6.146 4.862 ( 0.452 0.000 -10.239) 10.249 4.865 ( 2.816 0.000 -4.019) 4.907 5.021 ( -1.385 0.000 5.956) 6.115 5.114 ( -1.654 0.000 7.190) 7.378 5.131 ( 4.330 0.000 5.191) 6.760 5.218 ( -2.053 0.000 2.795) 3.468 5.259 ( 1.391 0.000 5.952) 6.112 5.322 ( -1.863 0.000 1.354) 2.303 5.447 ( 3.108 0.000 -4.685) 5.622 5.516 ( 3.250 0.000 -3.409) 4.710 5.551 ( 5.318 0.000 8.184) 9.760 5.709 ( -4.528 0.000 2.267) 5.064 5.822 ( -1.949 0.000 4.973) 5.341 5.854 ( 1.584 0.000 -1.265) 2.027 5.927 ( 8.482 0.000 -3.193) 9.063 5.955 ( 2.871 0.000 1.746) 3.360 5.977 ( -2.815 0.000 -0.660) 2.892 6.129 ( 1.155 0.000 9.154) 9.227 6.137 ( 2.863 0.000 1.809) 3.386 6.172 ( -1.391 0.000 2.605) 2.953 6.289 ( -1.358 0.000 -3.991) 4.216 6.488 ( 2.849 0.000 -4.256) 5.122 6.639 ( -0.136 0.000 -2.217) 2.221 6.682 ( -3.970 0.000 -1.618) 4.287 6.688 ( 1.710 0.000 2.376) 2.928 6.716 ( -1.644 0.000 -1.301) 2.096 6.791 ( -1.291 0.000 3.518) 3.748 6.847 ( -8.843 0.000 -8.011) 11.932 6.965 ( -5.104 0.000 4.034) 6.506 7.060 ( -3.641 0.000 -4.068) 5.459 7.211 ( -1.301 0.000 -6.567) 6.695 7.254 ( -7.074 0.000 2.041) 7.362 7.266 ( -2.665 0.000 -1.087) 2.878 7.282 ( -6.041 0.000 -1.995) 6.361 7.353 ( -6.413 0.000 -2.486) 6.878 7.593 ( -9.602 0.000 -4.137) 10.455 7.669 ( -6.133 0.000 -1.050) 6.222 8.107 ( -19.919 0.000 -0.504) 19.926 8.294 ( -16.936 0.000 1.998) 17.054 8.486 ( -18.465 0.000 0.017) 18.465 8.625 ( -10.959 0.000 -0.309) 10.964 8.890 ( -0.029 0.000 -1.772) 1.772 8.994 ( -1.134 0.000 0.473) 1.229 9.087 ( -0.455 0.000 5.436) 5.455 9.207 ( 4.785 0.000 2.151) 5.247 9.336 ( 4.902 0.000 -2.094) 5.330 9.338 ( 3.358 0.000 2.291) 4.065 9.374 ( -0.126 0.000 -2.416) 2.419 9.425 ( 1.503 0.000 3.169) 3.507 9.468 ( 4.415 0.000 0.052) 4.415 9.513 ( 5.504 0.000 -1.214) 5.636 9.653 ( 2.763 0.000 2.542) 3.755 9.746 ( 5.436 0.000 -1.465) 5.630 9.981 ( -1.107 0.000 -7.399) 7.481 10.033 ( -4.168 0.000 2.468) 4.844 10.095 ( -11.993 0.000 2.896) 12.338 10.196 ( -7.611 0.000 -1.663) 7.790 10.244 ( -8.331 0.000 -3.002) 8.856 10.367 ( -8.586 0.000 4.217) 9.565 10.456 ( -12.809 0.000 -0.975) 12.846 10.609 ( -8.375 0.000 0.878) 8.421 10.660 ( -4.553 0.000 2.337) 5.118 10.767 ( -4.937 0.000 0.230) 4.942 10.958 ( -3.001 0.000 -1.438) 3.328 11.031 ( -7.652 0.000 0.706) 7.685 11.567 ( 13.866 0.000 0.620) 13.879 11.569 ( 13.466 0.000 -0.434) 13.473 11.675 ( 4.718 0.000 0.157) 4.720 11.684 ( 2.339 0.000 0.318) 2.361 12.050 ( 1.081 0.000 -2.132) 2.391 12.074 ( 3.463 0.000 2.248) 4.128 12.247 ( -3.125 0.000 0.632) 3.188 12.260 ( -4.145 0.000 -0.070) 4.146 12.382 ( 0.096 0.000 0.985) 0.990 12.411 ( 5.238 0.000 1.103) 5.353 12.424 ( 0.343 0.000 -2.505) 2.529 12.448 ( 2.048 0.000 -0.196) 2.057 12.635 ( 4.572 0.000 1.251) 4.740 12.664 ( 4.325 0.000 -1.030) 4.446 12.976 ( 0.509 0.000 -0.107) 0.521 12.985 ( -1.595 0.000 -0.424) 1.651 13.253 ( 1.105 0.000 0.509) 1.217 13.295 ( 2.512 0.000 -0.706) 2.610 13.828 ( 15.343 0.000 -1.472) 15.413 13.843 ( -9.736 0.000 -0.418) 9.745 13.856 ( -8.492 0.000 -0.082) 8.492 13.987 ( 18.065 0.000 7.164) 19.434 14.270 ( 1.724 0.000 -1.410) 2.227 14.306 ( 5.145 0.000 -0.396) 5.161 14.354 ( -3.639 0.000 1.091) 3.799 14.386 ( -4.210 0.000 -0.332) 4.223 14.733 ( 2.379 0.000 -0.609) 2.456 14.777 ( 1.757 0.000 -0.063) 1.758 14.975 ( 8.985 0.000 0.584) 9.004 15.063 ( 11.664 0.000 -2.773) 11.989 15.308 ( 10.126 0.000 0.261) 10.129 15.331 ( 11.972 0.000 0.586) 11.987 15.440 ( 16.091 0.000 0.986) 16.121 15.522 ( 8.733 0.000 0.531) 8.749 15.638 ( -6.227 0.000 -0.179) 6.229 15.663 ( -3.858 0.000 0.142) 3.860 15.851 ( 4.129 0.000 -1.331) 4.338 15.962 ( 7.977 0.000 4.939) 9.382 15.994 ( -4.084 0.000 -4.866) 6.353 16.129 ( -5.572 0.000 3.551) 6.607 16.603 ( 1.741 0.000 -1.638) 2.391 16.605 ( 4.529 0.000 -1.207) 4.687 16.649 ( -0.117 0.000 2.858) 2.861 16.763 ( 3.278 0.000 3.974) 5.151 17.313 ( -0.260 0.000 0.067) 0.268 17.341 ( 1.258 0.000 -0.721) 1.450 17.377 ( 0.262 0.000 1.538) 1.560 17.395 ( 0.886 0.000 -1.965) 2.155 19.828 ( 3.271 0.000 -3.039) 4.465 19.867 ( 4.780 0.000 3.983) 6.222 20.080 ( 0.759 0.000 -0.443) 0.879 20.112 ( 4.641 0.000 1.760) 4.964 20.475 ( -5.774 0.000 2.625) 6.343 20.558 ( -4.029 0.000 -1.147) 4.189 20.741 ( -2.681 0.000 1.336) 2.995 20.801 ( -0.921 0.000 -1.249) 1.552 22.029 ( 6.465 0.000 -2.269) 6.851 22.055 ( 4.360 0.000 -1.682) 4.673 22.221 ( 6.583 0.000 0.624) 6.613 22.240 ( 5.907 0.000 0.439) 5.923 22.900 ( -9.098 0.000 0.721) 9.127 23.043 ( -6.896 0.000 0.494) 6.914 23.180 ( -10.991 0.000 0.640) 11.010 23.234 ( -10.190 0.000 -0.465) 10.201 26.834 ( 16.591 0.000 -1.556) 16.664 26.863 ( 17.979 0.000 2.028) 18.093 27.042 ( 24.770 0.000 -6.771) 25.678 27.335 ( 31.541 0.000 19.623) 37.147 28.704 ( -21.767 0.000 -1.851) 21.846 28.724 ( -21.475 0.000 1.228) 21.510 29.065 ( -17.165 0.000 -4.232) 17.679 29.178 ( -16.402 0.000 3.684) 16.811 30.129 ( 15.109 0.000 -1.583) 15.191 30.196 ( 17.044 0.000 2.833) 17.278 30.637 ( 4.047 0.000 -4.702) 6.204 30.722 ( 0.896 0.000 3.328) 3.447 30.830 ( 3.698 0.000 -1.849) 4.134 30.929 ( 7.568 0.000 2.902) 8.106 31.207 ( 7.184 0.000 0.808) 7.230 31.239 ( 7.373 0.000 4.488) 8.631 31.505 ( -1.876 0.000 0.271) 1.895 31.673 ( 3.026 0.000 0.988) 3.183 31.884 ( -6.251 0.000 -0.174) 6.253 31.918 ( -6.129 0.000 1.086) 6.225 32.015 ( -10.696 0.000 0.153) 10.697 32.042 ( 0.301 0.000 -12.603) 12.607 32.290 ( -0.798 0.000 1.855) 2.019 32.567 ( 5.245 0.000 12.791) 13.825 32.902 ( 11.611 0.000 -4.133) 12.324 32.934 ( 10.816 0.000 6.641) 12.692 32.962 ( 14.321 0.000 2.419) 14.524 33.045 ( 4.763 0.000 8.436) 9.688 33.652 ( -4.307 0.000 -3.948) 5.842 33.711 ( -2.877 0.000 2.145) 3.589 33.898 ( -6.014 0.000 3.134) 6.781 33.971 ( -6.493 0.000 6.353) 9.085 34.897 ( -2.958 0.000 -0.492) 2.999 34.970 ( -1.849 0.000 -3.494) 3.953 35.120 ( 3.330 0.000 -3.297) 4.686 35.195 ( 2.632 0.000 -2.993) 3.986 35.541 ( 1.265 0.000 2.634) 2.922 35.657 ( 5.122 0.000 -1.126) 5.244 35.752 ( 4.655 0.000 -0.362) 4.669 35.800 ( 5.059 0.000 0.735) 5.112 36.131 ( 3.444 0.000 -10.464) 11.017 36.164 ( 1.866 0.000 -11.761) 11.908 36.388 ( 2.175 0.000 7.009) 7.339 36.405 ( -1.935 0.000 6.494) 6.776 37.271 ( -0.497 0.000 -23.285) 23.290 37.769 ( -8.484 0.000 16.747) 18.774 38.293 ( -20.436 0.000 -16.486) 26.257 38.496 ( -19.786 0.000 9.397) 21.904 ======================= Grid point 93 (46/69) ======================= q-point: ( 0.33 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( 15.211 0.000 -10.130) 18.276 1.649 ( 20.908 0.000 -12.311) 24.264 2.096 ( 3.864 0.000 -0.859) 3.958 2.233 ( 10.874 0.000 -2.798) 11.228 2.356 ( -7.995 0.000 -0.249) 7.999 2.378 ( 5.601 0.000 6.156) 8.322 2.530 ( 7.636 0.000 -2.656) 8.085 2.600 ( 3.469 0.000 1.870) 3.941 2.676 ( -2.851 0.000 -15.929) 16.182 2.682 ( 21.711 0.000 -6.958) 22.799 2.731 ( 0.008 0.000 -7.908) 7.908 2.792 ( 4.285 0.000 -3.035) 5.251 2.963 ( 10.722 0.000 0.019) 10.722 2.983 ( 3.114 0.000 -9.368) 9.872 3.009 ( -10.758 0.000 -5.003) 11.865 3.050 ( -4.089 0.000 -4.027) 5.739 3.122 ( 1.061 0.000 3.986) 4.125 3.292 ( 2.580 0.000 2.800) 3.807 3.299 ( -0.040 0.000 -3.220) 3.220 3.301 ( 13.991 0.000 -1.433) 14.064 3.420 ( -4.535 0.000 -2.478) 5.168 3.466 ( 2.865 0.000 1.538) 3.252 3.701 ( 7.289 0.000 -4.581) 8.610 3.708 ( -1.817 0.000 9.715) 9.884 3.749 ( 4.516 0.000 -5.958) 7.476 3.842 ( -6.285 0.000 5.923) 8.636 4.039 ( 6.113 0.000 0.367) 6.124 4.069 ( 3.320 0.000 -1.016) 3.472 4.119 ( 3.545 0.000 1.778) 3.966 4.145 ( 3.978 0.000 -7.487) 8.478 4.205 ( 9.407 0.000 3.188) 9.933 4.343 ( -5.047 0.000 6.852) 8.510 4.368 ( 3.134 0.000 -0.597) 3.190 4.518 ( -3.478 0.000 -2.313) 4.177 4.576 ( 1.442 0.000 -2.048) 2.504 4.649 ( -8.357 0.000 -3.894) 9.219 4.669 ( 3.753 0.000 4.493) 5.854 4.775 ( 4.324 0.000 6.602) 7.892 4.782 ( 3.105 0.000 -8.276) 8.839 4.880 ( 1.975 0.000 1.338) 2.385 4.886 ( 1.270 0.000 -2.292) 2.621 5.008 ( -6.125 0.000 7.520) 9.699 5.190 ( -2.139 0.000 5.785) 6.168 5.206 ( -2.299 0.000 2.997) 3.777 5.207 ( 1.207 0.000 -1.032) 1.588 5.341 ( 3.719 0.000 1.420) 3.981 5.347 ( -3.679 0.000 -1.991) 4.183 5.439 ( 3.388 0.000 6.826) 7.620 5.613 ( 7.745 0.000 0.230) 7.748 5.681 ( -3.445 0.000 5.731) 6.687 5.704 ( 1.825 0.000 7.135) 7.365 5.828 ( -3.006 0.000 3.011) 4.255 5.923 ( -2.996 0.000 0.159) 3.000 5.940 ( 11.593 0.000 -1.293) 11.665 5.989 ( 1.022 0.000 0.237) 1.049 6.026 ( -0.376 0.000 5.304) 5.318 6.144 ( -0.713 0.000 -1.999) 2.122 6.157 ( -5.726 0.000 7.516) 9.449 6.208 ( -3.149 0.000 -0.269) 3.160 6.238 ( -0.830 0.000 5.429) 5.492 6.485 ( -5.044 0.000 -9.099) 10.404 6.550 ( 6.900 0.000 -3.087) 7.559 6.566 ( -4.880 0.000 -1.081) 4.998 6.623 ( -3.578 0.000 -5.050) 6.189 6.732 ( 3.195 0.000 -2.982) 4.371 6.764 ( -5.623 0.000 0.850) 5.687 6.786 ( 4.413 0.000 0.148) 4.416 6.887 ( -5.892 0.000 -2.861) 6.550 7.036 ( 0.470 0.000 2.836) 2.875 7.095 ( -2.725 0.000 -2.830) 3.929 7.197 ( -3.791 0.000 1.601) 4.115 7.216 ( 0.047 0.000 -3.219) 3.219 7.268 ( 2.538 0.000 -4.366) 5.050 7.289 ( 0.635 0.000 0.959) 1.150 7.469 ( -3.168 0.000 -0.444) 3.199 7.593 ( -4.268 0.000 0.514) 4.299 7.840 ( -14.964 0.000 3.044) 15.270 8.054 ( -15.567 0.000 1.308) 15.622 8.238 ( -13.487 0.000 2.328) 13.687 8.449 ( -10.871 0.000 0.231) 10.873 8.898 ( 1.842 0.000 -1.590) 2.433 8.976 ( -0.898 0.000 -1.072) 1.398 9.145 ( -0.135 0.000 5.109) 5.110 9.261 ( 1.486 0.000 -0.539) 1.581 9.316 ( 1.455 0.000 -2.769) 3.128 9.428 ( 3.304 0.000 3.658) 4.929 9.436 ( 5.711 0.000 0.973) 5.793 9.478 ( 0.950 0.000 2.795) 2.951 9.535 ( 4.229 0.000 -0.671) 4.282 9.594 ( 6.146 0.000 -1.297) 6.281 9.694 ( 0.381 0.000 0.417) 0.565 9.788 ( -1.046 0.000 0.338) 1.099 9.876 ( -3.469 0.000 -4.099) 5.370 9.921 ( -11.201 0.000 0.052) 11.201 9.935 ( -9.270 0.000 1.923) 9.468 10.054 ( -6.618 0.000 -2.219) 6.980 10.124 ( -2.140 0.000 -3.836) 4.393 10.272 ( -8.818 0.000 -1.790) 8.998 10.315 ( -4.957 0.000 5.112) 7.121 10.518 ( -4.761 0.000 0.538) 4.791 10.600 ( -5.781 0.000 1.098) 5.884 10.684 ( -4.698 0.000 -1.116) 4.828 10.911 ( -1.491 0.000 -0.371) 1.536 10.935 ( -5.348 0.000 1.511) 5.557 11.727 ( 2.411 0.000 0.305) 2.430 11.744 ( 3.649 0.000 -0.259) 3.658 11.746 ( 9.360 0.000 -0.014) 9.360 11.756 ( 9.816 0.000 -0.097) 9.816 12.043 ( 0.045 0.000 0.112) 0.121 12.133 ( 1.615 0.000 0.467) 1.681 12.206 ( -2.133 0.000 -0.985) 2.349 12.208 ( -2.428 0.000 -0.109) 2.430 12.396 ( -0.950 0.000 -0.313) 1.000 12.424 ( 2.881 0.000 2.065) 3.545 12.471 ( 2.156 0.000 -1.912) 2.882 12.511 ( 5.161 0.000 1.227) 5.305 12.691 ( 1.917 0.000 -1.988) 2.761 12.708 ( 3.495 0.000 0.510) 3.532 12.932 ( -4.164 0.000 -0.543) 4.199 12.973 ( -1.524 0.000 0.318) 1.557 13.304 ( 5.142 0.000 0.132) 5.144 13.344 ( 4.793 0.000 -0.607) 4.831 13.698 ( -8.240 0.000 -0.353) 8.248 13.714 ( -8.638 0.000 -0.004) 8.638 14.052 ( 12.321 0.000 0.218) 12.323 14.233 ( 4.960 0.000 0.700) 5.010 14.301 ( 6.041 0.000 0.755) 6.088 14.306 ( -1.841 0.000 0.482) 1.903 14.337 ( -0.728 0.000 0.388) 0.825 14.383 ( 5.053 0.000 -1.907) 5.401 14.691 ( -4.970 0.000 -1.176) 5.108 14.793 ( -1.468 0.000 1.038) 1.798 15.149 ( 8.887 0.000 1.739) 9.055 15.164 ( 6.127 0.000 -2.840) 6.753 15.432 ( 4.122 0.000 0.560) 4.160 15.468 ( 5.014 0.000 -0.939) 5.101 15.531 ( -1.521 0.000 -0.926) 1.781 15.580 ( -1.257 0.000 0.896) 1.544 15.618 ( -1.111 0.000 -0.174) 1.125 15.656 ( 6.124 0.000 -0.419) 6.138 15.924 ( 4.899 0.000 -2.325) 5.422 15.985 ( 8.477 0.000 0.053) 8.477 16.071 ( -3.441 0.000 1.575) 3.784 16.143 ( 4.485 0.000 5.257) 6.910 16.598 ( 0.029 0.000 -0.403) 0.404 16.662 ( 4.112 0.000 -1.621) 4.420 16.674 ( -1.318 0.000 3.430) 3.675 16.789 ( -4.814 0.000 2.442) 5.398 17.316 ( 0.457 0.000 -0.058) 0.461 17.366 ( 2.791 0.000 -1.545) 3.190 17.384 ( 0.453 0.000 -0.947) 1.050 17.400 ( -0.123 0.000 1.776) 1.781 19.865 ( 5.892 0.000 -2.255) 6.309 19.989 ( 5.265 0.000 2.555) 5.852 20.104 ( 2.108 0.000 0.151) 2.114 20.224 ( 4.510 0.000 2.158) 5.000 20.416 ( -5.740 0.000 3.288) 6.615 20.471 ( -4.705 0.000 -1.109) 4.834 20.715 ( -2.972 0.000 1.902) 3.529 20.768 ( -2.026 0.000 -0.291) 2.047 22.133 ( 8.400 0.000 -1.775) 8.585 22.138 ( 9.116 0.000 -0.496) 9.129 22.345 ( 7.322 0.000 -0.420) 7.334 22.346 ( 8.300 0.000 0.539) 8.317 22.769 ( -8.401 0.000 0.962) 8.455 22.901 ( -9.782 0.000 -1.427) 9.885 23.029 ( -10.642 0.000 1.907) 10.811 23.060 ( -10.750 0.000 -0.731) 10.775 27.095 ( 19.056 0.000 -1.614) 19.124 27.193 ( 19.876 0.000 2.559) 20.040 27.364 ( 25.473 0.000 -5.049) 25.968 27.981 ( 17.662 0.000 19.286) 26.151 28.345 ( -21.319 0.000 -1.643) 21.383 28.413 ( -20.037 0.000 1.087) 20.067 28.723 ( -20.678 0.000 -1.706) 20.749 28.958 ( -16.127 0.000 3.518) 16.506 30.325 ( 11.763 0.000 -0.898) 11.797 30.453 ( 12.437 0.000 0.934) 12.472 30.656 ( 2.573 0.000 -1.794) 3.137 30.757 ( -0.068 0.000 1.577) 1.578 30.904 ( 8.112 0.000 -0.437) 8.123 31.076 ( 7.882 0.000 0.592) 7.905 31.330 ( 4.418 0.000 2.160) 4.918 31.432 ( 6.520 0.000 8.125) 10.417 31.434 ( -4.437 0.000 -0.267) 4.445 31.566 ( -12.555 0.000 -0.313) 12.559 31.816 ( -4.843 0.000 2.311) 5.366 31.862 ( -9.749 0.000 0.893) 9.789 31.984 ( 4.800 0.000 -5.457) 7.268 31.992 ( 4.968 0.000 6.231) 7.969 32.376 ( 6.881 0.000 5.574) 8.855 32.769 ( 2.949 0.000 10.907) 11.298 33.021 ( 9.424 0.000 -4.460) 10.426 33.104 ( -6.460 0.000 6.701) 9.307 33.171 ( 12.915 0.000 -0.510) 12.925 33.214 ( 13.657 0.000 2.847) 13.951 33.529 ( -4.277 0.000 -4.100) 5.925 33.703 ( -4.927 0.000 6.333) 8.024 33.839 ( -8.005 0.000 4.890) 9.380 33.910 ( -9.569 0.000 4.699) 10.660 34.871 ( -0.258 0.000 1.077) 1.107 34.935 ( 0.923 0.000 -1.140) 1.466 35.118 ( 2.271 0.000 -4.674) 5.196 35.186 ( 2.121 0.000 -4.992) 5.424 35.610 ( 2.241 0.000 4.533) 5.057 35.718 ( 3.708 0.000 -0.421) 3.731 35.822 ( 4.623 0.000 -0.307) 4.633 35.879 ( 3.812 0.000 0.624) 3.863 36.072 ( 2.052 0.000 -7.798) 8.063 36.097 ( 6.976 0.000 -12.010) 13.889 36.334 ( -6.463 0.000 -6.188) 8.948 36.424 ( -4.063 0.000 -2.057) 4.554 37.145 ( 10.265 0.000 -10.350) 14.577 37.746 ( -13.285 0.000 9.295) 16.214 37.874 ( -4.310 0.000 -15.846) 16.421 38.277 ( -20.748 0.000 7.363) 22.016 ======================= Grid point 94 (47/69) ======================= q-point: ( 0.44 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( 18.544 0.000 -3.291) 18.834 1.843 ( 17.178 0.000 -6.231) 18.273 2.056 ( -15.717 0.000 -0.955) 15.746 2.243 ( 12.171 0.000 1.377) 12.248 2.246 ( -20.039 0.000 -7.950) 21.558 2.475 ( -4.313 0.000 -0.499) 4.342 2.505 ( 0.689 0.000 -4.640) 4.691 2.573 ( 15.911 0.000 -1.608) 15.992 2.618 ( 3.826 0.000 -13.345) 13.882 2.680 ( -6.748 0.000 -5.612) 8.777 2.709 ( 8.851 0.000 5.327) 10.331 2.891 ( -0.459 0.000 -2.545) 2.586 2.912 ( -1.103 0.000 0.549) 1.232 2.992 ( 5.815 0.000 -5.893) 8.278 3.051 ( -10.885 0.000 -4.117) 11.638 3.140 ( -3.682 0.000 9.007) 9.730 3.140 ( 16.940 0.000 5.688) 17.870 3.227 ( 7.053 0.000 0.530) 7.073 3.379 ( 7.836 0.000 0.121) 7.837 3.384 ( -7.361 0.000 -4.138) 8.445 3.523 ( 12.213 0.000 1.006) 12.255 3.629 ( 12.078 0.000 6.389) 13.663 3.664 ( -2.300 0.000 -10.133) 10.391 3.674 ( -10.044 0.000 0.436) 10.054 3.777 ( 6.613 0.000 -2.634) 7.118 3.805 ( -7.544 0.000 3.187) 8.190 3.921 ( -9.557 0.000 -6.543) 11.582 3.995 ( -7.556 0.000 -3.455) 8.308 4.147 ( -2.220 0.000 -1.133) 2.492 4.205 ( 4.314 0.000 -8.802) 9.802 4.261 ( 9.095 0.000 -1.102) 9.162 4.355 ( -1.260 0.000 2.601) 2.890 4.444 ( -6.485 0.000 4.146) 7.697 4.459 ( 3.220 0.000 2.600) 4.139 4.506 ( 1.403 0.000 -1.263) 1.888 4.684 ( 6.244 0.000 -0.216) 6.248 4.714 ( -1.240 0.000 -5.005) 5.156 4.731 ( 2.413 0.000 -4.705) 5.287 4.825 ( -4.612 0.000 4.407) 6.379 4.928 ( 0.986 0.000 6.951) 7.021 4.960 ( 7.669 0.000 2.778) 8.156 4.994 ( -2.260 0.000 3.520) 4.183 5.126 ( -2.977 0.000 -6.944) 7.555 5.141 ( -7.532 0.000 0.590) 7.555 5.279 ( 3.448 0.000 3.035) 4.593 5.283 ( -2.992 0.000 1.922) 3.557 5.456 ( 7.416 0.000 2.246) 7.748 5.462 ( -4.322 0.000 0.991) 4.434 5.663 ( -3.263 0.000 1.349) 3.531 5.700 ( -2.178 0.000 -5.360) 5.786 5.775 ( 2.616 0.000 6.785) 7.272 5.817 ( -5.077 0.000 7.648) 9.179 5.935 ( 4.098 0.000 2.286) 4.692 6.016 ( 2.360 0.000 2.328) 3.315 6.052 ( -2.365 0.000 1.867) 3.013 6.085 ( -1.693 0.000 3.185) 3.607 6.140 ( -0.903 0.000 -1.364) 1.636 6.141 ( -8.841 0.000 8.733) 12.427 6.206 ( 14.454 0.000 -2.044) 14.598 6.250 ( -3.776 0.000 3.333) 5.036 6.433 ( 5.423 0.000 -1.884) 5.741 6.517 ( -1.869 0.000 0.391) 1.910 6.544 ( 1.038 0.000 -2.014) 2.266 6.637 ( -10.109 0.000 -0.346) 10.114 6.651 ( 7.124 0.000 -2.627) 7.593 6.710 ( 1.210 0.000 -5.986) 6.107 6.782 ( -3.350 0.000 -3.516) 4.857 6.801 ( 0.707 0.000 -6.108) 6.149 7.085 ( 2.564 0.000 -0.289) 2.580 7.094 ( 4.512 0.000 1.632) 4.798 7.148 ( -6.877 0.000 2.573) 7.343 7.177 ( -2.942 0.000 0.468) 2.979 7.270 ( 2.770 0.000 -3.766) 4.675 7.291 ( -1.372 0.000 -0.335) 1.412 7.464 ( 0.499 0.000 2.957) 2.999 7.543 ( -3.195 0.000 0.401) 3.220 7.761 ( -1.049 0.000 4.328) 4.454 7.876 ( -7.402 0.000 0.784) 7.443 8.158 ( -2.033 0.000 4.703) 5.124 8.311 ( -5.917 0.000 -1.148) 6.028 8.897 ( 0.726 0.000 -1.265) 1.459 8.942 ( -0.851 0.000 -2.399) 2.545 9.187 ( -0.735 0.000 3.412) 3.491 9.257 ( -0.061 0.000 -1.613) 1.614 9.373 ( 5.851 0.000 1.927) 6.160 9.486 ( -1.982 0.000 2.323) 3.053 9.519 ( 0.938 0.000 2.037) 2.242 9.522 ( 2.747 0.000 1.085) 2.953 9.590 ( 4.182 0.000 -0.755) 4.250 9.651 ( 1.774 0.000 -1.854) 2.566 9.692 ( 2.020 0.000 -1.157) 2.328 9.713 ( -5.027 0.000 -0.303) 5.036 9.757 ( -7.247 0.000 -0.692) 7.280 9.768 ( -6.448 0.000 0.924) 6.514 9.930 ( 2.578 0.000 0.521) 2.630 9.963 ( -2.523 0.000 -0.314) 2.543 10.083 ( 2.691 0.000 -3.868) 4.712 10.130 ( -7.674 0.000 -1.275) 7.779 10.329 ( 0.622 0.000 3.414) 3.470 10.451 ( -3.293 0.000 -2.232) 3.978 10.540 ( -3.026 0.000 2.316) 3.810 10.612 ( -1.803 0.000 -2.221) 2.861 10.899 ( -2.079 0.000 1.659) 2.660 10.903 ( 0.412 0.000 0.075) 0.419 11.755 ( 0.642 0.000 0.514) 0.822 11.775 ( 1.125 0.000 -0.680) 1.315 11.854 ( 3.873 0.000 0.372) 3.891 11.864 ( 4.125 0.000 -0.395) 4.144 12.058 ( 0.552 0.000 1.653) 1.743 12.129 ( -0.834 0.000 -1.409) 1.638 12.171 ( -2.230 0.000 0.260) 2.245 12.174 ( -0.446 0.000 -0.805) 0.920 12.388 ( -0.715 0.000 1.263) 1.452 12.461 ( 0.509 0.000 -3.052) 3.095 12.505 ( 2.923 0.000 2.470) 3.826 12.580 ( 2.219 0.000 -0.910) 2.399 12.705 ( 2.280 0.000 -0.254) 2.294 12.751 ( 1.443 0.000 -0.596) 1.562 12.870 ( -2.294 0.000 0.730) 2.407 12.930 ( -3.282 0.000 -0.656) 3.347 13.406 ( 7.122 0.000 -0.101) 7.123 13.423 ( 5.112 0.000 -0.187) 5.116 13.579 ( -5.862 0.000 -0.647) 5.897 13.584 ( -7.771 0.000 0.036) 7.771 14.189 ( 3.930 0.000 1.517) 4.212 14.257 ( 1.309 0.000 -0.573) 1.429 14.286 ( -1.082 0.000 -0.009) 1.082 14.293 ( -1.409 0.000 -1.394) 1.982 14.465 ( 8.538 0.000 -2.113) 8.796 14.492 ( 9.708 0.000 2.740) 10.088 14.577 ( -7.586 0.000 -0.464) 7.601 14.719 ( -8.122 0.000 -0.950) 8.178 15.243 ( 7.803 0.000 -1.045) 7.872 15.274 ( 5.378 0.000 1.041) 5.477 15.396 ( -6.496 0.000 0.008) 6.496 15.431 ( -5.795 0.000 -0.915) 5.866 15.557 ( 4.655 0.000 -1.369) 4.852 15.587 ( -2.570 0.000 -0.070) 2.571 15.622 ( 4.287 0.000 0.467) 4.312 15.682 ( -1.456 0.000 -0.407) 1.512 16.002 ( 4.714 0.000 0.161) 4.717 16.056 ( -0.178 0.000 -0.476) 0.508 16.122 ( 7.711 0.000 0.772) 7.750 16.202 ( -2.262 0.000 2.058) 3.058 16.605 ( 1.402 0.000 0.786) 1.608 16.679 ( -2.679 0.000 2.761) 3.847 16.702 ( -6.443 0.000 -0.047) 6.443 16.703 ( 3.713 0.000 -1.777) 4.116 17.321 ( 0.105 0.000 0.081) 0.133 17.356 ( -0.022 0.000 -2.079) 2.079 17.410 ( -0.800 0.000 1.435) 1.643 17.414 ( 2.388 0.000 -0.176) 2.395 19.953 ( 7.332 0.000 -1.049) 7.407 20.041 ( -1.579 0.000 -0.897) 1.816 20.151 ( 3.797 0.000 1.638) 4.135 20.244 ( -3.086 0.000 -0.114) 3.088 20.385 ( -3.723 0.000 3.752) 5.286 20.418 ( -0.812 0.000 -0.136) 0.823 20.698 ( -1.723 0.000 2.166) 2.768 20.743 ( -0.152 0.000 -0.615) 0.634 22.245 ( 6.191 0.000 -0.856) 6.250 22.256 ( 3.863 0.000 0.234) 3.870 22.458 ( 7.855 0.000 0.450) 7.868 22.482 ( 7.322 0.000 0.979) 7.387 22.674 ( -5.155 0.000 0.205) 5.159 22.728 ( -8.774 0.000 -2.615) 9.156 22.906 ( -6.731 0.000 1.827) 6.975 22.916 ( -5.282 0.000 -0.245) 5.287 27.366 ( 16.080 0.000 -0.605) 16.092 27.463 ( 7.886 0.000 0.933) 7.941 27.711 ( 23.661 0.000 -1.425) 23.703 28.068 ( -8.139 0.000 -0.755) 8.174 28.090 ( -16.850 0.000 -1.503) 16.917 28.153 ( -16.170 0.000 1.521) 16.241 28.593 ( 3.730 0.000 8.035) 8.859 28.782 ( -11.168 0.000 3.264) 11.636 30.465 ( 6.517 0.000 0.252) 6.522 30.558 ( 1.021 0.000 -2.114) 2.348 30.694 ( 3.815 0.000 0.921) 3.925 30.752 ( -2.378 0.000 0.755) 2.495 31.069 ( 11.712 0.000 1.702) 11.835 31.185 ( 6.759 0.000 -1.253) 6.874 31.271 ( -8.557 0.000 1.007) 8.616 31.337 ( -12.061 0.000 -2.300) 12.278 31.507 ( 6.840 0.000 2.318) 7.222 31.603 ( 2.913 0.000 3.266) 4.376 31.742 ( -6.420 0.000 3.034) 7.101 31.776 ( -3.773 0.000 2.566) 4.563 32.041 ( 6.205 0.000 -0.203) 6.208 32.085 ( -3.318 0.000 6.017) 6.872 32.617 ( 13.527 0.000 7.455) 15.445 32.859 ( -9.499 0.000 9.149) 13.189 33.021 ( -1.121 0.000 -3.384) 3.565 33.066 ( 1.471 0.000 -3.906) 4.174 33.336 ( 6.497 0.000 0.221) 6.501 33.375 ( 3.531 0.000 -1.766) 3.948 33.528 ( 8.561 0.000 2.454) 8.906 33.679 ( -5.839 0.000 3.795) 6.964 33.764 ( -6.591 0.000 3.488) 7.457 33.793 ( -8.759 0.000 2.156) 9.021 34.912 ( 0.752 0.000 4.653) 4.713 34.967 ( 1.711 0.000 2.520) 3.046 35.090 ( 1.276 0.000 -5.041) 5.200 35.145 ( 0.543 0.000 -6.117) 6.141 35.708 ( 3.053 0.000 5.266) 6.086 35.757 ( 0.991 0.000 0.659) 1.190 35.884 ( 4.316 0.000 -1.031) 4.437 35.920 ( 1.171 0.000 -0.839) 1.441 36.037 ( 3.634 0.000 -6.025) 7.036 36.083 ( 6.016 0.000 -9.236) 11.023 36.137 ( -6.815 0.000 -6.935) 9.723 36.238 ( -7.552 0.000 -10.594) 13.010 37.314 ( 17.259 0.000 -0.762) 17.276 37.576 ( -17.324 0.000 3.185) 17.614 37.850 ( 13.708 0.000 -5.124) 14.634 38.022 ( -20.440 0.000 4.456) 20.920 ======================= Grid point 95 (48/69) ======================= q-point: (-0.44 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.779 ( -18.789 0.000 0.389) 18.793 1.829 ( -23.090 0.000 -4.169) 23.463 2.052 ( 14.037 0.000 -0.955) 14.069 2.105 ( 15.577 0.000 3.613) 15.991 2.280 ( -15.725 0.000 -2.480) 15.920 2.359 ( -7.152 0.000 5.219) 8.854 2.501 ( 10.270 0.000 0.911) 10.310 2.542 ( -9.798 0.000 -2.235) 10.050 2.584 ( 2.082 0.000 -8.958) 9.197 2.626 ( -0.244 0.000 -1.825) 1.841 2.831 ( -7.942 0.000 -4.552) 9.154 2.850 ( -4.606 0.000 -0.566) 4.641 2.934 ( 6.444 0.000 2.057) 6.764 2.965 ( 7.596 0.000 0.299) 7.602 3.029 ( -13.829 0.000 -8.335) 16.147 3.157 ( 8.725 0.000 7.568) 11.550 3.240 ( -14.034 0.000 -1.301) 14.094 3.251 ( -0.977 0.000 1.656) 1.923 3.295 ( 0.551 0.000 6.234) 6.258 3.459 ( 0.561 0.000 -8.636) 8.654 3.459 ( -12.111 0.000 3.967) 12.744 3.593 ( -10.794 0.000 -4.340) 11.634 3.670 ( 11.810 0.000 3.306) 12.264 3.713 ( 10.665 0.000 5.458) 11.980 3.770 ( -3.948 0.000 -7.631) 8.591 3.796 ( -2.727 0.000 0.152) 2.731 3.858 ( 1.506 0.000 -0.992) 1.803 3.918 ( 10.908 0.000 4.140) 11.667 4.071 ( -6.360 0.000 2.657) 6.893 4.177 ( 1.386 0.000 -4.934) 5.125 4.250 ( -11.158 0.000 -1.075) 11.210 4.361 ( 4.395 0.000 -0.585) 4.433 4.454 ( 0.020 0.000 2.830) 2.830 4.542 ( 6.260 0.000 2.768) 6.845 4.589 ( -4.627 0.000 -7.538) 8.845 4.615 ( 5.808 0.000 1.037) 5.900 4.687 ( -1.913 0.000 -3.049) 3.599 4.717 ( -1.062 0.000 -2.040) 2.300 4.877 ( -3.749 0.000 7.521) 8.404 4.901 ( -1.227 0.000 0.755) 1.441 4.994 ( -1.914 0.000 1.417) 2.382 5.025 ( -3.430 0.000 0.996) 3.572 5.050 ( 1.212 0.000 -3.737) 3.929 5.143 ( 5.244 0.000 -0.749) 5.297 5.302 ( 0.337 0.000 1.992) 2.020 5.330 ( 1.373 0.000 -0.259) 1.397 5.426 ( -1.982 0.000 5.096) 5.468 5.561 ( 8.210 0.000 -5.696) 9.993 5.627 ( 0.172 0.000 0.395) 0.430 5.657 ( 1.038 0.000 -0.130) 1.046 5.829 ( -2.937 0.000 4.697) 5.539 5.858 ( 1.430 0.000 4.084) 4.327 5.982 ( -4.367 0.000 -2.019) 4.811 6.027 ( -10.282 0.000 7.253) 12.583 6.039 ( -0.703 0.000 -1.456) 1.617 6.076 ( -1.627 0.000 3.582) 3.935 6.088 ( 5.555 0.000 -0.131) 5.556 6.180 ( 0.919 0.000 1.941) 2.148 6.218 ( 0.284 0.000 -2.237) 2.255 6.397 ( 11.494 0.000 -5.114) 12.581 6.475 ( -5.871 0.000 -4.178) 7.206 6.492 ( 3.209 0.000 1.181) 3.420 6.507 ( -3.355 0.000 2.919) 4.447 6.618 ( 7.474 0.000 0.765) 7.513 6.647 ( -2.536 0.000 -4.304) 4.995 6.677 ( -1.574 0.000 -4.243) 4.526 6.720 ( -1.572 0.000 1.145) 1.945 6.758 ( 3.793 0.000 -0.553) 3.833 7.055 ( -5.286 0.000 4.282) 6.803 7.073 ( -6.999 0.000 0.306) 7.005 7.168 ( 3.093 0.000 0.841) 3.205 7.207 ( 6.748 0.000 -1.399) 6.892 7.261 ( -1.227 0.000 -1.559) 1.984 7.288 ( 2.479 0.000 -1.047) 2.691 7.474 ( -6.380 0.000 1.248) 6.501 7.525 ( 2.908 0.000 2.231) 3.665 7.856 ( 5.518 0.000 -3.818) 6.710 7.862 ( 8.699 0.000 2.246) 8.984 8.249 ( 1.831 0.000 -3.670) 4.101 8.252 ( 6.590 0.000 4.446) 7.949 8.903 ( -0.764 0.000 -1.851) 2.003 8.910 ( 1.654 0.000 0.553) 1.744 9.208 ( -0.994 0.000 3.180) 3.332 9.234 ( -0.379 0.000 -1.569) 1.614 9.426 ( -5.517 0.000 -1.621) 5.750 9.488 ( 3.726 0.000 1.816) 4.145 9.514 ( -4.301 0.000 1.737) 4.639 9.525 ( -3.021 0.000 1.576) 3.407 9.585 ( -4.769 0.000 -1.137) 4.903 9.628 ( -0.314 0.000 0.112) 0.333 9.681 ( 0.035 0.000 -0.366) 0.367 9.720 ( 3.890 0.000 -0.646) 3.944 9.756 ( 6.716 0.000 0.113) 6.717 9.784 ( 7.311 0.000 -0.519) 7.329 9.956 ( 0.827 0.000 -1.505) 1.717 9.960 ( 1.488 0.000 -0.095) 1.491 10.013 ( -5.725 0.000 1.800) 6.001 10.134 ( 7.308 0.000 -1.483) 7.457 10.386 ( -0.482 0.000 -2.635) 2.679 10.406 ( 4.782 0.000 2.255) 5.287 10.564 ( 2.219 0.000 2.573) 3.398 10.588 ( 2.312 0.000 -2.347) 3.295 10.896 ( -0.230 0.000 0.754) 0.788 10.921 ( 2.047 0.000 -0.363) 2.079 11.758 ( -1.209 0.000 0.792) 1.446 11.768 ( -1.017 0.000 -0.607) 1.184 11.858 ( -3.749 0.000 0.148) 3.752 11.862 ( -3.869 0.000 -0.408) 3.890 12.094 ( 1.255 0.000 1.884) 2.264 12.095 ( -0.975 0.000 -1.799) 2.046 12.154 ( -0.858 0.000 1.063) 1.366 12.179 ( 1.814 0.000 -0.418) 1.862 12.401 ( -0.363 0.000 2.475) 2.501 12.428 ( -0.496 0.000 -2.459) 2.508 12.550 ( -0.079 0.000 1.902) 1.904 12.553 ( -2.799 0.000 -2.089) 3.492 12.711 ( -4.312 0.000 -0.913) 4.408 12.738 ( 0.250 0.000 0.666) 0.711 12.892 ( 1.072 0.000 -1.341) 1.717 12.914 ( 4.818 0.000 0.936) 4.909 13.409 ( -6.179 0.000 -0.353) 6.189 13.421 ( -6.139 0.000 0.052) 6.140 13.569 ( 6.711 0.000 0.221) 6.715 13.586 ( 7.031 0.000 -0.191) 7.034 14.226 ( -1.311 0.000 2.224) 2.582 14.229 ( -4.372 0.000 -2.282) 4.932 14.279 ( 0.426 0.000 0.018) 0.426 14.284 ( 1.719 0.000 0.130) 1.724 14.429 ( -9.496 0.000 1.308) 9.586 14.550 ( -9.999 0.000 -2.193) 10.236 14.579 ( 7.719 0.000 -1.229) 7.816 14.687 ( 9.711 0.000 1.971) 9.909 15.236 ( -8.344 0.000 -0.309) 8.349 15.304 ( -4.173 0.000 -1.698) 4.505 15.390 ( 6.157 0.000 0.567) 6.183 15.402 ( 4.108 0.000 1.584) 4.403 15.538 ( -4.015 0.000 0.343) 4.030 15.599 ( 2.205 0.000 -0.899) 2.381 15.632 ( -3.198 0.000 -0.735) 3.282 15.674 ( 1.156 0.000 0.408) 1.226 16.014 ( -4.984 0.000 -0.847) 5.055 16.045 ( 0.905 0.000 0.608) 1.091 16.134 ( -7.157 0.000 -0.303) 7.163 16.226 ( 4.474 0.000 0.023) 4.474 16.624 ( -2.285 0.000 -0.761) 2.409 16.661 ( -3.259 0.000 1.972) 3.809 16.682 ( 6.942 0.000 1.581) 7.120 16.733 ( 2.557 0.000 -1.858) 3.160 17.322 ( -0.727 0.000 1.019) 1.252 17.333 ( -0.457 0.000 -1.066) 1.160 17.405 ( -1.540 0.000 0.716) 1.698 17.436 ( 1.226 0.000 -1.000) 1.582 19.951 ( -7.101 0.000 -0.734) 7.139 20.037 ( 3.260 0.000 -0.567) 3.308 20.179 ( -3.158 0.000 -1.046) 3.327 20.235 ( 3.828 0.000 0.792) 3.909 20.371 ( -3.074 0.000 4.080) 5.108 20.425 ( 1.069 0.000 0.293) 1.109 20.718 ( 1.409 0.000 1.615) 2.143 20.748 ( 2.526 0.000 -2.072) 3.267 22.235 ( -5.768 0.000 0.061) 5.768 22.263 ( -3.536 0.000 -0.468) 3.567 22.473 ( -8.919 0.000 -0.675) 8.945 22.497 ( -7.488 0.000 -0.388) 7.498 22.682 ( 8.673 0.000 1.703) 8.838 22.687 ( 6.940 0.000 -1.251) 7.052 22.900 ( 4.233 0.000 1.232) 4.409 22.931 ( 6.820 0.000 -0.527) 6.840 27.363 ( -16.742 0.000 -0.257) 16.744 27.470 ( -6.248 0.000 0.260) 6.253 27.708 ( -26.460 0.000 -1.124) 26.484 28.042 ( 17.240 0.000 3.001) 17.499 28.066 ( 8.094 0.000 -0.359) 8.102 28.177 ( 18.420 0.000 -0.999) 18.447 28.691 ( -2.406 0.000 -0.414) 2.441 28.789 ( 11.337 0.000 2.627) 11.637 30.481 ( -7.392 0.000 -1.208) 7.490 30.519 ( -1.341 0.000 1.512) 2.021 30.703 ( -4.090 0.000 0.059) 4.090 30.756 ( 2.430 0.000 0.259) 2.444 31.105 ( -12.047 0.000 -1.539) 12.145 31.157 ( -7.537 0.000 1.445) 7.675 31.289 ( 12.938 0.000 2.499) 13.177 31.303 ( 8.029 0.000 -2.227) 8.332 31.540 ( -8.212 0.000 -0.828) 8.254 31.613 ( 2.365 0.000 1.867) 3.012 31.771 ( 2.068 0.000 0.425) 2.111 31.793 ( 5.040 0.000 1.467) 5.249 32.033 ( -7.742 0.000 1.844) 7.958 32.158 ( 6.842 0.000 1.605) 7.027 32.686 ( -15.823 0.000 0.890) 15.848 32.913 ( 14.211 0.000 4.383) 14.872 32.986 ( -6.350 0.000 -1.740) 6.584 33.016 ( -2.086 0.000 1.039) 2.330 33.357 ( -1.946 0.000 -0.518) 2.014 33.366 ( -2.536 0.000 -2.393) 3.487 33.562 ( -10.050 0.000 -0.472) 10.061 33.693 ( 6.881 0.000 3.816) 7.869 33.799 ( 6.455 0.000 0.727) 6.496 33.802 ( 9.415 0.000 1.172) 9.487 34.975 ( -0.655 0.000 5.693) 5.730 35.024 ( 0.123 0.000 4.547) 4.549 35.039 ( 0.032 0.000 -6.336) 6.336 35.067 ( -1.243 0.000 -6.356) 6.477 35.757 ( -1.834 0.000 0.059) 1.835 35.800 ( 3.201 0.000 0.217) 3.208 35.884 ( -2.661 0.000 -2.942) 3.967 35.929 ( 3.398 0.000 -2.196) 4.046 35.994 ( -6.145 0.000 -2.446) 6.614 36.049 ( -3.862 0.000 -3.871) 5.468 36.054 ( 2.113 0.000 0.404) 2.151 36.081 ( 4.513 0.000 -1.999) 4.936 37.305 ( -19.260 0.000 0.334) 19.263 37.602 ( 18.512 0.000 0.669) 18.524 37.759 ( -18.553 0.000 3.530) 18.886 38.088 ( 19.967 0.000 -1.901) 20.057 ======================= Grid point 96 (49/69) ======================= q-point: (-0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( -26.646 0.000 5.888) 27.289 1.476 ( -23.810 0.000 4.260) 24.188 2.063 ( -11.006 0.000 2.490) 11.284 2.183 ( -6.431 0.000 1.347) 6.570 2.340 ( -5.749 0.000 12.973) 14.190 2.362 ( -0.597 0.000 10.869) 10.886 2.366 ( 0.509 0.000 -1.891) 1.958 2.489 ( 2.100 0.000 -2.661) 3.389 2.493 ( -17.192 0.000 5.647) 18.096 2.604 ( -18.253 0.000 -8.921) 20.317 2.687 ( -4.448 0.000 -1.652) 4.745 2.756 ( 4.219 0.000 3.391) 5.413 2.859 ( -4.883 0.000 0.883) 4.963 2.957 ( 3.435 0.000 -0.669) 3.499 2.981 ( 0.364 0.000 0.587) 0.691 3.038 ( -5.584 0.000 -1.394) 5.756 3.174 ( -5.468 0.000 1.519) 5.675 3.243 ( 4.638 0.000 -3.358) 5.726 3.298 ( -6.985 0.000 -0.762) 7.026 3.381 ( -7.258 0.000 -4.676) 8.634 3.474 ( 4.199 0.000 -1.825) 4.578 3.522 ( -3.330 0.000 13.663) 14.063 3.591 ( -0.572 0.000 -10.066) 10.082 3.741 ( -2.089 0.000 -1.454) 2.546 3.843 ( 8.137 0.000 -1.965) 8.371 3.910 ( 0.733 0.000 -0.681) 1.000 3.984 ( 6.609 0.000 6.229) 9.082 4.025 ( -9.521 0.000 1.956) 9.720 4.047 ( 1.097 0.000 0.516) 1.213 4.115 ( -1.940 0.000 9.257) 9.458 4.119 ( -3.168 0.000 -2.094) 3.798 4.409 ( 1.329 0.000 2.103) 2.488 4.410 ( -6.426 0.000 -5.697) 8.588 4.500 ( 2.011 0.000 1.335) 2.414 4.573 ( -5.041 0.000 -3.912) 6.381 4.629 ( -1.195 0.000 2.013) 2.341 4.671 ( 0.867 0.000 -0.803) 1.182 4.704 ( 4.672 0.000 -1.021) 4.783 4.778 ( -9.733 0.000 3.355) 10.295 4.934 ( -0.733 0.000 -4.325) 4.387 4.955 ( -1.824 0.000 -3.682) 4.109 5.068 ( 9.367 0.000 3.269) 9.921 5.107 ( 1.145 0.000 6.306) 6.410 5.205 ( 2.382 0.000 3.896) 4.566 5.275 ( -0.452 0.000 -5.852) 5.869 5.342 ( 1.413 0.000 -0.766) 1.607 5.417 ( -1.777 0.000 -3.931) 4.313 5.610 ( 7.408 0.000 -8.704) 11.430 5.646 ( -3.858 0.000 0.098) 3.859 5.705 ( 3.464 0.000 2.464) 4.251 5.798 ( -2.777 0.000 -2.270) 3.587 5.865 ( -13.002 0.000 4.844) 13.875 5.927 ( 3.284 0.000 1.195) 3.494 5.928 ( 1.159 0.000 -1.864) 2.194 6.005 ( -3.660 0.000 -1.924) 4.134 6.100 ( 2.223 0.000 -0.083) 2.224 6.181 ( 0.783 0.000 -6.268) 6.317 6.196 ( -0.336 0.000 0.056) 0.340 6.226 ( 7.833 0.000 1.247) 7.931 6.358 ( -3.362 0.000 -0.158) 3.366 6.446 ( 5.668 0.000 -5.550) 7.933 6.490 ( -5.086 0.000 1.870) 5.419 6.553 ( 3.902 0.000 -3.490) 5.236 6.559 ( -1.632 0.000 -0.313) 1.662 6.610 ( -4.138 0.000 6.459) 7.671 6.736 ( -1.815 0.000 3.748) 4.165 6.762 ( 6.914 0.000 1.318) 7.039 6.847 ( 6.439 0.000 0.742) 6.481 7.014 ( -3.714 0.000 4.410) 5.765 7.054 ( -0.606 0.000 1.880) 1.976 7.192 ( -0.703 0.000 1.127) 1.328 7.217 ( 0.188 0.000 -3.219) 3.225 7.252 ( 4.599 0.000 -2.797) 5.382 7.314 ( -0.259 0.000 -1.407) 1.430 7.422 ( -2.753 0.000 3.767) 4.665 7.589 ( 2.798 0.000 0.718) 2.888 7.944 ( 13.836 0.000 -6.040) 15.097 8.071 ( 15.816 0.000 0.380) 15.820 8.304 ( 11.209 0.000 -3.812) 11.840 8.435 ( 11.365 0.000 2.066) 11.551 8.881 ( -0.746 0.000 -0.215) 0.776 8.957 ( 2.983 0.000 0.901) 3.116 9.211 ( -0.751 0.000 -0.816) 1.109 9.228 ( -1.089 0.000 2.911) 3.108 9.314 ( -4.169 0.000 -2.996) 5.134 9.441 ( -6.422 0.000 0.814) 6.474 9.463 ( -3.965 0.000 0.275) 3.975 9.522 ( -3.552 0.000 0.530) 3.591 9.528 ( -0.314 0.000 -1.441) 1.475 9.574 ( -6.059 0.000 0.516) 6.080 9.706 ( 2.645 0.000 -1.184) 2.898 9.785 ( 1.655 0.000 2.911) 3.349 9.822 ( -2.714 0.000 -2.031) 3.389 9.927 ( 12.879 0.000 0.460) 12.888 9.982 ( 9.592 0.000 -0.999) 9.644 10.009 ( 4.383 0.000 1.076) 4.513 10.050 ( 5.123 0.000 1.987) 5.495 10.251 ( 8.715 0.000 0.076) 8.715 10.393 ( 5.163 0.000 -2.410) 5.698 10.511 ( 5.995 0.000 1.007) 6.079 10.631 ( 5.719 0.000 -1.730) 5.975 10.659 ( 6.615 0.000 1.631) 6.813 10.908 ( 1.243 0.000 -0.045) 1.244 10.961 ( 4.327 0.000 -0.815) 4.403 11.732 ( -3.068 0.000 -0.143) 3.072 11.733 ( -3.393 0.000 0.745) 3.474 11.748 ( -9.696 0.000 -0.222) 9.698 11.755 ( -9.061 0.000 -0.081) 9.061 12.056 ( -2.069 0.000 -1.004) 2.299 12.128 ( 0.452 0.000 0.913) 1.019 12.173 ( 1.383 0.000 2.051) 2.473 12.208 ( 2.088 0.000 -0.204) 2.097 12.397 ( -0.936 0.000 -0.753) 1.202 12.426 ( -0.382 0.000 2.179) 2.212 12.473 ( -3.560 0.000 -2.031) 4.099 12.540 ( -2.529 0.000 -1.221) 2.808 12.646 ( -3.523 0.000 1.949) 4.026 12.719 ( -2.385 0.000 -0.518) 2.441 12.927 ( 3.472 0.000 -0.136) 3.474 12.980 ( 2.259 0.000 -0.260) 2.274 13.312 ( -4.412 0.000 -0.702) 4.468 13.330 ( -5.146 0.000 0.677) 5.190 13.692 ( 8.407 0.000 0.113) 8.408 13.712 ( 8.680 0.000 0.148) 8.681 14.064 ( -14.236 0.000 -0.922) 14.266 14.218 ( -2.543 0.000 2.095) 3.295 14.293 ( -0.199 0.000 0.906) 0.928 14.316 ( 2.151 0.000 -0.460) 2.200 14.347 ( -2.827 0.000 1.471) 3.187 14.378 ( -6.987 0.000 -2.802) 7.528 14.675 ( 5.027 0.000 0.180) 5.030 14.806 ( 2.839 0.000 -0.097) 2.841 15.117 ( -7.368 0.000 1.509) 7.521 15.194 ( -6.755 0.000 -2.478) 7.195 15.432 ( -4.911 0.000 0.398) 4.928 15.432 ( -4.485 0.000 2.127) 4.964 15.516 ( 2.425 0.000 0.465) 2.469 15.593 ( 1.244 0.000 -0.176) 1.257 15.623 ( 0.486 0.000 -0.870) 0.996 15.651 ( -4.039 0.000 -0.026) 4.039 15.904 ( -6.566 0.000 -0.085) 6.567 15.996 ( -8.823 0.000 -0.863) 8.865 16.087 ( 4.914 0.000 0.111) 4.915 16.244 ( -0.221 0.000 -3.470) 3.477 16.601 ( -0.688 0.000 -0.500) 0.851 16.628 ( -3.395 0.000 1.494) 3.710 16.732 ( -0.019 0.000 -1.608) 1.608 16.832 ( 10.106 0.000 -1.103) 10.166 17.320 ( -0.028 0.000 -0.522) 0.523 17.321 ( -1.568 0.000 1.872) 2.442 17.381 ( -1.824 0.000 0.112) 1.827 17.434 ( 0.395 0.000 -1.381) 1.436 19.839 ( -6.462 0.000 0.365) 6.473 20.027 ( -2.238 0.000 -1.280) 2.578 20.121 ( -3.446 0.000 -1.188) 3.645 20.252 ( -2.515 0.000 -0.219) 2.524 20.413 ( 2.375 0.000 4.190) 4.816 20.460 ( 3.703 0.000 -0.624) 3.755 20.766 ( 2.832 0.000 0.249) 2.843 20.769 ( 3.450 0.000 -2.777) 4.429 22.111 ( -9.084 0.000 0.033) 9.084 22.138 ( -10.030 0.000 -0.583) 10.047 22.338 ( -7.424 0.000 0.248) 7.428 22.352 ( -9.021 0.000 -0.082) 9.021 22.803 ( 10.057 0.000 -2.198) 10.295 22.859 ( 9.931 0.000 2.387) 10.214 23.034 ( 9.432 0.000 1.709) 9.586 23.064 ( 10.307 0.000 -1.268) 10.385 27.073 ( -19.027 0.000 0.476) 19.033 27.236 ( -19.566 0.000 -1.395) 19.616 27.300 ( -25.681 0.000 1.439) 25.722 28.253 ( 3.274 0.000 -3.246) 4.610 28.323 ( 21.188 0.000 0.454) 21.193 28.443 ( 18.298 0.000 -2.425) 18.457 28.745 ( 14.441 0.000 -3.196) 14.790 29.001 ( 14.861 0.000 -0.591) 14.873 30.317 ( -12.494 0.000 -0.163) 12.495 30.444 ( -10.508 0.000 1.443) 10.606 30.639 ( -4.702 0.000 0.265) 4.710 30.772 ( -0.079 0.000 -0.199) 0.214 30.914 ( -9.762 0.000 -1.203) 9.836 31.064 ( -6.582 0.000 1.316) 6.712 31.358 ( -5.629 0.000 -0.787) 5.684 31.442 ( 3.683 0.000 -0.954) 3.804 31.500 ( 7.780 0.000 1.176) 7.869 31.625 ( 4.236 0.000 -2.882) 5.124 31.861 ( 7.557 0.000 0.737) 7.593 31.865 ( 3.720 0.000 -1.693) 4.087 31.934 ( -5.322 0.000 0.486) 5.344 32.218 ( 3.618 0.000 -10.221) 10.842 32.460 ( -11.058 0.000 -1.695) 11.187 32.862 ( -8.341 0.000 0.393) 8.351 32.940 ( -9.927 0.000 2.968) 10.361 33.095 ( -0.038 0.000 2.720) 2.720 33.253 ( -11.766 0.000 -0.880) 11.799 33.273 ( 1.229 0.000 -4.522) 4.686 33.482 ( 1.874 0.000 0.289) 1.896 33.876 ( 14.941 0.000 -4.884) 15.719 33.924 ( 9.316 0.000 -2.304) 9.597 33.975 ( 11.113 0.000 -1.461) 11.209 34.946 ( -1.725 0.000 -6.575) 6.797 34.972 ( -2.269 0.000 -5.566) 6.011 35.014 ( -2.081 0.000 5.092) 5.501 35.068 ( -1.869 0.000 5.543) 5.850 35.698 ( -3.062 0.000 -3.197) 4.426 35.770 ( -1.103 0.000 -7.257) 7.341 35.808 ( -4.294 0.000 -0.237) 4.300 35.911 ( -4.531 0.000 3.444) 5.692 35.912 ( -1.217 0.000 -3.995) 4.177 35.996 ( -2.594 0.000 1.192) 2.855 36.130 ( 2.104 0.000 10.344) 10.556 36.246 ( 7.069 0.000 12.761) 14.589 37.024 ( -17.474 0.000 2.128) 17.604 37.579 ( -11.796 0.000 10.601) 15.860 37.867 ( 16.029 0.000 -2.377) 16.204 38.381 ( 20.486 0.000 -2.907) 20.691 ======================= Grid point 97 (50/69) ======================= q-point: (-0.22 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( -26.896 0.000 12.225) 29.544 1.227 ( -18.908 0.000 20.853) 28.149 1.835 ( -45.428 0.000 8.877) 46.288 2.022 ( -7.072 0.000 3.806) 8.031 2.094 ( -3.892 0.000 7.598) 8.536 2.286 ( -21.079 0.000 6.451) 22.044 2.376 ( 1.357 0.000 -2.163) 2.553 2.461 ( 3.684 0.000 3.911) 5.373 2.569 ( -4.407 0.000 12.116) 12.892 2.630 ( 8.636 0.000 2.847) 9.093 2.718 ( 3.846 0.000 4.869) 6.205 2.751 ( -4.574 0.000 2.376) 5.155 2.832 ( -5.504 0.000 7.264) 9.114 2.900 ( 0.767 0.000 -4.140) 4.211 3.056 ( 5.045 0.000 0.548) 5.075 3.068 ( -13.092 0.000 -1.299) 13.157 3.095 ( 7.313 0.000 3.019) 7.911 3.172 ( 5.797 0.000 2.134) 6.177 3.283 ( -4.894 0.000 -1.035) 5.002 3.317 ( 0.845 0.000 -3.492) 3.592 3.483 ( 2.891 0.000 -9.301) 9.740 3.548 ( -5.837 0.000 6.010) 8.378 3.562 ( 9.196 0.000 1.030) 9.254 3.713 ( -0.344 0.000 -3.072) 3.091 3.810 ( -0.590 0.000 -7.830) 7.852 3.847 ( -9.783 0.000 2.840) 10.187 3.952 ( -13.664 0.000 -2.158) 13.833 3.991 ( 6.624 0.000 0.910) 6.686 4.050 ( -8.803 0.000 -2.579) 9.173 4.057 ( -4.955 0.000 3.622) 6.138 4.081 ( -4.776 0.000 0.692) 4.825 4.338 ( -2.470 0.000 -2.476) 3.497 4.383 ( -8.006 0.000 -3.443) 8.715 4.466 ( -2.922 0.000 3.031) 4.211 4.564 ( 1.978 0.000 5.981) 6.299 4.613 ( -5.992 0.000 7.563) 9.649 4.688 ( -5.269 0.000 4.961) 7.238 4.756 ( 6.114 0.000 -4.980) 7.885 4.781 ( 8.734 0.000 -2.389) 9.054 4.840 ( -3.628 0.000 -3.911) 5.335 4.869 ( -1.992 0.000 -3.956) 4.429 5.156 ( -1.768 0.000 3.373) 3.809 5.183 ( 2.787 0.000 -10.533) 10.896 5.224 ( 0.644 0.000 1.096) 1.271 5.309 ( 5.438 0.000 -3.821) 6.646 5.326 ( 0.911 0.000 -1.534) 1.784 5.366 ( -0.180 0.000 4.441) 4.445 5.484 ( -6.357 0.000 -11.071) 12.766 5.575 ( 1.418 0.000 -12.854) 12.932 5.700 ( -2.728 0.000 -4.816) 5.535 5.756 ( -0.613 0.000 -0.316) 0.690 5.802 ( 0.419 0.000 3.221) 3.248 5.858 ( -11.808 0.000 3.084) 12.204 5.963 ( 2.505 0.000 -5.138) 5.716 5.967 ( 3.383 0.000 -2.113) 3.988 6.045 ( -4.468 0.000 -7.201) 8.475 6.182 ( -0.999 0.000 0.152) 1.011 6.184 ( 4.545 0.000 -1.617) 4.824 6.264 ( 2.127 0.000 -2.933) 3.623 6.366 ( -7.912 0.000 5.416) 9.588 6.402 ( 2.315 0.000 -12.967) 13.172 6.529 ( 7.201 0.000 8.657) 11.260 6.619 ( 2.427 0.000 3.889) 4.584 6.644 ( 6.267 0.000 9.245) 11.169 6.662 ( 2.763 0.000 4.914) 5.638 6.720 ( -2.300 0.000 0.869) 2.458 6.836 ( 1.362 0.000 -0.727) 1.544 6.961 ( 3.782 0.000 4.324) 5.745 7.045 ( -2.657 0.000 8.922) 9.309 7.057 ( 2.878 0.000 -3.030) 4.179 7.215 ( 2.338 0.000 2.347) 3.313 7.229 ( 4.084 0.000 1.997) 4.546 7.271 ( -1.008 0.000 -0.605) 1.176 7.344 ( 9.354 0.000 -0.901) 9.397 7.468 ( 2.428 0.000 6.625) 7.056 7.631 ( 1.437 0.000 1.755) 2.268 8.145 ( 18.008 0.000 -3.726) 18.390 8.339 ( 19.135 0.000 -1.695) 19.210 8.499 ( 16.571 0.000 -1.443) 16.634 8.626 ( 11.114 0.000 -0.178) 11.116 8.871 ( -0.164 0.000 0.341) 0.378 9.006 ( 2.579 0.000 -0.407) 2.611 9.188 ( -0.208 0.000 -2.805) 2.813 9.228 ( -1.938 0.000 0.456) 1.991 9.266 ( -1.513 0.000 2.179) 2.653 9.352 ( -5.038 0.000 0.777) 5.098 9.393 ( -3.897 0.000 -2.495) 4.627 9.473 ( -3.154 0.000 -0.080) 3.155 9.475 ( -5.253 0.000 0.025) 5.253 9.490 ( -2.904 0.000 -0.781) 3.007 9.704 ( -0.579 0.000 -2.366) 2.436 9.720 ( -8.164 0.000 1.322) 8.270 9.846 ( 0.005 0.000 4.729) 4.729 10.072 ( 5.613 0.000 -1.569) 5.828 10.138 ( 7.680 0.000 3.541) 8.457 10.152 ( 12.289 0.000 -1.809) 12.422 10.188 ( 9.691 0.000 1.606) 9.823 10.403 ( 9.763 0.000 0.154) 9.764 10.495 ( 12.397 0.000 -3.063) 12.769 10.619 ( 7.525 0.000 0.066) 7.525 10.700 ( 4.976 0.000 -1.580) 5.221 10.782 ( 7.782 0.000 -1.064) 7.855 10.937 ( 2.328 0.000 0.489) 2.379 11.044 ( 6.998 0.000 -0.421) 7.010 11.561 ( -13.772 0.000 0.299) 13.776 11.582 ( -12.443 0.000 -0.798) 12.469 11.675 ( -4.518 0.000 0.253) 4.525 11.687 ( -2.561 0.000 0.028) 2.561 12.015 ( -3.278 0.000 1.184) 3.485 12.114 ( -1.612 0.000 -1.447) 2.166 12.242 ( 4.517 0.000 1.692) 4.824 12.245 ( 2.849 0.000 0.367) 2.873 12.385 ( -1.262 0.000 1.157) 1.712 12.411 ( -1.784 0.000 -1.487) 2.322 12.419 ( -2.606 0.000 0.214) 2.614 12.467 ( -3.048 0.000 -1.963) 3.625 12.631 ( -2.888 0.000 2.183) 3.620 12.660 ( -3.742 0.000 -1.168) 3.920 12.975 ( 2.016 0.000 0.484) 2.073 12.978 ( -1.213 0.000 -0.385) 1.273 13.269 ( -0.091 0.000 -0.984) 0.988 13.279 ( -2.780 0.000 0.808) 2.895 13.806 ( -17.253 0.000 0.837) 17.273 13.834 ( 9.531 0.000 0.303) 9.535 13.857 ( 9.663 0.000 -0.260) 9.667 14.137 ( -9.550 0.000 -5.681) 11.112 14.239 ( -2.703 0.000 1.150) 2.938 14.300 ( -3.858 0.000 0.120) 3.859 14.370 ( 3.587 0.000 1.292) 3.813 14.375 ( 4.767 0.000 -0.860) 4.844 14.728 ( 0.782 0.000 0.068) 0.785 14.776 ( -4.834 0.000 -0.185) 4.837 15.019 ( -8.583 0.000 1.640) 8.738 15.020 ( -10.694 0.000 -3.772) 11.339 15.306 ( -11.587 0.000 0.380) 11.594 15.329 ( -10.587 0.000 0.674) 10.609 15.484 ( -8.064 0.000 -2.842) 8.550 15.532 ( -9.613 0.000 -0.209) 9.616 15.638 ( 4.701 0.000 -0.192) 4.704 15.660 ( 4.166 0.000 0.355) 4.181 15.837 ( -2.955 0.000 0.535) 3.003 15.923 ( 1.365 0.000 1.517) 2.040 16.115 ( -7.396 0.000 -8.560) 11.313 16.184 ( 7.342 0.000 -2.380) 7.718 16.575 ( -2.340 0.000 0.628) 2.423 16.588 ( -3.723 0.000 0.726) 3.793 16.700 ( -1.584 0.000 -1.426) 2.131 16.886 ( 1.125 0.000 -8.706) 8.778 17.315 ( -1.591 0.000 1.677) 2.312 17.319 ( 0.646 0.000 -0.548) 0.847 17.365 ( -0.846 0.000 0.859) 1.205 17.412 ( -0.894 0.000 -1.933) 2.130 19.777 ( -2.858 0.000 1.998) 3.487 19.950 ( -3.883 0.000 -3.741) 5.392 20.071 ( -1.520 0.000 0.477) 1.593 20.161 ( -6.078 0.000 -2.669) 6.638 20.506 ( 3.008 0.000 3.499) 4.614 20.514 ( 4.056 0.000 -0.989) 4.175 20.789 ( 3.247 0.000 -2.804) 4.290 20.793 ( 0.797 0.000 -0.506) 0.945 21.993 ( -7.957 0.000 0.950) 8.013 22.008 ( -4.348 0.000 2.445) 4.988 22.226 ( -7.304 0.000 0.139) 7.305 22.242 ( -5.452 0.000 0.201) 5.456 22.939 ( 10.743 0.000 -2.963) 11.144 23.034 ( 8.961 0.000 1.949) 9.171 23.197 ( 8.673 0.000 -1.258) 8.764 23.206 ( 9.441 0.000 2.232) 9.701 26.809 ( -15.613 0.000 0.812) 15.634 26.904 ( -19.334 0.000 -1.711) 19.410 26.953 ( -21.948 0.000 2.394) 22.078 27.906 ( -23.387 0.000 -32.984) 40.433 28.672 ( 21.807 0.000 1.165) 21.838 28.740 ( 21.048 0.000 -0.329) 21.051 29.002 ( 16.296 0.000 1.528) 16.367 29.235 ( 16.497 0.000 -1.759) 16.590 30.101 ( -15.695 0.000 1.066) 15.731 30.239 ( -15.885 0.000 -0.900) 15.910 30.554 ( -7.739 0.000 2.746) 8.212 30.758 ( -0.962 0.000 -0.665) 1.169 30.800 ( -4.510 0.000 0.835) 4.586 30.974 ( -5.907 0.000 -0.693) 5.948 31.218 ( -8.955 0.000 -0.085) 8.956 31.439 ( -4.850 0.000 -11.386) 12.376 31.511 ( 2.662 0.000 -0.357) 2.685 31.734 ( 3.293 0.000 -6.739) 7.501 31.874 ( -0.845 0.000 1.940) 2.116 31.911 ( 2.632 0.000 -0.725) 2.730 31.973 ( 3.739 0.000 -3.834) 5.355 32.041 ( 3.111 0.000 -7.399) 8.026 32.345 ( -1.062 0.000 -1.980) 2.247 32.717 ( -9.024 0.000 -2.716) 9.424 32.803 ( -12.472 0.000 4.523) 13.267 32.953 ( -14.394 0.000 0.313) 14.398 33.027 ( -13.522 0.000 -2.800) 13.809 33.343 ( 9.685 0.000 -8.128) 12.644 33.563 ( 4.231 0.000 3.417) 5.439 33.938 ( 10.491 0.000 -21.170) 23.627 34.009 ( 7.209 0.000 -5.778) 9.239 34.090 ( 7.854 0.000 -4.488) 9.046 34.887 ( 0.934 0.000 -0.541) 1.080 34.910 ( -0.842 0.000 1.005) 1.311 35.031 ( -2.894 0.000 4.768) 5.577 35.095 ( -2.715 0.000 5.823) 6.425 35.615 ( -2.011 0.000 -3.757) 4.262 35.657 ( -5.023 0.000 -2.407) 5.570 35.745 ( -4.161 0.000 0.578) 4.201 35.825 ( -4.747 0.000 -2.165) 5.218 35.918 ( -3.533 0.000 8.271) 8.994 35.995 ( -1.246 0.000 4.581) 4.747 36.337 ( 4.854 0.000 13.179) 14.044 36.474 ( 5.344 0.000 3.697) 6.498 36.859 ( -11.900 0.000 12.014) 16.910 37.802 ( 14.746 0.000 31.100) 34.418 38.024 ( 11.229 0.000 -7.915) 13.738 38.638 ( 17.589 0.000 -4.574) 18.174 ======================= Grid point 98 (51/69) ======================= q-point: (-0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 69 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.983 ( -39.341 0.000 15.002) 42.105 0.996 ( -18.865 0.000 24.452) 30.884 1.695 ( -1.565 0.000 36.109) 36.143 1.838 ( -24.586 0.000 -13.567) 28.081 1.930 ( -3.850 0.000 -7.511) 8.441 2.250 ( 5.550 0.000 11.965) 13.189 2.404 ( 6.419 0.000 -4.999) 8.135 2.596 ( 1.283 0.000 10.017) 10.098 2.672 ( -2.695 0.000 13.890) 14.149 2.728 ( 3.440 0.000 0.719) 3.514 2.799 ( 1.938 0.000 0.081) 1.940 2.847 ( -0.309 0.000 14.787) 14.791 2.864 ( 2.547 0.000 12.581) 12.836 2.930 ( -5.087 0.000 4.084) 6.523 2.965 ( -3.059 0.000 6.017) 6.750 3.111 ( -1.542 0.000 -3.471) 3.798 3.139 ( 2.604 0.000 -1.918) 3.235 3.250 ( 7.430 0.000 1.296) 7.542 3.282 ( -2.770 0.000 -0.690) 2.855 3.311 ( 0.685 0.000 1.642) 1.779 3.376 ( -0.396 0.000 -12.056) 12.063 3.528 ( -3.424 0.000 2.818) 4.434 3.660 ( -1.918 0.000 -3.494) 3.986 3.667 ( 0.718 0.000 -6.254) 6.295 3.688 ( -14.214 0.000 1.928) 14.344 3.748 ( -4.168 0.000 1.989) 4.618 3.817 ( 6.963 0.000 1.365) 7.096 3.873 ( -6.112 0.000 -1.581) 6.313 3.961 ( -6.409 0.000 -0.544) 6.432 4.010 ( -1.581 0.000 -2.948) 3.346 4.089 ( 3.165 0.000 -8.259) 8.844 4.223 ( -2.029 0.000 1.161) 2.338 4.252 ( -6.705 0.000 1.732) 6.925 4.446 ( -3.453 0.000 0.463) 3.484 4.579 ( -5.985 0.000 3.777) 7.077 4.600 ( -6.664 0.000 5.422) 8.590 4.699 ( -1.834 0.000 0.895) 2.041 4.715 ( -0.671 0.000 -4.762) 4.809 4.806 ( -0.069 0.000 -4.948) 4.949 4.828 ( 5.206 0.000 -4.674) 6.996 4.879 ( 6.266 0.000 -0.234) 6.270 5.135 ( -1.628 0.000 -3.623) 3.972 5.145 ( 4.953 0.000 -9.036) 10.305 5.207 ( 1.053 0.000 -5.785) 5.880 5.241 ( 0.384 0.000 -0.046) 0.387 5.262 ( -8.002 0.000 -2.797) 8.477 5.389 ( 3.322 0.000 -2.963) 4.452 5.394 ( -1.685 0.000 -9.281) 9.433 5.464 ( 1.356 0.000 3.889) 4.119 5.556 ( -4.201 0.000 -9.843) 10.702 5.692 ( -9.433 0.000 6.362) 11.378 5.802 ( 1.526 0.000 -2.880) 3.259 5.870 ( 2.767 0.000 0.495) 2.811 5.898 ( -0.010 0.000 -3.420) 3.420 5.924 ( -4.511 0.000 -5.233) 6.908 5.987 ( 0.863 0.000 0.673) 1.095 6.129 ( -2.413 0.000 -6.207) 6.660 6.138 ( -2.825 0.000 -4.849) 5.612 6.243 ( -3.426 0.000 1.677) 3.814 6.308 ( 3.179 0.000 -8.546) 9.118 6.449 ( 5.131 0.000 8.177) 9.653 6.589 ( -3.305 0.000 3.492) 4.808 6.667 ( 0.051 0.000 1.703) 1.703 6.712 ( -1.358 0.000 -2.724) 3.043 6.719 ( -1.024 0.000 0.164) 1.037 6.838 ( 2.307 0.000 -0.366) 2.336 6.901 ( 9.547 0.000 6.251) 11.411 7.021 ( -0.961 0.000 3.994) 4.108 7.101 ( -4.153 0.000 8.415) 9.384 7.122 ( 7.776 0.000 -2.664) 8.220 7.249 ( -0.239 0.000 4.149) 4.155 7.347 ( 6.023 0.000 3.020) 6.737 7.411 ( 6.814 0.000 3.319) 7.579 7.477 ( 7.052 0.000 -1.048) 7.129 7.696 ( 1.653 0.000 6.891) 7.087 7.799 ( 28.842 0.000 8.544) 30.081 8.398 ( 17.606 0.000 1.164) 17.644 8.603 ( 17.928 0.000 -3.832) 18.333 8.733 ( 12.270 0.000 0.569) 12.283 8.744 ( 4.346 0.000 -0.422) 4.366 8.928 ( 6.103 0.000 1.571) 6.302 9.020 ( 0.035 0.000 -1.052) 1.053 9.150 ( 1.544 0.000 -3.999) 4.287 9.167 ( -2.296 0.000 -3.292) 4.013 9.240 ( -4.878 0.000 2.197) 5.349 9.307 ( -3.439 0.000 -1.770) 3.868 9.320 ( -4.067 0.000 0.839) 4.153 9.395 ( -5.628 0.000 -0.775) 5.681 9.440 ( -2.535 0.000 -0.870) 2.680 9.445 ( 0.765 0.000 -0.754) 1.074 9.609 ( -8.498 0.000 2.915) 8.984 9.650 ( -1.107 0.000 -3.328) 3.507 9.910 ( -0.238 0.000 7.212) 7.215 10.119 ( 3.787 0.000 -2.558) 4.570 10.243 ( 1.180 0.000 2.801) 3.040 10.272 ( 6.329 0.000 -3.220) 7.101 10.369 ( 9.365 0.000 2.192) 9.618 10.527 ( 7.681 0.000 -3.544) 8.459 10.680 ( 12.568 0.000 -1.768) 12.692 10.734 ( 5.378 0.000 -0.051) 5.379 10.760 ( 6.410 0.000 -1.418) 6.565 10.852 ( 4.034 0.000 -2.331) 4.659 10.992 ( 3.309 0.000 1.197) 3.519 11.127 ( 2.767 0.000 -0.886) 2.905 11.346 ( -13.494 0.000 0.498) 13.503 11.356 ( -13.880 0.000 -1.579) 13.969 11.627 ( -0.923 0.000 -0.006) 0.923 11.661 ( -1.041 0.000 0.021) 1.041 11.981 ( -3.942 0.000 2.835) 4.855 12.062 ( -0.937 0.000 -3.349) 3.477 12.301 ( 2.964 0.000 0.942) 3.110 12.336 ( 3.958 0.000 1.243) 4.149 12.361 ( -1.599 0.000 -2.183) 2.706 12.363 ( -3.231 0.000 1.125) 3.421 12.397 ( 0.966 0.000 0.146) 0.977 12.427 ( -0.475 0.000 0.038) 0.476 12.582 ( -5.109 0.000 0.044) 5.109 12.585 ( -3.466 0.000 -1.594) 3.815 12.960 ( -0.578 0.000 0.506) 0.769 12.999 ( 0.664 0.000 0.221) 0.700 13.256 ( -1.671 0.000 0.976) 1.935 13.272 ( 1.724 0.000 -1.521) 2.299 13.563 ( -14.128 0.000 0.711) 14.146 13.730 ( -29.079 0.000 -11.960) 31.443 13.977 ( 6.918 0.000 0.830) 6.968 14.016 ( 9.960 0.000 -0.357) 9.966 14.218 ( -4.629 0.000 -0.430) 4.649 14.233 ( -0.083 0.000 1.074) 1.077 14.447 ( 3.618 0.000 0.833) 3.712 14.455 ( 6.252 0.000 -1.062) 6.342 14.639 ( -8.456 0.000 -1.264) 8.550 14.671 ( -9.931 0.000 2.026) 10.135 14.895 ( -1.123 0.000 1.161) 1.615 14.919 ( -3.365 0.000 -0.643) 3.426 15.119 ( -12.031 0.000 1.248) 12.096 15.141 ( -11.748 0.000 -0.889) 11.781 15.199 ( -17.305 0.000 -4.337) 17.841 15.340 ( -12.825 0.000 -0.569) 12.837 15.724 ( 3.642 0.000 -0.136) 3.645 15.740 ( 6.202 0.000 0.934) 6.272 15.853 ( 2.442 0.000 0.875) 2.594 15.899 ( -5.765 0.000 -4.549) 7.344 16.005 ( 2.791 0.000 4.713) 5.477 16.242 ( 3.961 0.000 -3.871) 5.538 16.529 ( -3.528 0.000 0.050) 3.528 16.562 ( -1.192 0.000 2.281) 2.574 16.663 ( -1.416 0.000 -2.240) 2.650 16.699 ( -9.708 0.000 -4.120) 10.546 17.318 ( -0.306 0.000 1.538) 1.568 17.327 ( 1.052 0.000 -0.346) 1.108 17.366 ( -0.917 0.000 1.343) 1.626 17.387 ( 0.232 0.000 -0.888) 0.917 19.768 ( -2.244 0.000 1.177) 2.534 19.850 ( -2.397 0.000 -4.190) 4.827 20.076 ( 0.536 0.000 0.928) 1.072 20.078 ( -0.665 0.000 -0.111) 0.674 20.561 ( 3.188 0.000 -0.549) 3.235 20.568 ( 0.163 0.000 2.706) 2.711 20.797 ( 0.152 0.000 0.407) 0.434 20.806 ( 2.806 0.000 -2.529) 3.778 21.926 ( -3.424 0.000 2.736) 4.383 22.016 ( 0.505 0.000 0.366) 0.624 22.142 ( -3.159 0.000 0.749) 3.246 22.175 ( -2.982 0.000 -0.278) 2.994 23.050 ( 7.491 0.000 -2.940) 8.048 23.130 ( 2.489 0.000 -2.158) 3.294 23.326 ( 7.685 0.000 1.229) 7.783 23.355 ( 6.158 0.000 1.639) 6.373 26.619 ( -9.435 0.000 0.380) 9.443 26.640 ( -11.731 0.000 -0.835) 11.761 26.688 ( -14.566 0.000 1.831) 14.680 26.968 ( -40.612 0.000 -19.398) 45.007 29.002 ( 17.622 0.000 1.805) 17.714 29.063 ( 20.628 0.000 -0.825) 20.644 29.225 ( 7.910 0.000 3.609) 8.694 29.438 ( 12.240 0.000 -3.780) 12.810 29.866 ( -16.268 0.000 1.737) 16.360 29.956 ( -16.183 0.000 -3.138) 16.484 30.503 ( -5.345 0.000 7.748) 9.413 30.731 ( -1.114 0.000 -1.224) 1.655 30.774 ( -1.572 0.000 1.847) 2.426 30.861 ( -4.565 0.000 -3.212) 5.582 31.102 ( -5.835 0.000 0.418) 5.850 31.166 ( -9.890 0.000 -6.012) 11.574 31.504 ( -1.461 0.000 -0.641) 1.595 31.564 ( -8.050 0.000 -0.309) 8.056 31.908 ( -0.694 0.000 7.629) 7.660 32.017 ( 9.186 0.000 1.701) 9.342 32.101 ( 12.271 0.000 -1.536) 12.367 32.163 ( 9.370 0.000 0.996) 9.423 32.349 ( 2.361 0.000 -1.263) 2.678 32.541 ( -6.776 0.000 -5.469) 8.707 32.674 ( -10.374 0.000 4.730) 11.402 32.732 ( -14.046 0.000 1.035) 14.084 32.794 ( -10.832 0.000 -3.749) 11.463 33.263 ( 3.213 0.000 -26.036) 26.233 33.665 ( 2.545 0.000 4.741) 5.381 33.804 ( 1.766 0.000 -13.049) 13.167 34.019 ( 3.494 0.000 -6.576) 7.446 34.116 ( 3.933 0.000 -6.905) 7.946 34.947 ( 4.089 0.000 1.314) 4.295 34.975 ( 4.292 0.000 4.489) 6.210 35.029 ( -3.620 0.000 3.902) 5.323 35.115 ( -2.605 0.000 4.703) 5.376 35.560 ( 0.123 0.000 -3.115) 3.117 35.575 ( -4.167 0.000 0.168) 4.171 35.694 ( -2.372 0.000 -0.196) 2.380 35.737 ( -3.899 0.000 -1.047) 4.037 35.982 ( -1.810 0.000 10.307) 10.465 36.065 ( 0.001 0.000 9.103) 9.103 36.424 ( -0.315 0.000 -5.083) 5.093 36.492 ( 1.375 0.000 -6.122) 6.274 37.004 ( -2.021 0.000 30.862) 30.928 38.028 ( 5.429 0.000 -14.282) 15.279 38.502 ( 26.141 0.000 15.623) 30.454 38.812 ( 11.504 0.000 -5.052) 12.565 ======================= Grid point 99 (52/69) ======================= q-point: ( 0.00 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.068 ( -3.096 18.495 18.777) 26.537 1.485 ( 1.449 11.824 -19.246) 22.635 1.561 ( -1.177 30.990 16.566) 35.160 1.915 ( 3.426 10.162 -12.593) 16.540 2.091 ( -1.210 -12.782 4.519) 13.611 2.242 ( 1.775 -16.059 -6.300) 17.342 2.365 ( -0.140 4.981 31.968) 32.355 2.580 ( -0.705 -11.268 10.065) 15.125 2.621 ( -1.000 -4.818 5.748) 7.566 2.774 ( -0.995 0.965 9.722) 9.821 2.814 ( -4.473 -6.468 3.682) 8.684 2.874 ( 1.893 0.024 0.828) 2.067 2.932 ( 6.230 -2.529 -0.009) 6.723 2.959 ( -1.198 -1.784 -2.543) 3.330 3.076 ( -8.067 7.264 -2.469) 11.132 3.105 ( -0.399 2.209 -0.992) 2.454 3.211 ( 5.338 3.173 4.347) 7.580 3.233 ( 1.755 -2.641 3.206) 4.509 3.293 ( -0.646 2.117 1.905) 2.920 3.351 ( 3.427 -3.569 6.690) 8.321 3.446 ( 1.032 -0.495 -2.053) 2.350 3.525 ( -0.709 2.202 6.015) 6.445 3.568 ( 0.000 2.190 -15.077) 15.235 3.624 ( -1.958 -1.289 3.522) 4.231 3.671 ( -0.737 -0.419 -5.219) 5.287 3.737 ( -4.242 3.850 1.539) 5.932 3.769 ( 0.492 2.627 -5.641) 6.242 3.926 ( 4.825 9.194 -6.718) 12.367 3.983 ( -6.074 9.700 2.100) 11.636 3.994 ( 1.795 -2.538 -2.261) 3.844 4.116 ( 1.443 8.418 2.538) 8.910 4.151 ( -1.325 -3.392 -1.434) 3.914 4.271 ( 0.818 -6.862 0.569) 6.934 4.327 ( -2.485 -4.089 -2.575) 5.434 4.437 ( -5.901 -1.710 5.834) 8.473 4.529 ( 0.571 -2.455 -0.707) 2.617 4.568 ( 2.125 -4.432 -2.136) 5.359 4.667 ( 0.598 -1.332 -6.795) 6.950 4.769 ( -0.582 0.301 6.467) 6.500 4.876 ( 1.986 -1.978 -3.507) 4.489 4.959 ( 4.276 2.564 1.500) 5.207 5.081 ( 4.064 3.113 -1.895) 5.459 5.114 ( -0.534 1.710 -5.207) 5.506 5.161 ( -6.288 7.213 -8.303) 12.669 5.235 ( -2.403 -0.746 -2.676) 3.673 5.281 ( 2.025 -3.073 -2.537) 4.470 5.334 ( 3.402 0.695 7.148) 7.946 5.416 ( 0.160 3.553 -0.441) 3.584 5.445 ( -0.107 -1.319 -0.630) 1.466 5.560 ( -1.182 0.166 -6.850) 6.953 5.706 ( 0.464 3.870 3.474) 5.221 5.810 ( -2.288 6.069 -6.105) 8.907 5.864 ( 2.468 2.798 -1.420) 3.992 5.891 ( -2.215 -6.906 -0.947) 7.314 5.896 ( -0.590 -1.223 0.179) 1.370 5.927 ( 1.935 0.903 -1.856) 2.829 6.068 ( -0.318 3.966 0.314) 3.991 6.105 ( 0.806 4.098 -2.950) 5.113 6.221 ( -2.339 0.405 -0.393) 2.406 6.253 ( 2.369 0.223 -1.625) 2.881 6.490 ( 0.197 -6.755 1.068) 6.842 6.540 ( -0.395 -8.608 -0.336) 8.623 6.558 ( -2.637 -3.530 2.279) 4.961 6.624 ( -0.778 -3.860 0.084) 3.938 6.783 ( -0.784 3.800 3.323) 5.109 6.871 ( 0.515 3.404 -2.794) 4.434 7.044 ( 0.030 -0.633 4.237) 4.284 7.091 ( 4.475 -0.021 0.445) 4.497 7.113 ( -4.028 1.606 2.529) 5.020 7.169 ( 3.911 -1.523 -2.164) 4.722 7.274 ( -1.352 -6.178 5.529) 8.401 7.357 ( 0.899 -6.722 -1.973) 7.063 7.476 ( -1.207 -0.197 2.560) 2.837 7.508 ( 1.407 0.228 -0.776) 1.623 7.680 ( -1.308 -11.291 5.591) 12.667 7.756 ( 1.751 -20.444 -1.208) 20.554 8.651 ( -0.683 2.518 2.764) 3.801 8.721 ( -0.341 0.715 -3.715) 3.799 8.807 ( 2.799 0.021 0.233) 2.809 8.829 ( 0.278 0.634 -1.599) 1.742 8.976 ( 1.870 -0.014 1.361) 2.313 9.017 ( -0.486 0.226 -2.472) 2.530 9.082 ( -5.626 -4.283 1.992) 7.346 9.116 ( 4.394 -4.370 -0.651) 6.231 9.171 ( -4.943 -1.522 1.601) 5.414 9.211 ( 4.243 -1.380 -1.596) 4.739 9.243 ( -2.728 -1.987 -0.637) 3.434 9.266 ( 0.939 -3.239 -2.462) 4.175 9.411 ( -0.259 1.874 1.793) 2.607 9.466 ( 0.948 2.261 -2.436) 3.456 9.523 ( -3.439 -1.690 2.768) 4.727 9.595 ( 2.860 -2.572 -3.574) 5.251 9.980 ( -2.216 0.059 6.627) 6.988 10.085 ( 1.974 -4.892 -2.553) 5.860 10.372 ( 0.546 5.930 -0.719) 5.998 10.381 ( -0.555 9.415 -1.087) 9.494 10.484 ( 0.178 1.056 2.299) 2.536 10.551 ( 0.216 2.975 -4.085) 5.058 10.719 ( 0.872 -4.078 0.699) 4.228 10.737 ( -1.394 -3.329 -1.021) 3.751 10.853 ( -0.658 2.801 0.930) 3.024 10.881 ( 0.299 3.438 -1.722) 3.857 11.044 ( 1.180 -2.389 1.483) 3.049 11.085 ( -1.293 -2.148 -2.244) 3.364 11.249 ( -0.057 3.056 0.079) 3.058 11.251 ( 0.456 2.694 -0.171) 2.738 11.529 ( 1.471 -9.161 0.637) 9.300 11.545 ( -1.389 -8.906 -0.882) 9.057 12.004 ( -2.414 4.287 3.141) 5.837 12.072 ( 2.603 3.265 -3.364) 5.362 12.260 ( -2.083 -3.397 2.459) 4.683 12.309 ( 1.386 -3.417 -2.088) 4.238 12.413 ( -0.319 3.478 0.429) 3.519 12.426 ( -0.680 4.307 -0.730) 4.421 12.468 ( -0.228 3.781 0.844) 3.881 12.490 ( 0.506 4.480 -1.167) 4.658 12.641 ( -1.444 9.352 2.458) 9.777 12.699 ( 2.070 8.916 -3.039) 9.645 12.937 ( -1.908 -4.589 0.930) 5.056 12.949 ( 2.222 -4.668 -0.238) 5.176 13.269 ( 0.014 2.853 0.313) 2.870 13.280 ( 0.261 1.268 -0.768) 1.505 13.389 ( -0.158 -1.254 1.297) 1.811 13.409 ( -0.319 -1.656 -0.663) 1.812 14.190 ( 2.931 9.363 2.010) 10.015 14.232 ( -2.667 4.044 -1.262) 5.006 14.278 ( -1.892 6.261 -0.398) 6.553 14.296 ( 1.023 6.048 -1.960) 6.439 14.485 ( -3.623 2.351 2.067) 4.788 14.532 ( 1.488 5.297 -2.291) 5.960 14.611 ( 4.382 2.657 1.118) 5.245 14.645 ( 1.186 3.643 -1.925) 4.288 14.827 ( -4.339 -2.848 0.886) 5.266 14.858 ( 3.912 -1.510 -2.293) 4.779 15.002 ( 0.518 -5.569 2.013) 5.944 15.050 ( 0.604 -3.083 -2.575) 4.062 15.224 ( -5.063 12.646 2.795) 13.906 15.303 ( 4.524 19.647 -5.539) 20.908 15.766 ( 1.239 -0.965 1.000) 1.862 15.778 ( -1.596 0.572 -0.359) 1.734 15.860 ( -3.589 -1.033 0.738) 3.807 15.867 ( 2.816 -0.718 0.044) 2.906 16.010 ( 1.158 -7.358 5.152) 9.056 16.145 ( -0.708 -7.810 -7.215) 10.656 16.528 ( 0.606 1.243 0.581) 1.501 16.542 ( -2.267 0.153 -0.824) 2.417 16.587 ( 0.698 -0.595 2.214) 2.396 16.627 ( -0.544 -1.655 -1.380) 2.222 17.336 ( -0.323 0.638 0.645) 0.963 17.343 ( 0.687 0.337 -0.086) 0.770 17.366 ( -0.895 0.156 1.017) 1.364 17.385 ( 0.955 -0.533 -0.711) 1.304 19.755 ( -0.998 1.312 1.604) 2.300 19.803 ( 0.966 0.443 -3.165) 3.339 20.029 ( 0.149 -5.085 0.667) 5.131 20.035 ( -0.379 -4.875 0.100) 4.891 20.580 ( -2.363 0.783 1.931) 3.151 20.600 ( 0.978 0.060 0.293) 1.022 20.795 ( -0.458 0.075 -0.243) 0.524 20.814 ( 1.619 -0.553 -1.893) 2.552 21.955 ( 0.749 1.364 2.589) 3.021 22.001 ( 0.508 0.104 -1.725) 1.802 22.111 ( -0.675 -1.977 0.973) 2.304 22.127 ( -0.179 -1.653 -0.591) 1.764 23.069 ( -1.398 -1.830 -0.553) 2.368 23.082 ( 1.764 -1.719 -1.960) 3.147 23.399 ( -0.045 -0.507 0.926) 1.057 23.402 ( -1.024 -0.587 0.674) 1.360 26.542 ( 0.357 0.152 -0.022) 0.389 26.544 ( -0.291 0.136 -0.209) 0.383 26.580 ( 0.474 0.178 0.222) 0.553 26.583 ( -0.120 0.033 -0.030) 0.128 29.208 ( -0.222 1.732 2.725) 3.236 29.256 ( -1.331 1.226 -1.249) 2.199 29.342 ( 3.021 -0.998 3.646) 4.839 29.442 ( -0.318 -3.473 -5.186) 6.250 29.887 ( -1.299 16.619 7.180) 18.150 30.090 ( -0.507 22.669 -12.729) 26.003 30.527 ( 0.048 -2.766 8.173) 8.629 30.676 ( -0.612 -2.302 -4.637) 5.213 30.791 ( 0.129 1.107 1.307) 1.718 30.817 ( 0.740 0.565 -1.675) 1.916 31.035 ( -1.857 -2.350 0.380) 3.019 31.037 ( 1.490 -2.243 0.217) 2.702 31.564 ( -1.339 7.468 1.761) 7.789 31.642 ( 0.413 15.147 -6.968) 16.678 31.971 ( 1.056 -6.322 12.153) 13.739 32.171 ( 1.755 1.761 0.819) 2.617 32.191 ( -4.665 1.822 -1.356) 5.188 32.261 ( 6.468 -2.308 -6.182) 9.240 32.318 ( -0.542 -4.017 1.199) 4.227 32.400 ( 2.615 -6.640 -9.103) 11.567 32.565 ( -6.192 0.565 2.399) 6.664 32.579 ( -3.744 -0.187 1.527) 4.048 32.726 ( 3.883 1.643 -2.029) 4.679 32.872 ( 0.338 -5.578 -21.375) 22.094 33.732 ( -0.052 0.008 2.665) 2.665 33.745 ( -0.441 -0.147 0.669) 0.814 33.996 ( 0.038 0.600 -3.405) 3.457 34.049 ( 0.069 -1.506 -6.870) 7.034 35.012 ( -2.896 0.636 2.285) 3.743 35.026 ( 2.964 0.060 1.061) 3.149 35.093 ( 3.621 0.257 2.280) 4.286 35.106 ( -2.019 -0.197 1.449) 2.493 35.550 ( -1.401 2.226 -0.235) 2.640 35.570 ( 2.106 1.691 -1.892) 3.298 35.659 ( 1.124 -1.947 -0.439) 2.291 35.667 ( -0.530 -2.148 -1.125) 2.482 36.100 ( 0.451 0.745 11.252) 11.286 36.161 ( 0.603 -2.065 10.891) 11.102 36.334 ( -0.302 1.024 -9.691) 9.749 36.389 ( -0.407 -1.468 -9.481) 9.603 37.485 ( -0.724 13.252 29.146) 32.025 37.937 ( -0.168 3.934 -13.253) 13.826 38.563 ( -1.619 -16.064 8.644) 18.313 38.735 ( 0.936 -12.135 -7.299) 14.192 ======================= Grid point 100 (53/69) ======================= q-point: ( 0.11 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.390 ( 19.581 6.970 5.514) 21.504 1.513 ( 19.240 8.772 -1.517) 21.199 1.769 ( 5.026 17.547 0.200) 18.253 1.850 ( 13.140 24.903 -5.328) 28.656 2.074 ( -6.405 -13.428 6.492) 16.232 2.178 ( 0.765 -11.086 -5.926) 12.594 2.544 ( -3.568 0.468 -9.825) 10.463 2.580 ( -1.719 -6.093 3.079) 7.040 2.628 ( -3.545 -7.301 -3.709) 8.924 2.798 ( -0.416 -0.542 10.268) 10.291 2.817 ( -4.247 2.263 -0.456) 4.834 2.885 ( 2.055 -3.762 2.456) 4.940 2.954 ( 7.562 -0.496 -4.326) 8.726 2.995 ( -0.228 -6.554 1.194) 6.666 3.089 ( -0.025 3.060 5.179) 6.016 3.157 ( -2.924 1.195 -1.441) 3.472 3.220 ( 3.890 0.100 -4.513) 5.959 3.250 ( 3.279 2.282 0.538) 4.031 3.360 ( 0.593 0.759 -7.269) 7.333 3.387 ( -0.046 -5.217 -4.958) 7.197 3.423 ( 3.866 1.083 5.614) 6.902 3.483 ( -0.759 5.840 -7.129) 9.247 3.559 ( 2.152 0.272 1.801) 2.819 3.642 ( 2.351 4.524 -1.475) 5.307 3.701 ( 1.063 2.518 1.415) 3.077 3.735 ( 2.395 1.401 16.489) 16.721 3.777 ( 2.420 -0.408 0.565) 2.519 3.915 ( 2.621 6.735 1.730) 7.431 3.957 ( 4.622 4.438 -4.127) 7.621 4.094 ( 6.553 7.426 -0.623) 9.923 4.122 ( 1.277 1.749 -1.725) 2.768 4.188 ( 5.040 -0.036 2.722) 5.728 4.247 ( -1.376 -2.738 -2.268) 3.813 4.352 ( 1.127 -4.439 7.889) 9.121 4.468 ( 3.355 -4.777 0.444) 5.854 4.552 ( 1.883 0.754 1.252) 2.384 4.580 ( 1.280 -5.973 -0.256) 6.114 4.629 ( 3.331 -4.511 -2.689) 6.219 4.802 ( -2.077 2.889 0.075) 3.559 4.890 ( 3.665 0.709 -4.113) 5.554 4.947 ( -3.142 1.613 -2.349) 4.242 5.006 ( -2.687 1.317 -0.759) 3.087 5.079 ( -0.026 2.816 0.357) 2.839 5.160 ( 0.172 3.480 2.272) 4.159 5.219 ( 0.632 1.718 1.685) 2.488 5.265 ( -0.995 -4.792 -1.962) 5.272 5.370 ( 1.515 4.477 0.958) 4.822 5.413 ( 0.211 3.333 0.720) 3.417 5.490 ( 2.311 2.652 -4.701) 5.871 5.536 ( 2.267 -1.925 3.609) 4.677 5.697 ( 0.004 -0.065 2.559) 2.560 5.822 ( -2.972 -2.625 -1.394) 4.203 5.860 ( 5.924 4.378 1.353) 7.490 5.889 ( -0.955 -3.441 0.268) 3.582 5.897 ( 1.212 -2.389 0.463) 2.719 5.947 ( 3.040 1.928 -2.296) 4.270 6.069 ( 1.007 2.878 0.092) 3.051 6.101 ( 0.030 5.645 0.132) 5.647 6.155 ( -4.141 0.084 0.718) 4.203 6.301 ( 4.038 0.472 -2.356) 4.699 6.481 ( -0.802 -4.931 0.698) 5.044 6.515 ( -2.360 -7.750 1.906) 8.323 6.602 ( 1.987 -4.331 3.909) 6.163 6.625 ( 0.702 -6.952 -0.486) 7.005 6.783 ( -3.585 3.449 1.041) 5.082 6.836 ( -1.010 2.649 -0.874) 2.967 7.004 ( -5.937 -1.343 -2.451) 6.562 7.070 ( -4.478 2.800 0.837) 5.348 7.113 ( -0.325 -3.033 -3.157) 4.390 7.190 ( 1.531 -1.576 -0.830) 2.349 7.276 ( -5.218 -5.775 4.400) 8.940 7.299 ( -3.229 -5.372 -3.887) 7.376 7.436 ( -5.214 -0.168 -0.674) 5.260 7.488 ( -3.858 1.711 0.011) 4.220 7.647 ( -7.054 -12.079 -0.162) 13.989 7.702 ( -4.413 -10.155 -1.427) 11.164 8.496 ( -18.052 3.802 -1.923) 18.548 8.556 ( -14.726 3.743 2.012) 15.327 8.709 ( -11.688 -2.382 -1.307) 11.999 8.755 ( -11.323 -4.394 -0.744) 12.169 8.943 ( -2.668 0.296 -1.991) 3.342 9.008 ( -0.972 1.259 0.077) 1.592 9.066 ( 3.343 -0.538 1.515) 3.710 9.123 ( -1.333 2.581 3.323) 4.414 9.233 ( 4.840 -3.771 -0.897) 6.201 9.254 ( 4.501 -3.766 -1.182) 5.986 9.264 ( 4.435 -3.389 1.222) 5.714 9.319 ( 5.365 -2.617 0.849) 6.029 9.448 ( 1.618 1.128 0.585) 2.057 9.484 ( 3.872 2.845 -1.619) 5.070 9.541 ( 1.105 -2.684 3.578) 4.607 9.632 ( 5.883 -3.671 -2.660) 7.427 10.010 ( -1.661 -0.457 3.384) 3.798 10.074 ( 1.048 -2.593 -3.836) 4.748 10.285 ( -7.655 6.536 -0.268) 10.070 10.345 ( -6.582 4.348 -0.198) 7.891 10.451 ( -7.964 0.914 0.064) 8.017 10.466 ( -4.820 4.275 0.383) 6.454 10.635 ( -9.129 -2.364 -0.728) 9.458 10.664 ( -7.339 -4.326 1.182) 8.601 10.786 ( -7.841 4.508 0.821) 9.081 10.845 ( -3.461 2.743 -0.357) 4.431 11.014 ( -3.398 -1.471 -0.781) 3.784 11.070 ( -2.409 -3.585 0.952) 4.422 11.346 ( 11.263 1.317 -0.317) 11.345 11.369 ( 12.106 0.901 0.053) 12.140 11.541 ( 2.776 -6.568 -0.608) 7.156 11.584 ( 4.647 -7.054 0.649) 8.472 12.032 ( 1.575 4.380 3.024) 5.550 12.087 ( 3.380 3.858 -3.377) 6.141 12.284 ( 1.042 -3.227 2.809) 4.403 12.321 ( 1.720 -4.870 -1.997) 5.537 12.372 ( -4.859 5.016 0.950) 7.048 12.383 ( -3.355 3.280 0.261) 4.700 12.446 ( -2.299 2.957 -0.278) 3.756 12.490 ( -0.475 2.200 -0.605) 2.331 12.649 ( 0.864 7.755 1.579) 7.961 12.714 ( 2.997 7.902 -1.947) 8.673 12.922 ( -0.027 -4.722 0.555) 4.754 12.969 ( 0.445 -3.528 -0.634) 3.612 13.275 ( 0.883 4.086 0.200) 4.185 13.296 ( 2.971 2.956 -0.357) 4.206 13.497 ( 11.192 -5.264 0.604) 12.382 13.534 ( 12.701 -5.448 -0.074) 13.820 14.139 ( -6.078 8.868 -1.173) 10.815 14.201 ( -7.550 7.236 0.303) 10.462 14.253 ( -0.985 6.596 1.174) 6.771 14.347 ( 10.523 9.703 0.600) 14.327 14.393 ( -7.065 -2.502 0.300) 7.501 14.477 ( -2.722 3.554 -0.020) 4.477 14.678 ( 5.298 2.217 -0.907) 5.815 14.785 ( 6.572 3.443 -0.953) 7.480 14.891 ( 13.572 1.724 -2.424) 13.894 14.916 ( 4.829 -0.074 0.078) 4.830 15.109 ( 9.830 -4.962 -0.017) 11.011 15.120 ( 10.463 -3.091 -0.204) 10.912 15.258 ( 5.847 12.460 2.512) 13.991 15.387 ( 10.963 8.969 -2.182) 14.331 15.703 ( -5.312 -2.099 0.469) 5.731 15.759 ( -7.591 -0.496 -0.586) 7.630 15.831 ( 2.476 -0.164 0.031) 2.482 15.881 ( -0.468 1.465 1.283) 2.003 16.031 ( -1.893 -8.921 -4.073) 9.987 16.087 ( -1.410 -6.287 3.610) 7.385 16.540 ( 2.820 0.537 0.157) 2.875 16.585 ( 2.582 -1.290 -0.182) 2.892 16.614 ( 2.874 0.746 0.685) 3.047 16.658 ( 4.148 -0.261 1.292) 4.352 17.329 ( -0.872 0.608 0.000) 1.063 17.344 ( -0.070 0.230 -0.451) 0.511 17.366 ( -0.350 0.214 0.841) 0.936 17.392 ( 1.100 -0.573 -1.078) 1.643 19.781 ( 1.582 0.808 2.290) 2.898 19.804 ( 2.731 -0.123 -2.301) 3.573 20.027 ( 0.276 -3.941 0.108) 3.952 20.044 ( 0.851 -3.961 0.353) 4.067 20.548 ( -4.313 1.501 1.843) 4.925 20.600 ( -1.485 -0.637 0.124) 1.620 20.776 ( -1.547 0.706 0.023) 1.701 20.812 ( 0.436 -0.835 -1.546) 1.810 22.001 ( 3.210 1.144 -2.810) 4.417 22.010 ( 3.259 0.618 0.758) 3.402 22.128 ( 2.294 -1.441 0.835) 2.835 22.151 ( 3.157 -1.525 0.513) 3.544 23.012 ( -5.552 -0.404 0.066) 5.567 23.065 ( -2.176 -2.953 -0.443) 3.695 23.329 ( -8.725 -0.401 0.397) 8.744 23.349 ( -7.118 -1.323 0.787) 7.283 26.629 ( 10.978 0.715 0.115) 11.002 26.644 ( 11.859 1.078 0.084) 11.908 26.721 ( 17.764 -1.971 -0.617) 17.884 26.743 ( 18.934 -1.656 0.338) 19.009 29.059 ( -17.416 4.377 0.456) 17.963 29.123 ( -15.702 4.899 -0.474) 16.456 29.282 ( -11.036 -4.174 -3.026) 12.180 29.308 ( -11.040 -3.610 2.075) 11.800 30.049 ( 11.464 16.057 -0.081) 19.730 30.134 ( 13.419 17.358 2.205) 22.051 30.605 ( 0.946 -4.025 -2.932) 5.069 30.643 ( 2.374 -2.375 3.422) 4.794 30.820 ( 2.375 1.057 -0.855) 2.736 30.837 ( 4.088 1.472 0.210) 4.350 31.051 ( 3.044 -3.198 0.360) 4.430 31.102 ( 6.232 -2.699 -0.271) 6.797 31.583 ( 0.671 9.328 1.750) 9.514 31.661 ( 6.316 10.319 0.016) 12.098 32.028 ( -8.339 -1.358 -0.657) 8.474 32.069 ( -7.740 0.482 1.401) 7.880 32.113 ( -6.779 -4.580 -5.772) 10.012 32.208 ( -2.603 -0.818 -5.516) 6.154 32.275 ( -0.021 -8.235 7.438) 11.096 32.301 ( -4.437 -4.331 -1.179) 6.312 32.674 ( 9.689 -0.108 6.727) 11.795 32.705 ( 11.410 -0.885 3.935) 12.102 32.813 ( 10.124 0.892 -6.566) 12.100 32.842 ( 10.320 -0.481 0.932) 10.373 33.729 ( -2.316 0.327 -0.012) 2.339 33.738 ( -1.758 -0.025 0.163) 1.766 33.966 ( -3.292 -0.559 -2.270) 4.038 33.972 ( -3.161 -0.759 3.208) 4.567 34.968 ( -3.894 1.269 0.193) 4.100 35.030 ( -2.713 -1.534 -1.423) 3.426 35.110 ( 2.934 1.664 -1.240) 3.594 35.161 ( 3.172 -0.690 -0.261) 3.256 35.542 ( 0.526 2.799 0.271) 2.861 35.607 ( 4.456 1.399 -1.081) 4.794 35.674 ( 2.684 -2.317 -0.886) 3.655 35.700 ( 4.062 -2.062 0.160) 4.559 36.211 ( 1.432 -0.097 -9.840) 9.944 36.231 ( 1.278 -0.934 2.581) 3.028 36.280 ( 0.558 0.137 -1.337) 1.455 36.308 ( 0.917 -0.723 7.638) 7.727 37.698 ( -4.056 10.324 -20.794) 23.567 37.731 ( -4.766 9.235 20.652) 23.119 38.538 ( -13.818 -12.614 9.632) 21.044 38.560 ( -11.538 -13.574 -8.914) 19.921 ======================= Grid point 101 (54/69) ======================= q-point: ( 0.22 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.640 ( 16.402 7.961 -14.554) 23.328 1.760 ( 9.724 15.716 -12.169) 22.127 1.926 ( 19.275 3.385 10.816) 22.360 2.052 ( 2.845 -9.879 2.541) 10.590 2.091 ( 10.062 1.172 -6.419) 11.992 2.245 ( 14.190 3.885 6.899) 16.250 2.427 ( 5.098 4.253 -4.890) 8.246 2.553 ( 1.623 -5.101 -5.312) 7.541 2.627 ( 1.686 -5.592 -1.431) 6.013 2.714 ( -2.740 -0.088 -2.537) 3.735 2.795 ( -2.789 -0.817 -2.801) 4.036 2.918 ( -0.103 -5.125 -6.818) 8.530 2.964 ( 1.253 -2.906 -1.559) 3.527 2.987 ( 0.718 -2.296 -4.415) 5.027 3.045 ( 1.741 3.387 -6.515) 7.547 3.148 ( 3.516 1.937 0.707) 4.076 3.183 ( -0.481 -2.450 -6.642) 7.096 3.216 ( -1.130 2.817 -6.639) 7.300 3.317 ( 3.095 3.042 -2.247) 4.887 3.335 ( -3.462 -0.475 -3.698) 5.088 3.429 ( -0.173 4.755 3.846) 6.118 3.545 ( 0.186 -6.024 1.026) 6.114 3.665 ( 3.069 6.043 1.560) 6.955 3.696 ( 3.248 3.643 -1.711) 5.173 3.756 ( 6.960 3.037 -0.707) 7.626 3.841 ( -1.542 4.113 2.091) 4.865 3.922 ( 4.138 0.443 9.747) 10.598 3.958 ( 9.710 4.562 -0.370) 10.734 4.058 ( 2.362 10.002 4.780) 11.335 4.115 ( 1.080 3.961 -3.131) 5.163 4.193 ( 9.646 -0.210 -1.829) 9.820 4.244 ( 2.499 0.494 1.136) 2.789 4.346 ( 6.460 1.138 3.882) 7.623 4.471 ( -0.002 -6.016 8.922) 10.760 4.502 ( 4.903 -4.314 -3.470) 7.395 4.600 ( 2.207 -6.745 2.170) 7.421 4.636 ( 0.993 -3.616 1.484) 4.033 4.682 ( 3.931 -1.356 1.676) 4.483 4.764 ( -1.260 -0.006 -2.108) 2.456 4.870 ( 0.993 0.722 -6.651) 6.763 4.883 ( 1.283 1.151 -4.761) 5.063 5.003 ( -1.601 -5.935 8.485) 10.478 5.126 ( -3.145 1.959 -0.677) 3.766 5.158 ( 2.318 2.705 5.546) 6.591 5.235 ( 5.249 1.516 4.949) 7.372 5.301 ( -0.482 4.575 2.337) 5.160 5.393 ( -1.836 4.670 0.671) 5.062 5.412 ( 3.231 -0.223 -2.146) 3.885 5.549 ( -0.537 2.025 -1.136) 2.383 5.603 ( 5.971 4.213 8.420) 11.149 5.724 ( -5.583 0.303 4.037) 6.896 5.805 ( -0.747 -4.101 2.455) 4.838 5.857 ( -2.272 -0.284 -1.492) 2.733 5.906 ( 0.125 -10.546 3.652) 11.161 5.929 ( 2.223 2.191 -1.425) 3.431 5.984 ( 3.568 2.344 1.783) 4.627 6.080 ( 0.379 -3.222 -2.589) 4.151 6.111 ( -0.621 -0.748 2.436) 2.622 6.162 ( 1.078 2.458 3.635) 4.519 6.295 ( -0.711 -0.244 -1.432) 1.617 6.445 ( -0.462 -4.264 -3.328) 5.429 6.556 ( -0.691 -7.509 -1.157) 7.629 6.595 ( -2.265 -3.868 3.523) 5.701 6.692 ( -0.724 -2.903 4.516) 5.417 6.725 ( 0.280 2.274 -4.119) 4.714 6.800 ( -3.818 -0.205 0.066) 3.824 6.852 ( -4.394 0.171 -6.196) 7.597 6.994 ( -5.508 0.154 -1.212) 5.642 7.037 ( -2.672 -0.098 -0.293) 2.689 7.187 ( -3.453 -0.233 -0.753) 3.541 7.211 ( -0.681 -2.982 -1.286) 3.318 7.252 ( -0.708 -1.160 0.201) 1.374 7.317 ( -5.768 1.906 -2.390) 6.528 7.390 ( -7.964 2.003 -1.381) 8.327 7.512 ( -5.033 -5.238 -3.751) 8.176 7.621 ( -3.942 -4.670 -0.889) 6.175 8.174 ( -19.770 6.197 -0.392) 20.723 8.329 ( -16.364 3.626 0.965) 16.788 8.438 ( -19.089 -4.820 0.260) 19.690 8.557 ( -13.120 -6.635 -0.821) 14.725 8.917 ( 1.691 3.549 -1.209) 4.113 9.000 ( -0.239 1.123 0.409) 1.219 9.116 ( -0.670 1.557 4.338) 4.657 9.187 ( 3.354 -2.112 1.120) 4.119 9.296 ( 4.997 -2.779 -0.490) 5.739 9.314 ( 3.358 -2.448 -0.318) 4.167 9.348 ( 3.640 -1.239 2.000) 4.334 9.406 ( 3.562 -2.129 1.250) 4.334 9.466 ( 2.273 0.357 -0.689) 2.402 9.539 ( 4.186 2.447 -0.592) 4.885 9.607 ( 2.529 -4.159 2.334) 5.398 9.697 ( 4.877 -4.548 -0.953) 6.736 9.982 ( -2.336 0.381 -2.881) 3.729 10.032 ( -3.950 -1.415 -0.783) 4.268 10.151 ( -8.048 2.368 -0.754) 8.423 10.180 ( -12.385 3.123 -0.874) 12.802 10.281 ( -10.655 1.750 -2.170) 11.013 10.410 ( -8.425 2.779 5.081) 10.224 10.454 ( -9.539 0.181 -2.550) 9.876 10.590 ( -5.199 -4.774 2.125) 7.371 10.673 ( -7.296 5.848 1.804) 9.523 10.777 ( -4.336 1.574 -0.353) 4.627 10.949 ( -3.730 -1.549 -0.760) 4.109 10.991 ( -7.922 -4.170 0.734) 8.983 11.541 ( 12.310 -0.971 0.184) 12.350 11.558 ( 11.007 -2.258 -0.146) 11.237 11.627 ( 8.160 -1.295 -0.100) 8.263 11.684 ( 7.027 -2.362 0.370) 7.422 12.085 ( 0.812 4.239 -2.070) 4.787 12.107 ( 3.326 3.732 2.116) 5.428 12.270 ( -3.751 1.390 -0.880) 4.096 12.293 ( -3.409 0.454 -0.445) 3.468 12.341 ( -0.518 -1.048 1.057) 1.576 12.390 ( 3.306 -2.856 0.730) 4.429 12.413 ( -1.704 0.748 0.753) 2.008 12.465 ( -1.080 -1.134 -0.992) 1.854 12.696 ( 2.699 5.160 0.327) 5.832 12.744 ( 2.725 5.953 -0.735) 6.588 12.932 ( -0.586 -4.609 0.048) 4.646 12.958 ( -0.386 -2.776 -0.416) 2.834 13.311 ( 3.713 6.886 0.115) 7.824 13.356 ( 5.038 6.507 -0.339) 8.236 13.670 ( 7.658 -8.362 0.613) 11.355 13.705 ( 6.537 -9.035 0.216) 11.153 14.051 ( -2.058 10.742 -0.228) 10.940 14.130 ( -0.456 6.942 0.839) 7.007 14.266 ( 1.363 -0.584 0.209) 1.498 14.300 ( -3.959 -3.282 -0.535) 5.170 14.421 ( 2.225 9.257 -2.823) 9.931 14.532 ( 1.276 12.640 4.113) 13.353 14.743 ( 2.472 0.212 -0.346) 2.505 14.811 ( 0.465 -0.431 -0.912) 1.111 15.003 ( 7.323 6.248 0.536) 9.642 15.087 ( 11.219 2.394 -1.624) 11.586 15.264 ( 9.665 -4.087 0.143) 10.494 15.308 ( 11.190 -2.668 0.539) 11.516 15.439 ( 11.703 0.892 0.127) 11.737 15.527 ( 6.652 0.538 0.937) 6.739 15.615 ( -6.747 -2.531 0.519) 7.225 15.641 ( -5.714 -2.494 -0.544) 6.258 15.851 ( 5.067 0.279 -1.856) 5.404 15.922 ( 1.070 -3.488 -3.131) 4.808 16.009 ( 5.048 1.406 3.763) 6.452 16.099 ( -3.229 -2.865 4.413) 6.173 16.594 ( 2.489 -0.573 0.061) 2.554 16.597 ( 1.755 -0.561 -1.236) 2.219 16.676 ( 2.038 2.334 1.595) 3.485 16.756 ( 3.128 -0.879 3.377) 4.686 17.319 ( -0.048 0.619 -0.086) 0.627 17.342 ( 0.875 -0.095 -0.580) 1.054 17.375 ( 0.380 0.069 0.818) 0.905 17.393 ( 0.772 -0.312 -1.293) 1.538 19.819 ( 3.468 -0.399 -2.384) 4.227 19.861 ( 3.945 -1.003 3.096) 5.114 20.058 ( 3.068 -1.302 0.324) 3.349 20.094 ( 4.968 -1.796 1.823) 5.589 20.492 ( -5.650 1.650 2.169) 6.272 20.553 ( -4.459 -0.725 -0.298) 4.527 20.749 ( -2.423 0.868 0.696) 2.666 20.792 ( -1.129 -0.910 -1.056) 1.794 22.047 ( 6.683 1.637 -2.163) 7.212 22.066 ( 5.181 0.877 -1.510) 5.467 22.210 ( 6.460 -0.793 1.010) 6.587 22.228 ( 5.796 -1.195 0.430) 5.934 22.904 ( -8.394 0.587 0.449) 8.427 23.004 ( -5.748 -3.752 0.263) 6.869 23.164 ( -11.801 -0.590 -0.039) 11.815 23.211 ( -10.548 -1.992 -0.141) 10.735 26.852 ( 17.545 2.005 -1.515) 17.724 26.901 ( 19.489 3.284 1.976) 19.862 27.008 ( 23.258 -2.618 -4.796) 23.891 27.217 ( 29.137 -9.732 12.469) 33.154 28.758 ( -21.152 6.058 0.347) 22.005 28.813 ( -21.531 6.823 -0.560) 22.593 29.018 ( -18.022 -4.593 -3.398) 18.906 29.110 ( -17.442 -6.574 2.857) 18.858 30.226 ( 13.381 9.804 -2.559) 16.785 30.394 ( 10.837 14.715 6.205) 19.299 30.593 ( 4.398 -4.001 -4.905) 7.708 30.719 ( 1.518 -1.135 2.749) 3.339 30.859 ( 4.733 3.124 -0.965) 5.753 30.963 ( 8.666 3.095 3.275) 9.767 31.127 ( 5.524 -6.108 1.342) 8.344 31.206 ( 7.233 -3.750 -0.138) 8.148 31.595 ( -2.430 6.550 1.017) 7.060 31.768 ( -2.811 9.676 4.576) 11.067 31.899 ( -8.118 1.091 -0.426) 8.202 31.915 ( -4.128 -7.171 -6.039) 10.244 31.973 ( -0.789 6.445 2.645) 7.011 32.093 ( -3.550 2.936 -2.835) 5.410 32.252 ( -1.075 -3.705 1.928) 4.312 32.485 ( 3.782 -9.007 15.334) 18.181 32.898 ( 11.019 0.276 1.786) 11.167 32.948 ( 11.067 -0.723 6.612) 12.912 32.956 ( 13.740 1.105 -1.521) 13.868 33.025 ( 7.864 -1.771 4.178) 9.079 33.658 ( -4.156 0.593 -3.343) 5.367 33.700 ( -3.194 -1.058 0.806) 3.460 33.905 ( -5.985 0.733 3.919) 7.192 33.956 ( -6.360 -1.357 6.103) 8.918 34.908 ( -2.774 1.132 -0.912) 3.132 34.960 ( -1.984 -1.007 -2.995) 3.731 35.133 ( 3.059 1.234 -3.317) 4.677 35.186 ( 2.601 -0.915 -3.089) 4.140 35.574 ( 1.809 3.244 2.117) 4.275 35.673 ( 5.007 1.615 -0.624) 5.298 35.723 ( 4.116 -2.724 -0.058) 4.936 35.778 ( 5.067 -2.324 0.774) 5.628 36.124 ( 2.727 -0.424 -10.605) 10.959 36.148 ( 2.775 -1.246 -12.007) 12.386 36.393 ( 1.670 0.365 7.147) 7.349 36.403 ( -1.118 -0.179 6.122) 6.226 37.384 ( -1.907 11.140 -22.607) 25.274 37.801 ( -8.995 0.663 9.009) 12.748 38.188 ( -16.702 -7.088 -11.873) 21.683 38.406 ( -18.237 -8.694 10.347) 22.699 ======================= Grid point 102 (55/69) ======================= q-point: ( 0.33 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( 11.835 3.539 -10.005) 15.896 1.840 ( 13.297 17.213 -7.665) 23.062 2.023 ( 4.180 -10.255 -3.910) 11.744 2.225 ( 14.702 1.798 2.431) 15.010 2.352 ( -6.147 -0.255 0.352) 6.162 2.429 ( 9.222 1.816 4.624) 10.475 2.517 ( 11.599 2.168 -4.856) 12.761 2.561 ( 1.695 -2.296 -9.698) 10.110 2.616 ( 0.283 -5.252 0.134) 5.262 2.696 ( 7.394 -0.728 -4.673) 8.777 2.729 ( 3.207 -2.249 -5.258) 6.556 2.795 ( -2.016 2.803 -8.325) 9.012 2.961 ( 8.406 -0.071 -0.893) 8.454 2.986 ( 2.641 1.194 -2.936) 4.126 3.068 ( -4.902 0.751 -1.764) 5.264 3.102 ( 4.008 1.914 -5.445) 7.026 3.121 ( 1.050 4.336 -3.352) 5.580 3.231 ( -0.317 -1.690 -3.461) 3.864 3.267 ( 8.679 -1.043 0.086) 8.742 3.381 ( 0.128 4.062 2.553) 4.800 3.471 ( 0.699 -0.433 1.633) 1.829 3.545 ( -0.352 -6.370 4.057) 7.560 3.634 ( -0.294 9.235 -4.499) 10.277 3.690 ( 4.659 0.038 -5.688) 7.352 3.823 ( 5.936 7.504 -7.459) 12.132 3.865 ( -2.629 1.524 4.908) 5.773 4.010 ( -0.882 -2.097 1.303) 2.622 4.092 ( 7.963 2.001 -4.997) 9.611 4.148 ( 6.202 1.055 -4.215) 7.572 4.204 ( 5.258 1.551 4.294) 6.963 4.252 ( 3.723 6.661 -0.978) 7.693 4.334 ( 0.700 1.255 7.362) 7.501 4.396 ( 0.041 -1.428 1.385) 1.990 4.485 ( 0.030 1.981 -1.416) 2.435 4.570 ( -3.276 -3.261 1.948) 5.017 4.629 ( 0.995 -2.222 6.571) 7.008 4.664 ( 0.000 -2.843 -0.897) 2.981 4.731 ( 3.462 -6.795 -3.567) 8.419 4.768 ( 0.441 -0.125 0.121) 0.474 4.838 ( 3.362 -0.074 -0.086) 3.364 4.868 ( 2.811 3.209 -0.811) 4.342 5.062 ( -5.275 -0.706 5.279) 7.496 5.141 ( -1.163 -2.028 2.521) 3.438 5.213 ( 0.332 -0.357 0.990) 1.103 5.254 ( -3.423 4.173 -0.576) 5.428 5.340 ( 2.476 1.866 1.001) 3.258 5.378 ( 0.756 1.437 -3.022) 3.430 5.506 ( 2.104 4.620 3.889) 6.394 5.608 ( 7.480 -0.000 3.993) 8.479 5.676 ( -3.566 -0.422 4.815) 6.007 5.725 ( -0.822 0.024 3.683) 3.774 5.801 ( -0.399 -2.065 0.366) 2.135 5.815 ( -2.357 -2.527 5.469) 6.469 5.964 ( -0.176 -2.681 3.099) 4.102 5.985 ( 1.080 -3.978 4.605) 6.181 6.024 ( -3.559 -4.548 1.458) 5.956 6.074 ( 3.456 -0.511 3.673) 5.069 6.131 ( 0.995 -1.653 0.846) 2.106 6.205 ( -4.024 1.148 5.394) 6.827 6.252 ( -1.887 1.609 -0.860) 2.624 6.432 ( -2.458 -4.304 -5.412) 7.339 6.482 ( 6.479 -4.295 -2.632) 8.207 6.532 ( -6.129 -2.450 -2.241) 6.970 6.642 ( -4.111 -2.436 -1.300) 4.952 6.710 ( -5.061 -0.939 -0.868) 5.220 6.768 ( 2.747 2.732 -3.090) 4.956 6.795 ( 1.588 -0.540 -1.895) 2.530 6.878 ( -4.293 -1.101 -3.736) 5.796 7.076 ( 2.999 3.955 2.343) 5.488 7.110 ( -3.460 2.397 -0.231) 4.215 7.214 ( -2.068 0.934 -3.064) 3.813 7.238 ( -2.337 1.341 0.728) 2.791 7.251 ( -0.302 -3.056 -2.110) 3.726 7.272 ( 1.699 -1.139 -0.170) 2.052 7.446 ( -1.903 -0.520 0.346) 2.003 7.560 ( -3.507 -3.187 0.250) 4.746 7.910 ( -14.671 6.410 2.696) 16.235 8.091 ( -14.435 3.684 0.302) 14.901 8.186 ( -13.746 -5.119 2.506) 14.881 8.356 ( -11.172 -8.116 -0.441) 13.816 8.941 ( 2.220 4.235 -1.191) 4.928 9.000 ( -0.037 2.034 -0.482) 2.091 9.153 ( -0.784 0.287 4.016) 4.102 9.224 ( 1.058 -3.494 -0.171) 3.655 9.321 ( 2.146 0.959 -1.116) 2.602 9.400 ( 5.313 -2.562 1.588) 6.109 9.421 ( 3.089 -2.040 1.316) 3.929 9.455 ( 0.590 -1.887 2.248) 2.994 9.528 ( 5.434 0.510 0.289) 5.465 9.592 ( 4.052 -0.247 -1.207) 4.235 9.657 ( 1.726 -2.058 0.409) 2.717 9.766 ( 3.423 -4.690 0.980) 5.889 9.871 ( -9.143 1.083 -1.008) 9.262 9.914 ( -10.156 -0.633 0.683) 10.199 9.982 ( -9.803 2.733 -1.780) 10.331 10.044 ( -4.530 0.159 -2.473) 5.164 10.116 ( -4.592 0.939 -3.269) 5.714 10.264 ( -8.115 -1.674 -1.902) 8.502 10.373 ( -5.012 4.441 2.824) 7.268 10.512 ( -6.284 -2.822 -0.156) 6.891 10.621 ( -3.394 5.593 2.664) 7.064 10.714 ( -3.083 2.322 -0.635) 3.911 10.876 ( -3.924 -3.172 -0.324) 5.056 10.908 ( -3.787 -3.344 1.566) 5.289 11.678 ( 6.354 -2.139 0.138) 6.706 11.727 ( 9.311 -2.641 -0.125) 9.679 11.743 ( 6.097 1.016 0.208) 6.185 11.783 ( 5.160 0.647 -0.430) 5.218 12.071 ( 0.029 3.143 -0.403) 3.169 12.173 ( 2.046 3.826 0.230) 4.344 12.207 ( -2.820 0.784 -0.345) 2.947 12.239 ( -2.173 1.415 -1.304) 2.902 12.343 ( -0.315 -2.158 0.439) 2.225 12.409 ( 0.830 -1.823 1.604) 2.566 12.440 ( -0.204 -3.138 -1.724) 3.586 12.467 ( 3.653 -5.146 1.122) 6.410 12.720 ( 1.403 3.336 -1.124) 3.790 12.779 ( 1.812 4.683 0.171) 5.024 12.893 ( -3.050 -3.515 -0.694) 4.705 12.948 ( -1.710 -2.666 0.249) 3.177 13.392 ( 6.250 9.079 0.180) 11.024 13.438 ( 5.903 8.608 -0.463) 10.448 13.713 ( -2.245 -1.695 0.555) 2.867 13.719 ( -2.527 -0.951 -0.659) 2.779 14.099 ( 6.394 5.423 0.470) 8.397 14.197 ( 5.462 -1.755 0.471) 5.756 14.281 ( 2.853 -2.250 -0.227) 3.640 14.297 ( 2.116 -0.538 -0.098) 2.185 14.431 ( 3.214 9.234 -1.764) 9.935 14.525 ( -4.138 11.063 0.832) 11.841 14.702 ( -5.392 0.852 -0.530) 5.485 14.805 ( -2.647 -0.603 0.211) 2.723 15.120 ( 5.879 0.120 -0.124) 5.881 15.195 ( 5.187 1.980 -0.606) 5.585 15.383 ( 2.232 -4.967 1.214) 5.579 15.409 ( 1.648 -6.445 -1.587) 6.839 15.522 ( 0.279 -1.182 -1.398) 1.852 15.534 ( 0.910 -3.542 -0.843) 3.753 15.601 ( 0.506 -0.644 0.379) 0.902 15.641 ( 5.439 -1.310 0.725) 5.641 15.924 ( 6.029 0.180 -1.770) 6.286 15.966 ( 7.603 -1.609 0.022) 7.771 16.096 ( -0.685 2.215 1.774) 2.919 16.150 ( 3.458 0.247 4.476) 5.662 16.598 ( 0.124 0.141 0.057) 0.196 16.633 ( 1.325 -1.664 0.893) 2.307 16.708 ( 0.471 2.137 0.417) 2.227 16.780 ( -3.928 -1.002 1.794) 4.433 17.325 ( 0.728 0.846 -0.297) 1.155 17.360 ( 2.256 -0.603 -1.410) 2.728 17.385 ( 0.531 0.123 -0.269) 0.608 17.396 ( 0.046 -0.322 1.158) 1.202 19.869 ( 6.007 0.769 -1.455) 6.228 19.961 ( 4.919 -2.711 1.773) 5.889 20.120 ( 3.302 1.732 0.902) 3.836 20.206 ( 4.521 -1.745 2.057) 5.265 20.428 ( -5.747 1.145 2.726) 6.463 20.468 ( -5.132 -0.385 -0.293) 5.155 20.719 ( -2.796 0.526 1.354) 3.150 20.757 ( -2.117 -0.998 -0.201) 2.349 22.155 ( 9.034 2.096 -1.327) 9.369 22.163 ( 9.047 2.182 -0.328) 9.312 22.328 ( 6.674 -1.508 -0.300) 6.849 22.332 ( 7.787 -1.425 0.384) 7.925 22.776 ( -8.319 1.003 0.627) 8.403 22.888 ( -8.888 -2.230 -0.728) 9.192 22.993 ( -10.148 -1.821 0.739) 10.336 23.040 ( -10.514 -1.912 -0.473) 10.696 27.126 ( 19.958 3.194 -1.743) 20.287 27.253 ( 21.649 4.507 2.110) 22.213 27.330 ( 23.669 -1.505 -3.104) 23.919 27.781 ( 20.985 -16.210 12.501) 29.316 28.421 ( -21.944 6.114 -0.077) 22.780 28.487 ( -19.912 7.188 0.813) 21.185 28.670 ( -21.635 -5.064 -1.807) 22.293 28.866 ( -17.191 -8.729 2.929) 19.501 30.393 ( 10.495 6.456 -1.186) 12.379 30.575 ( 6.718 9.007 0.536) 11.249 30.627 ( 4.497 -2.902 -1.004) 5.445 30.754 ( 0.862 -0.670 0.602) 1.247 30.952 ( 7.450 4.937 0.720) 8.967 31.114 ( 7.407 3.704 -0.092) 8.283 31.247 ( 3.839 -7.754 3.941) 9.507 31.318 ( 6.968 -4.230 0.331) 8.159 31.519 ( -7.160 2.715 -0.029) 7.658 31.639 ( -10.884 2.973 1.570) 11.392 31.780 ( -5.016 -1.577 -0.422) 5.275 31.843 ( -5.013 -1.340 1.468) 5.393 32.062 ( 2.167 6.708 -0.394) 7.061 32.125 ( 2.653 13.294 11.293) 17.644 32.333 ( 6.678 -4.159 5.597) 9.655 32.690 ( 0.972 -8.415 13.417) 15.867 33.037 ( 7.941 1.502 -3.054) 8.639 33.097 ( -2.799 -0.843 3.412) 4.493 33.169 ( 12.771 0.121 0.761) 12.794 33.205 ( 12.926 -0.916 2.392) 13.178 33.550 ( -3.997 2.097 -2.796) 5.309 33.672 ( -4.510 -2.956 4.507) 7.029 33.849 ( -8.175 0.955 5.019) 9.640 33.898 ( -9.291 -1.132 4.791) 10.515 34.881 ( -0.139 0.962 0.726) 1.214 34.925 ( 0.667 -0.911 -0.842) 1.409 35.128 ( 2.203 0.981 -4.776) 5.351 35.176 ( 2.086 -1.005 -5.003) 5.513 35.642 ( 2.489 3.219 3.885) 5.625 35.739 ( 3.662 2.122 0.077) 4.233 35.790 ( 3.868 -2.972 0.512) 4.905 35.864 ( 4.074 -2.285 1.539) 4.918 36.053 ( 2.950 -0.807 -9.533) 10.012 36.086 ( 6.483 -1.119 -12.087) 13.762 36.353 ( -6.061 1.601 -5.313) 8.218 36.413 ( -4.335 -1.100 -2.750) 5.250 37.234 ( 9.176 8.808 -11.110) 16.888 37.674 ( -3.081 -8.834 -6.625) 11.464 37.908 ( -12.274 5.275 0.509) 13.369 38.212 ( -19.812 -6.426 7.548) 22.154 ======================= Grid point 103 (56/69) ======================= q-point: ( 0.44 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.811 ( 13.856 2.865 -1.887) 14.275 2.004 ( 12.589 9.294 0.052) 15.648 2.124 ( 5.833 -5.427 2.742) 8.426 2.135 ( -13.087 6.684 -6.302) 15.989 2.311 ( -6.319 2.649 -6.572) 9.494 2.407 ( -2.924 -6.834 -9.270) 11.883 2.459 ( 0.332 -2.599 0.565) 2.680 2.544 ( 4.559 -0.315 -7.127) 8.466 2.645 ( 3.312 -0.298 -4.146) 5.315 2.727 ( 5.375 1.757 3.810) 6.819 2.769 ( 1.006 5.943 -1.810) 6.294 2.879 ( 2.697 -1.400 -1.586) 3.428 2.922 ( -3.896 -3.712 0.599) 5.414 3.016 ( 1.901 3.913 -4.754) 6.445 3.044 ( 11.565 -2.775 3.310) 12.346 3.107 ( -5.808 3.600 -3.217) 7.553 3.184 ( 1.420 2.511 0.902) 3.023 3.237 ( 9.605 1.849 -4.156) 10.628 3.360 ( -1.573 -1.630 5.320) 5.782 3.393 ( 4.983 -3.656 0.331) 6.189 3.535 ( -3.620 -10.224 -1.537) 10.954 3.559 ( -1.354 3.799 -3.354) 5.245 3.646 ( 4.491 -3.190 0.188) 5.512 3.672 ( 1.367 1.114 -4.489) 4.823 3.750 ( -2.555 7.038 -3.626) 8.319 3.874 ( 2.899 6.198 -2.936) 7.446 4.008 ( -3.011 6.502 0.399) 7.176 4.039 ( 1.160 -4.537 -2.480) 5.299 4.170 ( -1.280 3.394 -3.719) 5.195 4.239 ( -5.504 8.353 -3.452) 10.582 4.292 ( 8.851 2.691 -0.763) 9.283 4.388 ( -1.045 5.571 0.559) 5.695 4.448 ( -0.036 3.615 8.315) 9.067 4.533 ( 3.820 2.237 1.935) 4.831 4.583 ( -0.513 0.308 -1.165) 1.310 4.618 ( 2.871 -2.677 0.800) 4.006 4.680 ( -0.788 -4.729 -0.471) 4.818 4.753 ( -3.079 -3.709 1.677) 5.103 4.758 ( 3.770 -1.873 -2.057) 4.686 4.886 ( -1.352 2.195 3.373) 4.245 4.944 ( 5.041 -1.265 2.739) 5.875 5.018 ( -2.339 0.485 -1.218) 2.682 5.045 ( -7.190 -7.330 -2.714) 10.620 5.153 ( -1.087 0.725 -4.126) 4.328 5.298 ( 0.300 1.810 3.021) 3.534 5.351 ( 0.646 1.706 -1.194) 2.180 5.409 ( 2.944 1.315 2.606) 4.146 5.509 ( -0.836 0.161 0.986) 1.303 5.616 ( -3.555 -3.061 2.078) 5.131 5.725 ( 0.640 -3.533 5.117) 6.251 5.769 ( -4.697 4.157 -2.924) 6.921 5.847 ( -1.156 1.326 4.603) 4.928 5.895 ( 7.937 -1.736 4.907) 9.492 5.991 ( -0.316 -2.847 4.083) 4.988 6.007 ( -1.689 -3.968 4.791) 6.446 6.054 ( -1.131 -3.192 3.197) 4.657 6.124 ( -7.343 1.050 3.343) 8.136 6.148 ( 1.662 0.338 0.959) 1.949 6.183 ( 1.912 -0.745 4.184) 4.661 6.255 ( 2.355 -1.828 -1.513) 3.343 6.418 ( 4.933 0.399 -1.489) 5.168 6.465 ( 0.862 -4.197 -0.494) 4.313 6.510 ( -8.052 -7.015 1.607) 10.799 6.574 ( 1.985 -2.760 -3.818) 5.112 6.635 ( 0.411 1.317 -2.843) 3.160 6.730 ( -0.061 1.157 -5.397) 5.520 6.758 ( -1.805 -1.869 -4.109) 4.861 6.798 ( -1.176 -0.822 -4.925) 5.130 7.100 ( 1.813 1.605 -0.567) 2.486 7.137 ( 1.958 2.864 2.087) 4.049 7.178 ( -0.159 2.193 1.428) 2.622 7.206 ( -2.867 1.849 0.157) 3.416 7.246 ( 0.016 -1.796 -0.159) 1.803 7.311 ( 1.104 1.654 -0.977) 2.215 7.431 ( -0.873 -2.313 2.506) 3.520 7.512 ( -3.294 -2.824 0.037) 4.339 7.822 ( -2.191 5.588 4.440) 7.466 7.926 ( -5.925 4.904 -0.052) 7.691 8.099 ( -2.581 -5.700 4.214) 7.544 8.218 ( -5.064 -8.028 -1.127) 9.559 8.951 ( 0.967 4.856 -0.850) 5.024 8.985 ( -0.285 3.590 -1.603) 3.942 9.178 ( -0.820 -0.949 2.637) 2.920 9.224 ( -0.070 -3.106 -0.825) 3.214 9.383 ( 5.049 1.208 1.828) 5.504 9.462 ( 0.654 -4.122 1.062) 4.307 9.465 ( -0.887 -2.249 1.268) 2.730 9.492 ( 2.202 -2.420 0.604) 3.327 9.612 ( 4.064 1.566 0.405) 4.375 9.650 ( 3.753 -0.419 -0.379) 3.795 9.676 ( 1.935 -0.303 -1.665) 2.571 9.719 ( -7.032 -0.866 -0.532) 7.105 9.748 ( -6.319 0.401 1.331) 6.470 9.782 ( -6.825 -0.149 1.152) 6.923 9.908 ( 0.552 -1.657 -0.382) 1.788 9.944 ( -3.282 -1.954 -1.450) 4.085 10.083 ( 3.716 1.663 -3.021) 5.069 10.146 ( -4.903 0.969 -1.970) 5.372 10.344 ( -1.080 0.934 1.410) 2.006 10.413 ( -4.515 -2.947 -1.552) 5.610 10.609 ( -2.096 6.762 2.701) 7.578 10.668 ( -0.730 4.787 -1.617) 5.105 10.855 ( -0.356 -3.790 1.516) 4.097 10.882 ( -1.269 -3.205 0.528) 3.487 11.750 ( 2.433 0.200 0.533) 2.498 11.789 ( 0.747 0.926 -0.564) 1.316 11.831 ( 3.606 -2.276 -0.135) 4.266 11.846 ( 2.700 -1.265 0.136) 2.984 12.081 ( 0.553 2.184 1.047) 2.485 12.150 ( -1.206 0.586 -2.171) 2.552 12.188 ( -1.486 3.011 0.625) 3.415 12.204 ( -0.373 2.384 -1.105) 2.654 12.350 ( 0.091 -2.000 1.028) 2.251 12.411 ( -0.295 -3.951 -2.308) 4.586 12.459 ( 1.494 -3.986 2.077) 4.736 12.513 ( 1.709 -6.025 -1.004) 6.343 12.742 ( 2.336 2.958 0.500) 3.802 12.801 ( 0.891 3.333 -0.608) 3.503 12.845 ( -1.691 -2.241 0.399) 2.836 12.904 ( -3.217 -2.213 -0.631) 3.955 13.494 ( 5.830 8.485 0.117) 10.296 13.516 ( 3.972 7.989 -0.271) 8.926 13.652 ( -4.281 4.539 0.094) 6.240 13.662 ( -3.300 5.282 -0.620) 6.258 14.193 ( 3.580 1.906 1.398) 4.290 14.262 ( 3.218 -0.375 -1.121) 3.428 14.310 ( -0.397 2.559 0.299) 2.607 14.337 ( 1.008 1.268 -0.464) 1.685 14.495 ( 5.161 3.759 -1.856) 6.649 14.510 ( 4.776 3.386 1.648) 6.082 14.597 ( -6.318 1.601 0.184) 6.521 14.713 ( -8.021 -0.924 -1.067) 8.145 15.193 ( 5.262 -3.397 -0.317) 6.271 15.263 ( 3.482 -1.891 -0.107) 3.964 15.322 ( -5.272 -6.621 -0.445) 8.475 15.368 ( -5.225 -5.836 -0.176) 7.835 15.544 ( 4.256 -0.566 -0.975) 4.403 15.575 ( 0.490 -1.396 -0.535) 1.574 15.632 ( 3.441 1.232 -0.007) 3.654 15.677 ( -0.850 -0.668 -0.193) 1.098 16.012 ( 4.884 1.057 0.246) 5.003 16.056 ( 2.116 -0.352 0.001) 2.146 16.129 ( 4.116 1.047 0.524) 4.279 16.193 ( -2.165 -1.048 1.521) 2.846 16.611 ( 1.154 0.613 1.150) 1.740 16.660 ( -0.157 -1.663 2.006) 2.610 16.697 ( -3.284 0.445 -0.612) 3.370 16.716 ( -1.347 0.209 -0.932) 1.652 17.329 ( 0.159 0.725 -0.253) 0.784 17.354 ( 0.011 -0.259 -1.803) 1.821 17.408 ( -0.301 -0.116 1.174) 1.217 17.411 ( 1.908 -0.253 0.094) 1.927 19.962 ( 6.758 0.991 -0.559) 6.853 20.030 ( 1.208 -1.386 -0.464) 1.897 20.157 ( 1.222 0.945 0.986) 1.832 20.228 ( -2.801 -1.612 -0.279) 3.244 20.394 ( -3.245 0.825 3.388) 4.763 20.418 ( -1.345 -0.104 0.687) 1.514 20.702 ( -1.331 0.387 1.623) 2.135 20.734 ( -0.210 -0.901 -0.355) 0.991 22.275 ( 6.236 3.005 -0.652) 6.953 22.286 ( 4.173 3.054 0.299) 5.179 22.425 ( 6.598 -3.096 0.197) 7.291 22.454 ( 6.079 -3.149 0.637) 6.876 22.675 ( -4.880 0.699 0.066) 4.930 22.732 ( -8.106 -0.273 -1.784) 8.305 22.882 ( -4.993 -1.600 1.278) 5.397 22.902 ( -5.487 -1.395 -0.098) 5.663 27.412 ( 17.301 4.644 -0.512) 17.921 27.543 ( 7.321 7.853 0.856) 10.771 27.657 ( 22.306 -5.174 -1.230) 22.931 27.975 ( -8.673 -9.226 -0.258) 12.665 28.140 ( -11.141 4.661 0.012) 12.077 28.221 ( -15.252 7.075 0.682) 16.827 28.475 ( 1.360 -9.927 5.554) 11.456 28.663 ( -12.662 -10.958 2.597) 16.945 30.514 ( 5.666 4.441 0.152) 7.201 30.601 ( -0.498 2.578 -2.145) 3.390 30.709 ( 4.212 1.504 0.866) 4.555 30.758 ( -1.137 0.224 0.147) 1.168 31.099 ( 9.311 2.958 1.817) 9.937 31.206 ( 5.598 1.088 -0.960) 5.783 31.256 ( -5.019 -0.734 0.463) 5.094 31.328 ( -7.722 -1.222 -1.979) 8.064 31.477 ( 4.386 -1.236 1.467) 4.788 31.560 ( -3.521 -3.889 1.672) 5.506 31.746 ( 0.234 0.646 1.621) 1.761 31.786 ( -4.631 -0.508 2.199) 5.152 32.140 ( 5.009 9.422 3.650) 11.278 32.222 ( -4.374 12.231 7.878) 15.192 32.565 ( 11.927 -4.792 8.256) 15.277 32.781 ( -8.079 -7.893 9.931) 15.040 33.033 ( -1.436 1.079 -3.861) 4.258 33.066 ( 0.606 -0.206 -4.190) 4.238 33.335 ( 6.444 0.100 0.096) 6.446 33.367 ( 4.537 -0.923 -1.183) 4.779 33.546 ( 6.126 1.869 2.283) 6.800 33.651 ( -3.731 -2.522 3.375) 5.628 33.769 ( -7.026 0.389 3.176) 7.721 33.788 ( -8.551 -0.493 2.265) 8.859 34.919 ( 0.834 0.726 4.300) 4.440 34.958 ( 1.500 -0.913 2.816) 3.319 35.097 ( 1.195 0.711 -5.262) 5.443 35.136 ( 0.673 -0.879 -6.014) 6.115 35.731 ( 2.558 2.308 4.292) 5.504 35.785 ( 1.485 2.825 1.221) 3.417 35.848 ( 2.510 -2.721 0.792) 3.786 35.938 ( 2.959 -0.717 2.004) 3.645 35.998 ( 2.817 -1.613 -8.762) 9.344 36.062 ( 6.194 -1.694 -10.063) 11.937 36.162 ( -6.300 1.701 -7.901) 10.247 36.225 ( -7.257 -1.237 -10.324) 12.680 37.385 ( 16.652 6.842 -1.216) 18.044 37.608 ( -11.315 1.705 2.473) 11.707 37.807 ( 7.999 -2.804 -3.441) 9.148 37.968 ( -19.735 -5.306 4.169) 20.857 ======================= Grid point 104 (57/69) ======================= q-point: (-0.44 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( -19.449 5.073 -1.580) 20.161 1.987 ( -4.501 10.375 0.693) 11.331 2.056 ( 1.550 2.029 -1.034) 2.755 2.173 ( 0.919 2.628 -0.961) 2.946 2.224 ( -2.535 0.235 2.112) 3.308 2.336 ( 0.126 -4.325 -2.768) 5.136 2.434 ( 0.364 -3.090 2.982) 4.310 2.522 ( -6.188 -3.240 -4.974) 8.575 2.592 ( -4.036 4.564 -1.504) 6.276 2.710 ( 3.533 -0.447 0.828) 3.656 2.816 ( -3.569 -2.573 -4.051) 5.981 2.858 ( 5.921 -3.007 3.026) 7.298 2.935 ( -9.157 6.030 0.694) 10.986 3.018 ( -12.932 -0.106 -7.980) 15.196 3.068 ( 5.096 8.219 -0.343) 9.677 3.117 ( 5.377 -3.381 4.933) 8.042 3.171 ( -5.479 -1.746 0.875) 5.817 3.234 ( -4.945 -0.573 -5.941) 7.751 3.305 ( 1.387 -1.681 5.378) 5.803 3.443 ( -9.280 -5.013 -2.221) 10.779 3.496 ( 5.318 0.799 2.172) 5.800 3.582 ( 5.035 -8.044 -1.074) 9.550 3.604 ( 3.565 -2.569 -1.217) 4.560 3.649 ( 2.362 -2.963 -0.672) 3.848 3.763 ( -7.569 5.181 -2.743) 9.574 3.826 ( 0.275 5.144 0.117) 5.153 3.999 ( -0.438 10.241 2.515) 10.554 4.048 ( -1.398 0.268 -0.926) 1.698 4.075 ( -3.457 11.220 0.303) 11.745 4.190 ( 0.167 3.617 1.115) 3.788 4.295 ( -6.525 5.419 -1.926) 8.698 4.401 ( 4.530 3.700 -0.911) 5.920 4.528 ( -0.197 5.888 4.484) 7.404 4.565 ( 1.876 -1.009 -0.069) 2.131 4.609 ( -1.790 -5.266 -1.633) 5.797 4.644 ( -3.837 0.940 0.245) 3.958 4.665 ( 4.435 -1.396 -5.198) 6.974 4.701 ( 3.542 1.940 -0.974) 4.155 4.849 ( -1.246 -2.792 7.798) 8.376 4.882 ( -1.860 -2.820 -5.354) 6.331 4.901 ( -4.679 -6.006 4.741) 8.969 4.942 ( -0.230 -0.291 -0.503) 0.625 5.082 ( 3.281 0.338 -2.162) 3.943 5.132 ( 6.037 -3.943 -2.905) 7.774 5.297 ( -3.601 0.263 1.154) 3.790 5.339 ( -0.415 3.080 1.831) 3.607 5.500 ( 1.211 0.121 0.026) 1.217 5.509 ( 2.379 -4.810 -0.132) 5.368 5.631 ( -1.747 2.452 0.636) 3.078 5.694 ( 4.543 4.045 1.298) 6.220 5.785 ( -3.014 -3.171 3.938) 5.886 5.844 ( 1.310 -2.309 -2.664) 3.761 5.977 ( -4.739 -1.418 9.077) 10.337 5.993 ( -6.977 -0.403 0.403) 7.000 6.015 ( -2.838 -1.829 2.725) 4.339 6.074 ( 4.121 -1.821 -1.113) 4.641 6.115 ( 3.757 2.995 1.341) 4.989 6.187 ( 0.922 -1.064 0.446) 1.476 6.224 ( 1.843 -0.240 -0.983) 2.103 6.314 ( 7.486 -4.664 -3.094) 9.347 6.377 ( -8.327 -5.075 1.539) 9.872 6.476 ( 0.064 -1.978 2.359) 3.080 6.516 ( 1.114 -1.615 -1.942) 2.760 6.570 ( 6.937 -4.115 -3.450) 8.772 6.646 ( -0.224 0.692 -4.452) 4.511 6.656 ( 1.819 -0.360 -1.420) 2.336 6.712 ( -1.891 -0.569 0.798) 2.130 6.757 ( 2.518 -1.103 -1.175) 2.990 7.088 ( -6.523 1.624 0.334) 6.731 7.114 ( -3.360 3.647 4.178) 6.484 7.190 ( 1.144 2.551 0.009) 2.796 7.208 ( -0.025 -0.861 -1.736) 1.938 7.275 ( 2.809 0.341 1.745) 3.325 7.313 ( 2.930 3.266 -3.300) 5.490 7.449 ( -4.131 -2.536 0.781) 4.910 7.490 ( 3.167 -3.102 2.082) 4.898 7.892 ( 5.191 3.853 0.379) 6.476 7.919 ( 7.031 5.454 -1.356) 9.001 8.166 ( 4.093 -7.496 1.332) 8.644 8.186 ( 4.831 -6.044 -1.168) 7.825 8.959 ( -0.652 4.880 -1.417) 5.123 8.964 ( 1.100 4.569 0.240) 4.706 9.190 ( -1.046 -1.670 2.243) 2.986 9.213 ( 0.076 -2.091 -0.755) 2.224 9.421 ( -4.341 -0.284 -0.702) 4.407 9.466 ( -2.096 -3.468 1.022) 4.179 9.476 ( -0.111 -1.999 1.077) 2.273 9.489 ( 1.116 -2.109 -0.768) 2.507 9.600 ( -6.369 0.894 1.096) 6.524 9.635 ( -3.625 0.027 1.029) 3.768 9.652 ( -0.698 -0.548 0.068) 0.890 9.710 ( 4.159 -2.117 0.223) 4.672 9.776 ( 6.206 1.905 -0.349) 6.501 9.803 ( 8.688 0.884 -0.191) 8.735 9.913 ( 1.533 -3.238 0.688) 3.648 9.930 ( 1.766 -2.571 -2.023) 3.717 10.049 ( -4.623 3.464 -0.404) 5.791 10.142 ( 5.913 0.484 -1.538) 6.129 10.358 ( 0.387 -1.743 -0.300) 1.810 10.392 ( 4.963 -1.656 0.504) 5.256 10.618 ( -0.399 6.020 2.259) 6.442 10.668 ( 3.333 6.285 -1.795) 7.337 10.858 ( -1.189 -3.751 0.998) 4.060 10.896 ( 2.747 -3.181 -0.453) 4.228 11.761 ( -2.591 0.557 -0.254) 2.663 11.775 ( -0.650 0.909 0.417) 1.193 11.832 ( -4.077 -2.132 -0.202) 4.605 11.846 ( -2.432 -1.791 0.087) 3.021 12.104 ( -0.526 1.029 0.315) 1.198 12.116 ( 0.510 1.228 -0.385) 1.384 12.181 ( -0.098 3.053 0.924) 3.192 12.205 ( 1.688 2.606 -0.839) 3.216 12.367 ( 0.236 -2.308 1.648) 2.846 12.378 ( -0.938 -3.484 -1.571) 3.935 12.480 ( -1.560 -5.206 1.109) 5.547 12.504 ( -0.317 -5.083 -1.183) 5.228 12.755 ( -3.608 3.206 -0.611) 4.865 12.788 ( 1.058 3.351 0.401) 3.537 12.862 ( 0.270 -2.424 -1.208) 2.722 12.889 ( 4.317 -2.183 0.869) 4.915 13.500 ( -5.207 8.352 -0.466) 9.853 13.511 ( -4.486 8.091 0.217) 9.254 13.645 ( 3.331 5.184 0.459) 6.179 13.661 ( 4.087 4.790 -0.359) 6.307 14.227 ( -2.274 0.652 1.733) 2.933 14.228 ( -4.135 1.249 -1.579) 4.599 14.321 ( -0.150 2.662 -0.310) 2.684 14.328 ( -0.229 1.610 0.101) 1.629 14.456 ( -6.984 3.822 1.401) 8.084 14.558 ( -4.010 1.362 -2.379) 4.857 14.607 ( 5.793 2.755 -0.760) 6.460 14.683 ( 8.911 -0.427 1.566) 9.057 15.195 ( -6.362 -3.383 -0.481) 7.222 15.269 ( -0.021 -3.534 -0.644) 3.592 15.304 ( 1.685 -6.046 1.015) 6.358 15.368 ( 6.137 -4.973 -0.072) 7.899 15.533 ( -4.477 -0.090 -0.035) 4.479 15.575 ( -0.286 -2.228 -0.587) 2.322 15.631 ( -3.669 1.032 0.049) 3.812 15.675 ( 0.987 -0.549 0.023) 1.130 16.026 ( -4.688 1.231 -0.886) 4.927 16.054 ( -0.033 0.658 0.164) 0.679 16.136 ( -5.079 0.417 -0.021) 5.097 16.207 ( 3.767 -1.892 0.318) 4.228 16.634 ( -1.909 0.979 -0.701) 2.257 16.656 ( -1.262 -0.278 1.508) 1.986 16.683 ( 4.184 0.052 1.736) 4.530 16.718 ( 1.876 -1.411 -1.458) 2.763 17.327 ( -0.609 0.418 0.670) 0.997 17.334 ( -0.471 0.082 -0.785) 0.919 17.408 ( -1.054 0.305 0.399) 1.167 17.430 ( 0.921 -0.574 -0.801) 1.349 19.965 ( -6.399 1.432 -0.770) 6.602 20.031 ( 0.989 -0.895 -0.604) 1.464 20.175 ( -1.248 -0.044 -0.715) 1.439 20.218 ( 3.594 -1.529 0.696) 3.967 20.385 ( -2.549 1.240 3.549) 4.542 20.423 ( 0.364 -0.319 1.005) 1.116 20.719 ( 1.606 0.205 0.898) 1.852 20.741 ( 2.411 -0.673 -1.701) 3.027 22.267 ( -5.733 3.247 0.085) 6.589 22.294 ( -3.613 3.114 -0.439) 4.790 22.433 ( -7.731 -3.709 -0.412) 8.584 22.462 ( -5.800 -3.632 -0.116) 6.844 22.684 ( 6.241 0.916 -0.607) 6.337 22.706 ( 8.244 0.956 0.316) 8.305 22.885 ( 3.842 -1.368 1.087) 4.221 22.902 ( 5.159 -2.322 -0.216) 5.662 27.412 ( -18.246 4.853 -0.434) 18.885 27.545 ( -4.849 7.581 0.566) 9.017 27.654 ( -24.982 -5.196 -0.997) 25.536 27.951 ( 11.241 -8.507 1.927) 14.229 28.142 ( 9.558 6.176 -0.042) 11.379 28.227 ( 16.732 5.876 -0.074) 17.734 28.550 ( -1.766 -11.802 -0.879) 11.966 28.669 ( 13.201 -11.135 2.173) 17.406 30.527 ( -6.504 4.012 -0.950) 7.700 30.565 ( -0.361 3.323 1.228) 3.561 30.718 ( -3.860 1.195 -0.137) 4.043 30.757 ( 1.143 -0.196 0.165) 1.172 31.132 ( -9.405 2.616 -1.278) 9.845 31.180 ( -7.195 2.210 1.382) 7.652 31.262 ( 7.259 -2.166 1.144) 7.661 31.299 ( 6.008 -1.268 -0.382) 6.152 31.498 ( -3.873 -1.639 -0.362) 4.221 31.579 ( 6.072 -3.990 -0.438) 7.279 31.751 ( -1.316 0.663 1.361) 2.006 31.810 ( 4.737 -0.937 -0.183) 4.832 32.166 ( -7.776 11.626 2.563) 14.220 32.297 ( 7.748 11.968 3.052) 14.580 32.647 ( -13.607 -3.549 1.505) 14.143 32.857 ( 13.231 -6.200 4.115) 15.180 32.983 ( -5.143 -0.015 -1.144) 5.269 33.005 ( -2.291 -0.911 0.672) 2.556 33.356 ( -2.104 -0.131 -0.921) 2.300 33.361 ( -2.676 -0.434 -1.986) 3.360 33.577 ( -7.661 1.460 -0.054) 7.799 33.668 ( 4.159 -2.358 3.042) 5.667 33.796 ( 7.312 -0.160 0.976) 7.379 33.800 ( 8.911 -0.241 1.037) 8.974 34.981 ( -0.612 0.537 5.495) 5.555 35.014 ( -0.119 -0.913 4.662) 4.752 35.043 ( -0.039 0.366 -6.332) 6.342 35.063 ( -0.873 -0.447 -6.372) 6.447 35.776 ( -1.464 1.959 1.181) 2.715 35.823 ( 2.346 2.084 -1.464) 3.463 35.878 ( -0.890 -1.027 0.628) 1.497 35.917 ( -0.677 -1.082 -5.586) 5.730 36.000 ( -4.154 0.559 -4.317) 6.017 36.029 ( 2.611 -1.587 3.987) 5.023 36.041 ( -3.166 -0.933 -5.268) 6.216 36.071 ( 4.067 -1.055 -1.942) 4.629 37.363 ( -19.260 5.766 0.992) 20.129 37.611 ( 0.406 -1.932 1.781) 2.659 37.758 ( -0.587 2.667 1.596) 3.163 38.028 ( 19.634 -5.965 -1.579) 20.581 ======================= Grid point 105 (58/69) ======================= q-point: (-0.33 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( -22.801 7.560 5.562) 24.657 1.749 ( -19.672 22.366 0.838) 29.798 1.975 ( -11.353 -10.516 1.567) 15.554 2.177 ( -9.213 0.650 5.279) 10.638 2.281 ( -4.915 -4.707 6.344) 9.304 2.341 ( -6.073 -0.150 5.840) 8.426 2.398 ( 3.451 -0.537 1.418) 3.769 2.423 ( -1.854 -1.310 4.884) 5.386 2.599 ( -3.906 7.217 5.307) 9.773 2.663 ( -9.714 -2.556 -2.820) 10.433 2.701 ( -16.280 1.726 -4.564) 16.995 2.726 ( -0.948 5.301 -4.141) 6.794 2.877 ( 0.601 -2.257 2.089) 3.134 2.978 ( 0.992 3.651 2.102) 4.328 3.055 ( -5.139 1.507 -3.392) 6.339 3.080 ( -4.357 -6.649 2.165) 8.239 3.097 ( 5.793 8.099 -1.442) 10.061 3.160 ( 1.237 -6.484 1.654) 6.805 3.357 ( -2.751 -1.125 -1.432) 3.299 3.408 ( -5.537 9.103 -3.657) 11.265 3.498 ( 1.420 0.775 0.132) 1.623 3.603 ( -1.691 -1.405 -3.068) 3.774 3.636 ( -0.525 0.323 7.306) 7.332 3.657 ( -4.418 0.099 0.539) 4.451 3.699 ( 8.901 -5.801 -4.579) 11.569 3.915 ( 5.379 -0.730 2.320) 5.903 3.959 ( -6.392 -6.563 3.198) 9.704 3.987 ( -3.141 -0.996 1.933) 3.820 4.059 ( -12.176 3.190 2.740) 12.881 4.147 ( 1.678 8.086 4.886) 9.596 4.289 ( -3.694 8.767 -0.774) 9.545 4.396 ( -1.835 2.845 -1.838) 3.852 4.456 ( -3.537 2.528 -1.752) 4.687 4.548 ( -2.055 -0.586 -4.171) 4.686 4.591 ( -5.689 -3.352 -0.374) 6.613 4.625 ( 4.460 2.936 1.932) 5.678 4.685 ( 4.680 -1.115 -2.099) 5.249 4.728 ( 1.273 3.669 -0.576) 3.926 4.777 ( -9.118 -1.626 2.775) 9.668 4.819 ( -3.045 -3.049 -1.156) 4.462 4.876 ( -2.370 -5.372 -3.199) 6.687 5.078 ( 7.255 -3.227 5.468) 9.641 5.115 ( 4.776 -0.662 2.216) 5.307 5.202 ( 2.630 -1.306 -0.864) 3.061 5.267 ( -2.019 3.475 -0.066) 4.020 5.343 ( 1.709 -0.209 -1.124) 2.056 5.440 ( -0.289 1.180 -4.934) 5.081 5.593 ( 3.885 -4.025 -2.670) 6.199 5.646 ( -0.119 0.403 1.731) 1.781 5.697 ( -5.203 -2.990 0.776) 6.051 5.771 ( 0.299 4.352 1.932) 4.771 5.837 ( -1.451 -2.744 -5.756) 6.539 5.900 ( 1.446 -0.969 -2.124) 2.746 5.993 ( -1.671 0.052 1.580) 2.301 6.023 ( -1.369 0.998 3.197) 3.618 6.091 ( 3.125 -4.560 -4.470) 7.109 6.158 ( -1.664 -0.420 -1.061) 2.018 6.208 ( 0.202 -0.499 -5.118) 5.146 6.229 ( 2.926 2.738 -0.076) 4.008 6.316 ( -1.621 -0.601 2.897) 3.373 6.363 ( 4.705 -3.056 -4.569) 7.235 6.468 ( -3.549 -2.810 -1.822) 4.880 6.486 ( 2.926 -3.462 0.584) 4.571 6.584 ( 0.576 -2.253 2.026) 3.084 6.665 ( -0.254 3.041 2.037) 3.669 6.716 ( 1.379 -1.713 2.258) 3.152 6.747 ( 5.808 0.239 1.435) 5.987 6.827 ( 5.461 -2.058 1.098) 5.939 7.033 ( -3.370 2.714 4.129) 5.981 7.116 ( -1.512 4.552 3.098) 5.710 7.177 ( 0.391 -1.291 0.251) 1.372 7.209 ( 2.100 0.313 -2.532) 3.304 7.293 ( -0.785 1.517 -2.286) 2.854 7.299 ( 0.644 -1.444 -2.201) 2.710 7.434 ( -0.106 1.468 1.589) 2.166 7.554 ( 2.660 -3.190 0.660) 4.205 7.993 ( 13.107 4.962 -4.553) 14.736 8.096 ( 14.639 2.668 0.245) 14.882 8.251 ( 11.941 -5.121 -3.458) 13.445 8.340 ( 11.365 -8.175 1.390) 14.068 8.933 ( -1.196 4.990 -0.552) 5.161 8.991 ( 1.659 2.854 0.380) 3.323 9.195 ( -0.385 -1.695 0.644) 1.853 9.210 ( -0.857 -1.629 0.837) 2.022 9.337 ( -3.178 2.289 -2.436) 4.612 9.413 ( -5.657 -2.379 0.501) 6.157 9.431 ( -2.783 -2.909 0.116) 4.027 9.498 ( -1.139 -2.464 -1.467) 3.086 9.525 ( -5.448 -0.579 0.829) 5.541 9.571 ( -4.714 0.364 1.094) 4.853 9.660 ( 0.840 -1.891 -0.443) 2.116 9.765 ( -1.856 -4.086 1.302) 4.672 9.881 ( 2.411 3.863 -2.580) 5.233 9.921 ( 9.051 0.344 0.939) 9.106 9.959 ( 7.449 -1.573 -0.464) 7.627 10.002 ( 8.301 -0.820 2.246) 8.638 10.065 ( 7.196 2.684 0.557) 7.700 10.239 ( 8.667 -2.314 0.107) 8.972 10.406 ( 5.471 1.803 -0.310) 5.769 10.503 ( 7.717 -1.956 0.581) 7.983 10.650 ( 2.690 5.089 0.220) 5.761 10.722 ( 5.391 4.198 -1.323) 6.960 10.865 ( 1.557 -3.441 0.694) 3.840 10.940 ( 4.176 -3.306 -1.201) 5.460 11.685 ( -6.487 -1.815 -0.496) 6.754 11.729 ( -8.796 -2.213 -0.316) 9.076 11.742 ( -5.712 0.422 0.389) 5.740 11.769 ( -6.123 0.444 0.777) 6.188 12.071 ( -2.082 1.759 -0.307) 2.743 12.150 ( 1.039 1.398 1.469) 2.279 12.212 ( 2.538 3.448 1.309) 4.477 12.222 ( 1.452 2.094 -1.000) 2.737 12.349 ( -0.804 -2.987 -0.415) 3.121 12.398 ( 0.758 -2.154 1.750) 2.877 12.443 ( -1.879 -3.028 -1.132) 3.739 12.491 ( -0.586 -4.829 -0.881) 4.944 12.698 ( -3.092 4.453 0.705) 5.467 12.786 ( -0.979 4.680 -0.431) 4.800 12.885 ( 2.510 -3.755 -0.011) 4.517 12.951 ( 2.428 -2.987 -0.045) 3.849 13.401 ( -5.818 9.069 -0.724) 10.799 13.426 ( -6.133 8.850 0.631) 10.786 13.703 ( 2.003 -1.074 0.699) 2.378 13.723 ( 3.241 -1.246 -0.356) 3.490 14.115 ( -7.263 5.585 -1.010) 9.217 14.192 ( -4.060 -1.648 1.101) 4.518 14.276 ( -4.344 -2.751 -0.013) 5.142 14.303 ( -1.033 -0.621 -0.547) 1.324 14.396 ( -3.597 8.602 1.300) 9.414 14.538 ( 3.925 10.467 -0.391) 11.186 14.700 ( 5.473 2.039 -0.451) 5.858 14.803 ( 3.739 -1.429 0.328) 4.016 15.102 ( -6.214 0.186 0.988) 6.295 15.211 ( -3.665 1.952 -1.654) 4.470 15.368 ( -0.477 -6.950 2.066) 7.267 15.401 ( -4.567 -3.445 -0.521) 5.744 15.497 ( -0.425 -1.653 0.828) 1.897 15.527 ( 0.095 -5.501 -0.359) 5.514 15.603 ( -0.270 -0.186 0.164) 0.367 15.652 ( -3.504 -0.983 -0.370) 3.658 15.914 ( -7.264 1.181 -0.508) 7.377 15.980 ( -8.004 -1.505 -1.042) 8.211 16.114 ( 2.373 2.680 0.106) 3.581 16.229 ( 0.063 -1.701 -2.433) 2.969 16.610 ( -0.888 0.812 -0.965) 1.542 16.635 ( -1.982 0.542 0.657) 2.157 16.720 ( -0.286 -0.635 -0.535) 0.878 16.800 ( 7.210 -2.882 0.294) 7.770 17.323 ( -0.496 0.269 0.179) 0.592 17.326 ( -0.884 0.271 0.965) 1.336 17.387 ( -1.405 0.664 -0.189) 1.565 17.424 ( -0.017 -0.903 -1.249) 1.542 19.857 ( -6.133 2.044 -0.150) 6.467 19.991 ( -3.017 -3.366 -1.223) 4.683 20.143 ( -3.278 2.088 -0.992) 4.011 20.234 ( -2.610 -1.793 -0.272) 3.178 20.425 ( 2.696 1.123 3.467) 4.533 20.460 ( 3.589 -0.177 0.175) 3.598 20.761 ( 2.830 -0.408 -0.264) 2.871 20.764 ( 3.323 -0.436 -2.412) 4.129 22.141 ( -9.325 2.900 -0.164) 9.767 22.168 ( -9.789 2.580 -0.791) 10.155 22.318 ( -6.679 -1.762 0.490) 6.924 22.335 ( -8.373 -1.818 0.123) 8.569 22.803 ( 9.937 0.488 -1.870) 10.123 22.867 ( 9.773 0.023 1.205) 9.847 23.001 ( 8.707 -3.414 0.379) 9.360 23.022 ( 9.138 -2.455 0.819) 9.497 27.103 ( -19.996 2.991 0.463) 20.224 27.258 ( -24.485 -2.929 0.414) 24.663 27.323 ( -20.398 7.869 -0.656) 21.873 27.959 ( -11.400 -21.915 -3.140) 24.901 28.420 ( 22.018 5.626 0.322) 22.728 28.511 ( 19.310 6.938 -1.322) 20.561 28.666 ( 18.029 -6.219 -1.240) 19.112 28.904 ( 16.209 -9.276 -0.627) 18.686 30.381 ( -11.419 5.920 0.011) 12.863 30.539 ( -4.913 4.313 2.221) 6.904 30.639 ( -5.787 1.414 -0.702) 5.999 30.754 ( -1.280 -1.599 0.208) 2.059 30.979 ( -7.813 6.074 -1.518) 10.012 31.092 ( -6.419 2.674 1.589) 7.133 31.309 ( -0.124 -7.742 -1.732) 7.935 31.316 ( -7.239 -4.869 0.743) 8.756 31.515 ( 7.042 2.096 0.139) 7.349 31.676 ( 8.868 -2.190 -1.571) 9.269 31.781 ( 4.145 0.345 -0.128) 4.161 31.867 ( 3.023 -1.172 -1.033) 3.403 32.079 ( -3.219 9.849 -0.515) 10.374 32.368 ( -0.847 2.347 -3.957) 4.678 32.476 ( -1.556 10.776 -9.040) 14.152 32.841 ( -7.334 -2.356 -1.957) 7.948 32.957 ( -7.291 1.657 4.282) 8.616 33.069 ( 1.361 -2.688 3.302) 4.470 33.247 ( -8.289 -0.221 -2.039) 8.539 33.270 ( -1.872 -0.517 -3.801) 4.269 33.528 ( 2.670 4.815 -0.235) 5.511 33.811 ( 12.978 -6.234 -4.264) 15.016 33.934 ( 9.947 0.675 -2.143) 10.197 33.966 ( 10.835 -0.805 -1.521) 10.971 34.949 ( -1.783 0.321 -6.311) 6.566 34.967 ( -2.157 -0.438 -5.568) 5.988 35.021 ( -1.982 0.700 5.024) 5.446 35.059 ( -1.846 -0.877 5.431) 5.803 35.723 ( -3.177 2.451 -3.372) 5.241 35.787 ( -1.417 1.676 -5.532) 5.951 35.805 ( -4.141 -0.459 -1.856) 4.561 35.897 ( -3.652 -1.867 3.328) 5.282 35.909 ( -1.690 -0.251 -2.271) 2.842 35.950 ( -3.671 -3.145 -0.839) 4.906 36.156 ( 3.511 1.938 10.938) 11.650 36.229 ( 6.620 -1.555 12.578) 14.299 37.089 ( -17.843 6.532 3.314) 19.288 37.460 ( -14.145 -9.929 8.680) 19.339 37.973 ( 16.909 8.855 -2.018) 19.194 38.318 ( 20.078 -6.315 -2.851) 21.240 ======================= Grid point 106 (59/69) ======================= q-point: (-0.22 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( -17.052 8.718 17.790) 26.139 1.476 ( -21.257 23.315 11.168) 33.469 1.886 ( -7.977 -9.820 8.811) 15.417 2.037 ( -8.788 -3.014 2.077) 9.519 2.044 ( -31.017 13.498 5.308) 34.241 2.263 ( -17.448 -0.681 7.838) 19.140 2.358 ( -5.464 -2.212 3.914) 7.076 2.452 ( 1.821 1.649 0.934) 2.629 2.595 ( -1.530 -7.945 2.939) 8.609 2.605 ( 2.267 3.892 4.010) 6.031 2.693 ( 2.557 1.682 5.526) 6.317 2.752 ( 4.050 4.262 2.585) 6.422 2.896 ( -1.937 -0.602 3.950) 4.440 2.916 ( -2.141 4.720 -0.502) 5.207 3.040 ( 1.491 -1.613 -2.582) 3.390 3.081 ( 2.012 -2.837 -2.083) 4.054 3.124 ( -6.980 1.355 -1.235) 7.217 3.188 ( 1.720 -0.279 1.351) 2.205 3.257 ( 7.616 -0.610 2.777) 8.129 3.342 ( -7.850 1.252 -2.580) 8.357 3.531 ( -0.002 1.414 -3.271) 3.564 3.587 ( -0.703 -10.564 -2.893) 10.976 3.626 ( 6.000 4.830 4.170) 8.759 3.646 ( -3.083 4.238 2.497) 5.805 3.738 ( 2.149 2.653 -5.029) 6.078 3.871 ( -9.183 3.571 5.331) 11.203 3.919 ( -3.416 -0.626 -0.766) 3.556 3.995 ( -2.246 -0.880 7.398) 7.782 4.064 ( -0.572 -0.958 3.180) 3.370 4.085 ( -9.850 2.152 -3.280) 10.603 4.171 ( -5.685 5.853 1.260) 8.256 4.319 ( -5.984 1.226 -2.770) 6.706 4.390 ( -6.261 -2.218 -3.678) 7.592 4.470 ( -1.547 1.517 1.805) 2.820 4.560 ( -3.820 0.656 3.307) 5.095 4.610 ( -7.063 -3.124 1.768) 7.923 4.673 ( -3.069 -5.963 -2.443) 7.137 4.702 ( -3.267 -1.477 -0.622) 3.639 4.761 ( 7.285 -4.586 -5.358) 10.140 4.809 ( -0.635 -0.431 -1.416) 1.610 4.842 ( 4.638 3.654 2.132) 6.277 5.110 ( -1.635 -3.308 1.131) 3.860 5.179 ( -2.891 -1.174 -0.513) 3.162 5.223 ( 1.034 0.145 -3.572) 3.721 5.304 ( 5.798 -0.982 -1.587) 6.091 5.344 ( 0.571 -0.816 -1.671) 1.945 5.393 ( 0.458 2.441 -4.550) 5.184 5.530 ( -6.417 3.377 -6.536) 9.762 5.552 ( 1.185 2.435 -4.891) 5.591 5.735 ( 1.686 2.330 1.005) 3.046 5.779 ( 0.465 3.075 -0.593) 3.166 5.810 ( 2.327 -0.979 -1.170) 2.783 5.871 ( -3.124 -1.355 -2.130) 4.016 5.933 ( -3.643 -1.954 -3.246) 5.256 6.006 ( -3.074 -0.313 -2.239) 3.815 6.054 ( -3.217 -4.597 -3.947) 6.860 6.100 ( 3.048 -4.594 -6.793) 8.749 6.155 ( 2.535 -0.434 -1.956) 3.231 6.246 ( 1.558 1.655 -2.528) 3.399 6.348 ( 1.800 -3.702 0.914) 4.217 6.372 ( -3.511 0.240 -3.463) 4.937 6.473 ( 6.592 -2.712 5.626) 9.081 6.593 ( 3.985 -0.913 5.552) 6.895 6.647 ( -3.635 -0.407 5.821) 6.875 6.688 ( 3.982 1.052 1.693) 4.453 6.728 ( 0.172 0.293 1.806) 1.837 6.831 ( 4.541 -0.496 -2.465) 5.191 6.939 ( 5.224 -2.817 3.625) 6.955 7.036 ( -1.499 2.278 1.216) 2.986 7.136 ( -0.487 4.740 3.352) 5.825 7.200 ( 0.887 -2.431 0.875) 2.732 7.238 ( -0.614 0.012 0.660) 0.902 7.273 ( 6.502 1.057 0.192) 6.590 7.361 ( 9.129 -0.430 1.610) 9.280 7.454 ( 0.805 0.550 1.355) 1.669 7.592 ( 1.390 -3.776 1.183) 4.195 8.199 ( 17.758 5.685 -2.543) 18.818 8.352 ( 18.100 1.526 -0.816) 18.182 8.457 ( 17.235 -4.324 -1.653) 17.846 8.544 ( 13.205 -7.489 0.483) 15.189 8.908 ( -1.252 4.682 -0.208) 4.851 9.014 ( 1.274 0.968 -0.640) 1.723 9.188 ( -1.277 -0.825 -0.996) 1.817 9.199 ( -1.226 -2.415 0.339) 2.729 9.276 ( -3.186 1.309 -1.023) 3.593 9.327 ( -4.708 -2.014 -0.175) 5.124 9.383 ( -3.144 -1.658 -1.380) 3.813 9.440 ( -4.660 -3.326 -0.584) 5.755 9.448 ( -3.698 -0.163 -0.153) 3.705 9.525 ( -2.894 1.412 1.063) 3.391 9.648 ( -2.098 -3.868 -1.435) 4.628 9.690 ( -5.362 -2.594 -0.315) 5.965 9.894 ( -1.228 2.791 3.657) 4.761 10.023 ( 3.970 -4.400 0.413) 5.940 10.129 ( 11.249 1.399 1.691) 11.461 10.183 ( 12.530 1.716 -0.606) 12.661 10.236 ( 11.148 3.811 1.473) 11.873 10.415 ( 11.811 -1.025 1.184) 11.914 10.497 ( 8.123 1.846 -2.448) 8.682 10.619 ( 6.511 -2.593 -0.651) 7.039 10.704 ( 5.112 4.392 -0.974) 6.810 10.795 ( 6.410 1.223 -2.146) 6.869 10.925 ( 3.935 -1.260 1.313) 4.336 11.012 ( 7.028 -3.518 -0.966) 7.918 11.549 ( -11.975 -0.851 -0.618) 12.021 11.555 ( -11.079 -2.213 0.055) 11.298 11.625 ( -8.020 -1.885 0.047) 8.239 11.682 ( -6.663 -2.297 0.559) 7.070 12.042 ( -2.695 3.233 1.678) 4.532 12.149 ( -1.580 3.313 -1.191) 3.859 12.242 ( 1.797 -0.888 0.687) 2.119 12.287 ( 5.356 3.762 0.820) 6.596 12.345 ( 0.216 -0.856 0.413) 0.975 12.398 ( -2.338 -2.712 -0.211) 3.587 12.430 ( 1.287 0.329 -0.336) 1.370 12.472 ( 0.858 -0.883 -1.795) 2.177 12.675 ( -2.360 4.715 1.862) 5.591 12.752 ( -2.123 6.234 -1.002) 6.662 12.923 ( 1.659 -4.885 0.695) 5.205 12.959 ( -0.680 -2.638 -0.469) 2.764 13.319 ( -3.450 6.393 -0.660) 7.295 13.346 ( -4.928 6.950 0.564) 8.539 13.668 ( -8.383 -7.144 0.602) 11.030 13.722 ( -4.025 -10.567 -1.085) 11.360 14.054 ( 2.015 12.303 -0.428) 12.474 14.143 ( -0.592 2.560 -0.369) 2.653 14.254 ( -0.553 -0.667 1.213) 1.491 14.305 ( 3.376 -2.497 -0.919) 4.298 14.369 ( -2.359 7.703 1.991) 8.299 14.589 ( 1.831 11.063 -0.907) 11.251 14.750 ( 0.115 1.158 -0.660) 1.338 14.795 ( -3.609 -1.193 0.197) 3.806 14.994 ( -10.011 3.315 1.041) 10.597 15.107 ( -6.615 5.530 -2.697) 9.034 15.270 ( -10.149 -4.177 -0.446) 10.984 15.306 ( -9.123 -2.989 0.694) 9.625 15.443 ( -5.422 -0.646 -0.502) 5.483 15.556 ( -7.013 -0.202 -1.242) 7.125 15.617 ( 6.534 -1.812 0.440) 6.795 15.638 ( 4.494 -1.822 -0.479) 4.873 15.833 ( -3.576 -0.364 0.528) 3.633 15.871 ( -2.451 -3.258 0.715) 4.139 16.137 ( -4.548 1.173 -6.237) 7.808 16.171 ( 4.970 -1.160 -3.154) 6.000 16.580 ( -2.034 0.506 0.196) 2.105 16.601 ( -3.024 0.733 -0.399) 3.136 16.698 ( -2.175 0.642 -0.032) 2.268 16.845 ( -0.267 -4.011 -5.064) 6.466 17.320 ( -0.740 0.399 1.009) 1.314 17.322 ( 0.083 0.237 -0.138) 0.286 17.371 ( -0.762 0.571 0.408) 1.036 17.402 ( -0.881 -0.893 -1.330) 1.828 19.785 ( -3.488 1.494 0.911) 3.903 19.928 ( -2.424 -3.003 -2.940) 4.851 20.067 ( -4.113 0.497 -0.492) 4.172 20.142 ( -6.046 -1.846 -2.460) 6.783 20.514 ( 3.568 0.733 1.867) 4.093 20.523 ( 3.686 0.574 0.636) 3.784 20.787 ( 3.022 -0.232 -2.252) 3.776 20.788 ( 1.451 -0.374 -0.851) 1.723 22.014 ( -7.398 1.941 0.820) 7.692 22.034 ( -5.803 1.946 1.196) 6.236 22.219 ( -6.828 -0.671 0.211) 6.864 22.230 ( -5.382 -1.170 0.227) 5.512 22.938 ( 10.177 0.028 -2.716) 10.533 23.010 ( 6.953 -2.911 0.191) 7.540 23.150 ( 9.883 -2.147 1.032) 10.166 23.188 ( 9.658 -1.816 2.084) 10.046 26.826 ( -16.423 1.698 0.876) 16.534 26.915 ( -20.553 -1.362 1.025) 20.624 26.975 ( -21.505 5.053 -1.253) 22.127 27.526 ( -30.003 -25.354 -15.217) 42.125 28.766 ( 21.281 6.004 -0.489) 22.117 28.808 ( 20.555 6.528 -0.131) 21.567 28.964 ( 17.462 -3.523 1.597) 17.885 29.156 ( 17.481 -7.653 -1.532) 19.144 30.184 ( -14.691 8.059 1.398) 16.815 30.489 ( -4.286 6.194 2.506) 7.939 30.516 ( -7.888 4.612 -2.455) 9.461 30.737 ( -1.130 -1.619 0.380) 2.011 30.863 ( -5.175 6.036 -1.310) 8.058 31.007 ( -6.153 3.374 -0.165) 7.019 31.173 ( -8.928 -5.095 -1.299) 10.361 31.233 ( -5.561 -9.780 -3.315) 11.728 31.600 ( 1.810 3.034 0.356) 3.551 31.797 ( 3.904 -5.278 1.447) 6.723 31.875 ( 8.647 3.462 -1.400) 9.419 31.913 ( 8.270 1.601 -0.990) 8.481 32.083 ( 3.953 5.621 -0.346) 6.881 32.252 ( -3.665 22.697 -26.040) 34.737 32.303 ( -0.210 -3.687 -2.059) 4.228 32.689 ( -7.985 -2.769 -3.878) 9.299 32.853 ( -11.280 4.418 2.252) 12.322 32.947 ( -14.085 -0.616 0.489) 14.107 33.050 ( -10.542 3.130 -5.876) 12.469 33.303 ( 8.942 -4.230 -10.335) 14.306 33.601 ( 4.809 4.053 0.598) 6.317 33.870 ( 9.600 -6.358 -18.295) 21.617 34.025 ( 7.593 1.197 -6.341) 9.964 34.078 ( 7.818 -1.192 -4.746) 9.223 34.891 ( 0.629 0.376 -0.245) 0.772 34.907 ( -0.589 -0.304 0.842) 1.071 35.040 ( -2.766 0.944 5.005) 5.796 35.086 ( -2.658 -0.922 5.758) 6.409 35.636 ( -2.646 2.035 -3.248) 4.657 35.683 ( -4.742 2.606 -2.548) 5.980 35.729 ( -4.059 -1.678 -0.437) 4.414 35.809 ( -5.145 -1.908 -2.490) 6.026 35.916 ( -3.195 -0.173 8.050) 8.663 35.953 ( -1.055 -3.039 6.200) 6.985 36.371 ( 5.408 2.676 10.835) 12.402 36.458 ( 5.440 -1.600 4.640) 7.327 36.943 ( -11.705 8.809 15.386) 21.245 37.544 ( 2.371 -19.216 27.117) 33.320 38.174 ( 14.695 10.420 -5.327) 18.785 38.564 ( 17.020 -7.272 -5.123) 19.205 ======================= Grid point 107 (60/69) ======================= q-point: (-0.11 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.133 ( -24.871 17.263 13.907) 33.316 1.485 ( -10.228 32.611 15.522) 37.537 1.772 ( -5.821 9.057 25.163) 27.369 1.814 ( -14.299 1.493 -11.187) 18.216 2.034 ( -0.957 -4.469 2.926) 5.427 2.149 ( -0.224 -4.420 9.795) 10.749 2.296 ( -3.756 -8.986 1.307) 9.827 2.485 ( -2.373 -2.339 3.423) 4.777 2.588 ( -0.300 -2.909 3.027) 4.209 2.696 ( 0.085 -2.423 9.963) 10.254 2.786 ( -3.788 -3.918 3.334) 6.388 2.822 ( 3.800 3.815 1.476) 5.583 2.908 ( -1.045 0.615 1.975) 2.318 2.968 ( 0.566 3.098 2.865) 4.257 3.019 ( 4.890 2.350 8.947) 10.464 3.098 ( -0.623 -7.557 -1.006) 7.650 3.156 ( 1.937 0.046 0.648) 2.043 3.202 ( -1.306 0.082 1.510) 1.998 3.250 ( 1.015 -2.897 1.754) 3.536 3.356 ( -0.521 -2.646 1.570) 3.121 3.473 ( -2.131 5.356 -4.415) 7.261 3.549 ( -1.703 -3.287 -0.466) 3.731 3.604 ( -3.767 -2.678 2.911) 5.462 3.697 ( 0.333 4.837 -3.515) 5.989 3.746 ( 0.306 9.428 -7.252) 11.898 3.770 ( -6.548 2.101 3.688) 7.803 3.852 ( -2.458 0.968 1.764) 3.177 3.941 ( -3.588 5.121 -2.465) 6.721 4.012 ( -3.353 6.970 1.551) 7.889 4.058 ( -4.339 0.846 -3.600) 5.701 4.087 ( -1.863 7.993 3.275) 8.836 4.209 ( -1.461 -1.742 0.436) 2.315 4.302 ( -5.415 0.969 -3.379) 6.456 4.387 ( -3.732 -5.750 -0.691) 6.890 4.516 ( -5.517 -6.912 -0.148) 8.845 4.559 ( -3.889 0.251 0.564) 3.937 4.584 ( -2.295 -6.607 -1.005) 7.067 4.687 ( -2.743 -2.045 6.045) 6.946 4.755 ( 2.029 -3.369 -6.235) 7.372 4.871 ( 6.005 -2.011 -1.500) 6.508 4.898 ( 3.504 4.081 -3.277) 6.298 5.092 ( 1.152 -6.352 -7.649) 10.009 5.156 ( 3.284 0.008 3.222) 4.601 5.190 ( -0.986 1.672 -2.881) 3.474 5.257 ( 1.142 -0.233 -5.976) 6.088 5.317 ( -2.382 2.786 -1.085) 3.823 5.337 ( -2.321 -0.805 -3.030) 3.900 5.426 ( -1.216 4.226 -2.875) 5.253 5.566 ( 1.172 7.132 -1.984) 7.495 5.604 ( -4.599 4.141 -9.106) 11.010 5.745 ( -6.746 1.704 -0.488) 6.975 5.829 ( 2.830 2.283 -1.168) 3.819 5.876 ( 4.118 -4.513 -0.424) 6.124 5.904 ( -2.429 1.385 0.522) 2.844 5.916 ( 0.388 -1.862 -0.621) 2.000 5.968 ( -3.155 -0.362 -5.600) 6.438 6.083 ( 0.809 -4.580 -2.883) 5.472 6.148 ( -0.478 5.745 -3.737) 6.870 6.229 ( 2.660 -5.444 -5.305) 8.053 6.286 ( -2.357 3.776 -1.917) 4.846 6.431 ( 3.054 -4.084 5.663) 7.621 6.545 ( -3.532 -5.129 -1.687) 6.452 6.594 ( -1.642 -2.330 4.268) 5.132 6.670 ( -4.052 -3.158 -0.125) 5.139 6.740 ( 3.296 1.170 1.323) 3.739 6.862 ( 2.680 2.266 -0.141) 3.513 6.897 ( 10.651 -1.717 4.764) 11.794 7.023 ( -0.070 -0.102 4.543) 4.545 7.089 ( 6.127 -2.317 0.702) 6.588 7.149 ( -3.078 1.562 3.006) 4.577 7.214 ( 1.195 -2.675 3.083) 4.253 7.311 ( 4.795 -3.564 1.314) 6.117 7.405 ( 6.793 0.503 2.159) 7.146 7.481 ( 2.054 0.369 0.248) 2.102 7.588 ( 9.436 -9.009 5.032) 13.983 7.643 ( 4.023 -9.317 3.569) 10.758 8.464 ( 17.120 6.059 0.795) 18.178 8.611 ( 16.637 1.250 -2.657) 16.895 8.690 ( 11.048 -2.001 0.196) 11.229 8.747 ( 12.104 -4.671 0.100) 12.975 8.913 ( 2.323 2.384 0.815) 3.427 9.022 ( 1.505 1.014 -1.059) 2.101 9.112 ( -4.740 -1.988 -2.477) 5.706 9.181 ( -2.026 -1.901 0.292) 2.794 9.211 ( -2.766 -0.381 -1.278) 3.071 9.251 ( -5.499 -3.555 -0.623) 6.577 9.305 ( -3.230 -2.306 -2.433) 4.655 9.350 ( -5.755 -3.176 -1.473) 6.736 9.416 ( -1.946 0.433 1.406) 2.440 9.498 ( -1.938 1.490 -0.040) 2.444 9.571 ( -5.218 -2.752 0.745) 5.946 9.625 ( -1.797 -2.044 -2.438) 3.654 9.932 ( -1.077 1.580 6.087) 6.381 10.071 ( 2.104 -5.189 -0.234) 5.604 10.295 ( 8.521 4.159 -0.398) 9.490 10.350 ( 8.154 5.636 -0.545) 9.927 10.397 ( 6.254 3.656 2.856) 7.787 10.543 ( 6.143 2.305 -3.679) 7.523 10.635 ( 10.139 -4.054 -0.865) 10.954 10.692 ( 5.739 -3.296 -1.447) 6.775 10.794 ( 6.212 3.853 0.095) 7.311 10.861 ( 4.790 1.663 -2.049) 5.468 10.995 ( 3.261 -0.127 0.702) 3.338 11.099 ( 3.682 -3.045 -1.339) 4.962 11.347 ( -11.450 1.142 -0.378) 11.513 11.371 ( -12.176 1.239 -0.082) 12.239 11.534 ( -3.165 -7.042 0.124) 7.721 11.593 ( -4.307 -6.920 -0.290) 8.156 12.020 ( -3.601 4.133 2.994) 6.246 12.099 ( -0.942 3.584 -3.149) 4.863 12.267 ( -1.429 -3.506 2.266) 4.412 12.341 ( -1.446 -2.365 -1.965) 3.398 12.380 ( 2.992 2.781 0.666) 4.139 12.389 ( 5.459 3.772 -0.533) 6.656 12.449 ( 1.509 3.413 -0.051) 3.732 12.481 ( 1.571 2.731 -0.286) 3.163 12.652 ( -2.727 5.991 1.181) 6.688 12.712 ( -0.653 8.039 -1.530) 8.209 12.933 ( -0.655 -3.654 -0.552) 3.753 12.949 ( -0.391 -4.408 1.199) 4.585 13.282 ( -1.210 3.235 -0.361) 3.472 13.290 ( -2.193 3.295 0.059) 3.958 13.508 ( -10.755 -4.829 -0.160) 11.790 13.545 ( -14.523 -8.740 -1.357) 17.005 14.125 ( 4.974 10.275 0.134) 11.416 14.201 ( 6.443 6.638 0.342) 9.257 14.254 ( 0.355 2.783 0.554) 2.860 14.360 ( -1.911 3.503 0.366) 4.007 14.401 ( 8.760 0.303 -0.551) 8.783 14.529 ( -4.316 7.874 -4.760) 10.163 14.660 ( -6.165 0.452 0.421) 6.196 14.759 ( -6.992 4.125 1.332) 8.227 14.859 ( -4.855 0.468 0.828) 4.947 14.945 ( -9.192 2.488 -2.760) 9.914 15.107 ( -10.280 -5.897 -0.487) 11.861 15.138 ( -10.139 -1.758 -1.138) 10.353 15.320 ( -6.025 15.080 -2.754) 16.471 15.387 ( -8.583 7.795 -3.591) 12.137 15.704 ( 3.919 -2.851 0.617) 4.885 15.744 ( 7.495 -0.023 0.685) 7.526 15.828 ( 0.986 -1.623 0.306) 1.923 15.888 ( -0.584 -4.095 1.939) 4.569 15.980 ( -3.055 1.061 -3.338) 4.648 16.199 ( 3.261 -4.587 -5.056) 7.566 16.544 ( -2.978 1.277 -0.181) 3.245 16.561 ( -1.217 -0.048 1.327) 1.802 16.655 ( -2.829 -0.522 -1.589) 3.286 16.689 ( -9.199 -1.091 -2.929) 9.716 17.326 ( 0.002 0.654 1.137) 1.311 17.330 ( 0.939 0.249 -0.095) 0.976 17.368 ( -0.746 0.181 0.862) 1.154 17.383 ( 0.087 -0.435 -0.579) 0.729 19.763 ( -1.778 0.423 1.408) 2.307 19.851 ( -1.760 -0.517 -3.960) 4.365 20.026 ( -1.199 -3.398 0.268) 3.613 20.050 ( -2.213 -2.849 -0.616) 3.660 20.567 ( 2.189 0.628 0.442) 2.320 20.576 ( 0.756 0.488 1.733) 1.953 20.795 ( 0.472 -0.063 -0.208) 0.519 20.806 ( 2.472 -0.210 -2.109) 3.256 21.945 ( -3.428 1.774 2.304) 4.495 22.009 ( -0.730 -0.838 0.915) 1.439 22.135 ( -3.813 -0.438 0.207) 3.844 22.161 ( -3.289 -1.353 -0.317) 3.570 23.040 ( 6.672 -0.840 -2.737) 7.261 23.076 ( 2.482 -3.803 -1.124) 4.678 23.318 ( 8.398 -0.215 1.474) 8.530 23.343 ( 6.743 -1.092 1.465) 6.986 26.625 ( -10.089 0.657 0.334) 10.116 26.653 ( -12.712 0.627 -0.393) 12.733 26.686 ( -14.084 0.496 0.822) 14.117 26.850 ( -30.181 -7.971 -8.630) 32.387 29.053 ( 15.166 4.187 0.756) 15.752 29.120 ( 18.221 4.961 0.174) 18.885 29.199 ( 8.805 -2.486 3.013) 9.632 29.380 ( 13.226 -5.673 -3.143) 14.731 29.976 ( -14.567 11.370 3.415) 18.792 30.327 ( -8.291 16.060 -10.088) 20.698 30.474 ( -2.246 2.842 4.118) 5.484 30.722 ( -0.894 -1.121 -1.188) 1.862 30.795 ( -2.632 2.445 0.614) 3.644 30.881 ( -5.651 1.653 -3.707) 6.958 31.056 ( -4.158 -3.967 -0.133) 5.748 31.105 ( -6.404 -4.495 -0.950) 7.882 31.587 ( -2.759 4.766 0.659) 5.547 31.826 ( -5.989 19.989 -15.425) 25.950 31.858 ( 0.188 1.327 3.390) 3.645 32.038 ( 9.593 2.649 0.738) 9.980 32.113 ( 12.842 0.053 -1.231) 12.901 32.171 ( 5.967 1.678 0.687) 6.237 32.311 ( 2.193 -3.431 -1.240) 4.257 32.517 ( -5.204 -3.380 -7.818) 9.981 32.696 ( -11.766 1.822 3.124) 12.309 32.729 ( -13.957 -0.242 0.938) 13.991 32.818 ( -9.017 3.215 -5.876) 11.233 33.179 ( 2.092 -8.725 -27.626) 29.046 33.677 ( 2.290 1.264 3.157) 4.100 33.773 ( 1.720 -2.818 -8.946) 9.536 34.032 ( 3.588 1.328 -7.117) 8.080 34.101 ( 3.901 -1.529 -7.108) 8.251 34.950 ( 3.854 0.304 1.840) 4.282 34.968 ( 3.513 -0.521 4.019) 5.363 35.048 ( -2.666 1.642 4.150) 5.199 35.107 ( -2.470 -0.903 4.687) 5.374 35.577 ( -0.963 1.783 -2.056) 2.887 35.600 ( -3.442 2.421 -0.834) 4.290 35.674 ( -2.172 -1.993 -0.472) 2.986 35.715 ( -3.917 -2.181 -1.183) 4.637 35.984 ( -1.401 0.360 10.276) 10.377 36.037 ( 0.050 -2.253 9.682) 9.940 36.436 ( -0.280 0.979 -5.650) 5.741 36.479 ( 0.992 -1.124 -6.082) 6.264 37.135 ( -1.197 13.313 32.063) 34.738 37.934 ( 7.534 -16.156 9.659) 20.275 38.369 ( 14.361 -2.238 3.289) 14.902 38.717 ( 10.836 -9.239 -6.639) 15.712 ======================= Grid point 108 (61/69) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( -5.253 -20.912 7.445) 22.811 1.489 ( -5.253 20.912 7.445) 22.811 1.857 ( 4.596 -12.635 -10.016) 16.766 1.857 ( 4.596 12.635 -10.016) 16.766 2.098 ( 1.783 -12.805 3.649) 13.433 2.098 ( 1.783 12.805 3.649) 13.433 2.473 ( -4.355 -6.077 5.662) 9.379 2.473 ( -4.355 6.077 5.662) 9.379 2.691 ( 3.656 -12.658 15.256) 20.157 2.691 ( 3.656 12.658 15.256) 20.157 2.762 ( 0.137 -0.084 6.983) 6.985 2.762 ( 0.137 0.084 6.983) 6.985 2.907 ( 0.637 -1.591 -1.468) 2.256 2.907 ( 0.637 1.591 -1.468) 2.256 3.151 ( -1.940 -2.995 1.216) 3.770 3.151 ( -1.940 2.995 1.216) 3.770 3.222 ( -0.239 -3.316 0.771) 3.413 3.222 ( -0.239 3.316 0.771) 3.413 3.291 ( 2.953 -2.681 3.766) 5.486 3.291 ( 2.953 2.681 3.766) 5.486 3.507 ( -2.203 -5.792 -0.867) 6.257 3.507 ( -2.203 5.792 -0.867) 6.257 3.565 ( -2.548 -1.757 2.573) 4.025 3.565 ( -2.548 1.757 2.573) 4.025 3.730 ( 1.665 -5.221 -3.428) 6.464 3.730 ( 1.665 5.221 -3.428) 6.464 3.854 ( -1.816 -4.177 -15.083) 15.756 3.854 ( -1.816 4.177 -15.083) 15.756 4.113 ( 2.647 -7.780 2.889) 8.711 4.113 ( 2.647 7.780 2.889) 8.711 4.179 ( -3.690 -6.414 2.395) 7.778 4.179 ( -3.690 6.414 2.395) 7.778 4.297 ( -0.673 -11.565 0.486) 11.595 4.297 ( -0.673 11.565 0.486) 11.595 4.370 ( -1.285 -10.406 -2.252) 10.724 4.370 ( -1.285 10.406 -2.252) 10.724 4.623 ( 0.920 -6.193 -0.455) 6.277 4.623 ( 0.920 6.193 -0.455) 6.277 4.790 ( 0.920 -4.227 2.771) 5.137 4.790 ( 0.920 4.227 2.771) 5.137 5.066 ( 5.576 -6.100 3.446) 8.954 5.066 ( 5.576 6.100 3.446) 8.954 5.176 ( -2.825 -3.967 -2.804) 5.620 5.176 ( -2.825 3.967 -2.804) 5.620 5.236 ( 1.536 -1.563 -4.945) 5.409 5.236 ( 1.536 1.563 -4.945) 5.409 5.429 ( -1.060 -7.349 -2.491) 7.832 5.429 ( -1.060 7.349 -2.491) 7.832 5.474 ( -1.643 -3.852 -3.977) 5.775 5.474 ( -1.643 3.852 -3.977) 5.775 5.745 ( 0.165 -4.704 2.387) 5.277 5.745 ( 0.165 4.704 2.387) 5.277 5.894 ( -1.246 -0.613 -3.663) 3.918 5.894 ( -1.246 0.613 -3.663) 3.918 5.936 ( 1.006 -1.420 -2.235) 2.833 5.936 ( 1.006 1.420 -2.235) 2.833 6.164 ( 2.061 -5.930 3.898) 7.390 6.164 ( 2.061 5.930 3.898) 7.390 6.241 ( -0.389 -6.738 -2.484) 7.191 6.241 ( -0.389 6.738 -2.484) 7.191 6.413 ( -0.661 -1.012 0.126) 1.215 6.413 ( -0.661 1.012 0.126) 1.215 6.540 ( -1.972 -2.251 -1.844) 3.515 6.540 ( -1.972 2.251 -1.844) 3.515 6.876 ( 1.123 -6.037 0.383) 6.153 6.876 ( 1.123 6.037 0.383) 6.153 7.017 ( -0.328 -2.787 2.377) 3.678 7.017 ( -0.328 2.787 2.377) 3.678 7.136 ( 1.142 -1.223 1.891) 2.526 7.136 ( 1.142 1.223 1.891) 2.526 7.238 ( -0.644 -3.599 -0.162) 3.660 7.238 ( -0.644 3.599 -0.162) 3.660 7.509 ( -2.318 -4.568 3.248) 6.066 7.509 ( -2.318 4.568 3.248) 6.066 7.553 ( 2.911 -4.844 -1.119) 5.761 7.553 ( 2.911 4.844 -1.119) 5.761 8.737 ( -1.050 -5.072 1.109) 5.297 8.737 ( -1.050 5.072 1.109) 5.297 8.780 ( 1.928 -3.934 -2.562) 5.075 8.780 ( 1.928 3.934 -2.562) 5.075 9.023 ( 0.095 -1.074 0.148) 1.088 9.023 ( 0.095 1.074 0.148) 1.088 9.050 ( -0.580 -2.217 0.144) 2.296 9.050 ( -0.580 2.217 0.144) 2.296 9.178 ( -0.044 -1.901 -0.399) 1.943 9.178 ( -0.044 1.901 -0.399) 1.943 9.214 ( -0.247 -0.654 -1.499) 1.654 9.214 ( -0.247 0.654 -1.499) 1.654 9.456 ( -1.116 -2.516 2.790) 3.919 9.456 ( -1.116 2.516 2.790) 3.919 9.540 ( 1.083 -2.863 -3.148) 4.391 9.540 ( 1.083 2.863 -3.148) 4.391 10.002 ( -0.161 -2.824 2.374) 3.692 10.002 ( -0.161 2.824 2.374) 3.692 10.435 ( 0.749 -1.260 -1.761) 2.291 10.435 ( 0.749 1.260 -1.761) 2.291 10.602 ( -1.336 -6.360 1.130) 6.596 10.602 ( -1.336 6.360 1.130) 6.596 10.658 ( 0.864 -4.258 -1.390) 4.562 10.658 ( 0.864 4.258 -1.390) 4.562 10.919 ( 0.097 -2.355 1.041) 2.577 10.919 ( 0.097 2.355 1.041) 2.577 11.024 ( -0.535 -2.728 -1.722) 3.270 11.024 ( -0.535 2.728 -1.722) 3.270 11.318 ( 0.194 -0.687 -0.422) 0.830 11.318 ( 0.194 0.687 -0.422) 0.830 11.394 ( 0.092 -1.360 0.058) 1.364 11.394 ( 0.092 1.360 0.058) 1.364 12.091 ( -0.543 -3.172 0.944) 3.354 12.091 ( -0.543 3.172 0.944) 3.354 12.237 ( 0.177 -2.672 -1.056) 2.878 12.237 ( 0.177 2.672 -1.056) 2.878 12.480 ( -0.856 -2.244 1.203) 2.686 12.480 ( -0.856 2.244 1.203) 2.686 12.509 ( 0.551 -2.611 -1.338) 2.985 12.509 ( 0.551 2.611 -1.338) 2.985 12.800 ( 0.127 -5.225 0.698) 5.273 12.800 ( 0.127 5.225 0.698) 5.273 12.846 ( 0.393 -3.520 -0.264) 3.552 12.846 ( 0.393 3.520 -0.264) 3.552 13.314 ( 0.345 -0.408 0.015) 0.534 13.314 ( 0.345 0.408 0.015) 0.534 13.372 ( -0.313 -1.042 0.283) 1.124 13.372 ( -0.313 1.042 0.283) 1.124 14.289 ( -0.733 -1.247 0.076) 1.448 14.289 ( -0.733 1.247 0.076) 1.448 14.311 ( 1.386 -2.163 -0.566) 2.631 14.311 ( 1.386 2.163 -0.566) 2.631 14.582 ( -3.217 -2.626 1.007) 4.273 14.582 ( -3.217 2.626 1.007) 4.273 14.670 ( 2.777 -1.828 0.160) 3.328 14.670 ( 2.777 1.828 0.160) 3.328 14.851 ( 0.626 -6.389 2.378) 6.846 14.851 ( 0.626 6.389 2.378) 6.846 14.932 ( 0.035 -6.867 -4.336) 8.122 14.932 ( 0.035 6.867 -4.336) 8.122 15.535 ( -1.581 -12.789 4.148) 13.537 15.535 ( -1.581 12.789 4.148) 13.537 15.755 ( 1.090 -6.342 -3.679) 7.412 15.755 ( 1.090 6.342 -3.679) 7.412 15.836 ( 3.860 -1.660 -1.087) 4.340 15.836 ( 3.860 1.660 -1.087) 4.340 15.962 ( -3.525 -5.709 -3.401) 7.523 15.962 ( -3.525 5.709 -3.401) 7.523 16.546 ( -0.842 -0.174 0.399) 0.948 16.546 ( -0.842 0.174 0.399) 0.948 16.591 ( 0.036 -1.506 -0.101) 1.509 16.591 ( 0.036 1.506 -0.101) 1.509 17.347 ( 0.082 -0.205 0.399) 0.456 17.347 ( 0.082 0.205 0.399) 0.456 17.372 ( 0.188 -0.654 -0.093) 0.687 17.372 ( 0.188 0.654 -0.093) 0.687 19.794 ( 0.261 -1.946 -0.646) 2.067 19.794 ( 0.261 1.946 -0.646) 2.067 19.968 ( -0.313 -0.461 -0.095) 0.565 19.968 ( -0.313 0.461 -0.095) 0.565 20.595 ( -0.845 -0.612 1.273) 1.646 20.595 ( -0.845 0.612 1.273) 1.646 20.801 ( 0.685 -0.635 -1.166) 1.494 20.801 ( 0.685 0.635 -1.166) 1.494 21.986 ( 0.837 -1.612 1.005) 2.076 21.986 ( 0.837 1.612 1.005) 2.076 22.097 ( -0.697 -0.845 -0.233) 1.120 22.097 ( -0.697 0.845 -0.233) 1.120 23.056 ( 0.424 -0.565 -1.322) 1.499 23.056 ( 0.424 0.565 -1.322) 1.499 23.395 ( -0.575 -0.121 0.684) 0.902 23.395 ( -0.575 0.121 0.684) 0.902 26.545 ( 0.032 -0.068 -0.099) 0.124 26.545 ( 0.032 0.068 -0.099) 0.124 26.582 ( 0.127 -0.071 0.065) 0.159 26.582 ( 0.127 0.071 0.065) 0.159 29.251 ( -0.508 -2.203 2.687) 3.512 29.251 ( -0.508 2.203 2.687) 3.512 29.365 ( 1.018 -3.721 -2.731) 4.726 29.365 ( 1.018 3.721 -2.731) 4.726 30.197 ( -1.111 -11.582 7.464) 13.824 30.197 ( -1.111 11.582 7.464) 13.824 30.586 ( -0.505 -7.421 -7.524) 10.580 30.586 ( -0.505 7.421 -7.524) 10.580 30.816 ( 0.521 -1.012 -0.422) 1.214 30.816 ( 0.521 1.012 -0.422) 1.214 31.005 ( 0.272 -0.145 -0.013) 0.308 31.005 ( 0.272 0.145 -0.013) 0.308 31.749 ( -0.091 -9.974 5.816) 11.546 31.749 ( -0.091 9.974 5.816) 11.546 32.059 ( 0.045 -17.476 -17.458) 24.703 32.059 ( 0.045 17.476 -17.458) 24.703 32.233 ( 0.188 -2.397 -0.006) 2.405 32.233 ( 0.188 2.397 -0.006) 2.405 32.267 ( 2.015 -2.975 -1.629) 3.945 32.267 ( 2.015 2.975 -1.629) 3.945 32.575 ( -4.485 -0.360 1.902) 4.885 32.575 ( -4.485 0.360 1.902) 4.885 32.776 ( 2.264 -3.757 -8.063) 9.179 32.776 ( 2.264 3.757 -8.063) 9.179 33.738 ( -0.279 -0.505 2.231) 2.305 33.738 ( -0.279 0.505 2.231) 2.305 34.017 ( 0.064 -1.574 -5.603) 5.820 34.017 ( 0.064 1.574 -5.603) 5.820 35.023 ( -0.007 -0.438 1.933) 1.982 35.023 ( -0.007 0.438 1.933) 1.982 35.100 ( 0.823 -0.384 1.681) 1.910 35.100 ( 0.823 0.384 1.681) 1.910 35.599 ( 0.192 -1.332 -0.879) 1.607 35.599 ( 0.192 1.332 -0.879) 1.607 35.623 ( 0.476 -0.929 -1.008) 1.451 35.623 ( 0.476 0.929 -1.008) 1.451 36.123 ( 0.669 -1.675 10.982) 11.130 36.123 ( 0.669 1.675 10.982) 11.130 36.358 ( -0.418 -1.527 -9.495) 9.626 36.358 ( -0.418 1.527 -9.495) 9.626 37.809 ( -1.176 -17.379 19.433) 26.097 37.809 ( -1.176 17.379 19.433) 26.097 38.486 ( 0.303 -9.874 -7.905) 12.652 38.486 ( 0.303 9.874 -7.905) 12.652 ======================= Grid point 110 (62/69) ======================= q-point: ( 0.11 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( 8.044 -9.530 7.213) 14.407 1.590 ( 8.044 9.530 7.213) 14.407 1.859 ( 7.147 -9.005 -6.132) 13.030 1.859 ( 7.147 9.005 -6.132) 13.030 2.172 ( 7.558 -0.901 -2.644) 8.058 2.172 ( 7.558 0.901 -2.644) 8.058 2.496 ( -0.085 -3.172 4.822) 5.772 2.496 ( -0.085 3.172 4.822) 5.772 2.686 ( -9.063 -10.642 -4.716) 14.752 2.686 ( -9.063 10.642 -4.716) 14.752 2.817 ( 1.547 -4.054 -1.651) 4.643 2.817 ( 1.547 4.054 -1.651) 4.643 2.955 ( 4.319 -1.291 -1.003) 4.619 2.955 ( 4.319 1.291 -1.003) 4.619 3.152 ( -2.411 -3.228 1.787) 4.408 3.152 ( -2.411 3.228 1.787) 4.408 3.251 ( 0.597 -3.783 -2.470) 4.558 3.251 ( 0.597 3.783 -2.470) 4.558 3.326 ( 3.820 -2.119 -4.022) 5.938 3.326 ( 3.820 2.119 -4.022) 5.938 3.511 ( 1.202 -5.637 9.907) 11.462 3.511 ( 1.202 5.637 9.907) 11.462 3.612 ( 1.872 -6.786 0.096) 7.040 3.612 ( 1.872 6.786 0.096) 7.040 3.718 ( 3.900 -2.745 -1.263) 4.933 3.718 ( 3.900 2.745 -1.263) 4.933 3.817 ( 6.971 -6.853 1.618) 9.908 3.817 ( 6.971 6.853 1.618) 9.908 4.121 ( 0.183 -9.196 -1.484) 9.317 4.121 ( 0.183 9.196 -1.484) 9.317 4.225 ( 0.506 -6.498 4.570) 7.960 4.225 ( 0.506 6.498 4.570) 7.960 4.305 ( 3.489 -10.137 -0.727) 10.746 4.305 ( 3.489 10.137 -0.727) 10.746 4.397 ( 4.315 -11.684 1.374) 12.530 4.397 ( 4.315 11.684 1.374) 12.530 4.606 ( -0.815 -3.013 0.258) 3.132 4.606 ( -0.815 3.013 0.258) 3.132 4.839 ( 2.609 -3.672 -3.009) 5.417 4.839 ( 2.609 3.672 -3.009) 5.417 5.026 ( -5.912 -2.137 -5.669) 8.464 5.026 ( -5.912 2.137 -5.669) 8.464 5.138 ( -1.349 -2.849 -0.712) 3.231 5.138 ( -1.349 2.849 -0.712) 3.231 5.236 ( 3.160 -5.208 3.619) 7.086 5.236 ( 3.160 5.208 3.619) 7.086 5.457 ( -0.853 -2.182 -0.863) 2.497 5.457 ( -0.853 2.182 -0.863) 2.497 5.490 ( 8.302 -4.626 3.894) 10.270 5.490 ( 8.302 4.626 3.894) 10.270 5.702 ( -6.000 -3.192 -0.261) 6.801 5.702 ( -6.000 3.192 -0.261) 6.801 5.862 ( -1.290 -2.474 0.624) 2.859 5.862 ( -1.290 2.474 0.624) 2.859 5.965 ( 3.978 -2.417 -0.130) 4.657 5.965 ( 3.978 2.417 -0.130) 4.657 6.147 ( -3.915 -2.603 -2.234) 5.205 6.147 ( -3.915 2.603 -2.234) 5.205 6.252 ( 1.878 -6.806 -1.788) 7.283 6.252 ( 1.878 6.806 -1.788) 7.283 6.412 ( 0.115 -0.325 1.541) 1.579 6.412 ( 0.115 0.325 1.541) 1.579 6.537 ( 0.751 -2.296 3.542) 4.288 6.537 ( 0.751 2.296 3.542) 4.288 6.845 ( -3.738 -2.441 -1.405) 4.680 6.845 ( -3.738 2.441 -1.405) 4.680 6.992 ( -4.359 -2.645 0.100) 5.100 6.992 ( -4.359 2.645 0.100) 5.100 7.141 ( -0.699 -3.903 -1.246) 4.156 7.141 ( -0.699 3.903 -1.246) 4.156 7.231 ( -0.824 -1.232 0.867) 1.717 7.231 ( -0.824 1.232 0.867) 1.717 7.472 ( -5.265 -4.036 0.461) 6.650 7.472 ( -5.265 4.036 0.461) 6.650 7.562 ( 0.219 -4.308 -1.966) 4.740 7.562 ( 0.219 4.308 -1.966) 4.740 8.594 ( -15.974 -4.856 0.112) 16.696 8.594 ( -15.974 4.856 0.112) 16.696 8.662 ( -12.468 -3.014 -0.877) 12.857 8.662 ( -12.468 3.014 -0.877) 12.857 8.994 ( -1.247 -3.207 -0.341) 3.458 8.994 ( -1.247 3.207 -0.341) 3.458 9.111 ( 3.257 -4.646 0.608) 5.706 9.111 ( 3.257 4.646 0.608) 5.706 9.196 ( 3.287 -1.161 0.014) 3.486 9.196 ( 3.287 1.161 0.014) 3.486 9.260 ( 5.684 -2.674 0.645) 6.315 9.260 ( 5.684 2.674 0.645) 6.315 9.484 ( 0.702 -2.698 1.276) 3.066 9.484 ( 0.702 2.698 1.276) 3.066 9.553 ( 3.844 -4.041 -1.222) 5.710 9.553 ( 3.844 4.041 -1.222) 5.710 10.021 ( 0.406 -1.877 0.019) 1.920 10.021 ( 0.406 1.877 0.019) 1.920 10.361 ( -7.838 -2.116 -1.185) 8.204 10.361 ( -7.838 2.116 -1.185) 8.204 10.532 ( -9.247 -3.678 1.957) 10.142 10.532 ( -9.247 3.678 1.957) 10.142 10.589 ( -6.078 -1.418 -1.081) 6.334 10.589 ( -6.078 1.418 -1.081) 6.334 10.883 ( -5.211 -2.791 0.105) 5.913 10.883 ( -5.211 2.791 0.105) 5.913 10.990 ( -3.569 -2.367 0.466) 4.308 10.990 ( -3.569 2.367 0.466) 4.308 11.386 ( 8.141 -1.299 -0.393) 8.254 11.386 ( 8.141 1.299 -0.393) 8.254 11.466 ( 8.758 -2.246 0.175) 9.043 11.466 ( 8.758 2.246 0.175) 9.043 12.131 ( 3.814 -3.325 0.699) 5.108 12.131 ( 3.814 3.325 0.699) 5.108 12.233 ( -0.129 -2.389 -0.317) 2.413 12.233 ( -0.129 2.389 -0.317) 2.413 12.449 ( -4.321 -1.810 1.367) 4.880 12.449 ( -4.321 1.810 1.367) 4.880 12.472 ( -3.296 -3.034 -1.240) 4.648 12.472 ( -3.296 3.034 -1.240) 4.648 12.785 ( 0.002 -5.625 -0.050) 5.625 12.785 ( 0.002 5.625 -0.050) 5.625 12.870 ( 1.272 -5.186 -0.280) 5.347 12.870 ( 1.272 5.186 -0.280) 5.347 13.369 ( 6.432 -1.317 -0.349) 6.575 13.369 ( 6.432 1.317 -0.349) 6.575 13.423 ( 5.832 -2.621 0.281) 6.400 13.423 ( 5.832 2.621 0.281) 6.400 14.241 ( -3.237 -1.596 0.173) 3.613 14.241 ( -3.237 1.596 0.173) 3.613 14.323 ( -4.584 -3.024 -0.815) 5.552 14.323 ( -4.584 3.024 -0.815) 5.552 14.531 ( 3.735 -4.117 1.242) 5.695 14.531 ( 3.735 4.117 1.242) 5.695 14.731 ( 1.757 -5.901 -0.813) 6.211 14.731 ( 1.757 5.901 -0.813) 6.211 14.974 ( 12.609 -7.374 -0.266) 14.609 14.974 ( 12.609 7.374 -0.266) 14.609 15.028 ( 12.429 -6.698 -0.616) 14.132 15.028 ( 12.429 6.698 -0.616) 14.132 15.535 ( -3.160 -9.324 2.140) 10.075 15.535 ( -3.160 9.324 2.140) 10.075 15.674 ( -5.639 -8.563 -2.375) 10.524 15.674 ( -5.639 8.563 -2.375) 10.524 15.857 ( 2.998 -4.340 -3.430) 6.292 15.857 ( 2.998 4.340 -3.430) 6.292 15.949 ( 0.498 -5.622 4.217) 7.045 15.949 ( 0.498 5.622 4.217) 7.045 16.557 ( 1.922 -1.266 0.200) 2.310 16.557 ( 1.922 1.266 0.200) 2.310 16.641 ( 4.628 -1.491 0.871) 4.939 16.641 ( 4.628 1.491 0.871) 4.939 17.342 ( -0.697 -0.543 -0.153) 0.897 17.342 ( -0.697 0.543 -0.153) 0.897 17.377 ( 0.592 -0.878 -0.263) 1.091 17.377 ( 0.592 0.878 -0.263) 1.091 19.798 ( 1.158 -0.724 -0.342) 1.408 19.798 ( 1.158 0.724 -0.342) 1.408 19.986 ( 2.401 -0.736 0.513) 2.563 19.986 ( 2.401 0.736 0.513) 2.563 20.579 ( -3.004 -1.512 1.148) 3.554 20.579 ( -3.004 1.512 1.148) 3.554 20.793 ( -0.294 -1.013 -0.888) 1.379 20.793 ( -0.294 1.013 -0.888) 1.379 22.018 ( 3.395 -0.207 -1.376) 3.669 22.018 ( 3.395 0.207 -1.376) 3.669 22.120 ( 3.081 -0.985 1.105) 3.418 22.120 ( 3.081 0.985 1.105) 3.418 23.018 ( -3.747 -1.431 -0.509) 4.043 23.018 ( -3.747 1.431 -0.509) 4.043 23.330 ( -8.281 -0.530 0.701) 8.328 23.330 ( -8.281 0.530 0.701) 8.328 26.648 ( 12.979 -0.910 0.174) 13.012 26.648 ( 12.979 0.910 0.174) 13.012 26.710 ( 15.405 -1.176 -0.249) 15.452 26.710 ( 15.405 1.176 -0.249) 15.452 29.165 ( -12.854 -5.080 0.623) 13.835 29.165 ( -12.854 5.080 0.623) 13.835 29.228 ( -13.836 -3.656 -1.119) 14.355 29.228 ( -13.836 3.656 -1.119) 14.355 30.318 ( 8.125 -5.648 0.491) 9.907 30.318 ( 8.125 5.648 0.491) 9.907 30.561 ( 2.699 -3.832 1.315) 4.869 30.561 ( 2.699 3.832 1.315) 4.869 30.846 ( 4.060 -1.000 -0.379) 4.199 30.846 ( 4.060 1.000 -0.379) 4.199 31.036 ( 3.854 -2.444 -0.415) 4.582 31.036 ( 3.854 2.444 -0.415) 4.582 31.811 ( 1.014 -9.549 -1.085) 9.663 31.811 ( 1.014 9.549 -1.085) 9.663 31.956 ( 0.046 -9.296 1.428) 9.405 31.956 ( 0.046 9.296 1.428) 9.405 32.132 ( -7.313 -4.145 -0.239) 8.410 32.132 ( -7.313 4.145 -0.239) 8.410 32.226 ( -4.936 -2.783 -0.138) 5.669 32.226 ( -4.936 2.783 -0.138) 5.669 32.685 ( 10.446 -1.060 4.678) 11.494 32.685 ( 10.446 1.060 4.678) 11.494 32.830 ( 10.591 -0.775 -2.893) 11.007 32.830 ( 10.591 0.775 -2.893) 11.007 33.735 ( -2.138 -0.294 0.037) 2.159 33.735 ( -2.138 0.294 0.037) 2.159 33.961 ( -3.139 -0.184 0.523) 3.187 33.961 ( -3.139 0.184 0.523) 3.187 34.998 ( -3.248 -1.713 -0.561) 3.715 34.998 ( -3.248 1.713 -0.561) 3.715 35.141 ( 2.910 -1.427 -0.778) 3.333 35.141 ( 2.910 1.427 -0.778) 3.333 35.607 ( 1.963 -3.305 -0.392) 3.864 35.607 ( 1.963 3.305 -0.392) 3.864 35.653 ( 3.901 -2.192 -0.396) 4.492 35.653 ( 3.901 2.192 -0.396) 4.492 36.214 ( 0.881 -0.557 -5.702) 5.796 36.214 ( 0.881 0.557 -5.702) 5.796 36.291 ( 1.353 -0.895 5.106) 5.357 36.291 ( 1.353 0.895 5.106) 5.357 37.867 ( -5.914 -1.168 -0.119) 6.030 37.867 ( -5.914 1.168 -0.119) 6.030 38.357 ( -10.011 -0.735 0.338) 10.043 38.357 ( -10.011 0.735 0.338) 10.043 ======================= Grid point 112 (63/69) ======================= q-point: ( 0.22 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( 12.283 -9.446 -9.736) 18.300 1.806 ( 12.283 9.446 -9.736) 18.300 1.943 ( 10.021 -1.409 2.799) 10.499 1.943 ( 10.021 1.409 2.799) 10.499 2.244 ( 6.640 -10.571 -2.103) 12.659 2.244 ( 6.640 10.571 -2.103) 12.659 2.505 ( -0.315 -8.029 3.510) 8.769 2.505 ( -0.315 8.029 3.510) 8.769 2.641 ( 2.931 -4.789 1.086) 5.719 2.641 ( 2.931 4.789 1.086) 5.719 2.799 ( 5.071 -9.335 -9.307) 14.124 2.799 ( 5.071 9.335 -9.307) 14.124 2.940 ( -2.374 -4.624 -2.271) 5.673 2.940 ( -2.374 4.624 -2.271) 5.673 3.136 ( 2.914 -3.247 -4.875) 6.542 3.136 ( 2.914 3.247 -4.875) 6.542 3.222 ( 2.018 -5.351 -6.815) 8.897 3.222 ( 2.018 5.351 -6.815) 8.897 3.295 ( 0.109 -4.981 -0.276) 4.989 3.295 ( 0.109 4.981 -0.276) 4.989 3.489 ( -1.658 -2.217 -3.482) 4.449 3.489 ( -1.658 2.217 -3.482) 4.449 3.752 ( 4.878 -3.247 4.219) 7.221 3.752 ( 4.878 3.247 4.219) 7.221 3.842 ( 1.102 -6.912 1.361) 7.131 3.842 ( 1.102 6.912 1.361) 7.131 3.958 ( 10.657 -7.776 1.390) 13.265 3.958 ( 10.657 7.776 1.390) 13.265 4.158 ( 4.029 -4.250 4.644) 7.474 4.158 ( 4.029 4.250 4.644) 7.474 4.244 ( -0.574 -7.702 -1.160) 7.810 4.244 ( -0.574 7.702 -1.160) 7.810 4.389 ( 4.951 -7.043 -3.136) 9.163 4.389 ( 4.951 7.043 -3.136) 9.163 4.455 ( 2.449 -7.872 5.672) 10.006 4.455 ( 2.449 7.872 5.672) 10.006 4.670 ( 3.678 -3.599 2.619) 5.774 4.670 ( 3.678 3.599 2.619) 5.774 4.790 ( -0.659 -6.791 -6.031) 9.106 4.790 ( -0.659 6.791 -6.031) 9.106 4.919 ( -0.520 -2.019 0.699) 2.199 4.919 ( -0.520 2.019 0.699) 2.199 5.181 ( 0.353 -2.479 4.823) 5.434 5.181 ( 0.353 2.479 4.823) 5.434 5.299 ( 3.961 -5.499 -1.960) 7.055 5.299 ( 3.961 5.499 -1.960) 7.055 5.450 ( 0.507 -1.887 3.228) 3.773 5.450 ( 0.507 1.887 3.228) 3.773 5.609 ( -4.675 -6.017 0.104) 7.620 5.609 ( -4.675 6.017 0.104) 7.620 5.700 ( 6.229 -4.914 9.826) 12.629 5.700 ( 6.229 4.914 9.826) 12.629 5.817 ( -4.138 -3.184 -1.292) 5.379 5.817 ( -4.138 3.184 -1.292) 5.379 6.017 ( -3.469 -5.227 -0.602) 6.302 6.017 ( -3.469 5.227 -0.602) 6.302 6.047 ( 1.538 -2.997 -1.510) 3.692 6.047 ( 1.538 2.997 -1.510) 3.692 6.261 ( -0.722 -4.366 1.939) 4.831 6.261 ( -0.722 4.366 1.939) 4.831 6.411 ( -0.083 -4.007 -1.915) 4.442 6.411 ( -0.083 4.007 -1.915) 4.442 6.608 ( -2.856 -4.216 6.141) 7.978 6.608 ( -2.856 4.216 6.141) 7.978 6.767 ( 0.079 -2.083 -3.941) 4.459 6.767 ( 0.079 2.083 -3.941) 4.459 6.909 ( -4.024 -4.914 -2.042) 6.672 6.909 ( -4.024 4.914 -2.042) 6.672 7.124 ( 0.467 -5.533 -0.081) 5.553 7.124 ( 0.467 5.533 -0.081) 5.553 7.222 ( -1.441 -2.514 0.824) 3.012 7.222 ( -1.441 2.514 0.824) 3.012 7.357 ( -7.171 -2.754 -2.888) 8.206 7.357 ( -7.171 2.754 -2.888) 8.206 7.524 ( -1.938 -4.553 -1.468) 5.161 7.524 ( -1.938 4.553 -1.468) 5.161 8.311 ( -19.449 -7.511 0.487) 20.855 8.311 ( -19.449 7.511 0.487) 20.855 8.427 ( -15.191 -6.119 -0.890) 16.401 8.427 ( -15.191 6.119 -0.890) 16.401 8.994 ( 1.076 -2.935 0.133) 3.129 8.994 ( 1.076 2.935 0.133) 3.129 9.143 ( 0.409 -1.932 1.433) 2.440 9.143 ( 0.409 1.932 1.433) 2.440 9.273 ( 4.869 -0.878 0.991) 5.046 9.273 ( 4.869 0.878 0.991) 5.046 9.359 ( 4.620 -2.290 0.749) 5.211 9.359 ( 4.620 2.290 0.749) 5.211 9.508 ( 2.687 -4.317 -0.387) 5.099 9.508 ( 2.687 4.317 -0.387) 5.099 9.609 ( 3.144 -4.003 0.769) 5.147 9.609 ( 3.144 4.003 0.769) 5.147 9.999 ( -2.526 -1.450 -1.667) 3.356 9.999 ( -2.526 1.450 -1.667) 3.356 10.191 ( -10.821 -2.232 -1.530) 11.154 10.191 ( -10.821 2.232 -1.530) 11.154 10.366 ( -11.703 -5.497 -0.986) 12.967 10.366 ( -11.703 5.497 -0.986) 12.967 10.510 ( -5.444 -3.700 2.559) 7.062 10.510 ( -5.444 3.700 2.559) 7.062 10.793 ( -5.600 -3.592 0.351) 6.662 10.793 ( -5.600 3.592 0.351) 6.662 10.914 ( -6.300 -1.235 0.378) 6.431 10.914 ( -6.300 1.235 0.378) 6.431 11.531 ( 10.357 -0.490 -0.341) 10.374 11.531 ( 10.357 0.490 -0.341) 10.374 11.633 ( 10.782 -1.967 0.345) 10.966 11.633 ( 10.782 1.967 0.345) 10.966 12.184 ( 2.320 -4.074 -2.664) 5.392 12.184 ( 2.320 4.074 -2.664) 5.392 12.231 ( -0.376 -4.993 2.753) 5.714 12.231 ( -0.376 4.993 2.753) 5.714 12.390 ( -3.500 -2.587 -0.210) 4.357 12.390 ( -3.500 2.587 -0.210) 4.357 12.409 ( -3.256 -4.135 0.197) 5.267 12.409 ( -3.256 4.135 0.197) 5.267 12.801 ( 1.185 -4.733 -0.372) 4.893 12.801 ( 1.185 4.733 -0.372) 4.893 12.878 ( 0.362 -4.128 -0.070) 4.144 12.878 ( 0.362 4.128 -0.070) 4.144 13.483 ( 7.733 -6.438 0.122) 10.063 13.483 ( 7.733 6.438 0.122) 10.063 13.531 ( 7.077 -5.975 -0.040) 9.262 13.531 ( 7.077 5.975 -0.040) 9.262 14.205 ( -2.157 -5.217 0.432) 5.662 14.205 ( -2.157 5.217 0.432) 5.662 14.231 ( -2.641 -3.156 -0.686) 4.173 14.231 ( -2.641 3.156 -0.686) 4.173 14.642 ( 6.250 -10.162 -1.027) 11.974 14.642 ( 6.250 10.162 -1.027) 11.974 14.733 ( -1.070 -6.462 0.326) 6.558 14.733 ( -1.070 6.462 0.326) 6.558 15.158 ( 9.058 -3.147 0.540) 9.605 15.158 ( 9.058 3.147 0.540) 9.605 15.202 ( 9.358 -6.941 -1.319) 11.726 15.202 ( 9.358 6.941 -1.319) 11.726 15.508 ( -1.795 -4.796 0.400) 5.137 15.508 ( -1.795 4.796 0.400) 5.137 15.581 ( -2.785 -2.034 0.368) 3.468 15.581 ( -2.785 2.034 0.368) 3.468 15.868 ( 4.084 -1.679 -3.143) 5.421 15.868 ( 4.084 1.679 -3.143) 5.421 16.043 ( 3.314 -2.360 5.595) 6.918 16.043 ( 3.314 2.360 5.595) 6.918 16.589 ( 1.730 -0.132 -0.196) 1.746 16.589 ( 1.730 0.132 -0.196) 1.746 16.725 ( 2.963 -2.348 1.967) 4.262 16.725 ( 2.963 2.348 1.967) 4.262 17.333 ( 0.305 -0.707 -0.316) 0.832 17.333 ( 0.305 0.707 -0.316) 0.832 17.383 ( 0.595 -0.626 -0.303) 0.915 17.383 ( 0.595 0.626 -0.303) 0.915 19.830 ( 3.354 -1.608 0.143) 3.722 19.830 ( 3.354 1.608 0.143) 3.722 20.059 ( 5.310 -1.383 1.627) 5.723 20.059 ( 5.310 1.383 1.627) 5.723 20.528 ( -5.187 -1.771 1.120) 5.594 20.528 ( -5.187 1.771 1.120) 5.594 20.770 ( -1.731 -1.203 -0.393) 2.144 20.770 ( -1.731 1.203 -0.393) 2.144 22.073 ( 6.599 -0.536 -1.757) 6.850 22.073 ( 6.599 0.536 -1.757) 6.850 22.205 ( 5.899 -0.638 0.933) 6.006 22.205 ( 5.899 0.638 0.933) 6.006 22.934 ( -6.634 -2.770 -0.033) 7.189 22.934 ( -6.634 2.770 -0.033) 7.189 23.174 ( -11.467 -1.478 -0.008) 11.562 23.174 ( -11.467 1.478 -0.008) 11.562 26.905 ( 19.998 -3.060 -1.988) 20.328 26.905 ( 19.998 3.060 -1.988) 20.328 27.044 ( 23.941 -7.104 4.379) 25.354 27.044 ( 23.941 7.104 4.379) 25.354 28.898 ( -19.935 -7.270 -1.015) 21.243 28.898 ( -19.935 7.270 -1.015) 21.243 28.959 ( -19.567 -8.028 0.541) 21.157 28.959 ( -19.567 8.028 0.541) 21.157 30.430 ( 9.044 -9.372 -3.371) 13.454 30.430 ( 9.044 9.372 -3.371) 13.454 30.649 ( 2.876 -6.861 3.501) 8.222 30.649 ( 2.876 6.861 3.501) 8.222 30.949 ( 7.611 -5.572 2.219) 9.690 30.949 ( 7.611 5.572 2.219) 9.690 31.107 ( 6.104 -5.233 -0.573) 8.060 31.107 ( 6.104 5.233 -0.573) 8.060 31.743 ( -4.393 -8.782 -4.592) 10.840 31.743 ( -4.393 8.782 -4.592) 10.840 31.901 ( -8.794 -2.055 1.486) 9.153 31.901 ( -8.794 2.055 1.486) 9.153 32.160 ( -0.734 -3.263 2.210) 4.009 32.160 ( -0.734 3.263 2.210) 4.009 32.228 ( 2.898 -15.368 14.198) 21.122 32.228 ( 2.898 15.368 14.198) 21.122 32.919 ( 11.177 -1.651 5.017) 12.363 32.919 ( 11.177 1.651 5.017) 12.363 32.989 ( 11.711 -1.859 -0.789) 11.884 32.989 ( 11.711 1.859 -0.789) 11.884 33.676 ( -3.752 -1.249 -1.618) 4.273 33.676 ( -3.752 1.249 -1.618) 4.273 33.927 ( -6.098 -1.495 5.264) 8.193 33.927 ( -6.098 1.495 5.264) 8.193 34.935 ( -2.358 -1.475 -1.921) 3.381 34.935 ( -2.358 1.475 -1.921) 3.381 35.161 ( 2.687 -1.517 -3.255) 4.484 35.161 ( 2.687 1.517 -3.255) 4.484 35.651 ( 3.097 -4.225 1.007) 5.334 35.651 ( 3.097 4.225 1.007) 5.334 35.722 ( 4.786 -2.997 0.211) 5.650 35.722 ( 4.786 2.997 0.211) 5.650 36.127 ( 2.907 -0.768 -11.450) 11.838 36.127 ( 2.907 0.768 -11.450) 11.838 36.399 ( 0.423 -0.244 6.521) 6.539 36.399 ( 0.423 0.244 6.521) 6.539 37.651 ( -6.064 -14.552 -16.951) 23.148 37.651 ( -6.064 14.552 -16.951) 23.148 38.215 ( -15.281 -9.008 8.753) 19.780 38.215 ( -15.281 9.008 8.753) 19.780 ======================= Grid point 114 (64/69) ======================= q-point: ( 0.33 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 7.214 -10.513 -6.771) 14.436 1.795 ( 7.214 10.513 -6.771) 14.436 2.178 ( 12.435 -11.944 -1.264) 17.288 2.178 ( 12.435 11.944 -1.264) 17.288 2.339 ( 2.335 -3.645 3.223) 5.397 2.339 ( 2.335 3.645 3.223) 5.397 2.573 ( 3.545 -2.828 -6.252) 7.723 2.573 ( 3.545 2.828 -6.252) 7.723 2.641 ( 3.749 -7.462 -5.777) 10.155 2.641 ( 3.749 7.462 -5.777) 10.155 2.758 ( -0.245 -5.317 -1.827) 5.628 2.758 ( -0.245 5.317 -1.827) 5.628 2.939 ( 5.453 -2.024 -1.440) 5.992 2.939 ( 5.453 2.024 -1.440) 5.992 3.110 ( 1.035 -5.360 -6.259) 8.305 3.110 ( 1.035 5.360 -6.259) 8.305 3.205 ( 3.371 -1.640 -2.183) 4.338 3.205 ( 3.371 1.640 -2.183) 4.338 3.341 ( 3.995 -6.225 3.714) 8.277 3.341 ( 3.995 6.225 3.714) 8.277 3.471 ( -0.449 -3.675 -0.625) 3.754 3.471 ( -0.449 3.675 -0.625) 3.754 3.716 ( 2.086 -4.405 -7.224) 8.714 3.716 ( 2.086 4.405 -7.224) 8.714 3.906 ( 1.652 -2.868 0.997) 3.457 3.906 ( 1.652 2.868 0.997) 3.457 4.048 ( -1.952 -9.012 -9.627) 13.330 4.048 ( -1.952 9.012 -9.627) 13.330 4.212 ( 12.557 -6.974 -0.235) 14.366 4.212 ( 12.557 6.974 -0.235) 14.366 4.330 ( 1.014 -5.535 10.241) 11.686 4.330 ( 1.014 5.535 10.241) 11.686 4.432 ( 2.802 -6.200 1.600) 6.990 4.432 ( 2.802 6.200 1.600) 6.990 4.538 ( -3.105 -3.829 0.154) 4.933 4.538 ( -3.105 3.829 0.154) 4.933 4.691 ( 3.326 -1.255 -1.338) 3.799 4.691 ( 3.326 1.255 -1.338) 3.799 4.783 ( 2.997 -4.267 2.581) 5.818 4.783 ( 2.997 4.267 2.581) 5.818 4.965 ( -0.281 -5.610 1.654) 5.856 4.965 ( -0.281 5.610 1.654) 5.856 5.171 ( -5.146 -3.518 -0.524) 6.255 5.171 ( -5.146 3.518 -0.524) 6.255 5.331 ( 4.168 -4.199 -2.970) 6.620 5.331 ( 4.168 4.199 -2.970) 6.620 5.484 ( -2.786 -7.893 1.721) 8.545 5.484 ( -2.786 7.893 1.721) 8.545 5.650 ( 1.015 -2.743 6.842) 7.441 5.650 ( 1.015 2.743 6.842) 7.441 5.719 ( -0.543 -2.675 -0.198) 2.737 5.719 ( -0.543 2.675 -0.198) 2.737 5.860 ( 1.501 -4.865 5.500) 7.495 5.860 ( 1.501 4.865 5.500) 7.495 5.955 ( -3.225 -0.471 3.834) 5.032 5.955 ( -3.225 0.471 3.834) 5.032 6.103 ( 1.753 -1.310 3.525) 4.149 6.103 ( 1.753 1.310 3.525) 4.149 6.255 ( -3.225 -1.985 1.214) 3.976 6.255 ( -3.225 1.985 1.214) 3.976 6.403 ( 3.582 -2.404 -2.637) 5.056 6.403 ( 3.582 2.404 -2.637) 5.056 6.536 ( -7.550 -4.007 -0.364) 8.555 6.536 ( -7.550 4.007 -0.364) 8.555 6.757 ( 0.537 -2.778 -2.465) 3.753 6.757 ( 0.537 2.778 -2.465) 3.753 6.833 ( -1.658 -3.311 -3.881) 5.364 6.833 ( -1.658 3.311 -3.881) 5.364 7.162 ( 0.320 -3.936 0.546) 3.987 7.162 ( 0.320 3.936 0.546) 3.987 7.196 ( -1.428 -3.711 0.664) 4.031 7.196 ( -1.428 3.711 0.664) 4.031 7.245 ( -1.160 -0.848 -1.287) 1.929 7.245 ( -1.160 0.848 -1.287) 1.929 7.487 ( -1.754 -3.861 0.057) 4.242 7.487 ( -1.754 3.861 0.057) 4.242 8.051 ( -14.777 -7.666 2.728) 16.870 8.051 ( -14.777 7.666 2.728) 16.870 8.201 ( -11.884 -7.072 -0.888) 13.858 8.201 ( -11.884 7.072 -0.888) 13.858 9.016 ( 1.339 -1.840 -0.194) 2.285 9.016 ( 1.339 1.840 -0.194) 2.285 9.162 ( -0.179 -1.778 1.417) 2.281 9.162 ( -0.179 1.778 1.417) 2.281 9.356 ( 3.824 -2.010 1.399) 4.541 9.356 ( 3.824 2.010 1.399) 4.541 9.406 ( 1.644 -2.050 0.344) 2.650 9.406 ( 1.644 2.050 0.344) 2.650 9.567 ( 4.540 -2.596 0.033) 5.230 9.567 ( 4.540 2.596 0.033) 5.230 9.667 ( 3.103 -3.762 0.674) 4.923 9.667 ( 3.103 3.762 0.674) 4.923 9.895 ( -9.791 -1.274 0.401) 9.882 9.895 ( -9.791 1.274 0.401) 9.882 10.025 ( -7.273 -2.140 -2.490) 7.980 10.025 ( -7.273 2.140 -2.490) 7.980 10.194 ( -6.063 -5.265 -2.975) 8.563 10.194 ( -6.063 5.265 -2.975) 8.563 10.450 ( -5.794 -3.466 1.266) 6.869 10.450 ( -5.794 3.466 1.266) 6.869 10.741 ( -2.323 -3.208 1.630) 4.283 10.741 ( -2.323 3.208 1.630) 4.283 10.829 ( -4.498 -1.756 0.240) 4.834 10.829 ( -4.498 1.756 0.240) 4.834 11.677 ( 8.194 -1.844 -0.024) 8.399 11.677 ( 8.194 1.844 -0.024) 8.399 11.771 ( 6.236 -1.499 -0.049) 6.414 11.771 ( 6.236 1.499 -0.049) 6.414 12.156 ( -0.988 -4.924 -1.898) 5.368 12.156 ( -0.988 4.924 -1.898) 5.368 12.256 ( -0.766 -1.963 0.757) 2.239 12.256 ( -0.766 1.963 0.757) 2.239 12.369 ( 1.665 -2.886 -1.036) 3.489 12.369 ( 1.665 2.886 -1.036) 3.489 12.377 ( -1.690 -1.514 1.547) 2.747 12.377 ( -1.690 1.514 1.547) 2.747 12.797 ( -0.604 -4.105 -0.592) 4.191 12.797 ( -0.604 4.105 -0.592) 4.191 12.880 ( -0.433 -3.824 -0.000) 3.848 12.880 ( -0.433 3.824 -0.000) 3.848 13.591 ( 5.406 -7.613 0.240) 9.340 13.591 ( 5.406 7.613 0.240) 9.340 13.623 ( 4.585 -6.483 -0.212) 7.943 13.623 ( 4.585 6.483 -0.212) 7.943 14.202 ( 2.276 -1.839 0.510) 2.970 14.202 ( 2.276 1.839 0.510) 2.970 14.245 ( 3.881 -2.523 -0.489) 4.655 14.245 ( 3.881 2.523 -0.489) 4.655 14.656 ( -1.475 -6.152 -2.581) 6.833 14.656 ( -1.475 6.152 -2.581) 6.833 14.701 ( -4.417 -3.882 1.623) 6.100 14.701 ( -4.417 3.882 1.623) 6.100 15.219 ( -1.078 -7.811 -0.090) 7.885 15.219 ( -1.078 7.811 -0.090) 7.885 15.276 ( 1.973 -4.024 -0.438) 4.503 15.276 ( 1.973 4.024 -0.438) 4.503 15.500 ( 3.083 -0.538 -1.754) 3.588 15.500 ( 3.083 0.538 -1.754) 3.588 15.612 ( 3.410 -1.433 1.005) 3.833 15.612 ( 3.410 1.433 1.005) 3.833 15.937 ( 7.134 -1.201 -0.617) 7.261 15.937 ( 7.134 1.201 -0.617) 7.261 16.138 ( 1.878 -1.632 2.896) 3.818 16.138 ( 1.878 1.632 2.896) 3.818 16.607 ( 0.537 -0.900 0.709) 1.265 16.607 ( 0.537 0.900 0.709) 1.265 16.750 ( -1.552 -2.077 0.547) 2.650 16.750 ( -1.552 2.077 0.547) 2.650 17.344 ( 1.397 -1.029 -0.865) 1.938 17.344 ( 1.397 1.029 -0.865) 1.938 17.390 ( 0.384 -0.329 0.420) 0.658 17.390 ( 0.384 0.329 0.420) 0.658 19.903 ( 5.525 -2.738 0.252) 6.171 19.903 ( 5.525 2.738 0.252) 6.171 20.163 ( 4.311 -2.502 1.722) 5.273 20.163 ( 4.311 2.502 1.722) 5.273 20.453 ( -5.639 -1.195 1.358) 5.922 20.453 ( -5.639 1.195 1.358) 5.922 20.735 ( -2.415 -1.111 0.338) 2.679 20.735 ( -2.415 1.111 0.338) 2.679 22.189 ( 9.809 -0.424 -0.447) 9.828 22.189 ( 9.809 0.424 -0.447) 9.828 22.308 ( 6.162 -0.270 -0.060) 6.168 22.308 ( 6.162 0.270 -0.060) 6.168 22.819 ( -7.932 -3.538 0.092) 8.686 22.819 ( -7.932 3.538 0.092) 8.686 23.000 ( -10.222 -1.820 -0.249) 10.386 23.000 ( -10.222 1.820 -0.249) 10.386 27.209 ( 22.230 -4.986 -2.375) 22.906 27.209 ( 22.230 4.986 -2.375) 22.906 27.481 ( 22.440 -13.527 5.722) 26.819 27.481 ( 22.440 13.527 5.722) 26.819 28.549 ( -22.565 -6.923 -1.082) 23.627 28.549 ( -22.565 6.923 -1.082) 23.627 28.667 ( -18.927 -10.861 1.714) 21.889 28.667 ( -18.927 10.861 1.714) 21.889 30.529 ( 7.234 -6.667 -1.827) 10.005 30.529 ( 7.234 6.667 -1.827) 10.005 30.712 ( 2.673 -4.258 0.454) 5.048 30.712 ( 2.673 4.258 0.454) 5.048 31.081 ( 5.428 -7.808 1.794) 9.677 31.081 ( 5.428 7.808 1.794) 9.677 31.220 ( 7.844 -5.555 0.587) 9.630 31.220 ( 7.844 5.555 0.587) 9.630 31.594 ( -8.806 -4.789 -1.696) 10.166 31.594 ( -8.806 4.789 -1.696) 10.166 31.807 ( -5.395 -2.448 1.355) 6.078 31.807 ( -5.395 2.448 1.355) 6.078 32.202 ( 3.207 -6.998 3.401) 8.415 32.202 ( 3.207 6.998 3.401) 8.415 32.450 ( 0.280 -15.787 16.658) 22.952 32.450 ( 0.280 15.787 16.658) 22.952 33.071 ( 3.979 -1.800 -0.732) 4.429 33.071 ( 3.979 1.800 -0.732) 4.429 33.183 ( 12.061 -1.179 1.905) 12.268 33.183 ( 12.061 1.179 1.905) 12.268 33.606 ( -3.881 -3.525 0.617) 5.279 33.606 ( -3.881 3.525 0.617) 5.279 33.872 ( -8.686 -1.383 4.966) 10.101 33.872 ( -8.686 1.383 4.966) 10.101 34.903 ( 0.202 -1.267 -0.085) 1.286 34.903 ( 0.202 1.267 -0.085) 1.286 35.152 ( 2.090 -1.404 -4.945) 5.549 35.152 ( 2.090 1.404 -4.945) 5.549 35.719 ( 3.084 -4.239 2.182) 5.678 35.719 ( 3.084 4.239 2.182) 5.678 35.797 ( 3.690 -3.818 1.298) 5.466 35.797 ( 3.690 3.818 1.298) 5.466 36.061 ( 5.064 -1.234 -11.326) 12.468 36.061 ( 5.064 1.234 -11.326) 12.468 36.385 ( -5.148 -1.675 -4.021) 6.744 36.385 ( -5.148 1.675 -4.021) 6.744 37.451 ( 5.277 -12.783 -11.940) 18.271 37.451 ( 5.277 12.783 -11.940) 18.271 38.056 ( -17.291 -8.954 7.060) 20.712 38.056 ( -17.291 8.954 7.060) 20.712 ======================= Grid point 116 (65/69) ======================= q-point: ( 0.44 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.926 ( 9.584 -8.357 2.095) 12.887 1.926 ( 9.584 8.357 2.095) 12.887 2.237 ( -1.851 -8.394 -0.535) 8.612 2.237 ( -1.851 8.394 -0.535) 8.612 2.315 ( -2.530 -9.654 -7.041) 12.214 2.315 ( -2.530 9.654 -7.041) 12.214 2.476 ( 1.134 -7.160 -5.576) 9.146 2.476 ( 1.134 7.160 -5.576) 9.146 2.666 ( -0.973 -6.853 -1.864) 7.169 2.666 ( -0.973 6.853 -1.864) 7.169 2.836 ( 9.722 -4.075 -1.330) 10.625 2.836 ( 9.722 4.075 -1.330) 10.625 2.951 ( -1.847 -5.782 1.771) 6.323 2.951 ( -1.847 5.782 1.771) 6.323 3.131 ( 6.613 -5.871 -0.841) 8.884 3.131 ( 6.613 5.871 -0.841) 8.884 3.242 ( 2.994 -9.277 -1.824) 9.917 3.242 ( 2.994 9.277 -1.824) 9.917 3.334 ( -10.066 -2.616 -0.111) 10.401 3.334 ( -10.066 2.616 -0.111) 10.401 3.478 ( 6.103 -7.563 -3.126) 10.209 3.478 ( 6.103 7.563 -3.126) 10.209 3.687 ( -3.721 -2.865 -10.223) 11.250 3.687 ( -3.721 2.865 -10.223) 11.250 3.884 ( 2.989 -8.606 2.598) 9.474 3.884 ( 2.989 8.606 2.598) 9.474 4.027 ( 6.482 -5.397 -1.489) 8.565 4.027 ( 6.482 5.397 -1.489) 8.565 4.315 ( -0.436 -5.176 -1.818) 5.503 4.315 ( -0.436 5.176 -1.818) 5.503 4.405 ( -1.130 -8.226 5.627) 10.030 4.405 ( -1.130 8.226 5.627) 10.030 4.492 ( -0.670 -4.869 3.516) 6.042 4.492 ( -0.670 4.869 3.516) 6.042 4.542 ( 4.477 -3.403 1.476) 5.814 4.542 ( 4.477 3.403 1.476) 5.814 4.709 ( 0.039 -5.130 -1.111) 5.249 4.709 ( 0.039 5.130 -1.111) 5.249 4.830 ( -3.408 -10.363 -1.410) 11.000 4.830 ( -3.408 10.363 -1.410) 11.000 4.926 ( 0.135 -1.059 0.450) 1.158 4.926 ( 0.135 1.059 0.450) 1.158 5.086 ( 0.356 -5.702 -5.365) 7.837 5.086 ( 0.356 5.702 -5.365) 7.837 5.366 ( 0.568 -2.750 1.960) 3.424 5.366 ( 0.568 2.750 1.960) 3.424 5.443 ( -3.168 -3.404 -0.784) 4.716 5.443 ( -3.168 3.404 -0.784) 4.716 5.640 ( 0.896 -5.210 4.831) 7.162 5.640 ( 0.896 5.210 4.831) 7.162 5.830 ( -0.213 -2.086 -0.351) 2.126 5.830 ( -0.213 2.086 -0.351) 2.126 5.919 ( 0.527 -3.165 6.482) 7.232 5.919 ( 0.527 3.165 6.482) 7.232 5.986 ( -0.913 -2.382 6.224) 6.726 5.986 ( -0.913 2.382 6.224) 6.726 6.153 ( -0.676 -0.345 1.944) 2.087 6.153 ( -0.676 0.345 1.944) 2.087 6.208 ( -0.416 -3.437 -1.100) 3.632 6.208 ( -0.416 3.437 -1.100) 3.632 6.412 ( -6.582 -1.511 3.166) 7.459 6.412 ( -6.582 1.511 3.166) 7.459 6.479 ( 7.250 -4.551 -3.456) 9.231 6.479 ( 7.250 4.551 -3.456) 9.231 6.705 ( -2.230 -3.670 -4.098) 5.935 6.705 ( -2.230 3.670 -4.098) 5.935 6.764 ( -0.915 -2.175 -4.844) 5.388 6.764 ( -0.915 2.175 -4.844) 5.388 7.144 ( 1.678 -2.405 0.321) 2.950 7.144 ( 1.678 2.405 0.321) 2.950 7.201 ( -1.727 -1.332 -0.831) 2.334 7.201 ( -1.727 1.332 -0.831) 2.334 7.285 ( 2.692 -4.202 3.471) 6.079 7.285 ( 2.692 4.202 3.471) 6.079 7.447 ( -3.429 -3.496 -0.499) 4.922 7.447 ( -3.429 3.496 -0.499) 4.922 7.952 ( -3.486 -7.192 4.489) 9.167 7.952 ( -3.486 7.192 4.489) 9.167 8.062 ( -3.993 -7.272 -1.181) 8.380 8.062 ( -3.993 7.272 -1.181) 8.380 9.027 ( 0.673 -1.019 -0.510) 1.323 9.027 ( 0.673 1.019 -0.510) 1.323 9.168 ( -0.475 -1.261 0.839) 1.587 9.168 ( -0.475 1.261 0.839) 1.587 9.411 ( 1.647 -1.112 1.027) 2.237 9.411 ( 1.647 1.112 1.027) 2.237 9.443 ( 1.871 -1.684 0.681) 2.608 9.443 ( 1.871 1.684 0.681) 2.608 9.639 ( 3.351 -1.097 0.673) 3.590 9.639 ( 3.351 1.097 0.673) 3.590 9.689 ( 0.178 -1.996 -1.842) 2.722 9.689 ( 0.178 1.996 -1.842) 2.722 9.761 ( -7.517 -1.389 2.839) 8.154 9.761 ( -7.517 1.389 2.839) 8.154 9.905 ( -3.706 -1.510 -2.039) 4.491 9.905 ( -3.706 1.510 -2.039) 4.491 10.136 ( 1.474 -2.450 -2.552) 3.832 10.136 ( 1.474 2.450 -2.552) 3.832 10.365 ( -4.381 -1.767 -0.563) 4.757 10.365 ( -4.381 1.767 -0.563) 4.757 10.745 ( -0.846 -4.452 2.220) 5.046 10.745 ( -0.846 4.452 2.220) 5.046 10.788 ( -0.804 -4.083 -0.069) 4.162 10.788 ( -0.804 4.083 -0.069) 4.162 11.774 ( 3.818 -2.110 0.441) 4.385 11.774 ( 3.818 2.110 0.441) 4.385 11.820 ( 0.731 -1.232 -0.413) 1.491 11.820 ( 0.731 1.232 -0.413) 1.491 12.130 ( -0.324 -2.430 -0.818) 2.584 12.130 ( -0.324 2.430 -0.818) 2.584 12.238 ( -0.635 -0.668 -0.675) 1.143 12.238 ( -0.635 0.668 -0.675) 1.143 12.359 ( -0.873 -1.566 0.090) 1.796 12.359 ( -0.873 1.566 0.090) 1.796 12.409 ( 1.709 -2.147 0.070) 2.745 12.409 ( 1.709 2.147 0.070) 2.745 12.794 ( 0.839 -2.581 0.656) 2.792 12.794 ( 0.839 2.581 0.656) 2.792 12.858 ( -1.700 -2.525 -0.723) 3.129 12.858 ( -1.700 2.525 -0.723) 3.129 13.648 ( 1.785 -3.439 -0.139) 3.877 13.648 ( 1.785 3.439 -0.139) 3.877 13.666 ( 1.427 -3.340 -0.067) 3.633 13.666 ( 1.427 3.340 -0.067) 3.633 14.269 ( 3.636 -4.209 0.997) 5.650 14.269 ( 3.636 4.209 0.997) 5.650 14.308 ( 3.721 -3.512 -0.791) 5.177 14.308 ( 3.721 3.512 -0.791) 5.177 14.579 ( -4.222 -1.948 -0.719) 4.705 14.579 ( -4.222 1.948 -0.719) 4.705 14.648 ( -2.670 -5.811 0.229) 6.399 14.648 ( -2.670 5.811 0.229) 6.399 15.186 ( -1.526 -3.972 -0.564) 4.292 15.186 ( -1.526 3.972 -0.564) 4.292 15.268 ( -0.957 -2.700 -0.314) 2.882 15.268 ( -0.957 2.700 -0.314) 2.882 15.549 ( 3.217 -1.040 -0.746) 3.463 15.549 ( 3.217 1.040 -0.746) 3.463 15.657 ( 1.389 -1.294 -0.152) 1.904 15.657 ( 1.389 1.294 -0.152) 1.904 16.038 ( 4.740 -1.386 0.402) 4.955 16.038 ( 4.740 1.386 0.402) 4.955 16.162 ( -0.792 -1.988 0.640) 2.234 16.162 ( -0.792 1.988 0.640) 2.234 16.630 ( 0.687 -1.359 1.697) 2.280 16.630 ( 0.687 1.359 1.697) 2.280 16.710 ( -2.323 -0.681 -0.935) 2.595 16.710 ( -2.323 0.681 -0.935) 2.595 17.344 ( 0.158 -0.736 -1.055) 1.296 17.344 ( 0.158 0.736 -1.055) 1.296 17.407 ( 0.790 -0.059 0.635) 1.015 17.407 ( 0.790 0.059 0.635) 1.015 19.993 ( 4.939 -2.099 -0.033) 5.367 19.993 ( 4.939 2.099 -0.033) 5.367 20.189 ( -1.770 -2.153 -0.048) 2.788 20.189 ( -1.770 2.153 -0.048) 2.788 20.411 ( -2.344 -0.708 2.251) 3.326 20.411 ( -2.344 0.708 2.251) 3.326 20.715 ( -0.597 -0.945 0.485) 1.218 20.715 ( -0.597 0.945 0.485) 1.218 22.342 ( 8.037 -2.181 0.384) 8.337 22.342 ( 8.037 2.181 0.384) 8.337 22.376 ( 2.365 -2.917 -0.301) 3.767 22.376 ( 2.365 2.917 -0.301) 3.767 22.706 ( -5.522 -2.087 -0.356) 5.914 22.706 ( -5.522 2.087 -0.356) 5.914 22.875 ( -4.923 -0.933 0.230) 5.016 22.875 ( -4.923 0.933 0.230) 5.016 27.529 ( 20.342 -6.927 -0.614) 21.498 27.529 ( 20.342 6.927 -0.614) 21.498 27.751 ( 1.484 -12.482 0.530) 12.581 27.751 ( 1.484 12.482 0.530) 12.581 28.267 ( -7.969 -7.860 1.346) 11.274 28.267 ( -7.969 7.860 1.346) 11.274 28.430 ( -13.045 -11.310 1.840) 17.363 28.430 ( -13.045 11.310 1.840) 17.363 30.596 ( 2.753 -3.062 -0.636) 4.167 30.596 ( 2.753 3.062 -0.636) 4.167 30.745 ( 1.294 -1.684 -0.245) 2.138 30.745 ( 1.294 1.684 -0.245) 2.138 31.169 ( 4.115 -3.780 1.384) 5.757 31.169 ( 4.115 3.780 1.384) 5.757 31.288 ( -0.637 -2.717 -1.723) 3.280 31.288 ( -0.637 2.717 -1.723) 3.280 31.492 ( -1.961 -2.620 0.730) 3.353 31.492 ( -1.961 2.620 0.730) 3.353 31.763 ( -2.086 -1.296 1.499) 2.877 31.763 ( -2.086 1.296 1.499) 2.877 32.328 ( 4.431 -7.042 6.637) 10.643 32.328 ( 4.431 7.042 6.637) 10.643 32.581 ( -3.203 -10.810 10.991) 15.745 32.581 ( -3.203 10.810 10.991) 15.745 33.055 ( -0.762 -0.948 -4.423) 4.588 33.055 ( -0.762 0.948 -4.423) 4.588 33.346 ( 5.904 -0.998 -0.329) 5.996 33.346 ( 5.904 0.998 -0.329) 5.996 33.595 ( 1.063 -3.015 2.527) 4.075 33.595 ( 1.063 3.015 2.527) 4.075 33.778 ( -7.850 -0.495 2.637) 8.296 33.778 ( -7.850 0.495 2.637) 8.296 34.937 ( 1.107 -1.085 3.524) 3.850 34.937 ( 1.107 1.085 3.524) 3.850 35.116 ( 0.954 -1.119 -5.688) 5.875 35.116 ( 0.954 1.119 -5.688) 5.875 35.787 ( 1.977 -3.157 2.412) 4.438 35.787 ( 1.977 3.157 2.412) 4.438 35.864 ( 2.278 -4.752 2.358) 5.774 35.864 ( 2.278 4.752 2.358) 5.774 36.022 ( 5.030 -2.301 -9.722) 11.185 36.022 ( 5.030 2.301 -9.722) 11.185 36.195 ( -6.728 -1.748 -9.424) 11.710 36.195 ( -6.728 1.748 -9.424) 11.710 37.541 ( 12.110 -7.969 -1.503) 14.574 37.541 ( 12.110 7.969 -1.503) 14.574 37.846 ( -15.115 -6.235 2.612) 16.558 37.846 ( -15.115 6.235 2.612) 16.558 ======================= Grid point 118 (66/69) ======================= q-point: (-0.44 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( -11.808 -8.361 0.754) 14.488 1.941 ( -11.808 8.361 0.754) 14.488 2.188 ( 4.881 -8.496 -2.885) 10.214 2.188 ( 4.881 8.496 -2.885) 10.214 2.308 ( -0.901 -3.332 -0.025) 3.452 2.308 ( -0.901 3.332 -0.025) 3.452 2.418 ( -3.991 -6.868 -0.951) 8.000 2.418 ( -3.991 6.868 -0.951) 8.000 2.624 ( -1.403 -1.186 2.017) 2.728 2.624 ( -1.403 1.186 2.017) 2.728 2.819 ( -2.357 -3.897 -1.104) 4.686 2.819 ( -2.357 3.897 -1.104) 4.686 3.004 ( -9.454 -1.547 -1.369) 9.677 3.004 ( -9.454 1.547 -1.369) 9.677 3.130 ( -2.589 -1.722 0.474) 3.145 3.130 ( -2.589 1.722 0.474) 3.145 3.225 ( 1.267 -6.493 -0.745) 6.657 3.225 ( 1.267 6.493 -0.745) 6.657 3.331 ( 6.815 -9.596 1.603) 11.879 3.331 ( 6.815 9.596 1.603) 11.879 3.452 ( 1.841 -1.237 -5.412) 5.849 3.452 ( 1.841 1.237 -5.412) 5.849 3.586 ( 0.271 -1.642 0.788) 1.841 3.586 ( 0.271 1.642 0.788) 1.841 3.917 ( -3.644 -2.604 0.211) 4.483 3.917 ( -3.644 2.604 0.211) 4.483 4.025 ( -6.854 -2.324 -1.492) 7.389 4.025 ( -6.854 2.324 -1.492) 7.389 4.305 ( -3.950 -2.490 -0.969) 4.769 4.305 ( -3.950 2.490 -0.969) 4.769 4.417 ( 1.557 -3.614 3.717) 5.413 4.417 ( 1.557 3.614 3.717) 5.413 4.501 ( -2.331 -3.020 1.576) 4.128 4.501 ( -2.331 3.020 1.576) 4.128 4.598 ( 3.088 -4.884 -0.924) 5.852 4.598 ( 3.088 4.884 -0.924) 5.852 4.705 ( 1.025 -7.923 2.185) 8.283 4.705 ( 1.025 7.923 2.185) 8.283 4.789 ( 1.445 -4.777 -2.795) 5.720 4.789 ( 1.445 4.777 -2.795) 5.720 4.937 ( -2.510 -4.515 -0.450) 5.185 4.937 ( -2.510 4.515 -0.450) 5.185 5.062 ( 5.207 -1.029 -3.510) 6.363 5.062 ( 5.207 1.029 -3.510) 6.363 5.369 ( -2.652 -4.788 2.414) 5.982 5.369 ( -2.652 4.788 2.414) 5.982 5.432 ( 2.239 -3.756 0.106) 4.374 5.432 ( 2.239 3.756 0.106) 4.374 5.712 ( -6.236 -4.216 0.620) 7.552 5.712 ( -6.236 4.216 0.620) 7.552 5.781 ( 4.140 -4.004 1.558) 5.966 5.781 ( 4.140 4.004 1.558) 5.966 5.975 ( -2.341 -1.907 6.032) 6.746 5.975 ( -2.341 1.907 6.032) 6.746 6.016 ( -1.263 -2.802 0.118) 3.076 6.016 ( -1.263 2.802 0.118) 3.076 6.160 ( 1.331 -1.365 -0.016) 1.907 6.160 ( 1.331 1.365 -0.016) 1.907 6.245 ( 7.290 -2.815 -2.591) 8.233 6.245 ( 7.290 2.815 -2.591) 8.233 6.380 ( -3.165 -4.890 3.983) 7.057 6.380 ( -3.165 4.890 3.983) 7.057 6.519 ( 0.947 -2.062 -5.133) 5.612 6.519 ( 0.947 2.062 -5.133) 5.612 6.659 ( 1.728 -0.906 0.070) 1.952 6.659 ( 1.728 0.906 0.070) 1.952 6.719 ( 1.263 -2.162 -1.708) 3.031 6.719 ( 1.263 2.162 -1.708) 3.031 7.128 ( -5.065 -1.907 1.301) 5.566 7.128 ( -5.065 1.907 1.301) 5.566 7.207 ( 2.915 -1.253 -0.627) 3.234 7.207 ( 2.915 1.253 -0.627) 3.234 7.322 ( -2.166 -3.664 0.163) 4.260 7.322 ( -2.166 3.664 0.163) 4.260 7.430 ( 3.001 -2.299 0.739) 3.852 7.430 ( 3.001 2.299 0.739) 3.852 7.999 ( 3.854 -5.797 1.642) 7.152 7.999 ( 3.854 5.797 1.642) 7.152 8.059 ( 6.041 -5.399 -2.094) 8.369 8.059 ( 6.041 5.399 -2.094) 8.369 9.026 ( 0.000 -0.239 -0.461) 0.519 9.026 ( 0.000 0.239 -0.461) 0.519 9.171 ( -0.079 -0.979 0.575) 1.138 9.171 ( -0.079 0.979 0.575) 1.138 9.420 ( -2.042 -0.635 0.497) 2.195 9.420 ( -2.042 0.635 0.497) 2.195 9.458 ( -0.174 -1.051 -0.738) 1.296 9.458 ( -0.174 1.051 -0.738) 1.296 9.622 ( -5.941 -1.390 1.903) 6.392 9.622 ( -5.941 1.390 1.903) 6.392 9.668 ( 0.090 -1.930 0.199) 1.943 9.668 ( 0.090 1.930 0.199) 1.943 9.803 ( 8.361 -0.883 0.564) 8.426 9.803 ( 8.361 0.883 0.564) 8.426 9.886 ( 2.906 -1.031 -1.449) 3.407 9.886 ( 2.906 1.031 -1.449) 3.407 10.122 ( -0.643 -3.051 -1.491) 3.456 10.122 ( -0.643 3.051 -1.491) 3.456 10.355 ( 3.843 -1.589 0.326) 4.171 10.355 ( 3.843 1.589 0.326) 4.171 10.752 ( -0.744 -6.533 1.607) 6.769 10.752 ( -0.744 6.533 1.607) 6.769 10.798 ( 2.423 -6.209 -0.958) 6.733 10.798 ( 2.423 6.209 -0.958) 6.733 11.786 ( -3.492 -1.761 -0.633) 3.961 11.786 ( -3.492 1.761 -0.633) 3.961 11.807 ( -1.324 -1.716 0.760) 2.296 11.807 ( -1.324 1.716 0.760) 2.296 12.123 ( 0.027 -0.562 -0.197) 0.596 12.123 ( 0.027 0.562 -0.197) 0.596 12.236 ( 1.439 -1.015 -0.527) 1.838 12.236 ( 1.439 1.015 -0.527) 1.838 12.350 ( -0.846 -1.140 0.761) 1.611 12.350 ( -0.846 1.140 0.761) 1.611 12.414 ( -0.510 -1.598 -0.317) 1.707 12.414 ( -0.510 1.598 -0.317) 1.707 12.811 ( -1.039 -2.533 -0.748) 2.839 12.811 ( -1.039 2.533 -0.748) 2.839 12.844 ( 2.095 -2.308 0.511) 3.158 12.844 ( 2.095 2.308 0.511) 3.158 13.646 ( -1.857 -2.051 0.061) 2.767 13.646 ( -1.857 2.051 0.061) 2.767 13.667 ( -1.348 -2.187 -0.095) 2.571 13.667 ( -1.348 2.187 -0.095) 2.571 14.281 ( -3.749 -2.582 0.488) 4.578 14.281 ( -3.749 2.582 0.488) 4.578 14.299 ( -3.381 -2.584 -0.573) 4.294 14.299 ( -3.381 2.584 -0.573) 4.294 14.564 ( 2.419 -4.135 0.533) 4.820 14.564 ( 2.419 4.135 0.533) 4.820 14.660 ( 4.476 -2.362 -0.738) 5.114 14.660 ( 4.476 2.362 -0.738) 5.114 15.175 ( 0.339 -2.972 0.388) 3.016 15.175 ( 0.339 2.972 0.388) 3.016 15.270 ( 1.918 -2.806 -0.482) 3.433 15.270 ( 1.918 2.806 -0.482) 3.433 15.543 ( -3.557 -1.108 -0.197) 3.731 15.543 ( -3.557 1.108 -0.197) 3.731 15.655 ( -1.378 -1.287 0.037) 1.886 15.655 ( -1.378 1.287 0.037) 1.886 16.052 ( -3.320 -1.037 -0.827) 3.575 16.052 ( -3.320 1.037 -0.827) 3.575 16.162 ( 0.699 -2.327 0.659) 2.518 16.162 ( 0.699 2.327 0.659) 2.518 16.652 ( -0.815 -0.463 0.411) 1.024 16.652 ( -0.815 0.463 0.411) 1.024 16.690 ( 1.774 -1.047 0.197) 2.069 16.690 ( 1.774 1.047 0.197) 2.069 17.333 ( -0.513 -0.200 -0.089) 0.557 17.333 ( -0.513 0.200 -0.089) 0.557 17.417 ( 0.033 -0.643 -0.259) 0.694 17.417 ( 0.033 0.643 -0.259) 0.694 20.001 ( -3.723 -2.019 -0.752) 4.302 20.001 ( -3.723 2.019 -0.752) 4.302 20.187 ( 2.264 -1.327 0.105) 2.627 20.187 ( 2.264 1.327 0.105) 2.627 20.410 ( -1.213 -1.098 2.409) 2.912 20.410 ( -1.213 1.098 2.409) 2.912 20.727 ( 2.057 -0.658 -0.584) 2.237 20.727 ( 2.057 0.658 -0.584) 2.237 22.348 ( -6.397 -4.690 -0.096) 7.933 22.348 ( -6.397 4.690 -0.096) 7.933 22.374 ( -3.843 -4.840 -0.166) 6.182 22.374 ( -3.843 4.840 -0.166) 6.182 22.707 ( 6.854 -0.959 -0.512) 6.940 22.707 ( 6.854 0.959 -0.512) 6.940 22.871 ( 3.538 -0.503 0.627) 3.629 22.871 ( 3.538 0.503 0.627) 3.629 27.531 ( -21.742 -6.968 -0.789) 22.845 27.531 ( -21.742 6.968 -0.789) 22.845 27.741 ( 1.217 -11.878 1.381) 12.019 27.741 ( 1.217 11.878 1.381) 12.019 28.290 ( 7.132 -7.682 -0.638) 10.501 28.290 ( 7.132 7.682 -0.638) 10.501 28.442 ( 13.015 -9.336 0.952) 16.046 28.442 ( 13.015 9.336 0.952) 16.046 30.590 ( -3.136 -1.437 -0.018) 3.449 30.590 ( -3.136 1.437 -0.018) 3.449 30.742 ( -1.546 -1.246 0.010) 1.986 30.742 ( -1.546 1.246 0.010) 1.986 31.190 ( -5.217 -2.721 -0.306) 5.892 31.190 ( -5.217 2.721 -0.306) 5.892 31.254 ( 1.031 -2.669 1.153) 3.084 31.254 ( 1.031 2.669 1.153) 3.084 31.510 ( 3.157 -2.558 -0.850) 4.151 31.510 ( 3.157 2.558 -0.850) 4.151 31.777 ( 2.352 -1.897 0.140) 3.025 31.777 ( 2.352 1.897 0.140) 3.025 32.380 ( -6.962 -7.568 2.941) 10.695 32.380 ( -6.962 7.568 2.941) 10.695 32.684 ( 7.497 -9.882 3.486) 12.885 32.684 ( 7.497 9.882 3.486) 12.885 32.989 ( -3.277 -0.649 -0.142) 3.344 32.989 ( -3.277 0.649 -0.142) 3.344 33.355 ( -2.511 -0.117 -1.457) 2.906 33.355 ( -2.511 0.117 -1.457) 2.906 33.617 ( -1.971 -2.606 1.327) 3.526 33.617 ( -1.971 2.606 1.327) 3.526 33.796 ( 8.263 -0.127 1.049) 8.330 33.796 ( 8.263 0.127 1.049) 8.330 34.995 ( -0.442 -0.963 5.057) 5.167 34.995 ( -0.442 0.963 5.057) 5.167 35.052 ( -0.332 -0.587 -6.374) 6.409 35.052 ( -0.332 0.587 -6.374) 6.409 35.824 ( -0.553 -2.593 2.157) 3.418 35.824 ( -0.553 2.593 2.157) 3.418 35.884 ( -0.132 -2.371 -4.856) 5.406 35.884 ( -0.132 2.371 -4.856) 5.406 36.007 ( -2.502 -0.636 -1.764) 3.126 36.007 ( -2.502 0.636 -1.764) 3.126 36.045 ( 2.495 -1.325 -1.930) 3.421 36.045 ( 2.495 1.325 -1.930) 3.421 37.501 ( -17.421 -7.720 2.134) 19.174 37.501 ( -17.421 7.720 2.134) 19.174 37.882 ( 17.294 -8.352 -0.665) 19.217 37.882 ( 17.294 8.352 -0.665) 19.217 ======================= Grid point 120 (67/69) ======================= q-point: (-0.33 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( -17.275 -14.458 1.978) 22.614 1.710 ( -17.275 14.458 1.978) 22.614 2.138 ( -18.723 -10.777 2.252) 21.720 2.138 ( -18.723 10.777 2.252) 21.720 2.285 ( 2.074 -9.063 6.647) 11.429 2.285 ( 2.074 9.063 6.647) 11.429 2.372 ( -3.316 -1.897 2.941) 4.821 2.372 ( -3.316 1.897 2.941) 4.821 2.650 ( 1.615 -4.205 -1.429) 4.726 2.650 ( 1.615 4.205 -1.429) 4.726 2.767 ( -1.947 -1.121 -1.523) 2.715 2.767 ( -1.947 1.121 -1.523) 2.715 2.923 ( -3.719 -11.136 6.678) 13.507 2.923 ( -3.719 11.136 6.678) 13.507 2.996 ( -6.089 -2.348 -4.565) 7.964 2.996 ( -6.089 2.348 -4.565) 7.964 3.206 ( -2.831 -3.061 -1.436) 4.410 3.206 ( -2.831 3.061 -1.436) 4.410 3.393 ( -1.553 -6.543 1.461) 6.882 3.393 ( -1.553 6.543 1.461) 6.882 3.525 ( 7.836 -5.052 -4.157) 10.208 3.525 ( 7.836 5.052 -4.157) 10.208 3.621 ( -1.583 -5.494 2.033) 6.068 3.621 ( -1.583 5.494 2.033) 6.068 3.839 ( -4.370 -6.231 5.782) 9.558 3.839 ( -4.370 6.231 5.782) 9.558 3.917 ( -2.457 -4.398 1.010) 5.138 3.917 ( -2.457 4.398 1.010) 5.138 4.203 ( -12.888 -10.448 1.228) 16.637 4.203 ( -12.888 10.448 1.228) 16.637 4.392 ( -2.555 -9.540 1.965) 10.070 4.392 ( -2.555 9.540 1.965) 10.070 4.497 ( -0.552 -1.791 -1.401) 2.340 4.497 ( -0.552 1.791 -1.401) 2.340 4.597 ( 0.480 -5.610 -6.195) 8.371 4.597 ( 0.480 5.610 -6.195) 8.371 4.717 ( -2.533 -4.529 -3.589) 6.310 4.717 ( -2.533 4.529 -3.589) 6.310 4.808 ( -1.212 -5.911 1.392) 6.192 4.808 ( -1.212 5.911 1.392) 6.192 4.889 ( 0.340 -6.787 4.697) 8.261 4.889 ( 0.340 6.787 4.697) 8.261 5.180 ( 9.903 -4.033 0.034) 10.693 5.180 ( 9.903 4.033 0.034) 10.693 5.318 ( -4.559 -1.831 -1.362) 5.099 5.318 ( -4.559 1.831 -1.362) 5.099 5.496 ( 3.450 -4.683 0.846) 5.878 5.496 ( 3.450 4.683 0.846) 5.878 5.659 ( 0.226 -1.251 2.109) 2.462 5.659 ( 0.226 1.251 2.109) 2.462 5.802 ( -1.898 -0.488 -3.051) 3.626 5.802 ( -1.898 0.488 -3.051) 3.626 5.938 ( -3.424 -4.579 -3.919) 6.932 5.938 ( -3.424 4.579 -3.919) 6.932 6.018 ( 1.682 -2.173 0.540) 2.801 6.018 ( 1.682 2.173 0.540) 2.801 6.183 ( -1.711 -1.775 -0.065) 2.467 6.183 ( -1.711 1.775 -0.065) 2.467 6.317 ( 5.742 -3.747 -4.529) 8.217 6.317 ( 5.742 3.747 -4.529) 8.217 6.373 ( 0.308 -5.220 -1.166) 5.358 6.373 ( 0.308 5.220 -1.166) 5.358 6.489 ( 1.220 -4.009 2.640) 4.952 6.489 ( 1.220 4.009 2.640) 4.952 6.705 ( 1.568 -0.913 1.648) 2.452 6.705 ( 1.568 0.913 1.648) 2.452 6.776 ( 4.869 -2.530 1.272) 5.633 6.776 ( 4.869 2.530 1.272) 5.633 7.102 ( -1.633 -3.727 4.484) 6.055 7.102 ( -1.633 3.727 4.484) 6.055 7.221 ( 1.210 -1.500 -1.852) 2.673 7.221 ( 1.210 1.500 -1.852) 2.673 7.275 ( -1.439 -0.796 -2.076) 2.649 7.275 ( -1.439 0.796 -2.076) 2.649 7.487 ( 2.412 -3.517 0.060) 4.265 7.487 ( 2.412 3.517 0.060) 4.265 8.114 ( 12.446 -6.408 -2.232) 14.176 8.114 ( 12.446 6.408 -2.232) 14.176 8.193 ( 12.489 -5.534 -0.519) 13.670 8.193 ( 12.489 5.534 -0.519) 13.670 9.018 ( -0.401 -1.881 -0.443) 1.973 9.018 ( -0.401 1.881 -0.443) 1.973 9.177 ( 0.061 -0.905 0.161) 0.921 9.177 ( 0.061 0.905 0.161) 0.921 9.379 ( -3.371 -1.344 -0.124) 3.631 9.379 ( -3.371 1.344 -0.124) 3.631 9.418 ( -2.529 -3.835 -1.344) 4.787 9.418 ( -2.529 3.835 -1.344) 4.787 9.551 ( -5.517 -2.300 1.722) 6.220 9.551 ( -5.517 2.300 1.722) 6.220 9.678 ( -0.562 -3.702 -0.312) 3.758 9.678 ( -0.562 3.702 -0.312) 3.758 9.915 ( 3.035 -0.987 -1.148) 3.392 9.915 ( 3.035 0.987 -1.148) 3.392 9.975 ( 10.578 -1.973 1.580) 10.876 9.975 ( 10.578 1.973 1.580) 10.876 10.156 ( 7.645 -5.658 0.502) 9.524 10.156 ( 7.645 5.658 0.502) 9.524 10.456 ( 7.313 -2.818 0.399) 7.848 10.456 ( 7.313 2.818 0.399) 7.848 10.764 ( 1.297 -4.276 -0.088) 4.469 10.764 ( 1.297 4.276 -0.088) 4.469 10.840 ( 4.585 -5.150 -0.821) 6.944 10.840 ( 4.585 5.150 -0.821) 6.944 11.685 ( -8.071 -1.673 -0.790) 8.280 11.685 ( -8.071 1.673 -0.790) 8.280 11.760 ( -6.456 -1.092 0.980) 6.620 11.760 ( -6.456 1.092 0.980) 6.620 12.125 ( -0.137 -3.326 0.789) 3.421 12.125 ( -0.137 3.326 0.789) 3.421 12.270 ( 3.364 -0.516 -0.509) 3.441 12.270 ( 3.364 0.516 -0.509) 3.441 12.344 ( -1.566 -3.664 1.065) 4.124 12.344 ( -1.566 3.664 1.065) 4.124 12.406 ( 1.048 -2.054 -0.889) 2.471 12.406 ( 1.048 2.054 -0.889) 2.471 12.791 ( -0.418 -4.880 -0.118) 4.899 12.791 ( -0.418 4.880 -0.118) 4.899 12.878 ( 1.086 -4.157 0.141) 4.298 12.878 ( 1.086 4.157 0.141) 4.298 13.594 ( -5.087 -3.772 0.089) 6.334 13.594 ( -5.087 3.772 0.089) 6.334 13.620 ( -4.565 -3.559 -0.064) 5.788 13.620 ( -4.565 3.559 -0.064) 5.788 14.210 ( -3.671 -2.879 -0.084) 4.666 14.210 ( -3.671 2.879 -0.084) 4.666 14.240 ( -2.602 -5.266 -0.156) 5.876 14.240 ( -2.602 5.266 -0.156) 5.876 14.611 ( 0.608 -8.230 1.549) 8.396 14.611 ( 0.608 8.230 1.549) 8.396 14.731 ( 4.919 -3.243 -1.292) 6.032 14.731 ( 4.919 3.243 -1.292) 6.032 15.194 ( -0.652 -8.952 1.630) 9.122 15.194 ( -0.652 8.952 1.630) 9.122 15.292 ( 0.357 -6.434 -1.338) 6.581 15.292 ( 0.357 6.434 -1.338) 6.581 15.473 ( -3.228 -0.407 0.663) 3.320 15.473 ( -3.228 0.407 0.663) 3.320 15.621 ( -2.452 -1.764 0.029) 3.021 15.621 ( -2.452 1.764 0.029) 3.021 15.946 ( -7.696 -1.891 -1.116) 8.003 15.946 ( -7.696 1.891 -1.116) 8.003 16.177 ( 0.474 -3.435 -0.645) 3.527 16.177 ( 0.474 3.435 -0.645) 3.527 16.629 ( -0.959 -1.088 -1.268) 1.926 16.629 ( -0.959 1.088 -1.268) 1.926 16.741 ( 2.158 -2.733 1.486) 3.786 16.741 ( 2.158 2.733 1.486) 3.786 17.327 ( -0.635 -0.129 0.493) 0.814 17.327 ( -0.635 0.129 0.493) 0.814 17.404 ( -0.707 -1.044 -0.800) 1.494 17.404 ( -0.707 1.044 -0.800) 1.494 19.916 ( -4.778 -3.897 -0.895) 6.230 19.916 ( -4.778 3.897 -0.895) 6.230 20.190 ( -2.938 -2.594 -0.582) 3.962 20.190 ( -2.938 2.594 -0.582) 3.962 20.448 ( 3.236 -1.046 1.889) 3.890 20.448 ( 3.236 1.046 1.889) 3.890 20.757 ( 3.031 -0.119 -1.427) 3.352 20.757 ( 3.031 0.119 -1.427) 3.352 22.195 ( -10.288 -1.265 -0.965) 10.411 22.195 ( -10.288 1.265 -0.965) 10.411 22.298 ( -6.145 -0.879 0.831) 6.263 22.298 ( -6.145 0.879 0.831) 6.263 22.834 ( 9.338 -2.600 -1.265) 9.775 22.834 ( 9.338 2.600 -1.265) 9.775 22.981 ( 8.512 -1.448 1.457) 8.756 22.981 ( 8.512 1.448 1.457) 8.756 27.179 ( -22.354 -4.493 0.554) 22.807 27.179 ( -22.354 4.493 0.554) 22.807 27.566 ( -20.155 -17.159 -1.750) 26.528 27.566 ( -20.155 17.159 -1.750) 26.528 28.539 ( 21.645 -6.633 -0.021) 22.638 28.539 ( 21.645 6.633 -0.021) 22.638 28.694 ( 18.189 -11.284 -0.754) 21.419 28.694 ( 18.189 11.284 -0.754) 21.419 30.503 ( -8.381 -5.641 0.711) 10.128 30.503 ( -8.381 5.641 0.711) 10.128 30.709 ( -2.480 -3.449 0.397) 4.267 30.709 ( -2.480 3.449 0.397) 4.267 31.104 ( -4.924 -4.873 -0.227) 6.932 31.104 ( -4.924 4.873 -0.227) 6.932 31.227 ( -6.288 -2.587 0.139) 6.801 31.227 ( -6.288 2.587 0.139) 6.801 31.585 ( 7.471 -4.899 -0.585) 8.953 31.585 ( 7.471 4.899 -0.585) 8.953 31.828 ( 4.724 -2.655 -0.918) 5.496 31.828 ( 4.724 2.655 -0.918) 5.496 32.263 ( -6.557 -8.614 -1.164) 10.888 32.263 ( -6.557 8.614 -1.164) 10.888 32.739 ( 0.688 -9.765 -8.454) 12.934 32.739 ( 0.688 9.765 -8.454) 12.934 33.004 ( -0.482 -3.380 5.003) 6.056 33.004 ( -0.482 3.380 5.003) 6.056 33.254 ( -4.902 -0.862 -3.131) 5.880 33.254 ( -4.902 0.862 -3.131) 5.880 33.661 ( 7.645 -8.402 -2.225) 11.575 33.661 ( 7.645 8.402 -2.225) 11.575 33.949 ( 10.341 -0.915 -1.776) 10.532 33.949 ( 10.341 0.915 -1.776) 10.532 34.958 ( -1.941 -0.497 -5.830) 6.164 34.958 ( -1.941 0.497 -5.830) 6.164 35.039 ( -1.857 -1.100 5.157) 5.591 35.039 ( -1.857 1.100 5.157) 5.591 35.777 ( -3.413 -2.541 -4.298) 6.048 35.777 ( -3.413 2.541 -4.298) 6.048 35.836 ( -2.342 -3.383 0.177) 4.118 35.836 ( -2.342 3.383 0.177) 4.118 35.914 ( -3.463 -0.901 -1.419) 3.850 35.914 ( -3.463 0.901 -1.419) 3.850 36.194 ( 5.396 -1.978 11.994) 13.300 36.194 ( 5.396 1.978 11.994) 13.300 37.257 ( -17.380 -10.384 5.965) 21.106 37.257 ( -17.380 10.384 5.965) 21.106 38.158 ( 18.879 -9.720 -2.567) 21.389 38.158 ( 18.879 9.720 -2.567) 21.389 ======================= Grid point 122 (68/69) ======================= q-point: (-0.22 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( -11.924 -15.673 12.445) 23.295 1.549 ( -11.924 15.673 12.445) 23.295 1.875 ( -18.242 -13.460 7.761) 23.962 1.875 ( -18.242 13.460 7.761) 23.962 2.266 ( -12.764 -1.684 1.219) 12.932 2.266 ( -12.764 1.684 1.219) 12.932 2.432 ( 1.768 -10.304 8.122) 13.239 2.432 ( 1.768 10.304 8.122) 13.239 2.644 ( 0.445 -13.446 -3.859) 13.996 2.644 ( 0.445 13.446 -3.859) 13.996 2.728 ( -3.873 -10.153 0.886) 10.902 2.728 ( -3.873 10.153 0.886) 10.902 2.862 ( -1.216 -5.499 3.068) 6.413 2.862 ( -1.216 5.499 3.068) 6.413 3.021 ( 4.483 -2.918 1.466) 5.546 3.021 ( 4.483 2.918 1.466) 5.546 3.160 ( -5.002 -3.990 0.321) 6.406 3.160 ( -5.002 3.990 0.321) 6.406 3.291 ( -5.192 -6.181 -1.140) 8.152 3.291 ( -5.192 6.181 -1.140) 8.152 3.515 ( 2.037 -1.242 -3.448) 4.193 3.515 ( 2.037 1.242 -3.448) 4.193 3.721 ( 4.829 -5.893 3.685) 8.463 3.721 ( 4.829 5.893 3.685) 8.463 3.815 ( -8.489 -9.812 2.936) 13.303 3.815 ( -8.489 9.812 2.936) 13.303 3.996 ( -4.604 -4.390 2.285) 6.760 3.996 ( -4.604 4.390 2.285) 6.760 4.020 ( -0.443 -3.262 8.261) 8.892 4.020 ( -0.443 3.262 8.261) 8.892 4.346 ( -4.736 -1.369 -2.337) 5.456 4.346 ( -4.736 1.369 -2.337) 5.456 4.418 ( -3.689 -13.972 -6.714) 15.935 4.418 ( -3.689 13.972 -6.714) 15.935 4.550 ( -7.014 -5.317 0.677) 8.827 4.550 ( -7.014 5.317 0.677) 8.827 4.621 ( -1.260 -5.877 -0.217) 6.014 4.621 ( -1.260 5.877 -0.217) 6.014 4.771 ( -0.915 -4.188 -0.918) 4.384 4.771 ( -0.915 4.188 -0.918) 4.384 4.969 ( 2.538 -7.748 0.566) 8.173 4.969 ( 2.538 7.748 0.566) 8.173 5.223 ( -4.585 -2.617 -0.915) 5.358 5.223 ( -4.585 2.617 -0.915) 5.358 5.296 ( 4.491 -1.096 -2.274) 5.152 5.296 ( 4.491 1.096 -2.274) 5.152 5.511 ( -1.422 -6.157 -2.572) 6.822 5.511 ( -1.422 6.157 -2.572) 6.822 5.660 ( -1.143 -9.735 -2.668) 10.159 5.660 ( -1.143 9.735 -2.668) 10.159 5.781 ( 4.872 -1.988 0.251) 5.268 5.781 ( 4.872 1.988 0.251) 5.268 5.890 ( 0.557 -6.989 -3.949) 8.047 5.890 ( 0.557 6.989 -3.949) 8.047 5.984 ( -2.632 -2.766 -3.230) 5.001 5.984 ( -2.632 2.766 -3.230) 5.001 6.113 ( -2.026 -3.010 -2.465) 4.387 6.113 ( -2.026 3.010 -2.465) 4.387 6.303 ( -0.587 -2.029 -2.116) 2.989 6.303 ( -0.587 2.029 -2.116) 2.989 6.410 ( 4.830 -3.985 -2.453) 6.725 6.410 ( 4.830 3.985 -2.453) 6.725 6.600 ( 2.482 -2.537 8.480) 9.193 6.600 ( 2.482 2.537 8.480) 9.193 6.725 ( 0.525 -2.184 -1.562) 2.736 6.725 ( 0.525 2.184 -1.562) 2.736 6.860 ( 4.366 -4.073 1.259) 6.102 6.860 ( 4.366 4.073 1.259) 6.102 7.118 ( -2.458 -5.019 1.206) 5.717 7.118 ( -2.458 5.019 1.206) 5.717 7.222 ( -0.080 -2.554 1.093) 2.779 7.222 ( -0.080 2.554 1.093) 2.779 7.304 ( 7.573 -2.903 0.869) 8.157 7.304 ( 7.573 2.903 0.869) 8.157 7.513 ( 1.690 -4.012 -0.490) 4.381 7.513 ( 1.690 4.012 -0.490) 4.381 8.336 ( 18.027 -7.395 -1.534) 19.545 8.336 ( 18.027 7.395 -1.534) 19.545 8.414 ( 15.767 -4.844 0.130) 16.494 8.414 ( 15.767 4.844 0.130) 16.494 9.005 ( -0.272 -3.498 -0.778) 3.594 9.005 ( -0.272 3.498 -0.778) 3.594 9.170 ( -0.773 -0.586 -0.664) 1.175 9.170 ( -0.773 0.586 -0.664) 1.175 9.300 ( -5.379 -1.185 -1.356) 5.672 9.300 ( -5.379 1.185 -1.356) 5.672 9.373 ( -2.789 -2.447 -0.566) 3.753 9.373 ( -2.789 2.447 -0.566) 3.753 9.488 ( -4.483 -3.830 1.263) 6.030 9.488 ( -4.483 3.830 1.263) 6.030 9.637 ( -2.442 -2.367 -1.596) 3.757 9.637 ( -2.442 2.367 -1.596) 3.757 9.945 ( 0.217 -3.195 2.709) 4.195 9.945 ( 0.217 3.195 2.709) 4.195 10.173 ( 12.830 -2.266 0.465) 13.037 10.173 ( 12.830 2.266 0.465) 13.037 10.339 ( 12.819 -5.768 1.118) 14.101 10.339 ( 12.819 5.768 1.118) 14.101 10.561 ( 6.436 -3.388 -1.557) 7.438 10.561 ( 6.436 3.388 -1.557) 7.438 10.799 ( 3.995 -3.033 -0.500) 5.041 10.799 ( 3.995 3.033 -0.500) 5.041 10.927 ( 7.318 -3.605 -0.558) 8.176 10.927 ( 7.318 3.605 -0.558) 8.176 11.533 ( -9.956 -0.382 -0.544) 9.978 11.533 ( -9.956 0.382 -0.544) 9.978 11.630 ( -10.911 -2.141 0.566) 11.134 11.630 ( -10.911 2.141 0.566) 11.134 12.131 ( -1.559 -5.127 2.086) 5.751 12.131 ( -1.559 5.127 2.086) 5.751 12.289 ( 0.178 -5.737 -2.480) 6.252 12.289 ( 0.178 5.737 -2.480) 6.252 12.358 ( 2.614 -1.038 1.877) 3.381 12.358 ( 2.614 1.038 1.877) 3.381 12.434 ( 3.900 -2.177 -1.294) 4.650 12.434 ( 3.900 2.177 -1.294) 4.650 12.789 ( -0.714 -6.088 0.720) 6.172 12.789 ( -0.714 6.088 0.720) 6.172 12.879 ( -0.565 -4.635 -0.225) 4.675 12.879 ( -0.565 4.635 -0.225) 4.675 13.489 ( -7.829 -3.209 -0.377) 8.470 13.489 ( -7.829 3.209 -0.377) 8.470 13.528 ( -7.092 -0.780 0.195) 7.137 13.528 ( -7.092 0.780 0.195) 7.137 14.197 ( 1.371 -4.037 0.825) 4.343 14.197 ( 1.371 4.037 0.825) 4.343 14.238 ( 3.481 -4.918 -0.985) 6.105 14.238 ( 3.481 4.918 -0.985) 6.105 14.599 ( -4.712 -12.007 2.285) 13.099 14.599 ( -4.712 12.007 2.285) 13.099 14.754 ( -0.614 -3.008 -1.167) 3.284 14.754 ( -0.614 3.008 -1.167) 3.284 15.136 ( -9.882 -8.936 1.643) 13.424 15.136 ( -9.882 8.936 1.643) 13.424 15.214 ( -7.424 -5.345 -1.449) 9.261 15.214 ( -7.424 5.345 -1.449) 9.261 15.500 ( 3.587 -4.615 0.703) 5.887 15.500 ( 3.587 4.615 0.703) 5.887 15.607 ( 2.236 -0.914 -1.511) 2.850 15.607 ( 2.236 0.914 -1.511) 2.850 15.834 ( -4.479 -0.806 0.359) 4.565 15.834 ( -4.479 0.806 0.359) 4.565 16.152 ( -0.340 -0.703 -4.192) 4.265 16.152 ( -0.340 0.703 -4.192) 4.265 16.595 ( -1.872 -0.957 -0.758) 2.235 16.595 ( -1.872 0.957 -0.758) 2.235 16.754 ( -2.314 -4.726 -0.485) 5.284 16.754 ( -2.314 4.726 -0.485) 5.284 17.325 ( -0.189 -0.037 0.390) 0.435 17.325 ( -0.189 0.037 0.390) 0.435 17.384 ( -0.798 -0.815 -0.421) 1.216 17.384 ( -0.798 0.815 -0.421) 1.216 19.846 ( -2.774 -4.504 -1.127) 5.408 19.846 ( -2.774 4.504 -1.127) 5.408 20.098 ( -5.883 -2.377 -1.897) 6.622 20.098 ( -5.883 2.377 -1.897) 6.622 20.526 ( 3.628 -0.329 1.279) 3.861 20.526 ( 3.628 0.329 1.279) 3.861 20.784 ( 2.425 -0.020 -1.470) 2.836 20.784 ( 2.425 0.020 -1.470) 2.836 22.049 ( -7.430 -0.923 0.427) 7.499 22.049 ( -7.430 0.923 0.427) 7.499 22.211 ( -5.681 -0.279 0.345) 5.698 22.211 ( -5.681 0.279 0.345) 5.698 22.953 ( 8.034 -1.953 -1.828) 8.468 22.953 ( 8.034 1.953 -1.828) 8.468 23.151 ( 10.399 -1.561 2.172) 10.737 23.151 ( 10.399 1.561 2.172) 10.737 26.870 ( -18.487 -2.657 1.207) 18.716 26.870 ( -18.487 2.657 1.207) 18.716 27.152 ( -26.396 -13.684 -4.913) 30.136 27.152 ( -26.396 13.684 -4.913) 30.136 28.872 ( 19.167 -4.925 1.065) 19.818 28.872 ( 19.167 4.925 1.065) 19.818 28.979 ( 19.488 -9.635 -0.989) 21.762 28.979 ( 19.488 9.635 -0.989) 21.762 30.362 ( -11.602 -9.207 2.549) 15.029 30.362 ( -11.602 9.207 2.549) 15.029 30.685 ( -0.763 -4.590 -0.045) 4.653 30.685 ( -0.763 4.590 -0.045) 4.653 31.018 ( -5.390 -9.003 -2.896) 10.885 31.018 ( -5.390 9.003 -2.896) 10.885 31.099 ( -7.711 -5.467 -0.152) 9.454 31.099 ( -7.711 5.467 -0.152) 9.454 31.682 ( 3.059 -5.633 1.268) 6.534 31.682 ( 3.059 5.633 1.268) 6.534 31.917 ( 8.754 -1.086 -0.661) 8.846 31.917 ( 8.754 1.086 -0.661) 8.846 32.198 ( 0.392 -6.123 -1.372) 6.288 32.198 ( 0.392 6.123 -1.372) 6.288 32.586 ( -3.618 -9.531 -12.911) 16.450 32.586 ( -3.618 9.531 -12.911) 16.450 32.925 ( -12.622 -2.146 0.942) 12.838 32.925 ( -12.622 2.146 0.942) 12.838 33.176 ( 3.302 -8.584 -14.290) 16.994 33.176 ( 3.302 8.584 -14.290) 16.994 33.721 ( 7.073 -8.087 -9.435) 14.299 33.721 ( 7.073 8.087 -9.435) 14.299 34.051 ( 7.735 -1.469 -5.470) 9.586 34.051 ( 7.735 1.469 -5.470) 9.586 34.899 ( -0.006 -0.462 0.364) 0.589 34.899 ( -0.006 0.462 0.364) 0.589 35.063 ( -2.620 -1.314 5.465) 6.202 35.063 ( -2.620 1.314 5.465) 6.202 35.684 ( -3.588 -2.751 -2.020) 4.952 35.684 ( -3.588 2.751 -2.020) 4.952 35.749 ( -4.842 -3.871 -2.817) 6.809 35.749 ( -4.842 3.871 -2.817) 6.809 35.917 ( -2.052 -0.612 7.658) 7.952 35.917 ( -2.052 0.612 7.658) 7.952 36.419 ( 5.650 -2.281 7.237) 9.461 36.419 ( 5.650 2.281 7.237) 9.461 37.189 ( -8.248 -16.406 22.369) 28.941 37.189 ( -8.248 16.406 22.369) 28.941 38.383 ( 15.829 -10.876 -5.961) 20.109 38.383 ( 15.829 10.876 -5.961) 20.109 ======================= Grid point 124 (69/69) ======================= q-point: (-0.11 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( -9.995 -20.572 9.234) 24.665 1.528 ( -9.995 20.572 9.234) 24.665 1.869 ( 1.041 -4.694 10.419) 11.475 1.869 ( 1.041 4.694 10.419) 11.475 2.059 ( -10.143 -4.619 1.295) 11.220 2.059 ( -10.143 4.619 1.295) 11.220 2.443 ( -7.449 -20.996 7.590) 23.536 2.443 ( -7.449 20.996 7.590) 23.536 2.646 ( 0.043 -11.397 -1.058) 11.446 2.646 ( 0.043 11.397 -1.058) 11.446 2.692 ( -0.948 -7.564 1.893) 7.855 2.692 ( -0.948 7.564 1.893) 7.855 2.913 ( 0.497 -2.855 2.208) 3.643 2.913 ( 0.497 2.855 2.208) 3.643 3.070 ( -0.663 -1.942 6.491) 6.808 3.070 ( -0.663 1.942 6.491) 6.808 3.173 ( 6.127 -1.968 2.478) 6.896 3.173 ( 6.127 1.968 2.478) 6.896 3.263 ( -2.398 -4.517 0.896) 5.191 3.263 ( -2.398 4.517 0.896) 5.191 3.512 ( 0.467 -1.034 -0.560) 1.266 3.512 ( 0.467 1.034 -0.560) 1.266 3.639 ( -8.506 -6.630 1.324) 10.866 3.639 ( -8.506 6.630 1.324) 10.866 3.822 ( -3.786 -2.451 -0.695) 4.563 3.822 ( -3.786 2.451 -0.695) 4.563 3.963 ( 2.318 -4.874 -0.906) 5.473 3.963 ( 2.318 4.874 -0.906) 5.473 4.092 ( -2.474 -6.439 -1.338) 7.027 4.092 ( -2.474 6.439 -1.338) 7.027 4.238 ( -4.780 -8.889 -0.638) 10.113 4.238 ( -4.780 8.889 -0.638) 10.113 4.320 ( -1.295 -9.620 -3.185) 10.216 4.320 ( -1.295 9.620 -3.185) 10.216 4.428 ( -4.886 -9.346 0.855) 10.581 4.428 ( -4.886 9.346 0.855) 10.581 4.612 ( -2.671 -4.249 2.609) 5.656 4.612 ( -2.671 4.249 2.609) 5.656 4.779 ( 0.834 -5.659 -0.302) 5.728 4.779 ( 0.834 5.659 -0.302) 5.728 4.973 ( 4.088 -4.366 -4.845) 7.697 4.973 ( 4.088 4.366 -4.845) 7.697 5.199 ( 0.344 -2.218 2.754) 3.552 5.199 ( 0.344 2.218 2.754) 3.552 5.273 ( -0.854 -2.204 -5.114) 5.633 5.273 ( -0.854 2.204 -5.114) 5.633 5.444 ( -1.336 -4.959 -1.469) 5.341 5.444 ( -1.336 4.959 -1.469) 5.341 5.648 ( -2.798 -2.121 -4.607) 5.792 5.648 ( -2.798 2.121 -4.607) 5.792 5.727 ( -1.315 -2.959 -6.694) 7.436 5.727 ( -1.315 2.959 -6.694) 7.436 5.876 ( 4.438 -1.899 -1.100) 4.951 5.876 ( 4.438 1.899 -1.100) 4.951 5.999 ( -1.743 -3.572 1.114) 4.128 5.999 ( -1.743 3.572 1.114) 4.128 6.073 ( 2.585 -8.072 -0.380) 8.484 6.073 ( 2.585 8.072 -0.380) 8.484 6.286 ( -0.633 -6.816 -1.197) 6.949 6.286 ( -0.633 6.816 -1.197) 6.949 6.421 ( 0.264 -7.245 -1.612) 7.427 6.421 ( 0.264 7.245 -1.612) 7.427 6.613 ( -5.233 -2.844 -0.051) 5.956 6.613 ( -5.233 2.844 -0.051) 5.956 6.794 ( 7.492 -5.444 1.159) 9.333 6.794 ( 7.492 5.444 1.159) 9.333 6.952 ( 3.588 -5.785 3.507) 7.657 6.952 ( 3.588 5.785 3.507) 7.657 7.104 ( -0.468 -3.352 1.530) 3.714 7.104 ( -0.468 3.352 1.530) 3.714 7.238 ( 0.443 -3.364 0.619) 3.449 7.238 ( 0.443 3.364 0.619) 3.449 7.447 ( 5.940 -3.093 2.697) 7.220 7.447 ( 5.940 3.093 2.697) 7.220 7.530 ( 0.749 -2.563 0.133) 2.673 7.530 ( 0.749 2.563 0.133) 2.673 8.598 ( 15.523 -7.338 -0.183) 17.171 8.598 ( 15.523 7.338 -0.183) 17.171 8.657 ( 14.145 -3.195 -0.403) 14.507 8.657 ( 14.145 3.195 -0.403) 14.507 9.000 ( 1.129 -4.399 -0.765) 4.606 9.000 ( 1.129 4.399 -0.765) 4.606 9.128 ( -4.260 -3.284 -0.862) 5.447 9.128 ( -4.260 3.284 -0.862) 5.447 9.205 ( -3.924 -0.852 -0.765) 4.087 9.205 ( -3.924 0.852 -0.765) 4.087 9.293 ( -4.906 -2.006 -2.359) 5.801 9.293 ( -4.906 2.006 -2.359) 5.801 9.457 ( -2.427 -3.558 2.403) 4.932 9.457 ( -2.427 3.558 2.403) 4.932 9.581 ( -1.907 -2.368 -2.268) 3.794 9.581 ( -1.907 2.368 -2.268) 3.794 9.977 ( -0.692 -3.653 3.424) 5.055 9.977 ( -0.692 3.653 3.424) 5.055 10.361 ( 10.344 -2.367 -0.640) 10.631 10.361 ( 10.344 2.367 -0.640) 10.631 10.529 ( 8.530 -6.855 1.430) 11.036 10.529 ( 8.530 6.855 1.430) 11.036 10.621 ( 5.405 -4.229 -3.075) 7.520 10.621 ( 5.405 4.229 -3.075) 7.520 10.870 ( 4.144 -2.764 0.828) 5.050 10.870 ( 4.144 2.764 0.828) 5.050 11.020 ( 4.942 -4.073 -1.900) 6.680 11.020 ( 4.942 4.073 -1.900) 6.680 11.386 ( -7.475 -2.096 -0.440) 7.776 11.386 ( -7.475 2.096 -0.440) 7.776 11.467 ( -9.233 -3.689 0.171) 9.944 11.467 ( -9.233 3.689 0.171) 9.944 12.114 ( -3.331 -4.211 1.771) 5.654 12.114 ( -3.331 4.211 1.771) 5.654 12.257 ( -0.305 -4.430 -2.166) 4.941 12.257 ( -0.305 4.430 -2.166) 4.941 12.439 ( 3.922 -2.210 1.758) 4.833 12.439 ( 3.922 2.210 1.758) 4.833 12.483 ( 4.115 -2.719 -1.533) 5.165 12.483 ( 4.115 2.719 -1.533) 5.165 12.780 ( -0.528 -5.800 0.447) 5.841 12.780 ( -0.528 5.800 0.447) 5.841 12.865 ( -1.203 -3.562 0.069) 3.761 12.865 ( -1.203 3.562 0.069) 3.761 13.366 ( -6.598 -1.789 -0.105) 6.837 13.366 ( -6.598 1.789 -0.105) 6.837 13.423 ( -6.029 -1.681 0.290) 6.266 13.423 ( -6.029 1.681 0.290) 6.266 14.245 ( 3.511 -3.141 -0.078) 4.712 14.245 ( 3.511 3.141 -0.078) 4.712 14.311 ( 4.268 -3.507 0.112) 5.526 14.311 ( 4.268 3.507 0.112) 5.526 14.543 ( -1.983 -8.772 0.302) 8.999 14.543 ( -1.983 8.772 0.302) 8.999 14.707 ( -3.936 -6.185 1.143) 7.420 14.707 ( -3.936 6.185 1.143) 7.420 14.955 ( -13.409 -7.080 0.797) 15.185 14.955 ( -13.409 7.080 0.797) 15.185 15.061 ( -8.594 -5.848 -2.707) 10.742 15.061 ( -8.594 5.848 -2.707) 10.742 15.521 ( -2.072 -8.654 2.582) 9.266 15.521 ( -2.072 8.654 2.582) 9.266 15.685 ( 9.717 -6.939 -2.704) 12.243 15.685 ( 9.717 6.939 -2.704) 12.243 15.818 ( -0.217 -1.211 0.753) 1.443 15.818 ( -0.217 1.211 0.753) 1.443 16.073 ( -1.252 -7.379 -7.419) 10.539 16.073 ( -1.252 7.379 -7.419) 10.539 16.560 ( -1.557 -0.219 -0.240) 1.591 16.560 ( -1.557 0.219 -0.240) 1.591 16.662 ( -6.747 -1.331 -1.002) 6.950 16.662 ( -6.747 1.331 -1.002) 6.950 17.334 ( 0.624 -0.041 0.497) 0.799 17.334 ( 0.624 0.041 0.497) 0.799 17.373 ( -0.355 -0.438 0.055) 0.567 17.373 ( -0.355 0.438 0.055) 0.567 19.806 ( -0.793 -3.555 -1.057) 3.793 19.806 ( -0.793 3.555 -1.057) 3.793 20.003 ( -3.481 -1.346 -1.156) 3.908 20.003 ( -3.481 1.346 -1.156) 3.908 20.578 ( 1.297 -0.320 1.168) 1.775 20.578 ( 1.297 0.320 1.168) 1.775 20.798 ( 1.454 -0.406 -1.242) 1.955 20.798 ( 1.454 0.406 -1.242) 1.955 21.983 ( -2.849 -1.860 1.735) 3.819 21.983 ( -2.849 1.860 1.735) 3.819 22.137 ( -3.671 -0.823 -0.363) 3.779 22.137 ( -3.671 0.823 -0.363) 3.779 23.033 ( 4.824 -0.586 -1.894) 5.215 23.033 ( 4.824 0.586 -1.894) 5.215 23.324 ( 7.941 -0.749 1.365) 8.092 23.324 ( 7.941 0.749 1.365) 8.092 26.643 ( -11.638 -1.102 0.479) 11.700 26.643 ( -11.638 1.102 0.479) 11.700 26.734 ( -18.744 -4.193 -2.214) 19.335 26.734 ( -18.744 4.193 -2.214) 19.335 29.133 ( 11.325 -3.887 2.401) 12.212 29.133 ( 11.325 3.887 2.401) 12.212 29.247 ( 15.686 -7.395 -1.777) 17.433 29.247 ( 15.686 7.395 -1.777) 17.433 30.225 ( -11.054 -12.554 5.825) 17.713 30.225 ( -11.054 12.554 5.825) 17.713 30.669 ( 0.322 -5.642 -3.971) 6.906 30.669 ( 0.322 5.642 -3.971) 6.906 30.871 ( -5.551 -4.067 -3.921) 7.920 30.871 ( -5.551 4.067 -3.921) 7.920 31.025 ( -3.256 -2.515 0.746) 4.181 31.025 ( -3.256 2.515 0.746) 4.181 31.712 ( -1.338 -7.761 3.429) 8.590 31.712 ( -1.338 7.761 3.429) 8.590 32.080 ( 11.919 -2.853 -0.505) 12.266 32.080 ( 11.919 2.853 -0.505) 12.266 32.219 ( 2.961 -3.729 -2.640) 5.444 32.219 ( 2.961 3.729 -2.640) 5.444 32.353 ( -2.476 -15.157 -17.991) 23.655 32.353 ( -2.476 15.157 -17.991) 23.655 32.722 ( -13.660 -0.703 1.227) 13.733 32.722 ( -13.660 0.703 1.227) 13.733 32.960 ( -3.122 -11.692 -19.880) 23.273 32.960 ( -3.122 11.692 -19.880) 23.273 33.716 ( 1.870 -2.740 -1.603) 3.684 33.716 ( 1.870 2.740 -1.603) 3.684 34.065 ( 3.776 -1.951 -7.393) 8.527 34.065 ( 3.776 1.951 -7.393) 8.527 34.958 ( 3.437 -0.498 2.977) 4.574 34.958 ( 3.437 0.498 2.977) 4.574 35.082 ( -2.281 -1.646 4.512) 5.317 35.082 ( -2.281 1.646 4.512) 5.317 35.623 ( -1.877 -2.637 -1.288) 3.483 35.623 ( -1.877 2.637 -1.288) 3.483 35.660 ( -3.416 -3.121 -1.142) 4.766 35.660 ( -3.416 3.121 -1.142) 4.766 36.000 ( -0.522 -1.356 10.189) 10.292 36.000 ( -0.522 1.356 10.189) 10.292 36.456 ( 0.219 -1.134 -6.011) 6.120 36.456 ( 0.219 1.134 -6.011) 6.120 37.495 ( 2.366 -23.384 31.510) 39.310 37.495 ( 2.366 23.384 31.510) 39.310 38.502 ( 9.828 -11.598 -8.649) 17.490 38.502 ( 9.828 11.598 -8.649) 17.490 =================== 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 3/38880 10.0 186.434 139.359 112.894 0.000 -11.118 0.000 3/38880 20.0 30.645 29.342 21.113 0.000 0.338 0.000 3/38880 30.0 11.907 11.575 8.549 0.000 0.460 0.000 3/38880 40.0 6.615 6.421 4.885 0.000 0.330 0.000 3/38880 50.0 4.421 4.282 3.323 0.000 0.240 0.000 3/38880 60.0 3.294 3.181 2.501 0.000 0.182 0.000 3/38880 70.0 2.632 2.528 2.005 0.000 0.145 0.000 3/38880 80.0 2.206 2.103 1.676 0.000 0.119 0.000 3/38880 90.0 1.912 1.807 1.442 0.000 0.100 0.000 3/38880 100.0 1.700 1.590 1.268 0.000 0.086 0.000 3/38880 110.0 1.541 1.424 1.134 0.000 0.076 0.000 3/38880 120.0 1.417 1.295 1.026 0.000 0.067 0.000 3/38880 130.0 1.318 1.190 0.939 0.000 0.061 0.000 3/38880 140.0 1.238 1.105 0.866 0.000 0.055 0.000 3/38880 150.0 1.171 1.033 0.805 0.000 0.050 0.000 3/38880 160.0 1.114 0.972 0.753 0.000 0.046 0.000 3/38880 170.0 1.066 0.919 0.708 0.000 0.043 0.000 3/38880 180.0 1.025 0.873 0.669 0.000 0.040 0.000 3/38880 190.0 0.989 0.832 0.635 0.000 0.037 0.000 3/38880 200.0 0.957 0.796 0.605 0.000 0.035 0.000 3/38880 210.0 0.929 0.764 0.579 0.000 0.033 0.000 3/38880 220.0 0.904 0.735 0.556 0.000 0.031 0.000 3/38880 230.0 0.882 0.708 0.535 0.000 0.029 0.000 3/38880 240.0 0.862 0.684 0.516 0.000 0.028 0.000 3/38880 250.0 0.843 0.662 0.500 0.000 0.026 0.000 3/38880 260.0 0.827 0.642 0.485 0.000 0.025 0.000 3/38880 270.0 0.812 0.623 0.472 0.000 0.024 0.000 3/38880 280.0 0.798 0.606 0.460 0.000 0.023 0.000 3/38880 290.0 0.785 0.590 0.449 0.000 0.022 0.000 3/38880 300.0 0.772 0.575 0.439 0.000 0.021 0.000 3/38880 310.0 0.761 0.561 0.431 0.000 0.020 0.000 3/38880 320.0 0.750 0.547 0.422 0.000 0.019 0.000 3/38880 330.0 0.740 0.535 0.415 0.000 0.018 0.000 3/38880 340.0 0.730 0.523 0.408 0.000 0.017 0.000 3/38880 350.0 0.721 0.512 0.402 0.000 0.017 0.000 3/38880 360.0 0.712 0.502 0.396 0.000 0.016 0.000 3/38880 370.0 0.703 0.492 0.390 0.000 0.015 0.000 3/38880 380.0 0.694 0.482 0.385 0.000 0.015 0.000 3/38880 390.0 0.686 0.473 0.380 0.000 0.014 0.000 3/38880 400.0 0.678 0.464 0.375 0.000 0.014 0.000 3/38880 410.0 0.670 0.456 0.371 0.000 0.013 0.000 3/38880 420.0 0.663 0.448 0.366 0.000 0.013 0.000 3/38880 430.0 0.655 0.440 0.362 0.000 0.012 0.000 3/38880 440.0 0.648 0.433 0.358 0.000 0.012 0.000 3/38880 450.0 0.641 0.426 0.355 0.000 0.011 0.000 3/38880 460.0 0.633 0.419 0.351 0.000 0.011 0.000 3/38880 470.0 0.626 0.412 0.347 0.000 0.010 0.000 3/38880 480.0 0.620 0.406 0.344 0.000 0.010 0.000 3/38880 490.0 0.613 0.399 0.340 0.000 0.010 0.000 3/38880 500.0 0.606 0.393 0.337 0.000 0.009 0.000 3/38880 510.0 0.600 0.387 0.334 0.000 0.009 0.000 3/38880 520.0 0.593 0.382 0.330 0.000 0.009 0.000 3/38880 530.0 0.587 0.376 0.327 0.000 0.008 0.000 3/38880 540.0 0.581 0.371 0.324 0.000 0.008 0.000 3/38880 550.0 0.575 0.366 0.321 0.000 0.008 0.000 3/38880 560.0 0.569 0.361 0.318 0.000 0.007 0.000 3/38880 570.0 0.563 0.356 0.315 0.000 0.007 0.000 3/38880 580.0 0.557 0.351 0.312 0.000 0.007 0.000 3/38880 590.0 0.551 0.346 0.309 0.000 0.007 0.000 3/38880 600.0 0.545 0.342 0.307 0.000 0.007 0.000 3/38880 610.0 0.540 0.337 0.304 0.000 0.006 0.000 3/38880 620.0 0.534 0.333 0.301 0.000 0.006 0.000 3/38880 630.0 0.529 0.329 0.298 0.000 0.006 0.000 3/38880 640.0 0.523 0.325 0.296 0.000 0.006 0.000 3/38880 650.0 0.518 0.321 0.293 0.000 0.006 0.000 3/38880 660.0 0.513 0.317 0.290 0.000 0.005 0.000 3/38880 670.0 0.508 0.313 0.288 0.000 0.005 0.000 3/38880 680.0 0.502 0.309 0.285 0.000 0.005 0.000 3/38880 690.0 0.498 0.306 0.283 0.000 0.005 0.000 3/38880 700.0 0.493 0.302 0.280 0.000 0.005 0.000 3/38880 710.0 0.488 0.298 0.278 0.000 0.005 0.000 3/38880 720.0 0.483 0.295 0.275 0.000 0.004 0.000 3/38880 730.0 0.478 0.292 0.273 0.000 0.004 0.000 3/38880 740.0 0.474 0.288 0.271 0.000 0.004 0.000 3/38880 750.0 0.469 0.285 0.268 0.000 0.004 0.000 3/38880 760.0 0.465 0.282 0.266 0.000 0.004 0.000 3/38880 770.0 0.460 0.279 0.264 0.000 0.004 0.000 3/38880 780.0 0.456 0.276 0.262 0.000 0.004 0.000 3/38880 790.0 0.452 0.273 0.259 0.000 0.004 0.000 3/38880 800.0 0.447 0.270 0.257 0.000 0.004 0.000 3/38880 810.0 0.443 0.267 0.255 0.000 0.003 0.000 3/38880 820.0 0.439 0.265 0.253 0.000 0.003 0.000 3/38880 830.0 0.435 0.262 0.251 0.000 0.003 0.000 3/38880 840.0 0.431 0.259 0.249 0.000 0.003 0.000 3/38880 850.0 0.427 0.257 0.247 0.000 0.003 0.000 3/38880 860.0 0.424 0.254 0.245 0.000 0.003 0.000 3/38880 870.0 0.420 0.251 0.243 0.000 0.003 0.000 3/38880 880.0 0.416 0.249 0.241 0.000 0.003 0.000 3/38880 890.0 0.412 0.247 0.239 0.000 0.003 0.000 3/38880 900.0 0.409 0.244 0.237 0.000 0.003 0.000 3/38880 910.0 0.405 0.242 0.235 0.000 0.003 0.000 3/38880 920.0 0.402 0.240 0.233 0.000 0.003 0.000 3/38880 930.0 0.398 0.237 0.231 0.000 0.003 0.000 3/38880 940.0 0.395 0.235 0.229 0.000 0.003 0.000 3/38880 950.0 0.392 0.233 0.227 0.000 0.002 0.000 3/38880 960.0 0.388 0.231 0.226 0.000 0.002 0.000 3/38880 970.0 0.385 0.229 0.224 0.000 0.002 0.000 3/38880 980.0 0.382 0.227 0.222 0.000 0.002 0.000 3/38880 990.0 0.379 0.225 0.220 0.000 0.002 0.000 3/38880 1000.0 0.375 0.223 0.219 0.000 0.002 0.000 3/38880 Thermal conductivity related properties were written into "kappa-m945.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:00:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|